A0A077Z8F1_TRITR Loading...

EGF-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z8F1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 937 aa.

						>A0A077Z8F1_TRITR|A0A077Z8F1
MTASSYMQMLYIFTIGAFIPLVVAEKSSRLLCPFEGDQNEFVGGYRKHVEHNYSQTVPCVTMIPKGDVTVDQSGVLSSYSKYCHQMEGRVAHFDNADGLPAESNWFSTKEVRLFSGHEVVDIVTKNWMVFPFDKAPFQPACAKHTDMQCVVAVYRISLLDDRIIRLNATNCFGVLAPDCTMSDPIVSNCSGSLQYCKIDQQVAYLPGCRVFVATVRGVYHLERFRFCLDQAWDYFACETRASDKWIYRKKVECTYDESTRTCYKYNCTETEIKSLYKCNWHEKIVCTCACAPDAQWSEWSVPSASCGVTMRVRYKPLMGQEISHCTQENSTVCCSESVQEVLLPCSEYHHGTNIEFKRKPCVNGLQVPHSQGGSRCECFQGYAGMLCEMELGGAAAKVRELSAIITSVIIVVCTVVLTLALSVFIKKWLYAYYDSLYPTEAGPEGALSELIGESRDGARQLLLLFFLLTLPELEIAWTTSCPHEDPKWDFLGYHIKDDFCMTFVPANMIIHHTWERSELYVIKASQYCDSLKQGKVYHFYDSSKLPTDTKWLGPFDYIDVFYGSSLLKPTDNITVHKNAEVRQGGATNDTECPETVSCYSSLLMEFFWIGDPKSWTFQLNDNHIVPFPNNVTAFNCIDVPEKCQYYHPMFKGCMANSSCFQELLNSKNGTFFCRAYRAKTRLTHEVFPLHDCSAKQTWKYFACEHYAYQNCRYKKIIGCHFNKQLSKCVTARYEIIAEAEPPFGRCEMEKPEECICECKTEHWQSWSQPSRTCDTAVRIRYGPKDGAKNKVCTATSNEHCCTEVMEESLTPCSEYHHGTNLEFKSLPCVNGIQVAHPKGGGRCECYSGFTGRSCELRKLAITKEDDTAVPVATGQLLWLARLWLLCQLTRQEQKLKNVLQPGRNEALINSSMLCDVWARENFIKRSQLLWLSQWCAK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.3	Very low	33.1	Very low	229 Å²	229	143 Å²	143	100%	1.128	75%	0.75	S	S	*	*				0	92.9	0	-68.7	150	-179.2	0	0	105.9
2	T	33.4	Very low	33	Very low	128 Å²	128	140.6 Å²	140.6	79%	0.785	74%	0.736	S	S	*	*				67.7	96.3	97.9	52.9	0	0	0	0	110.8
3	A	31	Very low	33.2	Very low	101 Å²	101	142.1 Å²	142.1	84%	0.835	73%	0.734	S	S	*	*				73.8	145	80.2	0	0	0	0	0	112.1
4	S	34.3	Very low	33.3	Very low	87 Å²	87	140 Å²	140	61%	0.608	73%	0.731	S	S	*	*			cis	-144.1	147.4	7.5	175.3	0	0	0	0	107.6
5	S	33.3	Very low	33.5	Very low	93 Å²	93	142.3 Å²	142.3	65%	0.65	74%	0.742	S	S	*	*				62	145.7	57.8	48.1	0	0	0	0	117.1
6	Y	32.6	Very low	33.6	Very low	188 Å²	188	138.1 Å²	138.1	74%	0.737	74%	0.744	S	S	*	*			trans	79.3	145.8	179.1	-57.3	-75.1	0	0	0	117.2
7	M	33.6	Very low	33.5	Very low	136 Å²	136	135.3 Å²	135.3	67%	0.67	74%	0.744	S	S	*	*			cis	-142.5	156.8	-1.6	-121.8	168.9	-166.2	0	0	108.6	M9	M7-M9 HydrophobicContact CE-CE 4.12Å; M7-M9 HydrophobicContact SD-CE 4.47Å
8	Q	31	Very low	33.4	Very low	166 Å²	166	138.4 Å²	138.4	78%	0.776	75%	0.75	S	S	*	*			cis	78.2	162.3	27.7	-85	-170.4	-18.1	0	0	117.5
9	M	32.2	Very low	33.2	Very low	143 Å²	143	139.4 Å²	139.4	70%	0.704	75%	0.752	S	S	*	*			trans	87.7	157.2	-163.5	-56.8	-47.7	-174.5	0	0	113.8	M7	M7-M9 HydrophobicContact CE-CE 4.12Å; M7-M9 HydrophobicContact SD-CE 4.47Å
10	L	33	Very low	33	Very low	132 Å²	132	137.6 Å²	137.6	69%	0.691	75%	0.748	S	S	*	*			cis	-172	160.8	-20.7	-91.6	171.2	0	0	0	105.6
11	Y	32.8	Very low	33.1	Very low	170 Å²	170	139.6 Å²	139.6	67%	0.667	76%	0.758	S	S	*	*			cis	-160.6	137.8	-21.2	-126.9	-152.1	0	0	0	107.3	F13	Y11-F13 AromaticContact CD1-CE2 3.84Å; Y11-F13 HydrophobicContact CD1-CE2 3.84Å; Y11-F13 HydrophobicContact CE1-CE2 4.07Å
12	I	31.6	Very low	32.9	Very low	114 Å²	114	134.7 Å²	134.7	59%	0.585	74%	0.74	S	S	*	*				69.4	145.3	87	-51.9	-175.3	0	0	0	116.8
13	F	34.8	Very low	32.9	Very low	160 Å²	160	135 Å²	135	70%	0.702	74%	0.742	S	S	*	*			trans	100.9	137.6	163.1	-60.5	-67.8	0	0	0	118.5	Y11	Y11-F13 AromaticContact CD1-CE2 3.84Å; Y11-F13 HydrophobicContact CD1-CE2 3.84Å; Y11-F13 HydrophobicContact CE1-CE2 4.07Å
14	T	34.7	Very low	32.9	Very low	113 Å²	113	134.8 Å²	134.8	69%	0.693	74%	0.739	S	S	*	*			cis	-171.7	177.4	-34.3	15	0	0	0	0	111.1
15	I	36.5	Very low	32.8	Very low	174 Å²	174	139 Å²	139	89%	0.892	75%	0.749	S	S	*	*			trans	81	107	170.9	-47.1	165.1	0	0	0	112.4
16	G	34.6	Very low	32.7	Very low	75 Å²	75	143.4 Å²	143.4	77%	0.773	76%	0.757	S	S	*	*			cis	-169.9	-160.8	0.3	0	0	0	0	0	109.6
17	A	32.6	Very low	32.9	Very low	91 Å²	91	138.4 Å²	138.4	75%	0.752	75%	0.749	S	S	*	*			cis	-161.6	173.9	-7.3	0	0	0	0	0	109.9
18	F	31.6	Very low	33.5	Very low	192 Å²	192	136 Å²	136	84%	0.842	75%	0.746	S	S	*	*			trans	64.2	135.7	177.2	-83.2	-85	0	0	0	119.3
19	I	29.9	Very low	34.7	Very low	156 Å²	156	138.2 Å²	138.2	80%	0.8	75%	0.747	S	S	*	*			trans	76.7	145.1	154.3	-70	166.1	0	0	0	116.2
20	P	29.3	Very low	36.3	Very low	103 Å²	103	134.2 Å²	134.2	67%	0.669	73%	0.729	S	S	*	*			trans	-105.8	178.6	-143.3	40.6	-35.5	0	0	0	115.7	V22	P20-V22 PolarHBondContact O-N 2.91Å
21	L	34.5	Very low	38	Very low	181 Å²	181	130.6 Å²	130.6	95%	0.948	71%	0.71	S	S	*	*			trans	-53	115.9	-178.7	-72.7	92.2	0	0	0	113.3
22	V	33.9	Very low	40	Very low	126 Å²	126	122.6 Å²	122.6	76%	0.764	68%	0.678	S	S	*	*			trans	-129.5	159.8	166.2	177.6	0	0	0	0	108.2	P20 A24	P20-V22 PolarHBondContact O-N 2.91Å; V22-A24 PolarHBondContact O-N 3.49Å
23	V	33.8	Very low	41.9	Very low	135 Å²	135	117.2 Å²	117.2	82%	0.818	65%	0.651	S	S	*	*			trans	-40.5	133.6	-178.2	-178.6	0	0	0	0	112.5	E25	V23-E25 PolarHBondContact O-N 2.9Å
24	A	30.6	Very low	43.8	Very low	95 Å²	95	111.4 Å²	111.4	79%	0.785	63%	0.625	S	S	*	*			trans	-65.1	95.9	-177.2	0	0	0	0	0	112.1	V22 K26	V22-A24 PolarHBondContact O-N 3.49Å; A24-K26 PolarHBondContact O-N 2.92Å
25	E	32.2	Very low	45.6	Very low	175 Å²	175	109.3 Å²	109.3	82%	0.818	61%	0.608	S	S	*	*			trans	-55	120.5	168.3	-176.7	176	-120.4	0	0	109.8	V23 S27	V23-E25 PolarHBondContact O-N 2.9Å; E25-S27 PolarHBondContact O-N 3.1Å
26	K	31.7	Very low	46.9	Very low	186 Å²	186	102.3 Å²	102.3	81%	0.809	58%	0.579	S	S	*	*			trans	-82.7	49.4	-174.3	-160.7	-173.4	172.9	-163.9	0	111.6	A24 S28	A24-K26 PolarHBondContact O-N 2.92Å; K26-S28 PolarHBondContact O-N 3.13Å
27	S	36.3	Very low	47.9	Very low	83 Å²	83	106.5 Å²	106.5	58%	0.58	58%	0.584	S	S	*	*			trans	-59.6	129.6	176.7	-179.3	0	0	0	0	110.6	E25 R29	E25-S27 PolarHBondContact O-N 3.1Å; S27-R29 PolarHBondContact O-N 3.13Å
28	S	44.9	Very low	49	Very low	87 Å²	87	103 Å²	103	61%	0.608	55%	0.552	S	S	*	*			trans	-70.4	89.6	177.6	36.5	0	0	0	0	110	K26 L30	K26-S28 PolarHBondContact O-N 3.13Å; S28-L30 PolarHBondContact O-N 2.88Å
29	R	56.7	Low	50.2	Low	211 Å²	211	102 Å²	102	80%	0.796	56%	0.555	S	S	*	*			trans	-60.4	100	173.3	-71.4	-172.8	177.8	-171.4	-1.5	110	S27 L31	S27-R29 PolarHBondContact O-N 3.13Å; R29-L31 PolarHBondContact O-N 3.13Å
30	L	66.4	Low	51.7	Low	59 Å²	59	99.8 Å²	99.8	31%	0.309	54%	0.542	S	S	.	.			trans	-58.9	115.9	166.8	-62.6	169	0	0	0	108.2	S28 R46 A241	S28-L30 PolarHBondContact O-N 2.88Å; L30-R46 PolarHBondContact O-NH1 2.9Å; L30-R46 PolarHBondContact O-NH2 2.91Å; L30-A241 HydrophobicContact CB-CB 3.79Å
31	L	69.6	Low	53.6	Low	57 Å²	57	96.8 Å²	96.8	30%	0.298	52%	0.518	S	S	.	.	B	Isolated β-bridge	trans	-105.4	148.1	-177.7	-72.7	164.7	0	0	0	110.9	R29 E35 A241 S242	R29-L31 PolarHBondContact O-N 3.13Å; L31-E35 WeakPolarHBondContact CA-OE2 3.39Å; L31-E35 HydrophobicContact CD2-CB 3.92Å; L31-A241 CarbonylContact O-C 3.56Å; L31-A241 WeakPolarHBondContact O-CA 3.23Å; L31-S242 PolarHBondContact N-O 3.19Å; L31-S242 PolarHBondContact O-N 3.43Å
32	C	73.6	Confident	55.2	Low	1 Å²	1	90.5 Å²	90.5	1%	0.007	49%	0.487	C	S	.	.			trans	-79.6	154.9	165.3	-60.8	0	0	0	0	110.8	F34 E35 R46 C59	C32-F34 VanDerWaalsContact C-N 3.27Å; C32-F34 HydrophobicContact CB-CD1 3.66Å; C32-F34 HydrophobicContact CB-CE1 3.18Å; C32-F34 HydrophobicContact CB-CE2 4.29Å; C32-F34 HydrophobicContact CB-CG 4.37Å; C32-F34 HydrophobicContact CB-CZ 3.5Å; C32-F34 PolarHBondContact O-N 2.93Å; C32-E35 HydrophobicContact CB-CG 3.94Å; C32-E35 PolarHBondContact N-OE2 3.45Å; C32-E35 WeakPolarHBondContact O-CB 3.37Å; C32-E35 PolarHBondContact O-N 2.8Å; C32-R46 VanDerWaalsContact SG-CG 3.55Å; C32-C59 WeakPolarHBondContact CA-SG 3.31Å; C32-C59 HydrophobicContact CB-CB 3.52Å; C32-C59 WeakPolarHBondContact CB-SG 3.11Å; C32-C59 WeakPolarHBondContact SG-CB 3.32Å; C32-C59 CovalentContact SG-SG 2.02Å; C32-C59 PolarHBondContact SG-SG 2.76Å
33	P	71.3	Confident	57	Low	1 Å²	1	85.1 Å²	85.1	1%	0.006	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-55.9	-38.1	179.7	-27	34.8	0	0	0	114.2	E35 G36 F41 T61 M86 T239 W245	P33-E35 VanDerWaalsContact C-N 3.3Å; P33-E35 PolarHBondContact O-N 3.44Å; P33-G36 PolarHBondContact O-N 2.03Å; P33-F41 HydrophobicContact CB-CE2 3.81Å; P33-F41 HydrophobicContact CB-CZ 4.04Å; P33-F41 VanDerWaalsContact O-CD2 3.28Å; P33-F41 WeakPolarHBondContact O-CD2 3.42Å; P33-F41 VanDerWaalsContact O-CE2 3.25Å; P33-F41 WeakPolarHBondContact O-CE2 3.41Å; P33-T61 HydrophobicContact CB-CG2 4.32Å; P33-M86 HydrophobicContact CB-SD 3.77Å; P33-M86 HydrophobicContact CG-SD 3.89Å; P33-T239 HydrophobicContact CG-CG2 4.36Å; P33-W245 HydrophobicContact CG-CD2 4.49Å
34	F	74.9	Confident	58.9	Low	38 Å²	38	79.1 Å²	79.1	17%	0.167	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-76	-7.6	177.1	68.5	-94.3	0	0	0	114.9	C32 F41 G43 G44 Y45 C59 T61	C32-F34 VanDerWaalsContact C-N 3.27Å; C32-F34 HydrophobicContact CB-CD1 3.66Å; C32-F34 HydrophobicContact CB-CE1 3.18Å; C32-F34 HydrophobicContact CB-CE2 4.29Å; C32-F34 HydrophobicContact CB-CG 4.37Å; C32-F34 HydrophobicContact CB-CZ 3.5Å; C32-F34 PolarHBondContact O-N 2.93Å; F34-F41 HydrophobicContact CB-CB 4.18Å; F34-G43 WeakPolarHBondContact CB-O 3.34Å; F34-G44 VanDerWaalsContact CE2-C 3.48Å; F34-G44 VanDerWaalsContact CZ-C 3.46Å; F34-Y45 VanDerWaalsContact CE1-N 3.26Å; F34-C59 HydrophobicContact CE1-CB 4.33Å; F34-T61 HydrophobicContact CB-CG2 4.32Å
35	E	72.9	Confident	60.9	Low	69 Å²	69	75.5 Å²	75.5	32%	0.322	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-91.7	-3.7	174.9	-63.4	172.6	155.3	0	0	112.1	L31 C32 P33 R46	L31-E35 WeakPolarHBondContact CA-OE2 3.39Å; L31-E35 HydrophobicContact CD2-CB 3.92Å; C32-E35 HydrophobicContact CB-CG 3.94Å; C32-E35 PolarHBondContact N-OE2 3.45Å; C32-E35 WeakPolarHBondContact O-CB 3.37Å; C32-E35 PolarHBondContact O-N 2.8Å; P33-E35 VanDerWaalsContact C-N 3.3Å; P33-E35 PolarHBondContact O-N 3.44Å; E35-R46 IonicContact OE1-CZ 2.81Å; E35-R46 IonicContact OE1-NE 3.48Å; E35-R46 PolarHBondContact OE1-NE 2.84Å; E35-R46 IonicContact OE1-NH2 3.38Å; E35-R46 PolarHBondContact OE1-NH2 3.37Å; E35-R46 IonicContact OE2-CZ 3.25Å; E35-R46 IonicContact OE2-NE 2.67Å; E35-R46 IonicContact OE2-NH2 2.64Å; E35-R46 PolarHBondContact OE2-NH2 3.48Å
36	G	63.7	Low	63	Low	28 Å²	28	71.8 Å²	71.8	29%	0.289	37%	0.367	S	S	.	.	S	Bend	trans	-77.5	158.9	165.1	0	0	0	0	0	111.7	P33 Q38	P33-G36 PolarHBondContact O-N 2.03Å; G36-Q38 PolarHBondContact O-N 3.41Å
37	D	55.9	Low	65	Low	163 Å²	163	66.5 Å²	66.5	87%	0.872	34%	0.344	S	S	*	.	S	Bend	trans	-76.9	54.6	-176.6	-143.1	9.6	0	0	0	111.2
38	Q	56.1	Low	66.1	Low	18 Å²	18	71.3 Å²	71.3	8%	0.084	36%	0.357	C	S	.	.			trans	-120.3	112	-167.5	-65.9	-160.3	95	0	0	113	G36 E40 F41 Y247	G36-Q38 PolarHBondContact O-N 3.41Å; Q38-E40 PolarHBondContact O-N 3.41Å; Q38-F41 HydrophobicContact CB-CD2 4.12Å; Q38-F41 HydrophobicContact CB-CE2 4.37Å; Q38-F41 PolarHBondContact O-N 3.19Å; Q38-Y247 HydrophobicContact CG-CE2 3.76Å; Q38-Y247 VanDerWaalsContact OE1-CZ 3.28Å; Q38-Y247 PolarHBondContact OE1-OH 2.8Å
39	N	55.5	Low	66.8	Low	170 Å²	170	70.8 Å²	70.8	91%	0.909	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-2.6	-179.9	-65.4	-18.6	0	0	0	115.3
40	E	63.1	Low	66.5	Low	110 Å²	110	69.6 Å²	69.6	51%	0.514	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-18.6	-178.9	-64.7	178.2	-172.3	0	0	112.5	Q38	Q38-E40 PolarHBondContact O-N 3.41Å
41	F	68.6	Low	65.3	Low	39 Å²	39	74 Å²	74	17%	0.171	37%	0.372	C	S	.	.			trans	-97.9	132.9	175.6	-56.3	-46.3	0	0	0	110.5	P33 F34 Q38 G43 T61 I63 M86	P33-F41 HydrophobicContact CB-CE2 3.81Å; P33-F41 HydrophobicContact CB-CZ 4.04Å; P33-F41 VanDerWaalsContact O-CD2 3.28Å; P33-F41 WeakPolarHBondContact O-CD2 3.42Å; P33-F41 VanDerWaalsContact O-CE2 3.25Å; P33-F41 WeakPolarHBondContact O-CE2 3.41Å; F34-F41 HydrophobicContact CB-CB 4.18Å; Q38-F41 HydrophobicContact CB-CD2 4.12Å; Q38-F41 HydrophobicContact CB-CE2 4.37Å; Q38-F41 PolarHBondContact O-N 3.19Å; F41-G43 VanDerWaalsContact C-N 3.32Å; F41-T61 HydrophobicContact CB-CG2 4.42Å; F41-T61 HydrophobicContact CD1-CG2 3.55Å; F41-T61 HydrophobicContact CD2-CG2 4.43Å; F41-T61 HydrophobicContact CE1-CG2 3.85Å; F41-T61 HydrophobicContact CG-CG2 3.88Å; F41-T61 HydrophobicContact CZ-CG2 4.39Å; F41-I63 HydrophobicContact CD1-CD1 4.04Å; F41-I63 HydrophobicContact CD1-CG1 3.49Å; F41-I63 VanDerWaalsContact CD1-CG1 3.49Å; F41-I63 HydrophobicContact CE1-CD1 3.84Å; F41-I63 HydrophobicContact CE1-CG1 3.79Å; F41-M86 HydrophobicContact CE1-SD 4.05Å; F41-M86 HydrophobicContact CZ-SD 3.88Å
42	V	68.5	Low	63.7	Low	49 Å²	49	78.7 Å²	78.7	30%	0.297	40%	0.398	S	S	.	.			trans	-78.6	-25.7	178.7	171.3	0	0	0	0	110.7	M62 P64 W105 F106 Y234	V42-M62 PolarHBondContact N-O 2.03Å; V42-P64 HydrophobicContact CG2-CB 4.31Å; V42-P64 HydrophobicContact CG2-CG 4.17Å; V42-W105 VanDerWaalsContact CG1-O 3.31Å; V42-W105 WeakPolarHBondContact CG1-O 3.34Å; V42-F106 HydrophobicContact CG1-CD1 3.61Å; V42-F106 HydrophobicContact CG1-CE1 3.68Å; V42-Y234 HydrophobicContact CB-CD1 4.27Å; V42-Y234 HydrophobicContact CB-CE1 4.1Å; V42-Y234 HydrophobicContact CG1-CD1 4.19Å; V42-Y234 HydrophobicContact CG1-CE1 3.76Å; V42-Y234 HydrophobicContact CG2-CD1 3.94Å; V42-Y234 HydrophobicContact CG2-CE1 3.56Å
43	G	70.8	Confident	61.8	Low	14 Å²	14	89.6 Å²	89.6	14%	0.144	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.2	-155.3	172.9	0	0	0	0	0	110.8	F34 F41 M62	F34-G43 WeakPolarHBondContact CB-O 3.34Å; F41-G43 VanDerWaalsContact C-N 3.32Å; G43-M62 PolarHBondContact O-N 3.48Å
44	G	73.1	Confident	60.2	Low	9 Å²	9	92.3 Å²	92.3	9%	0.093	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.4	-171.2	177	0	0	0	0	0	112	F34 V60 W105	F34-G44 VanDerWaalsContact CE2-C 3.48Å; F34-G44 VanDerWaalsContact CZ-C 3.46Å; G44-V60 CarbonylContact C-O 3.59Å; G44-V60 WeakPolarHBondContact CA-O 3.02Å; G44-W105 PolarHBondContact O-NE1 3.49Å
45	Y	73.5	Confident	59	Low	19 Å²	19	99 Å²	99	8%	0.075	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	161.8	176.7	63.1	-76.9	0	0	0	113.8	F34 K47 V60 M62 F93 G98 L99 P100 W105	F34-Y45 VanDerWaalsContact CE1-N 3.26Å; Y45-K47 HydrophobicContact CE2-CB 4.24Å; Y45-V60 HydrophobicContact CD1-CB 3.81Å; Y45-V60 HydrophobicContact CD1-CG1 4.13Å; Y45-V60 HydrophobicContact CE1-CB 3.48Å; Y45-V60 VanDerWaalsContact CE1-CB 3.48Å; Y45-V60 HydrophobicContact CE1-CG1 3.47Å; Y45-V60 VanDerWaalsContact CE1-CG1 3.47Å; Y45-V60 HydrophobicContact CE1-CG2 4.07Å; Y45-V60 HydrophobicContact CE2-CB 4.26Å; Y45-V60 HydrophobicContact CE2-CG2 4.07Å; Y45-V60 HydrophobicContact CG-CB 4.37Å; Y45-V60 PolarHBondContact N-O 2.81Å; Y45-V60 PolarHBondContact O-N 3.47Å; Y45-M62 HydrophobicContact CE1-CE 4.3Å; Y45-F93 WeakPolarHBondContact OH-CE1 3.5Å; Y45-G98 WeakPolarHBondContact CE2-O 3.47Å; Y45-G98 PolarHBondContact OH-O 3.16Å; Y45-L99 HydrophobicContact CE1-CD2 3.96Å; Y45-P100 HydrophobicContact CD1-CG 4.2Å; Y45-P100 HydrophobicContact CD2-CG 3.92Å; Y45-P100 HydrophobicContact CG-CG 3.72Å; Y45-W105 AromaticContact CD1-CH2 3.49Å; Y45-W105 HydrophobicContact CD1-CH2 3.49Å; Y45-W105 VanDerWaalsContact CD1-CH2 3.49Å; Y45-W105 AromaticContact CD1-CZ2 3.25Å; Y45-W105 HydrophobicContact CD1-CZ2 3.25Å; Y45-W105 AromaticContact CE1-CH2 3.71Å; Y45-W105 HydrophobicContact CE1-CH2 3.71Å; Y45-W105 AromaticContact CE1-CZ2 3.99Å; Y45-W105 HydrophobicContact CE1-CZ2 3.99Å; Y45-W105 HydrophobicContact CG-CH2 4.33Å; Y45-W105 AromaticContact CG-CZ2 3.87Å; Y45-W105 HydrophobicContact CG-CZ2 3.87Å
46	R	76.4	Confident	58.3	Low	96 Å²	96	98.4 Å²	98.4	36%	0.362	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	118.1	165.6	-72.6	174.4	-175.7	-109.6	-3.3	108.7	L30 C32 E35 H48 V57 P58	L30-R46 PolarHBondContact O-NH1 2.9Å; L30-R46 PolarHBondContact O-NH2 2.91Å; C32-R46 VanDerWaalsContact SG-CG 3.55Å; E35-R46 IonicContact OE1-CZ 2.81Å; E35-R46 IonicContact OE1-NE 3.48Å; E35-R46 PolarHBondContact OE1-NE 2.84Å; E35-R46 IonicContact OE1-NH2 3.38Å; E35-R46 PolarHBondContact OE1-NH2 3.37Å; E35-R46 IonicContact OE2-CZ 3.25Å; E35-R46 IonicContact OE2-NE 2.67Å; E35-R46 IonicContact OE2-NH2 2.64Å; E35-R46 PolarHBondContact OE2-NH2 3.48Å; R46-H48 PolarHBondContact O-N 2.8Å; R46-V57 HydrophobicContact CB-CG1 3.71Å; R46-V57 HydrophobicContact CG-CG1 3.83Å; R46-P58 WeakPolarHBondContact CA-O 3.45Å
47	K	72.6	Confident	58.5	Low	75 Å²	75	99.3 Å²	99.3	33%	0.326	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-72.1	122.1	178.3	-174.5	170.3	176.7	172	0	109	Y45 P58 V60 E238	Y45-K47 HydrophobicContact CE2-CB 4.24Å; K47-P58 HydrophobicContact CB-CB 4.02Å; K47-P58 HydrophobicContact CB-CG 4.22Å; K47-P58 HydrophobicContact CD-CB 4.42Å; K47-P58 PolarHBondContact N-O 3.29Å; K47-V60 HydrophobicContact CB-CG2 4.25Å; K47-V60 HydrophobicContact CD-CG2 4.34Å; K47-E238 VanDerWaalsContact CD-OE1 3.29Å; K47-E238 WeakPolarHBondContact CD-OE1 3.02Å; K47-E238 WeakPolarHBondContact CE-OE1 3.48Å; K47-E238 IonicContact NZ-OE1 2.92Å; K47-E238 PolarHBondContact NZ-OE1 3.5Å
48	H	60.8	Low	59.5	Low	185 Å²	185	92.7 Å²	92.7	86%	0.856	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-63.3	137.1	174.3	-109.2	-90.6	0	0	0	110.2	R46	R46-H48 PolarHBondContact O-N 2.8Å
49	V	58.5	Low	60.6	Low	76 Å²	76	91.9 Å²	91.9	46%	0.461	45%	0.454	S	S	.	.			trans	-122.8	121	173.1	-177	0	0	0	0	106.6	H51 P58	V49-H51 PolarHBondContact O-N 2.74Å; V49-H51 VanDerWaalsContact O-N 3.13Å; V49-P58 HydrophobicContact CG2-CG 3.72Å
50	E	50.2	Low	61.8	Low	186 Å²	186	83.9 Å²	83.9	87%	0.869	41%	0.411	S	S	*	.	S	Bend	trans	-72.2	-5.1	-171.1	-61.6	-173.5	124.2	0	0	114.1
51	H	42.8	Very low	62.6	Low	150 Å²	150	78.6 Å²	78.6	69%	0.694	39%	0.387	S	S	*	.	S	Bend	trans	-123.9	103.4	-177.5	-65.9	-12	0	0	0	111.2	V49 Y53	V49-H51 PolarHBondContact O-N 2.74Å; V49-H51 VanDerWaalsContact O-N 3.13Å; H51-Y53 PolarHBondContact O-N 2.73Å
52	N	34	Very low	63	Low	156 Å²	156	76.8 Å²	76.8	83%	0.834	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	39.7	-162.4	-159	22	0	0	0	114.8
53	Y	35.7	Very low	63.4	Low	231 Å²	231	75 Å²	75	91%	0.906	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-9.5	175.9	-73.6	-78.8	0	0	0	113.4	H51	H51-Y53 PolarHBondContact O-N 2.73Å
54	S	37.1	Very low	63.7	Low	57 Å²	57	76.9 Å²	76.9	40%	0.399	38%	0.377	S	S	.	.			trans	-94.9	112.5	176.7	168.6	0	0	0	0	111	T56	S54-T56 PolarHBondContact O-N 3.45Å; S54-T56 PolarHBondContact OG-N 2.74Å; S54-T56 PolarHBondContact OG-O 3.49Å; S54-T56 PolarHBondContact OG-OG1 3.47Å
55	Q	50.1	Low	63.8	Low	180 Å²	180	78.7 Å²	78.7	84%	0.841	38%	0.382	S	S	*	.	S	Bend	trans	-66.6	-19.9	170.5	-68.1	-175.3	-5.3	0	0	113	V57	Q55-V57 PolarHBondContact O-N 3.15Å
56	T	57.8	Low	63.6	Low	55 Å²	55	80.7 Å²	80.7	34%	0.337	41%	0.409	S	S	.	.			trans	-81.7	107.1	173.8	50.6	0	0	0	0	110.8	S54	S54-T56 PolarHBondContact O-N 3.45Å; S54-T56 PolarHBondContact OG-N 2.74Å; S54-T56 PolarHBondContact OG-O 3.49Å; S54-T56 PolarHBondContact OG-OG1 3.47Å
57	V	67.5	Low	62.9	Low	48 Å²	48	83.8 Å²	83.8	29%	0.291	43%	0.433	S	S	.	.			trans	-77.7	127.1	169.1	-177.2	0	0	0	0	108.9	R46 Q55 A241	R46-V57 HydrophobicContact CB-CG1 3.71Å; R46-V57 HydrophobicContact CG-CG1 3.83Å; Q55-V57 PolarHBondContact O-N 3.15Å; V57-A241 HydrophobicContact CB-CB 4.28Å; V57-A241 PolarHBondContact O-N 3.43Å
58	P	76.8	Confident	62.7	Low	24 Å²	24	80.5 Å²	80.5	16%	0.156	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	140.3	173.6	-3	18.2	0	0	0	110.6	R46 K47 V49 E238 T239	R46-P58 WeakPolarHBondContact CA-O 3.45Å; K47-P58 HydrophobicContact CB-CB 4.02Å; K47-P58 HydrophobicContact CB-CG 4.22Å; K47-P58 HydrophobicContact CD-CB 4.42Å; K47-P58 PolarHBondContact N-O 3.29Å; V49-P58 HydrophobicContact CG2-CG 3.72Å; P58-E238 HydrophobicContact CB-CG 4.47Å; P58-T239 WeakPolarHBondContact CA-O 3.35Å
59	C	79.2	Confident	63	Low	0 Å²	0	75.2 Å²	75.2	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	119.9	-174.9	-70.2	0	0	0	0	109.6	C32 F34 E238 T239 A241	C32-C59 WeakPolarHBondContact CA-SG 3.31Å; C32-C59 HydrophobicContact CB-CB 3.52Å; C32-C59 WeakPolarHBondContact CB-SG 3.11Å; C32-C59 WeakPolarHBondContact SG-CB 3.32Å; C32-C59 CovalentContact SG-SG 2.02Å; C32-C59 PolarHBondContact SG-SG 2.76Å; F34-C59 HydrophobicContact CE1-CB 4.33Å; C59-E238 WeakPolarHBondContact O-CA 3.46Å; C59-T239 VanDerWaalsContact CB-OG1 3.28Å; C59-T239 WeakPolarHBondContact CB-OG1 3.37Å; C59-T239 PolarHBondContact N-O 3.08Å; C59-T239 PolarHBondContact O-N 2.75Å; C59-T239 PolarHBondContact O-OG1 3.49Å; C59-A241 VanDerWaalsContact SG-CA 3.5Å; C59-A241 VanDerWaalsContact SG-CB 3.59Å; C59-A241 PolarHBondContact SG-N 3.21Å
60	V	81	Confident	63.3	Low	2 Å²	2	72.2 Å²	72.2	1%	0.012	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	99.6	178.7	-178.6	0	0	0	0	108.1	G44 Y45 K47 A91 F93 A236 C237	G44-V60 CarbonylContact C-O 3.59Å; G44-V60 WeakPolarHBondContact CA-O 3.02Å; Y45-V60 HydrophobicContact CD1-CB 3.81Å; Y45-V60 HydrophobicContact CD1-CG1 4.13Å; Y45-V60 HydrophobicContact CE1-CB 3.48Å; Y45-V60 VanDerWaalsContact CE1-CB 3.48Å; Y45-V60 HydrophobicContact CE1-CG1 3.47Å; Y45-V60 VanDerWaalsContact CE1-CG1 3.47Å; Y45-V60 HydrophobicContact CE1-CG2 4.07Å; Y45-V60 HydrophobicContact CE2-CB 4.26Å; Y45-V60 HydrophobicContact CE2-CG2 4.07Å; Y45-V60 HydrophobicContact CG-CB 4.37Å; Y45-V60 PolarHBondContact N-O 2.81Å; Y45-V60 PolarHBondContact O-N 3.47Å; K47-V60 HydrophobicContact CB-CG2 4.25Å; K47-V60 HydrophobicContact CD-CG2 4.34Å; V60-A91 HydrophobicContact CG1-CB 4.4Å; V60-F93 HydrophobicContact CG1-CE1 4.15Å; V60-F93 HydrophobicContact CG1-CZ 3.94Å; V60-A236 HydrophobicContact CG1-CB 3.61Å; V60-C237 WeakPolarHBondContact CA-O 3.46Å
61	T	79.1	Confident	63.9	Low	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	127.1	-178.9	-58.9	0	0	0	0	109.9	P33 F34 F41 I63 M86 A236 C237	P33-T61 HydrophobicContact CB-CG2 4.32Å; F34-T61 HydrophobicContact CB-CG2 4.32Å; F41-T61 HydrophobicContact CB-CG2 4.42Å; F41-T61 HydrophobicContact CD1-CG2 3.55Å; F41-T61 HydrophobicContact CD2-CG2 4.43Å; F41-T61 HydrophobicContact CE1-CG2 3.85Å; F41-T61 HydrophobicContact CG-CG2 3.88Å; F41-T61 HydrophobicContact CZ-CG2 4.39Å; T61-I63 HydrophobicContact CG2-CD1 4.01Å; T61-I63 HydrophobicContact CG2-CG1 4.15Å; T61-M86 HydrophobicContact CG2-CE 4.41Å; T61-M86 HydrophobicContact CG2-SD 4.3Å; T61-A236 CarbonylContact O-C 3.48Å; T61-A236 WeakPolarHBondContact O-CA 3.3Å; T61-C237 PolarHBondContact N-O 3.25Å; T61-C237 PolarHBondContact O-N 3.23Å
62	M	77.7	Confident	64.8	Low	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	126.9	178.4	-67.6	-177.1	170.7	0	0	111.5	V42 G43 Y45 L99 W105 F106 L113 F235 A236	V42-M62 PolarHBondContact N-O 2.03Å; G43-M62 PolarHBondContact O-N 3.48Å; Y45-M62 HydrophobicContact CE1-CE 4.3Å; M62-L99 HydrophobicContact CE-CD2 4.02Å; M62-W105 HydrophobicContact CE-CD2 4.45Å; M62-W105 HydrophobicContact CE-CE3 3.77Å; M62-W105 HydrophobicContact CE-CH2 3.78Å; M62-W105 HydrophobicContact CE-CZ2 4.46Å; M62-W105 HydrophobicContact CE-CZ3 3.39Å; M62-W105 HydrophobicContact SD-CD2 3.81Å; M62-W105 HydrophobicContact SD-CE3 3.49Å; M62-W105 HydrophobicContact SD-CG 4.42Å; M62-W105 HydrophobicContact SD-CH2 4.37Å; M62-W105 HydrophobicContact SD-CZ3 3.8Å; M62-F106 HydrophobicContact SD-CE1 4.35Å; M62-F106 HydrophobicContact SD-CE2 4.17Å; M62-F106 HydrophobicContact SD-CZ 3.51Å; M62-F106 VanDerWaalsContact SD-CZ 3.51Å; M62-L113 HydrophobicContact CE-CD1 3.6Å; M62-L113 HydrophobicContact CE-CD2 3.82Å; M62-L113 HydrophobicContact CE-CG 4.39Å; M62-L113 HydrophobicContact CG-CD2 4.29Å; M62-L113 HydrophobicContact SD-CD1 4.24Å; M62-L113 HydrophobicContact SD-CD2 3.99Å; M62-F235 WeakPolarHBondContact CA-O 3.44Å; M62-A236 HydrophobicContact CG-CB 4.1Å
63	I	76.3	Confident	65.7	Low	13 Å²	13	62.6 Å²	62.6	7%	0.067	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	141.7	-175.9	-68	146.1	0	0	0	107.8	F41 T61 Y79 M86 Y234 F235	F41-I63 HydrophobicContact CD1-CD1 4.04Å; F41-I63 HydrophobicContact CD1-CG1 3.49Å; F41-I63 VanDerWaalsContact CD1-CG1 3.49Å; F41-I63 HydrophobicContact CE1-CD1 3.84Å; F41-I63 HydrophobicContact CE1-CG1 3.79Å; T61-I63 HydrophobicContact CG2-CD1 4.01Å; T61-I63 HydrophobicContact CG2-CG1 4.15Å; I63-Y79 VanDerWaalsContact CB-OH 3.23Å; I63-Y79 WeakPolarHBondContact CB-OH 2.99Å; I63-Y79 PolarHBondContact O-OH 3.33Å; I63-Y79 VanDerWaalsContact O-OH 3.05Å; I63-M86 HydrophobicContact CD1-CE 3.56Å; I63-Y234 WeakPolarHBondContact O-CA 3.18Å; I63-Y234 WeakPolarHBondContact O-CB 3.28Å; I63-F235 HydrophobicContact CB-CE1 4.46Å; I63-F235 HydrophobicContact CB-CE2 3.65Å; I63-F235 HydrophobicContact CB-CZ 3.63Å; I63-F235 HydrophobicContact CD1-CE2 3.53Å; I63-F235 HydrophobicContact CD1-CZ 4.25Å; I63-F235 HydrophobicContact CG1-CE2 4.19Å; I63-F235 HydrophobicContact CG2-CE1 3.95Å; I63-F235 HydrophobicContact CG2-CE2 3.93Å; I63-F235 HydrophobicContact CG2-CZ 3.18Å; I63-F235 PolarHBondContact N-O 3.18Å; I63-F235 VanDerWaalsContact N-O 3.14Å; I63-F235 PolarHBondContact O-N 2.92Å
64	P	77	Confident	66.8	Low	52 Å²	52	51.6 Å²	51.6	34%	0.338	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	152.8	178.4	30.7	-34.4	0	0	0	111.3	V42 G66 Y234 F235	V42-P64 HydrophobicContact CG2-CB 4.31Å; V42-P64 HydrophobicContact CG2-CG 4.17Å; P64-G66 VanDerWaalsContact C-N 3.29Å; P64-G66 PolarHBondContact O-N 3.47Å; P64-Y234 VanDerWaalsContact CA-CD1 3.5Å; P64-Y234 HydrophobicContact CB-CD1 3.92Å; P64-Y234 HydrophobicContact CB-CE1 3.91Å; P64-F235 WeakPolarHBondContact O-CE1 3.17Å
65	K	74.8	Confident	67.9	Low	47 Å²	47	49.2 Å²	49.2	20%	0.204	28%	0.279	C	S	.	.			trans	-48.6	-45	179.9	176.5	165.2	174.2	-166.6	0	114.2	D67 V68 Q230 W232 D233	K65-D67 PolarHBondContact O-N 3.45Å; K65-V68 WeakPolarHBondContact O-CB 3.04Å; K65-V68 VanDerWaalsContact O-CG2 3.22Å; K65-V68 WeakPolarHBondContact O-CG2 3.46Å; K65-V68 PolarHBondContact O-N 3.14Å; K65-Q230 PolarHBondContact NZ-O 3.18Å; K65-W232 HydrophobicContact CB-CE3 4.15Å; K65-W232 HydrophobicContact CB-CH2 4.15Å; K65-W232 HydrophobicContact CB-CZ3 3.48Å; K65-W232 VanDerWaalsContact CB-CZ3 3.48Å; K65-W232 HydrophobicContact CD-CD2 4.47Å; K65-W232 HydrophobicContact CD-CE3 3.99Å; K65-W232 HydrophobicContact CD-CH2 3.75Å; K65-W232 HydrophobicContact CD-CZ2 4.26Å; K65-W232 HydrophobicContact CD-CZ3 3.6Å; K65-W232 VanDerWaalsContact CD-O 3.29Å; K65-W232 WeakPolarHBondContact CD-O 3.32Å; K65-W232 HydrophobicContact CG-CE3 4.25Å; K65-W232 HydrophobicContact CG-CH2 3.58Å; K65-W232 HydrophobicContact CG-CZ3 3.43Å; K65-W232 VanDerWaalsContact CG-CZ3 3.43Å; K65-D233 VanDerWaalsContact CB-O 3.29Å; K65-D233 WeakPolarHBondContact CB-O 3.42Å; K65-D233 PolarHBondContact N-O 3.23Å
66	G	69.7	Low	68.6	Low	62 Å²	62	40.8 Å²	40.8	64%	0.639	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	-136.6	-179.9	0	0	0	0	0	112.6	P64 V68	P64-G66 VanDerWaalsContact C-N 3.29Å; P64-G66 PolarHBondContact O-N 3.47Å; G66-V68 PolarHBondContact O-N 3.12Å
67	D	62.1	Low	68.8	Low	160 Å²	160	40.8 Å²	40.8	86%	0.856	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	9.6	178.5	-59.1	-50.8	0	0	0	114.3	K65 T69	K65-D67 PolarHBondContact O-N 3.45Å; D67-T69 PolarHBondContact O-N 3.33Å
68	V	68.1	Low	68.4	Low	7 Å²	7	40.3 Å²	40.3	4%	0.042	24%	0.242	C	C	.	.			trans	-67.7	125.6	-175.1	167.9	0	0	0	0	111.6	K65 G66 L76 Y79 W232 F235	K65-V68 WeakPolarHBondContact O-CB 3.04Å; K65-V68 VanDerWaalsContact O-CG2 3.22Å; K65-V68 WeakPolarHBondContact O-CG2 3.46Å; K65-V68 PolarHBondContact O-N 3.14Å; G66-V68 PolarHBondContact O-N 3.12Å; V68-L76 HydrophobicContact CG1-CB 4.49Å; V68-L76 HydrophobicContact CG1-CD2 3.71Å; V68-Y79 HydrophobicContact CB-CD2 4.18Å; V68-Y79 HydrophobicContact CB-CE2 4.26Å; V68-Y79 HydrophobicContact CG1-CD2 3.49Å; V68-Y79 VanDerWaalsContact CG1-CD2 3.49Å; V68-Y79 HydrophobicContact CG1-CE2 3.88Å; V68-Y79 HydrophobicContact CG2-CD2 3.64Å; V68-Y79 HydrophobicContact CG2-CE2 3.68Å; V68-W232 HydrophobicContact CB-CH2 4.23Å; V68-W232 HydrophobicContact CG1-CH2 3.73Å; V68-W232 HydrophobicContact CG1-CZ2 4.34Å; V68-F235 HydrophobicContact CG2-CE1 3.77Å
69	T	67.1	Low	67.5	Low	73 Å²	73	39.2 Å²	39.2	45%	0.448	23%	0.234	S	C	.	.			trans	-104.1	157.3	171	52	0	0	0	0	111.8	D67 S77 S78	D67-T69 PolarHBondContact O-N 3.33Å; T69-S77 PolarHBondContact O-N 3.44Å; T69-S77 PolarHBondContact O-OG 3.02Å; T69-S77 PolarHBondContact OG1-OG 3.5Å; T69-S78 PolarHBondContact N-OG 3.27Å
70	V	65.5	Low	66.4	Low	13 Å²	13	41 Å²	41	8%	0.079	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-109.5	129.6	174.3	173.1	0	0	0	0	107.4	G74 V75 L76 C227 L228 Q230 W232	V70-G74 WeakPolarHBondContact CG1-O 3.26Å; V70-V75 WeakPolarHBondContact CA-O 3.21Å; V70-L76 HydrophobicContact CG2-CD2 3.95Å; V70-C227 HydrophobicContact CG1-CB 3.68Å; V70-L228 HydrophobicContact CG1-CD2 4.18Å; V70-Q230 HydrophobicContact CB-CG 4.33Å; V70-Q230 HydrophobicContact CG2-CG 3.93Å; V70-W232 HydrophobicContact CG2-CZ2 4Å
71	D	63.1	Low	65.5	Low	59 Å²	59	45.8 Å²	45.8	32%	0.316	27%	0.267	S	S	.	.			trans	-81.6	176.4	178.4	75.1	29.7	0	0	0	113.1	S73 G74 V75 L228	D71-S73 PolarHBondContact O-N 3.49Å; D71-S73 VanDerWaalsContact OD1-CA 3.26Å; D71-S73 WeakPolarHBondContact OD1-CA 3.28Å; D71-S73 WeakPolarHBondContact OD1-CB 3.17Å; D71-S73 PolarHBondContact OD1-N 3.42Å; D71-S73 PolarHBondContact OD1-OG 3.06Å; D71-S73 PolarHBondContact OD2-OG 3.28Å; D71-G74 WeakPolarHBondContact O-CA 3.45Å; D71-G74 PolarHBondContact O-N 3.49Å; D71-G74 PolarHBondContact OD1-N 3.33Å; D71-G74 VanDerWaalsContact OD1-N 3.12Å; D71-V75 PolarHBondContact N-O 3.14Å; D71-V75 PolarHBondContact OD1-N 2.8Å; D71-L228 WeakPolarHBondContact O-CD2 3.43Å
72	Q	61.6	Low	64.8	Low	179 Å²	179	50.9 Å²	50.9	84%	0.836	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-21	-178.6	-66.7	-176.2	-8.7	0	0	114.1	G74	Q72-G74 PolarHBondContact O-N 3.08Å
73	S	52.3	Low	64.6	Low	52 Å²	52	51 Å²	51	36%	0.364	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	0.1	170.1	77.5	0	0	0	0	112.7	D71 V75	D71-S73 PolarHBondContact O-N 3.49Å; D71-S73 VanDerWaalsContact OD1-CA 3.26Å; D71-S73 WeakPolarHBondContact OD1-CA 3.28Å; D71-S73 WeakPolarHBondContact OD1-CB 3.17Å; D71-S73 PolarHBondContact OD1-N 3.42Å; D71-S73 PolarHBondContact OD1-OG 3.06Å; D71-S73 PolarHBondContact OD2-OG 3.28Å; S73-V75 VanDerWaalsContact C-N 3.33Å; S73-V75 WeakPolarHBondContact OG-CG2 3.33Å
74	G	58	Low	64.1	Low	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	86.6	-0.7	-178.5	0	0	0	0	0	114.3	V70 D71 Q72 H117 C227	V70-G74 WeakPolarHBondContact CG1-O 3.26Å; D71-G74 WeakPolarHBondContact O-CA 3.45Å; D71-G74 PolarHBondContact O-N 3.49Å; D71-G74 PolarHBondContact OD1-N 3.33Å; D71-G74 VanDerWaalsContact OD1-N 3.12Å; Q72-G74 PolarHBondContact O-N 3.08Å; G74-H117 PolarHBondContact O-CE1 2.9Å; G74-H117 PolarHBondContact O-ND1 2.98Å; G74-C227 WeakPolarHBondContact O-CB 3.49Å
75	V	61.5	Low	63.6	Low	7 Å²	7	55.9 Å²	55.9	4%	0.042	31%	0.306	C	S	.	.			trans	-82.6	142.3	-169.8	176.8	0	0	0	0	110.8	V70 D71 S73 S77 H117 I156 L158	V70-V75 WeakPolarHBondContact CA-O 3.21Å; D71-V75 PolarHBondContact N-O 3.14Å; D71-V75 PolarHBondContact OD1-N 2.8Å; S73-V75 VanDerWaalsContact C-N 3.33Å; S73-V75 WeakPolarHBondContact OG-CG2 3.33Å; V75-S77 PolarHBondContact O-N 3.34Å; V75-H117 WeakPolarHBondContact CA-CE1 3.49Å; V75-I156 HydrophobicContact CG2-CG2 4.4Å; V75-L158 HydrophobicContact CG1-CD1 3.62Å; V75-L158 HydrophobicContact CG1-CG 4.2Å
76	L	65.1	Low	63.3	Low	3 Å²	3	54.2 Å²	54.2	2%	0.016	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-70.2	98.9	176.6	-65.3	162.6	0	0	0	109.4	V68 V70 S78 Y79 V90 F114 H117 W232	V68-L76 HydrophobicContact CG1-CB 4.49Å; V68-L76 HydrophobicContact CG1-CD2 3.71Å; V70-L76 HydrophobicContact CG2-CD2 3.95Å; L76-S78 VanDerWaalsContact C-N 3.27Å; L76-S78 PolarHBondContact O-N 3.05Å; L76-Y79 HydrophobicContact CB-CD2 3.66Å; L76-Y79 HydrophobicContact CB-CG 3.62Å; L76-Y79 HydrophobicContact CD1-CD1 4.21Å; L76-Y79 HydrophobicContact CD1-CD2 3.77Å; L76-Y79 HydrophobicContact CD1-CE2 4.16Å; L76-Y79 HydrophobicContact CD1-CG 3.85Å; L76-Y79 HydrophobicContact CD2-CD2 4.03Å; L76-Y79 HydrophobicContact CD2-CE2 4.46Å; L76-Y79 HydrophobicContact CG-CD2 4.03Å; L76-Y79 HydrophobicContact CG-CG 4.26Å; L76-Y79 WeakPolarHBondContact O-CB 3.37Å; L76-Y79 PolarHBondContact O-N 2.8Å; L76-V90 HydrophobicContact CD1-CG1 4.39Å; L76-F114 HydrophobicContact CD1-CD1 3.71Å; L76-F114 HydrophobicContact CD1-CD2 4.24Å; L76-F114 HydrophobicContact CD1-CE1 3.43Å; L76-F114 VanDerWaalsContact CD1-CE1 3.43Å; L76-F114 HydrophobicContact CD1-CE2 3.98Å; L76-F114 HydrophobicContact CD1-CG 4.12Å; L76-F114 HydrophobicContact CD1-CZ 3.61Å; L76-F114 HydrophobicContact CD2-CD2 4.4Å; L76-F114 HydrophobicContact CD2-CE2 4.3Å; L76-F114 HydrophobicContact CG-CE1 4.37Å; L76-F114 HydrophobicContact CG-CE2 4.14Å; L76-F114 HydrophobicContact CG-CZ 4.06Å; L76-H117 PolarHBondContact N-CE1 3.24Å; L76-H117 VanDerWaalsContact N-CE1 3.28Å; L76-H117 PolarHBondContact N-NE2 3.01Å; L76-W232 HydrophobicContact CD2-CH2 3.64Å; L76-W232 HydrophobicContact CD2-CZ2 3.3Å
77	S	61.8	Low	63.4	Low	56 Å²	56	56.3 Å²	56.3	39%	0.392	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.9	-165.5	70	0	0	0	0	114.3	T69 V75	T69-S77 PolarHBondContact O-N 3.44Å; T69-S77 PolarHBondContact O-OG 3.02Å; T69-S77 PolarHBondContact OG1-OG 3.5Å; V75-S77 PolarHBondContact O-N 3.34Å
78	S	58.2	Low	63.8	Low	38 Å²	38	49.7 Å²	49.7	27%	0.266	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	11.3	-166.2	-3.6	0	0	0	0	111.6	T69 L76	T69-S78 PolarHBondContact N-OG 3.27Å; L76-S78 VanDerWaalsContact C-N 3.27Å; L76-S78 PolarHBondContact O-N 3.05Å
79	Y	58.6	Low	64	Low	1 Å²	1	56.7 Å²	56.7	0%	0.004	29%	0.287	C	S	.	.	H	α-helix	trans	-121.4	-33.2	-145.9	-141.8	-69.2	0	0	0	115	I63 V68 L76 K81 Y82 C83 V90 F235	I63-Y79 VanDerWaalsContact CB-OH 3.23Å; I63-Y79 WeakPolarHBondContact CB-OH 2.99Å; I63-Y79 PolarHBondContact O-OH 3.33Å; I63-Y79 VanDerWaalsContact O-OH 3.05Å; V68-Y79 HydrophobicContact CB-CD2 4.18Å; V68-Y79 HydrophobicContact CB-CE2 4.26Å; V68-Y79 HydrophobicContact CG1-CD2 3.49Å; V68-Y79 VanDerWaalsContact CG1-CD2 3.49Å; V68-Y79 HydrophobicContact CG1-CE2 3.88Å; V68-Y79 HydrophobicContact CG2-CD2 3.64Å; V68-Y79 HydrophobicContact CG2-CE2 3.68Å; L76-Y79 HydrophobicContact CB-CD2 3.66Å; L76-Y79 HydrophobicContact CB-CG 3.62Å; L76-Y79 HydrophobicContact CD1-CD1 4.21Å; L76-Y79 HydrophobicContact CD1-CD2 3.77Å; L76-Y79 HydrophobicContact CD1-CE2 4.16Å; L76-Y79 HydrophobicContact CD1-CG 3.85Å; L76-Y79 HydrophobicContact CD2-CD2 4.03Å; L76-Y79 HydrophobicContact CD2-CE2 4.46Å; L76-Y79 HydrophobicContact CG-CD2 4.03Å; L76-Y79 HydrophobicContact CG-CG 4.26Å; L76-Y79 WeakPolarHBondContact O-CB 3.37Å; L76-Y79 PolarHBondContact O-N 2.8Å; Y79-K81 PolarHBondContact O-N 3.08Å; Y79-Y82 PolarHBondContact O-N 3.39Å; Y79-C83 PolarHBondContact O-N 3.39Å; Y79-C83 VanDerWaalsContact O-N 3.17Å; Y79-V90 HydrophobicContact CD1-CG2 3.72Å; Y79-V90 HydrophobicContact CE1-CG2 4.31Å; Y79-F235 AromaticContact CD1-CD2 3.9Å; Y79-F235 HydrophobicContact CD1-CD2 3.9Å; Y79-F235 AromaticContact CD1-CE2 3.8Å; Y79-F235 HydrophobicContact CD1-CE2 3.8Å; Y79-F235 HydrophobicContact CD1-CG 4.37Å; Y79-F235 HydrophobicContact CD1-CZ 4.19Å; Y79-F235 AromaticContact CD2-CD1 3.9Å; Y79-F235 HydrophobicContact CD2-CD1 3.9Å; Y79-F235 AromaticContact CD2-CE1 3.77Å; Y79-F235 HydrophobicContact CD2-CE1 3.77Å; Y79-F235 HydrophobicContact CD2-CG 4.38Å; Y79-F235 HydrophobicContact CD2-CZ 4.13Å; Y79-F235 HydrophobicContact CE1-CB 4.31Å; Y79-F235 AromaticContact CE1-CD1 3.73Å; Y79-F235 HydrophobicContact CE1-CD1 3.73Å; Y79-F235 AromaticContact CE1-CD2 2.54Å; Y79-F235 HydrophobicContact CE1-CD2 2.54Å; Y79-F235 AromaticContact CE1-CE1 3.73Å; Y79-F235 HydrophobicContact CE1-CE1 3.73Å; Y79-F235 AromaticContact CE1-CE2 2.53Å; Y79-F235 HydrophobicContact CE1-CE2 2.53Å; Y79-F235 AromaticContact CE1-CG 3.17Å; Y79-F235 HydrophobicContact CE1-CG 3.17Å; Y79-F235 AromaticContact CE1-CZ 3.15Å; Y79-F235 HydrophobicContact CE1-CZ 3.15Å; Y79-F235 HydrophobicContact CE2-CB 4.27Å; Y79-F235 AromaticContact CE2-CD1 2.54Å; Y79-F235 HydrophobicContact CE2-CD1 2.54Å; Y79-F235 AromaticContact CE2-CD2 3.72Å; Y79-F235 HydrophobicContact CE2-CD2 3.72Å; Y79-F235 AromaticContact CE2-CE1 2.53Å; Y79-F235 HydrophobicContact CE2-CE1 2.53Å; Y79-F235 AromaticContact CE2-CE2 3.71Å; Y79-F235 HydrophobicContact CE2-CE2 3.71Å; Y79-F235 AromaticContact CE2-CG 3.16Å; Y79-F235 HydrophobicContact CE2-CG 3.16Å; Y79-F235 AromaticContact CE2-CZ 3.14Å; Y79-F235 HydrophobicContact CE2-CZ 3.14Å; Y79-F235 AromaticContact CZ-CD1 2.29Å; Y79-F235 AromaticContact CZ-CD2 2.28Å; Y79-F235 AromaticContact CZ-CE1 2.29Å; Y79-F235 AromaticContact CZ-CE2 2.28Å; Y79-F235 AromaticContact CZ-CG 2.26Å; Y79-F235 AromaticContact CZ-CZ 2.26Å; Y79-F235 WeakPolarHBondContact OH-CD1 3.48Å; Y79-F235 WeakPolarHBondContact OH-CD2 3.45Å; Y79-F235 WeakPolarHBondContact OH-CE1 3.46Å; Y79-F235 WeakPolarHBondContact OH-CE2 3.34Å; Y79-F235 WeakPolarHBondContact OH-CG 3.01Å; Y79-F235 WeakPolarHBondContact OH-CZ 3.38Å
80	S	56	Low	64.2	Low	36 Å²	36	54.5 Å²	54.5	25%	0.252	27%	0.274	S	S	.	.	H	α-helix	trans	-43.3	-49.2	156.4	50	0	0	0	0	108.5	Y82 C83 H84	S80-Y82 PolarHBondContact O-N 3.05Å; S80-C83 PolarHBondContact O-N 3.07Å; S80-H84 WeakPolarHBondContact O-CA 3.46Å; S80-H84 WeakPolarHBondContact O-CB 3.47Å; S80-H84 PolarHBondContact O-N 3.1Å
81	K	62.7	Low	64.6	Low	104 Å²	104	54 Å²	54	45%	0.452	27%	0.271	S	S	.	.	H	α-helix	trans	-49.4	-55.5	178.4	-165.1	169.3	-175.3	175.6	0	113.9	Y79 Q85 E271	Y79-K81 PolarHBondContact O-N 3.08Å; K81-Q85 WeakPolarHBondContact O-CB 3.37Å; K81-Q85 WeakPolarHBondContact O-CG 3.33Å; K81-Q85 PolarHBondContact O-N 3.49Å; K81-E271 VanDerWaalsContact CE-OE2 3.27Å; K81-E271 WeakPolarHBondContact CE-OE2 3.35Å; K81-E271 IonicContact NZ-OE2 2.68Å; K81-E271 PolarHBondContact NZ-OE2 2.92Å
82	Y	64.6	Low	64.8	Low	106 Å²	106	53.1 Å²	53.1	42%	0.416	27%	0.265	S	S	.	.	H	α-helix	trans	-66.9	-49	-178.1	-75.8	-72.7	0	0	0	113.5	Y79 S80 M86 F235	Y79-Y82 PolarHBondContact O-N 3.39Å; S80-Y82 PolarHBondContact O-N 3.05Å; Y82-M86 PolarHBondContact O-N 2.72Å; Y82-F235 HydrophobicContact CD2-CZ 4.17Å; Y82-F235 HydrophobicContact CG-CZ 4.3Å
83	C	72.1	Confident	65	Low	3 Å²	3	45.4 Å²	45.4	2%	0.02	23%	0.229	C	C	.	.	H	α-helix	trans	-69.6	-40	-179.4	-61.5	0	0	0	0	111.9	Y79 S80 M86 E87 G88 C237	Y79-C83 PolarHBondContact O-N 3.39Å; Y79-C83 VanDerWaalsContact O-N 3.17Å; S80-C83 PolarHBondContact O-N 3.07Å; C83-M86 CarbonylContact O-C 3.58Å; C83-M86 WeakPolarHBondContact O-CA 3.41Å; C83-M86 PolarHBondContact O-N 3.24Å; C83-E87 PolarHBondContact O-N 3.05Å; C83-G88 CarbonylContact C-O 3.57Å; C83-G88 VanDerWaalsContact C-O 3.28Å; C83-G88 CarbonylContact O-C 3.53Å; C83-G88 WeakPolarHBondContact O-CA 3.35Å; C83-G88 PolarHBondContact O-N 2.79Å; C83-G88 VanDerWaalsContact O-O 3.14Å; C83-C237 WeakPolarHBondContact CA-SG 3.34Å; C83-C237 HydrophobicContact CB-CB 3.87Å; C83-C237 WeakPolarHBondContact CB-SG 3.41Å; C83-C237 WeakPolarHBondContact SG-CB 3.49Å; C83-C237 CovalentContact SG-SG 2.04Å; C83-C237 PolarHBondContact SG-SG 3.33Å
84	H	66.9	Low	65.2	Low	108 Å²	108	46.8 Å²	46.8	50%	0.5	23%	0.232	S	C	.	.	H	α-helix	trans	-67.9	-35.3	178.7	-175	97	0	0	0	112.1	S80 M86 E87 D160	S80-H84 WeakPolarHBondContact O-CA 3.46Å; S80-H84 WeakPolarHBondContact O-CB 3.47Å; S80-H84 PolarHBondContact O-N 3.1Å; H84-M86 PolarHBondContact O-N 3.11Å; H84-E87 PolarHBondContact O-N 2.83Å; H84-D160 IonicContact CE1-OD1 3.34Å
85	Q	65.6	Low	65.3	Low	59 Å²	59	50.4 Å²	50.4	28%	0.276	25%	0.252	S	S	.	.	H	α-helix	trans	-59.1	-33.9	169	-82.3	175	-18.5	0	0	112	K81 E87	K81-Q85 WeakPolarHBondContact O-CB 3.37Å; K81-Q85 WeakPolarHBondContact O-CG 3.33Å; K81-Q85 PolarHBondContact O-N 3.49Å; Q85-E87 VanDerWaalsContact C-N 3.32Å
86	M	69.2	Low	65.1	Low	13 Å²	13	51.5 Å²	51.5	6%	0.064	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	9.8	173.3	-63	-171.9	-70.5	0	0	114.7	P33 F41 T61 I63 Y82 C83 H84 G88 C237 T239 W245	P33-M86 HydrophobicContact CB-SD 3.77Å; P33-M86 HydrophobicContact CG-SD 3.89Å; F41-M86 HydrophobicContact CE1-SD 4.05Å; F41-M86 HydrophobicContact CZ-SD 3.88Å; T61-M86 HydrophobicContact CG2-CE 4.41Å; T61-M86 HydrophobicContact CG2-SD 4.3Å; I63-M86 HydrophobicContact CD1-CE 3.56Å; Y82-M86 PolarHBondContact O-N 2.72Å; C83-M86 CarbonylContact O-C 3.58Å; C83-M86 WeakPolarHBondContact O-CA 3.41Å; C83-M86 PolarHBondContact O-N 3.24Å; H84-M86 PolarHBondContact O-N 3.11Å; M86-G88 PolarHBondContact O-N 2.7Å; M86-G88 VanDerWaalsContact O-N 3.15Å; M86-C237 HydrophobicContact CE-CB 3.62Å; M86-C237 WeakPolarHBondContact CE-SG 3.49Å; M86-T239 HydrophobicContact CB-CG2 3.62Å; M86-T239 HydrophobicContact CE-CG2 4.32Å; M86-T239 HydrophobicContact SD-CG2 4.4Å; M86-W245 HydrophobicContact CB-CH2 4.31Å; M86-W245 HydrophobicContact CB-CZ2 4.21Å; M86-W245 HydrophobicContact CG-CH2 4.42Å
87	E	71.4	Confident	64.6	Low	106 Å²	106	57.4 Å²	57.4	50%	0.495	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	31.1	-173.3	-60.8	179.5	-173.6	0	0	113.5	C83 H84 Q85 K244	C83-E87 PolarHBondContact O-N 3.05Å; H84-E87 PolarHBondContact O-N 2.83Å; Q85-E87 VanDerWaalsContact C-N 3.32Å; E87-K244 IonicContact OE1-NZ 2.94Å; E87-K244 PolarHBondContact OE1-NZ 3.15Å; E87-K244 IonicContact OE2-NZ 2.68Å; E87-K244 PolarHBondContact OE2-NZ 3.47Å
88	G	70.7	Confident	64.3	Low	21 Å²	21	57.1 Å²	57.1	22%	0.216	30%	0.299	C	S	.	.			trans	-120.2	-178.1	178	0	0	0	0	0	113.4	C83 M86 E238	C83-G88 CarbonylContact C-O 3.57Å; C83-G88 VanDerWaalsContact C-O 3.28Å; C83-G88 CarbonylContact O-C 3.53Å; C83-G88 WeakPolarHBondContact O-CA 3.35Å; C83-G88 PolarHBondContact O-N 2.79Å; C83-G88 VanDerWaalsContact O-O 3.14Å; M86-G88 PolarHBondContact O-N 2.7Å; M86-G88 VanDerWaalsContact O-N 3.15Å; G88-E238 CarbonylContact C-O 3.57Å; G88-E238 WeakPolarHBondContact CA-O 3.42Å
89	R	71.9	Confident	64.6	Low	153 Å²	153	55.9 Å²	55.9	58%	0.577	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	161.7	177.7	59.9	-175.7	176.8	-170.8	1.7	110.2	A91 C237 E238	R89-A91 PolarHBondContact O-N 2.91Å; R89-C237 CarbonylContact O-C 3.56Å; R89-C237 VanDerWaalsContact O-CA 3.23Å; R89-C237 WeakPolarHBondContact O-CA 3.48Å; R89-E238 HydrophobicContact CG-CB 4.19Å; R89-E238 IonicContact CZ-OE2 3.83Å; R89-E238 PolarHBondContact N-O 2.89Å; R89-E238 IonicContact NE-OE2 3.71Å; R89-E238 PolarHBondContact NE-OE2 3.2Å; R89-E238 IonicContact NH2-OE2 3.24Å; R89-E238 PolarHBondContact NH2-OE2 3.23Å; R89-E238 PolarHBondContact O-N 3.24Å
90	V	72.2	Confident	64.6	Low	27 Å²	27	58.3 Å²	58.3	16%	0.164	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	130	167.5	-176.3	0	0	0	0	108.2	L76 Y79 H92 F114	L76-V90 HydrophobicContact CD1-CG1 4.39Å; Y79-V90 HydrophobicContact CD1-CG2 3.72Å; Y79-V90 HydrophobicContact CE1-CG2 4.31Å; V90-H92 PolarHBondContact O-CD2 3.34Å; V90-F114 HydrophobicContact CG1-CD1 3.98Å; V90-F114 HydrophobicContact CG1-CE1 3.78Å
91	A	72.7	Confident	64.6	Low	3 Å²	3	60.1 Å²	60.1	3%	0.025	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-74.5	130.4	177.1	0	0	0	0	0	109.5	V60 R89 F93 A236 E238	V60-A91 HydrophobicContact CG1-CB 4.4Å; R89-A91 PolarHBondContact O-N 2.91Å; A91-F93 HydrophobicContact CB-CE1 4.34Å; A91-F93 HydrophobicContact CB-CE2 4.21Å; A91-F93 HydrophobicContact CB-CZ 3.86Å; A91-A236 HydrophobicContact CB-CB 3.95Å; A91-A236 PolarHBondContact N-O 3.41Å; A91-E238 HydrophobicContact CB-CB 4.09Å
92	H	67.7	Low	64.2	Low	41 Å²	41	64.2 Å²	64.2	19%	0.19	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-103.5	134.3	167.3	-64.3	-116.6	0	0	0	108.2	V90 G116 R155	V90-H92 PolarHBondContact O-CD2 3.34Å; H92-G116 WeakPolarHBondContact ND1-CA 3.47Å; H92-R155 PolarHBondContact ND1-NE 3.47Å
93	F	65.2	Low	63.7	Low	16 Å²	16	60.6 Å²	60.6	7%	0.07	33%	0.333	C	S	.	.			trans	-112.9	104.3	172.8	-45	-85	0	0	0	108.3	Y45 V60 A91 N95 L99 S115 F211 A236	Y45-F93 WeakPolarHBondContact OH-CE1 3.5Å; V60-F93 HydrophobicContact CG1-CE1 4.15Å; V60-F93 HydrophobicContact CG1-CZ 3.94Å; A91-F93 HydrophobicContact CB-CE1 4.34Å; A91-F93 HydrophobicContact CB-CE2 4.21Å; A91-F93 HydrophobicContact CB-CZ 3.86Å; F93-N95 PolarHBondContact O-N 2.87Å; F93-L99 HydrophobicContact CD1-CD2 4.28Å; F93-L99 HydrophobicContact CD1-CG 4.35Å; F93-L99 HydrophobicContact CE1-CD2 3.92Å; F93-L99 HydrophobicContact CE1-CG 4.46Å; F93-L99 HydrophobicContact CZ-CD2 4.3Å; F93-S115 WeakPolarHBondContact CA-OG 3.46Å; F93-S115 VanDerWaalsContact CB-OG 3.27Å; F93-S115 WeakPolarHBondContact CB-OG 3.33Å; F93-S115 WeakPolarHBondContact CD2-OG 3.41Å; F93-S115 PolarHBondContact N-OG 2.98Å; F93-S115 PolarHBondContact O-OG 3.44Å; F93-F211 HydrophobicContact CB-CD2 3.83Å; F93-F211 HydrophobicContact CB-CE2 3.95Å; F93-A236 HydrophobicContact CE2-CB 4.16Å; F93-A236 HydrophobicContact CZ-CB 3.81Å
94	D	57.4	Low	62.8	Low	82 Å²	82	66.9 Å²	66.9	44%	0.439	37%	0.366	S	S	.	.	S	Bend	trans	-65.7	-31	177.9	-79	-64.1	0	0	0	112.3	R155 R209	D94-R155 IonicContact OD1-CZ 2.66Å; D94-R155 IonicContact OD1-NH1 3.46Å; D94-R155 PolarHBondContact OD1-NH1 3.5Å; D94-R155 IonicContact OD1-NH2 2.68Å; D94-R155 PolarHBondContact OD1-NH2 3.4Å; D94-R155 IonicContact OD2-CZ 3.44Å; D94-R155 IonicContact OD2-NH1 2.67Å; D94-R155 PolarHBondContact OD2-NH1 3.19Å; D94-R155 IonicContact OD2-NH2 3.17Å; D94-R155 PolarHBondContact OD2-NH2 3.03Å; D94-R209 PolarHBondContact O-NH1 3.35Å
95	N	60.5	Low	62.3	Low	76 Å²	76	63.4 Å²	63.4	41%	0.406	35%	0.349	S	S	.	.	S	Bend	trans	-146.8	175	-175.2	48.9	-10.4	0	0	0	109.2	F93 D97 F211	F93-N95 PolarHBondContact O-N 2.87Å; N95-D97 WeakPolarHBondContact ND2-CB 3.3Å; N95-D97 PolarHBondContact ND2-OD2 3.21Å; N95-F211 WeakPolarHBondContact O-CE2 3.38Å
96	A	56.7	Low	62	Low	30 Å²	30	61.8 Å²	61.8	25%	0.248	34%	0.341	C	S	.	.	S	Bend	trans	-77	-15	175.6	0	0	0	0	0	112.3	G98 L99 F211 Y219	A96-G98 PolarHBondContact O-N 2.84Å; A96-L99 WeakPolarHBondContact O-CB 3.41Å; A96-L99 PolarHBondContact O-N 2.81Å; A96-F211 HydrophobicContact CB-CE1 3.8Å; A96-F211 HydrophobicContact CB-CZ 3.83Å; A96-F211 VanDerWaalsContact N-CZ 3.28Å; A96-Y219 HydrophobicContact CB-CG 4.5Å
97	D	55.3	Low	61.4	Low	126 Å²	126	67 Å²	67	67%	0.674	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	123.5	-171.7	-51.8	-52.8	0	0	0	110.6	N95	N95-D97 WeakPolarHBondContact ND2-CB 3.3Å; N95-D97 PolarHBondContact ND2-OD2 3.21Å
98	G	54.3	Low	60.9	Low	50 Å²	50	65 Å²	65	52%	0.515	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	93	3.1	-173.2	0	0	0	0	0	115	Y45 A96	Y45-G98 WeakPolarHBondContact CE2-O 3.47Å; Y45-G98 PolarHBondContact OH-O 3.16Å; A96-G98 PolarHBondContact O-N 2.84Å
99	L	64	Low	60.6	Low	12 Å²	12	72.8 Å²	72.8	6%	0.063	40%	0.402	C	S	.	.	S	Bend	trans	-82.3	116.1	153.9	-71.9	164.2	0	0	0	108.2	Y45 M62 F93 A96 A101 W105 Y219	Y45-L99 HydrophobicContact CE1-CD2 3.96Å; M62-L99 HydrophobicContact CE-CD2 4.02Å; F93-L99 HydrophobicContact CD1-CD2 4.28Å; F93-L99 HydrophobicContact CD1-CG 4.35Å; F93-L99 HydrophobicContact CE1-CD2 3.92Å; F93-L99 HydrophobicContact CE1-CG 4.46Å; F93-L99 HydrophobicContact CZ-CD2 4.3Å; A96-L99 WeakPolarHBondContact O-CB 3.41Å; A96-L99 PolarHBondContact O-N 2.81Å; L99-A101 PolarHBondContact O-N 2.74Å; L99-W105 HydrophobicContact CD2-CH2 4.08Å; L99-W105 HydrophobicContact CD2-CZ3 4.13Å; L99-Y219 HydrophobicContact CB-CE1 4.14Å; L99-Y219 HydrophobicContact CB-CE2 4.22Å; L99-Y219 HydrophobicContact CD1-CD1 3.77Å; L99-Y219 HydrophobicContact CD1-CE1 4.04Å; L99-Y219 HydrophobicContact CD1-CG 4.2Å
100	P	59.1	Low	60.6	Low	52 Å²	52	69.5 Å²	69.5	34%	0.338	39%	0.393	S	S	.	.			trans	-63.9	122.4	179.6	24.1	-35.6	0	0	0	111.9	Y45 E102 S103 W105 Y219	Y45-P100 HydrophobicContact CD1-CG 4.2Å; Y45-P100 HydrophobicContact CD2-CG 3.92Å; Y45-P100 HydrophobicContact CG-CG 3.72Å; P100-E102 PolarHBondContact O-N 3.11Å; P100-E102 VanDerWaalsContact O-N 3.11Å; P100-S103 PolarHBondContact O-OG 3.13Å; P100-W105 HydrophobicContact CG-CH2 3.85Å; P100-W105 HydrophobicContact CG-CZ2 3.67Å; P100-Y219 PolarHBondContact O-OH 2.77Å
101	A	55.4	Low	60.6	Low	74 Å²	74	68.3 Å²	68.3	61%	0.612	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.2	-173.1	0	0	0	0	0	115.6	L99	L99-A101 PolarHBondContact O-N 2.74Å
102	E	55.4	Low	60.9	Low	190 Å²	190	71.7 Å²	71.7	89%	0.888	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	2.6	-174.1	-57.5	-171.6	151.5	0	0	113.7	P100 N104	P100-E102 PolarHBondContact O-N 3.11Å; P100-E102 VanDerWaalsContact O-N 3.11Å; E102-N104 PolarHBondContact O-N 3.17Å
103	S	53.6	Low	61.3	Low	30 Å²	30	69.7 Å²	69.7	21%	0.21	39%	0.389	C	S	.	.			trans	-90.3	103.5	-169.6	56.9	0	0	0	0	114.9	P100 W105	P100-S103 PolarHBondContact O-OG 3.13Å; S103-W105 VanDerWaalsContact CB-CD2 3.47Å; S103-W105 PolarHBondContact O-N 2.85Å; S103-W105 VanDerWaalsContact OG-CD2 3.27Å; S103-W105 VanDerWaalsContact OG-CE2 3.23Å; S103-W105 VanDerWaalsContact OG-CE3 3.25Å; S103-W105 VanDerWaalsContact OG-CH2 3.23Å; S103-W105 WeakPolarHBondContact OG-CH2 3.38Å; S103-W105 WeakPolarHBondContact OG-CZ2 3.3Å; S103-W105 VanDerWaalsContact OG-CZ3 3.24Å; S103-W105 WeakPolarHBondContact OG-CZ3 3.06Å
104	N	53.5	Low	61.9	Low	135 Å²	135	69 Å²	69	72%	0.722	39%	0.385	S	S	*	.			trans	-73.9	50.8	166	-67.6	-40.5	0	0	0	112.3	E102 F106	E102-N104 PolarHBondContact O-N 3.17Å; N104-F106 PolarHBondContact O-N 3.29Å; N104-F106 VanDerWaalsContact O-N 3.16Å
105	W	56.6	Low	62.4	Low	36 Å²	36	65 Å²	65	14%	0.136	36%	0.364	C	S	.	.			trans	-64	-17.2	-178.7	-62.9	-49.5	0	0	0	114.1	V42 G44 Y45 M62 L99 P100 S103	V42-W105 VanDerWaalsContact CG1-O 3.31Å; V42-W105 WeakPolarHBondContact CG1-O 3.34Å; G44-W105 PolarHBondContact O-NE1 3.49Å; Y45-W105 AromaticContact CD1-CH2 3.49Å; Y45-W105 HydrophobicContact CD1-CH2 3.49Å; Y45-W105 VanDerWaalsContact CD1-CH2 3.49Å; Y45-W105 AromaticContact CD1-CZ2 3.25Å; Y45-W105 HydrophobicContact CD1-CZ2 3.25Å; Y45-W105 AromaticContact CE1-CH2 3.71Å; Y45-W105 HydrophobicContact CE1-CH2 3.71Å; Y45-W105 AromaticContact CE1-CZ2 3.99Å; Y45-W105 HydrophobicContact CE1-CZ2 3.99Å; Y45-W105 HydrophobicContact CG-CH2 4.33Å; Y45-W105 AromaticContact CG-CZ2 3.87Å; Y45-W105 HydrophobicContact CG-CZ2 3.87Å; M62-W105 HydrophobicContact CE-CD2 4.45Å; M62-W105 HydrophobicContact CE-CE3 3.77Å; M62-W105 HydrophobicContact CE-CH2 3.78Å; M62-W105 HydrophobicContact CE-CZ2 4.46Å; M62-W105 HydrophobicContact CE-CZ3 3.39Å; M62-W105 HydrophobicContact SD-CD2 3.81Å; M62-W105 HydrophobicContact SD-CE3 3.49Å; M62-W105 HydrophobicContact SD-CG 4.42Å; M62-W105 HydrophobicContact SD-CH2 4.37Å; M62-W105 HydrophobicContact SD-CZ3 3.8Å; L99-W105 HydrophobicContact CD2-CH2 4.08Å; L99-W105 HydrophobicContact CD2-CZ3 4.13Å; P100-W105 HydrophobicContact CG-CH2 3.85Å; P100-W105 HydrophobicContact CG-CZ2 3.67Å; S103-W105 VanDerWaalsContact CB-CD2 3.47Å; S103-W105 PolarHBondContact O-N 2.85Å; S103-W105 VanDerWaalsContact OG-CD2 3.27Å; S103-W105 VanDerWaalsContact OG-CE2 3.23Å; S103-W105 VanDerWaalsContact OG-CE3 3.25Å; S103-W105 VanDerWaalsContact OG-CH2 3.23Å; S103-W105 WeakPolarHBondContact OG-CH2 3.38Å; S103-W105 WeakPolarHBondContact OG-CZ2 3.3Å; S103-W105 VanDerWaalsContact OG-CZ3 3.24Å; S103-W105 WeakPolarHBondContact OG-CZ3 3.06Å
106	F	59.9	Low	62.5	Low	25 Å²	25	61.4 Å²	61.4	11%	0.11	35%	0.345	C	S	.	.			trans	-132.3	141.4	-164.2	-53.6	-68.2	0	0	0	112.5	V42 M62 N104 V111 L113 Y234	V42-F106 HydrophobicContact CG1-CD1 3.61Å; V42-F106 HydrophobicContact CG1-CE1 3.68Å; M62-F106 HydrophobicContact SD-CE1 4.35Å; M62-F106 HydrophobicContact SD-CE2 4.17Å; M62-F106 HydrophobicContact SD-CZ 3.51Å; M62-F106 VanDerWaalsContact SD-CZ 3.51Å; N104-F106 PolarHBondContact O-N 3.29Å; N104-F106 VanDerWaalsContact O-N 3.16Å; F106-V111 HydrophobicContact CB-CB 4.49Å; F106-V111 HydrophobicContact CB-CG2 3.33Å; F106-V111 HydrophobicContact CD1-CG1 3.84Å; F106-V111 HydrophobicContact CD1-CG2 4.16Å; F106-V111 HydrophobicContact CD2-CB 3.94Å; F106-V111 HydrophobicContact CD2-CG1 3.67Å; F106-V111 HydrophobicContact CD2-CG2 3.59Å; F106-V111 HydrophobicContact CE1-CG1 3.78Å; F106-V111 HydrophobicContact CE2-CB 4.22Å; F106-V111 HydrophobicContact CE2-CG1 3.59Å; F106-V111 HydrophobicContact CE2-CG2 4.35Å; F106-V111 HydrophobicContact CG-CB 4.14Å; F106-V111 HydrophobicContact CG-CG1 3.78Å; F106-V111 HydrophobicContact CG-CG2 3.45Å; F106-V111 VanDerWaalsContact CG-CG2 3.45Å; F106-V111 HydrophobicContact CZ-CG1 3.64Å; F106-L113 HydrophobicContact CE2-CD1 4.19Å; F106-L113 HydrophobicContact CZ-CD1 4.13Å; F106-L113 HydrophobicContact CZ-CD2 4.31Å; F106-L113 HydrophobicContact CZ-CG 4.28Å; F106-Y234 HydrophobicContact CD1-CD2 4.04Å; F106-Y234 HydrophobicContact CD1-CE1 4.19Å; F106-Y234 AromaticContact CD1-CE2 3.66Å; F106-Y234 HydrophobicContact CD1-CE2 3.66Å; F106-Y234 HydrophobicContact CD1-CG 4.46Å; F106-Y234 AromaticContact CD1-CZ 3.75Å; F106-Y234 AromaticContact CE1-CD1 3.93Å; F106-Y234 HydrophobicContact CE1-CD1 3.93Å; F106-Y234 AromaticContact CE1-CD2 3.59Å; F106-Y234 HydrophobicContact CE1-CD2 3.59Å; F106-Y234 HydrophobicContact CE1-CE1 4.07Å; F106-Y234 AromaticContact CE1-CE2 3.72Å; F106-Y234 HydrophobicContact CE1-CE2 3.72Å; F106-Y234 AromaticContact CE1-CG 3.72Å; F106-Y234 HydrophobicContact CE1-CG 3.72Å; F106-Y234 AromaticContact CE1-CZ 3.96Å; F106-Y234 HydrophobicContact CZ-CD2 4.26Å; F106-Y234 HydrophobicContact CZ-CG 4.44Å
107	S	54.9	Low	62.6	Low	122 Å²	122	60.7 Å²	60.7	85%	0.853	34%	0.336	S	S	*	.	S	Bend	trans	-86.7	-13.3	179.7	55.9	0	0	0	0	114.1
108	T	61.1	Low	62.4	Low	63 Å²	63	55 Å²	55	39%	0.387	31%	0.306	S	S	.	.	S	Bend	trans	-90.5	155.3	-179.3	55.7	0	0	0	0	112.1	E110 V111 V215	T108-E110 VanDerWaalsContact C-N 3.29Å; T108-E110 WeakPolarHBondContact CB-O 3.17Å; T108-E110 PolarHBondContact O-N 2.87Å; T108-E110 PolarHBondContact OG1-O 3.12Å; T108-V111 WeakPolarHBondContact OG1-CG2 3.29Å; T108-V215 WeakPolarHBondContact O-CG2 3.49Å
109	K	64.4	Low	62	Low	186 Å²	186	53.4 Å²	53.4	81%	0.809	29%	0.286	S	S	*	.	S	Bend	trans	-66.8	-31.9	-178	-75	-175.8	177.3	177	0	114	V215	K109-V215 VanDerWaalsContact CA-CG2 3.5Å; K109-V215 HydrophobicContact CB-CG2 4.49Å; K109-V215 WeakPolarHBondContact O-CG2 3.5Å; K109-V215 PolarHBondContact O-N 3.4Å
110	E	71.8	Confident	61	Low	83 Å²	83	55.2 Å²	55.2	39%	0.388	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	145.3	-179.3	-171.6	-172.8	133.7	0	0	106.8	T108 R112 V212 A213	T108-E110 VanDerWaalsContact C-N 3.29Å; T108-E110 WeakPolarHBondContact CB-O 3.17Å; T108-E110 PolarHBondContact O-N 2.87Å; T108-E110 PolarHBondContact OG1-O 3.12Å; E110-R112 IonicContact OE1-CZ 3.34Å; E110-R112 IonicContact OE1-NE 3.22Å; E110-R112 PolarHBondContact OE1-NE 2.94Å; E110-R112 IonicContact OE1-NH2 2.7Å; E110-R112 PolarHBondContact OE1-NH2 3.16Å; E110-V212 HydrophobicContact CG-CG1 3.39Å; E110-A213 WeakPolarHBondContact CA-O 3.35Å
111	V	73.4	Confident	59.9	Low	3 Å²	3	53.9 Å²	53.9	2%	0.018	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	130.5	-171.7	177.6	0	0	0	0	109.1	F106 T108 V212 A213 Y234	F106-V111 HydrophobicContact CB-CB 4.49Å; F106-V111 HydrophobicContact CB-CG2 3.33Å; F106-V111 HydrophobicContact CD1-CG1 3.84Å; F106-V111 HydrophobicContact CD1-CG2 4.16Å; F106-V111 HydrophobicContact CD2-CB 3.94Å; F106-V111 HydrophobicContact CD2-CG1 3.67Å; F106-V111 HydrophobicContact CD2-CG2 3.59Å; F106-V111 HydrophobicContact CE1-CG1 3.78Å; F106-V111 HydrophobicContact CE2-CB 4.22Å; F106-V111 HydrophobicContact CE2-CG1 3.59Å; F106-V111 HydrophobicContact CE2-CG2 4.35Å; F106-V111 HydrophobicContact CG-CB 4.14Å; F106-V111 HydrophobicContact CG-CG1 3.78Å; F106-V111 HydrophobicContact CG-CG2 3.45Å; F106-V111 VanDerWaalsContact CG-CG2 3.45Å; F106-V111 HydrophobicContact CZ-CG1 3.64Å; T108-V111 WeakPolarHBondContact OG1-CG2 3.29Å; V111-V212 CarbonylContact O-C 3.21Å; V111-V212 WeakPolarHBondContact O-CA 3.41Å; V111-A213 HydrophobicContact CB-CB 4.34Å; V111-A213 PolarHBondContact N-O 3.07Å; V111-A213 PolarHBondContact O-N 3.29Å; V111-Y234 HydrophobicContact CG1-CD2 3.41Å; V111-Y234 VanDerWaalsContact CG1-CD2 3.41Å; V111-Y234 HydrophobicContact CG1-CE2 3.54Å
112	R	78.3	Confident	59.2	Low	73 Å²	73	56 Å²	56	28%	0.275	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	105.9	-175.6	-58.2	-161	-174.4	137.6	3.3	110.5	E110 V210 V212 A231 W232 D233 Y234	E110-R112 IonicContact OE1-CZ 3.34Å; E110-R112 IonicContact OE1-NE 3.22Å; E110-R112 PolarHBondContact OE1-NE 2.94Å; E110-R112 IonicContact OE1-NH2 2.7Å; E110-R112 PolarHBondContact OE1-NH2 3.16Å; R112-V210 HydrophobicContact CB-CG1 3.66Å; R112-V210 HydrophobicContact CG-CG1 4.26Å; R112-V212 HydrophobicContact CG-CG2 4.11Å; R112-A231 WeakPolarHBondContact CD-O 3.37Å; R112-W232 HydrophobicContact CB-CB 4.33Å; R112-W232 CarbonylContact O-C 3.44Å; R112-D233 WeakPolarHBondContact CB-OD2 3.15Å; R112-D233 PolarHBondContact N-OD2 3.5Å; R112-D233 PolarHBondContact O-N 3.05Å; R112-Y234 PolarHBondContact O-N 3.44Å; R112-Y234 VanDerWaalsContact O-N 3.16Å
113	L	76.4	Confident	58.3	Low	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	123.8	175.8	-82.6	156.6	0	0	0	110.2	M62 F106 S115 V210 F211 Y234	M62-L113 HydrophobicContact CE-CD1 3.6Å; M62-L113 HydrophobicContact CE-CD2 3.82Å; M62-L113 HydrophobicContact CE-CG 4.39Å; M62-L113 HydrophobicContact CG-CD2 4.29Å; M62-L113 HydrophobicContact SD-CD1 4.24Å; M62-L113 HydrophobicContact SD-CD2 3.99Å; F106-L113 HydrophobicContact CE2-CD1 4.19Å; F106-L113 HydrophobicContact CZ-CD1 4.13Å; F106-L113 HydrophobicContact CZ-CD2 4.31Å; F106-L113 HydrophobicContact CZ-CG 4.28Å; L113-S115 PolarHBondContact O-N 2.93Å; L113-V210 CarbonylContact O-C 3.55Å; L113-V210 WeakPolarHBondContact O-CA 3.33Å; L113-F211 HydrophobicContact CB-CB 4.14Å; L113-F211 PolarHBondContact N-O 3.4Å; L113-F211 PolarHBondContact O-N 3.27Å; L113-Y234 CarbonylContact C-O 3.33Å; L113-Y234 WeakPolarHBondContact CA-O 3.4Å
114	F	77.5	Confident	57.2	Low	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	130	167.2	177.2	-88.7	0	0	0	110.8	L76 V90 G116 H117 C208 W232 Y234 F235	L76-F114 HydrophobicContact CD1-CD1 3.71Å; L76-F114 HydrophobicContact CD1-CD2 4.24Å; L76-F114 HydrophobicContact CD1-CE1 3.43Å; L76-F114 VanDerWaalsContact CD1-CE1 3.43Å; L76-F114 HydrophobicContact CD1-CE2 3.98Å; L76-F114 HydrophobicContact CD1-CG 4.12Å; L76-F114 HydrophobicContact CD1-CZ 3.61Å; L76-F114 HydrophobicContact CD2-CD2 4.4Å; L76-F114 HydrophobicContact CD2-CE2 4.3Å; L76-F114 HydrophobicContact CG-CE1 4.37Å; L76-F114 HydrophobicContact CG-CE2 4.14Å; L76-F114 HydrophobicContact CG-CZ 4.06Å; V90-F114 HydrophobicContact CG1-CD1 3.98Å; V90-F114 HydrophobicContact CG1-CE1 3.78Å; F114-G116 VanDerWaalsContact CZ-C 3.42Å; F114-G116 VanDerWaalsContact CZ-CA 3.44Å; F114-H117 AromaticContact CE2-CE1 3.73Å; F114-H117 AromaticContact CZ-CE1 3.26Å; F114-H117 WeakPolarHBondContact CZ-CE1 3.43Å; F114-H117 AromaticContact CZ-ND1 3.59Å; F114-H117 AromaticContact CZ-NE2 3.57Å; F114-C208 HydrophobicContact CE2-CB 4.25Å; F114-C208 VanDerWaalsContact CE2-SG 3.55Å; F114-W232 HydrophobicContact CB-CB 4.33Å; F114-W232 HydrophobicContact CB-CD2 3.91Å; F114-W232 HydrophobicContact CB-CE3 4.13Å; F114-W232 HydrophobicContact CB-CG 3.97Å; F114-W232 AromaticContact CD2-CD1 3.91Å; F114-W232 HydrophobicContact CD2-CD2 4.21Å; F114-W232 AromaticContact CD2-CE2 3.99Å; F114-W232 HydrophobicContact CD2-CG 4.21Å; F114-W232 AromaticContact CD2-NE1 3.75Å; F114-W232 HydrophobicContact CG-CD2 4.49Å; F114-Y234 PolarHBondContact N-O 3.29Å; F114-F235 HydrophobicContact CB-CB 3.75Å; F114-F235 HydrophobicContact CD1-CB 4.24Å; F114-F235 HydrophobicContact CG-CB 4.33Å
115	S	67.9	Low	56.2	Low	0 Å²	0	56 Å²	56	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	37.9	-178.2	-160.1	0	0	0	0	113.5	F93 L113 R209	F93-S115 WeakPolarHBondContact CA-OG 3.46Å; F93-S115 VanDerWaalsContact CB-OG 3.27Å; F93-S115 WeakPolarHBondContact CB-OG 3.33Å; F93-S115 WeakPolarHBondContact CD2-OG 3.41Å; F93-S115 PolarHBondContact N-OG 2.98Å; F93-S115 PolarHBondContact O-OG 3.44Å; L113-S115 PolarHBondContact O-N 2.93Å; S115-R209 PolarHBondContact N-O 2.98Å
116	G	62.3	Low	55	Low	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	97.4	164.1	168.4	0	0	0	0	0	116.3	H92 F114 R209	H92-G116 WeakPolarHBondContact ND1-CA 3.47Å; F114-G116 VanDerWaalsContact CZ-C 3.42Å; F114-G116 VanDerWaalsContact CZ-CA 3.44Å; G116-R209 PolarHBondContact O-N 3.18Å
117	H	60	Low	53.7	Low	14 Å²	14	68.8 Å²	68.8	7%	0.065	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124	174.7	-53.2	-62.2	0	0	0	110.6	G74 V75 L76 F114 I156	G74-H117 PolarHBondContact O-CE1 2.9Å; G74-H117 PolarHBondContact O-ND1 2.98Å; V75-H117 WeakPolarHBondContact CA-CE1 3.49Å; L76-H117 PolarHBondContact N-CE1 3.24Å; L76-H117 VanDerWaalsContact N-CE1 3.28Å; L76-H117 PolarHBondContact N-NE2 3.01Å; F114-H117 AromaticContact CE2-CE1 3.73Å; F114-H117 AromaticContact CZ-CE1 3.26Å; F114-H117 WeakPolarHBondContact CZ-CE1 3.43Å; F114-H117 AromaticContact CZ-ND1 3.59Å; F114-H117 AromaticContact CZ-NE2 3.57Å; H117-I156 HydrophobicContact CB-CB 4.38Å; H117-I156 PolarHBondContact O-N 3.39Å
118	E	50.7	Low	52.5	Low	8 Å²	8	70.2 Å²	70.2	4%	0.037	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	105.1	170.9	-78.4	179.3	-164.7	0	0	108.7	V153 R155 G207 R209 F224	E118-V153 HydrophobicContact CB-CG1 3.86Å; E118-V153 HydrophobicContact CG-CG1 4.18Å; E118-R155 IonicContact OE1-NH2 2.66Å; E118-G207 CarbonylContact C-O 3.55Å; E118-G207 PolarHBondContact N-O 3.23Å; E118-G207 CarbonylContact O-C 3.55Å; E118-G207 WeakPolarHBondContact O-CA 3.35Å; E118-G207 PolarHBondContact O-N 3.36Å; E118-R209 VanDerWaalsContact CD-NH2 3.32Å; E118-R209 IonicContact OE1-CZ 2.67Å; E118-R209 VanDerWaalsContact OE1-CZ 3.22Å; E118-R209 IonicContact OE1-NE 3.64Å; E118-R209 PolarHBondContact OE1-NE 3.12Å; E118-R209 IonicContact OE1-NH2 3.58Å; E118-R209 PolarHBondContact OE1-NH2 3.07Å; E118-R209 VanDerWaalsContact OE1-NH2 3.08Å; E118-R209 IonicContact OE2-CZ 3.3Å; E118-R209 IonicContact OE2-NE 2.63Å; E118-R209 PolarHBondContact OE2-NE 3.42Å; E118-R209 IonicContact OE2-NH2 3.5Å; E118-R209 PolarHBondContact OE2-NH2 3.15Å; E118-F224 HydrophobicContact CB-CE1 4.06Å; E118-F224 VanDerWaalsContact OE2-CE1 3.25Å; E118-F224 WeakPolarHBondContact OE2-CE1 3.49Å; E118-F224 VanDerWaalsContact OE2-CZ 3.3Å; E118-F224 WeakPolarHBondContact OE2-CZ 3.39Å
119	V	45.8	Very low	51.1	Low	15 Å²	15	74 Å²	74	9%	0.091	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	120.9	177.1	173.4	0	0	0	0	108.4	D121 Y154 I156 Y204	V119-D121 PolarHBondContact O-N 3.29Å; V119-Y154 PolarHBondContact N-O 3.09Å; V119-Y154 PolarHBondContact O-N 3.31Å; V119-I156 HydrophobicContact CB-CD1 4.11Å; V119-I156 HydrophobicContact CG2-CD1 3.51Å; V119-I156 HydrophobicContact CG2-CG1 4.35Å; V119-Y204 HydrophobicContact CG1-CD1 4.12Å
120	V	42.2	Very low	49.6	Very low	50 Å²	50	70.3 Å²	70.3	30%	0.303	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	98.8	169.6	-174.6	0	0	0	0	107.3	V151	V120-V151 HydrophobicContact CG1-CG1 4.05Å
121	D	37.1	Very low	47.6	Very low	25 Å²	25	70 Å²	70	13%	0.134	36%	0.357	C	S	.	.			trans	-92.5	114.8	173.9	-172.6	-11.7	0	0	0	108.1	V119 V123 Y154 R165	V119-D121 PolarHBondContact O-N 3.29Å; D121-V123 PolarHBondContact O-N 3.14Å; D121-V123 VanDerWaalsContact O-N 3.09Å; D121-Y154 HydrophobicContact CB-CD2 3.6Å; D121-Y154 HydrophobicContact CB-CE2 3.78Å; D121-R165 IonicContact OD2-NH1 2.81Å; D121-R165 PolarHBondContact OD2-NH1 3.14Å
122	I	40.1	Very low	45.5	Very low	117 Å²	117	79.3 Å²	79.3	60%	0.6	40%	0.398	S	S	*	.			trans	-81.9	90.1	178.7	-56.9	177.4	0	0	0	107	T124	I122-T124 WeakPolarHBondContact O-CG2 3.47Å; I122-T124 PolarHBondContact O-N 3.44Å
123	V	36.1	Very low	43.4	Very low	59 Å²	59	81.4 Å²	81.4	36%	0.358	41%	0.414	S	S	.	.			trans	-63.3	89.5	-168.5	-169.7	0	0	0	0	112.5	D121 K125 W127 A152 Y154	D121-V123 PolarHBondContact O-N 3.14Å; D121-V123 VanDerWaalsContact O-N 3.09Å; V123-K125 VanDerWaalsContact C-N 3.25Å; V123-K125 PolarHBondContact O-N 3.36Å; V123-W127 VanDerWaalsContact O-CD1 3.24Å; V123-A152 HydrophobicContact CG2-CB 4.18Å; V123-Y154 HydrophobicContact CG2-CE2 3.88Å; V123-Y154 WeakPolarHBondContact CG2-OH 3.3Å
124	T	31.2	Very low	41.4	Very low	127 Å²	127	87.8 Å²	87.8	78%	0.779	44%	0.442	S	S	*	.			trans	-77.2	63.2	-177.4	42.7	0	0	0	0	113.2	I122	I122-T124 WeakPolarHBondContact O-CG2 3.47Å; I122-T124 PolarHBondContact O-N 3.44Å
125	K	31.9	Very low	39.5	Very low	171 Å²	171	92.1 Å²	92.1	74%	0.743	48%	0.478	S	S	*	.	S	Bend	trans	-133.9	125	162.5	-69.6	-168.8	176.3	-177.6	0	110.8	V123 W127	V123-K125 VanDerWaalsContact C-N 3.25Å; V123-K125 PolarHBondContact O-N 3.36Å; K125-W127 VanDerWaalsContact C-N 3.33Å; K125-W127 PolarHBondContact O-N 2.95Å
126	N	32.6	Very low	38.1	Very low	176 Å²	176	95.9 Å²	95.9	94%	0.941	50%	0.502	S	S	*	.	S	Bend	trans	67.5	10.4	179.3	-57.5	4.3	0	0	0	117.5
127	W	32.1	Very low	37	Very low	153 Å²	153	105.9 Å²	105.9	58%	0.58	55%	0.546	S	S	*	.			trans	-92.8	125.2	174.9	-65.8	82.6	0	0	0	112.2	V123 K125 V186	V123-W127 VanDerWaalsContact O-CD1 3.24Å; K125-W127 VanDerWaalsContact C-N 3.33Å; K125-W127 PolarHBondContact O-N 2.95Å; W127-V186 HydrophobicContact CZ3-CG1 3.98Å; W127-V186 HydrophobicContact CZ3-CG2 4.18Å
128	M	29	Very low	36.3	Very low	152 Å²	152	110.1 Å²	110.1	75%	0.749	57%	0.566	S	S	*	*			trans	-84.3	117.3	164	-73.6	-172.5	-74.6	0	0	109.7	F130	M128-F130 HydrophobicContact CB-CE2 4.09Å; M128-F130 HydrophobicContact CB-CZ 4.33Å; M128-F130 HydrophobicContact CE-CZ 4.39Å; M128-F130 WeakPolarHBondContact O-CD2 3.34Å; M128-F130 PolarHBondContact O-N 3.42Å
129	V	32	Very low	36	Very low	141 Å²	141	112.2 Å²	112.2	86%	0.855	58%	0.581	S	S	*	*			trans	-81.1	106.1	173.2	-178.9	0	0	0	0	108.6
130	F	33.2	Very low	36.2	Very low	110 Å²	110	116 Å²	116	48%	0.482	61%	0.613	S	S	.	*			trans	-77.5	141.7	173.5	-67.4	-85.3	0	0	0	110.8	M128	M128-F130 HydrophobicContact CB-CE2 4.09Å; M128-F130 HydrophobicContact CB-CZ 4.33Å; M128-F130 HydrophobicContact CE-CZ 4.39Å; M128-F130 WeakPolarHBondContact O-CD2 3.34Å; M128-F130 PolarHBondContact O-N 3.42Å
131	P	30.2	Very low	36.4	Very low	75 Å²	75	117.8 Å²	117.8	49%	0.487	63%	0.627	S	S	.	*			trans	-65.8	157.2	170.7	29.9	-35.2	0	0	0	111.3	D133 K134	P131-D133 WeakPolarHBondContact CB-OD1 3.46Å; P131-D133 WeakPolarHBondContact CG-OD1 3.24Å; P131-D133 PolarHBondContact O-N 3.12Å; P131-K134 PolarHBondContact O-N 3.41Å
132	F	28.3	Very low	37	Very low	199 Å²	199	116.9 Å²	116.9	87%	0.873	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-4.1	-167.3	-160.9	-97.7	0	0	0	115.3	Y195	F132-Y195 HydrophobicContact CZ-CD1 4.36Å; F132-Y195 HydrophobicContact CZ-CE1 4.31Å
133	D	34.8	Very low	37.2	Very low	117 Å²	117	118 Å²	118	63%	0.626	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	-4.4	-174.2	67.1	-43.5	0	0	0	114.5	P131	P131-D133 WeakPolarHBondContact CB-OD1 3.46Å; P131-D133 WeakPolarHBondContact CG-OD1 3.24Å; P131-D133 PolarHBondContact O-N 3.12Å
134	K	35.6	Very low	37.9	Very low	135 Å²	135	123.9 Å²	123.9	59%	0.587	65%	0.647	S	S	*	*			trans	-131.3	113.4	-171.6	-69.1	175.6	-172.2	173.8	0	113.8	P131	P131-K134 PolarHBondContact O-N 3.41Å
135	A	36.2	Very low	38.5	Very low	91 Å²	91	121.3 Å²	121.3	75%	0.752	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-71.2	144.7	168.8	0	0	0	0	0	111.4
136	P	38.8	Very low	38.8	Very low	78 Å²	78	121.2 Å²	121.2	51%	0.506	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-68.4	148	175.1	29.2	-34.8	0	0	0	111.6	Q138	P136-Q138 PolarHBondContact O-N 3.4Å
137	F	39.9	Very low	38.7	Very low	210 Å²	210	114.8 Å²	114.8	92%	0.921	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-71.6	126.8	176.4	-113.5	-100.9	0	0	0	110.8
138	Q	45.6	Very low	38.7	Very low	103 Å²	103	113.9 Å²	113.9	48%	0.481	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-70.9	123.6	174.7	-166.3	174	38	0	0	109.5	P136 A142	P136-Q138 PolarHBondContact O-N 3.4Å; Q138-A142 VanDerWaalsContact CD-O 3.31Å; Q138-A142 HydrophobicContact CG-CB 4.44Å; Q138-A142 PolarHBondContact NE2-O 3.39Å
139	P	44.2	Very low	38.8	Very low	53 Å²	53	108.4 Å²	108.4	34%	0.344	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-67.3	149.2	179.8	27	-32.6	0	0	0	110.6	C141 A142	P139-C141 PolarHBondContact O-N 3.24Å; P139-C141 VanDerWaalsContact O-N 3.12Å; P139-A142 HydrophobicContact CG-CB 3.89Å; P139-A142 PolarHBondContact O-N 3.01Å
140	A	48.9	Very low	38.8	Very low	93 Å²	93	105 Å²	105	77%	0.769	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-61	-28.7	-168.5	0	0	0	0	0	114.3	A142	A140-A142 VanDerWaalsContact C-N 3.34Å
141	C	47.1	Very low	38.9	Very low	88 Å²	88	104.4 Å²	104.4	60%	0.595	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-73.1	-20.4	174.1	53.4	0	0	0	0	114.2	P139	P139-C141 PolarHBondContact O-N 3.24Å; P139-C141 VanDerWaalsContact O-N 3.12Å
142	A	48.6	Very low	39.2	Very low	6 Å²	6	102.5 Å²	102.5	5%	0.05	56%	0.557	C	S	.	*	G	3₁₀ helix	trans	-104.3	17.9	-179.9	0	0	0	0	0	113	Q138 P139 A140 H144 T145 M147	Q138-A142 VanDerWaalsContact CD-O 3.31Å; Q138-A142 HydrophobicContact CG-CB 4.44Å; Q138-A142 PolarHBondContact NE2-O 3.39Å; P139-A142 HydrophobicContact CG-CB 3.89Å; P139-A142 PolarHBondContact O-N 3.01Å; A140-A142 VanDerWaalsContact C-N 3.34Å; A142-H144 PolarHBondContact O-N 2.89Å; A142-T145 WeakPolarHBondContact CA-OG1 3.41Å; A142-T145 PolarHBondContact O-N 3.06Å; A142-T145 PolarHBondContact O-OG1 3.04Å; A142-M147 HydrophobicContact CB-CE 3.57Å
143	K	45.7	Very low	39.7	Very low	140 Å²	140	95.1 Å²	95.1	61%	0.609	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	126.3	166.5	-97.5	-174.3	172.1	-178.9	0	108.9
144	H	50.7	Low	39.8	Very low	184 Å²	184	91.8 Å²	91.8	85%	0.852	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	19.8	-179.2	-42.3	-75.6	0	0	0	116.2	A142	A142-H144 PolarHBondContact O-N 2.89Å
145	T	42.4	Very low	40.1	Very low	72 Å²	72	87.8 Å²	87.8	44%	0.442	49%	0.488	S	S	.	.			trans	-115.2	139.9	166.4	48.1	0	0	0	0	112.5	A142	A142-T145 WeakPolarHBondContact CA-OG1 3.41Å; A142-T145 PolarHBondContact O-N 3.06Å; A142-T145 PolarHBondContact O-OG1 3.04Å
146	D	38.1	Very low	40.6	Very low	170 Å²	170	84.3 Å²	84.3	91%	0.909	46%	0.457	S	S	*	.			trans	-78.1	154	172.1	-71.9	-45.3	0	0	0	111.4
147	M	31.6	Very low	40.8	Very low	41 Å²	41	81.8 Å²	81.8	20%	0.202	44%	0.441	C	S	.	.			trans	-128.2	163	179	-61.1	178.6	-176.6	0	0	109.8	A142 I185 S187	A142-M147 HydrophobicContact CB-CE 3.57Å; M147-I185 HydrophobicContact CE-CG2 3.65Å; M147-I185 HydrophobicContact CG-CG2 4.21Å; M147-I185 HydrophobicContact SD-CG2 3.41Å; M147-I185 WeakPolarHBondContact SD-CG2 3.3Å; M147-S187 CarbonylContact C-O 3.51Å; M147-S187 WeakPolarHBondContact CB-O 3.1Å; M147-S187 WeakPolarHBondContact CB-OG 3.24Å; M147-S187 PolarHBondContact SD-OG 3.42Å
148	Q	32.3	Very low	41	Very low	134 Å²	134	74.4 Å²	74.4	63%	0.626	41%	0.411	S	S	*	.			trans	-128.9	151	167.4	-66.6	-167.2	-3.6	0	0	114.6	S187 N188	Q148-S187 CarbonylContact C-O 3.57Å; Q148-S187 WeakPolarHBondContact CA-O 3.46Å; Q148-S187 PolarHBondContact N-O 3.45Å; Q148-N188 VanDerWaalsContact CA-O 3.23Å; Q148-N188 WeakPolarHBondContact CA-O 3.33Å
149	C	30.6	Very low	40.8	Very low	36 Å²	36	74.1 Å²	74.1	24%	0.243	41%	0.412	C	S	.	.			trans	-110.2	153.3	174.2	-107.3	0	0	0	0	110.9	V186 S187 N188 C189	C149-V186 VanDerWaalsContact SG-CG1 3.54Å; C149-S187 PolarHBondContact N-O 3.32Å; C149-S187 WeakPolarHBondContact SG-CA 3.44Å; C149-N188 VanDerWaalsContact N-C 3.31Å; C149-N188 PolarHBondContact N-O 2.92Å; C149-N188 VanDerWaalsContact N-O 3.17Å; C149-C189 VanDerWaalsContact CB-SG 3.58Å; C149-C189 PolarHBondContact O-SG 2.69Å
150	V	32.5	Very low	40.7	Very low	69 Å²	69	76.1 Å²	76.1	42%	0.418	42%	0.42	S	S	.	.			trans	-135.6	140	178.9	-169.4	0	0	0	0	110.9	C171	V150-C171 HydrophobicContact CG2-CB 4.24Å
151	V	35.8	Very low	40.4	Very low	99 Å²	99	78 Å²	78	60%	0.6	42%	0.417	S	S	*	.			trans	-100.3	130.8	169.2	175.9	0	0	0	0	108.4	V120	V120-V151 HydrophobicContact CG1-CG1 4.05Å
152	A	34.7	Very low	40	Very low	35 Å²	35	81.9 Å²	81.9	29%	0.289	42%	0.419	S	S	.	.			trans	-78.7	126.9	174.4	0	0	0	0	0	110.7	V123 Y154	V123-A152 HydrophobicContact CG2-CB 4.18Å; A152-Y154 HydrophobicContact CB-CD2 4.42Å; A152-Y154 HydrophobicContact CB-CE2 3.65Å
153	V	38.8	Very low	39.7	Very low	44 Å²	44	86.2 Å²	86.2	27%	0.267	44%	0.44	S	S	.	.			trans	-119.3	122.8	173.1	-177.6	0	0	0	0	107.6	E118	E118-V153 HydrophobicContact CB-CG1 3.86Å; E118-V153 HydrophobicContact CG-CG1 4.18Å
154	Y	38.1	Very low	39.4	Very low	46 Å²	46	82.7 Å²	82.7	18%	0.18	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124	-177.1	-68.6	-88.7	0	0	0	110.8	V119 D121 V123 A152	V119-Y154 PolarHBondContact N-O 3.09Å; V119-Y154 PolarHBondContact O-N 3.31Å; D121-Y154 HydrophobicContact CB-CD2 3.6Å; D121-Y154 HydrophobicContact CB-CE2 3.78Å; V123-Y154 HydrophobicContact CG2-CE2 3.88Å; V123-Y154 WeakPolarHBondContact CG2-OH 3.3Å; A152-Y154 HydrophobicContact CB-CD2 4.42Å; A152-Y154 HydrophobicContact CB-CE2 3.65Å
155	R	42.4	Very low	38.9	Very low	51 Å²	51	80.8 Å²	80.8	19%	0.192	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	120.8	170.2	175.7	172.1	-87.4	167.9	0.5	108.6	H92 D94 E118 L166	H92-R155 PolarHBondContact ND1-NE 3.47Å; D94-R155 IonicContact OD1-CZ 2.66Å; D94-R155 IonicContact OD1-NH1 3.46Å; D94-R155 PolarHBondContact OD1-NH1 3.5Å; D94-R155 IonicContact OD1-NH2 2.68Å; D94-R155 PolarHBondContact OD1-NH2 3.4Å; D94-R155 IonicContact OD2-CZ 3.44Å; D94-R155 IonicContact OD2-NH1 2.67Å; D94-R155 PolarHBondContact OD2-NH1 3.19Å; D94-R155 IonicContact OD2-NH2 3.17Å; D94-R155 PolarHBondContact OD2-NH2 3.03Å; E118-R155 IonicContact OE1-NH2 2.66Å; R155-L166 HydrophobicContact CB-CB 4.31Å; R155-L166 HydrophobicContact CG-CD1 4.14Å; R155-L166 PolarHBondContact O-N 3.43Å
156	I	45.6	Very low	38.8	Very low	19 Å²	19	81.1 Å²	81.1	10%	0.097	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	129.6	172.8	-70.7	-178.4	0	0	0	109.1	V75 H117 V119 I163	V75-I156 HydrophobicContact CG2-CG2 4.4Å; H117-I156 HydrophobicContact CB-CB 4.38Å; H117-I156 PolarHBondContact O-N 3.39Å; V119-I156 HydrophobicContact CB-CD1 4.11Å; V119-I156 HydrophobicContact CG2-CD1 3.51Å; V119-I156 HydrophobicContact CG2-CG1 4.35Å; I156-I163 HydrophobicContact CD1-CG2 4.12Å; I156-I163 HydrophobicContact CG1-CG2 4.26Å; I156-I163 HydrophobicContact CG2-CG2 3.92Å
157	S	43.1	Very low	38.6	Very low	24 Å²	24	79 Å²	79	17%	0.168	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.2	165.3	-173.6	0	0	0	0	109	I164	S157-I164 PolarHBondContact N-O 3.09Å; S157-I164 VanDerWaalsContact N-O 3.08Å; S157-I164 PolarHBondContact O-N 2.92Å
158	L	44	Very low	38.6	Very low	55 Å²	55	80.4 Å²	80.4	29%	0.288	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	137.1	162.9	-79.4	176.7	0	0	0	109.8	V75 I163	V75-L158 HydrophobicContact CG1-CD1 3.62Å; V75-L158 HydrophobicContact CG1-CG 4.2Å; L158-I163 HydrophobicContact CD2-CG1 4.04Å
159	L	40.9	Very low	38.4	Very low	98 Å²	98	78.9 Å²	78.9	51%	0.513	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	119.5	167.7	-111	158.2	0	0	0	106.4	D161 R162 I164	L159-D161 PolarHBondContact O-N 3.48Å; L159-R162 PolarHBondContact N-O 2.87Å; L159-R162 VanDerWaalsContact N-O 3.16Å; L159-R162 WeakPolarHBondContact O-CB 3.39Å; L159-R162 PolarHBondContact O-N 2.05Å; L159-I164 HydrophobicContact CB-CD1 3.7Å; L159-I164 HydrophobicContact CB-CG1 4.38Å; L159-I164 HydrophobicContact CD1-CD1 3.77Å; L159-I164 HydrophobicContact CG-CD1 4.38Å
160	D	42.8	Very low	38.3	Very low	94 Å²	94	83.5 Å²	83.5	50%	0.503	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.9	56.9	-175.2	-49.2	-28.6	0	0	0	113.2	H84 R162	H84-D160 IonicContact CE1-OD1 3.34Å; D160-R162 PolarHBondContact O-N 3.43Å; D160-R162 PolarHBondContact O-NE 2.72Å; D160-R162 IonicContact OD2-NH2 2.64Å
161	D	41.9	Very low	38	Very low	132 Å²	132	84.4 Å²	84.4	71%	0.706	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	12.6	-174.9	-64.8	-25.9	0	0	0	116.3	L159	L159-D161 PolarHBondContact O-N 3.48Å
162	R	40.4	Very low	37.6	Very low	170 Å²	170	88.1 Å²	88.1	64%	0.642	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	128.3	175.4	-71.3	169.8	-80.2	-174.4	0	110.5	L159 D160 I164	L159-R162 PolarHBondContact N-O 2.87Å; L159-R162 VanDerWaalsContact N-O 3.16Å; L159-R162 WeakPolarHBondContact O-CB 3.39Å; L159-R162 PolarHBondContact O-N 2.05Å; D160-R162 PolarHBondContact O-N 3.43Å; D160-R162 PolarHBondContact O-NE 2.72Å; D160-R162 IonicContact OD2-NH2 2.64Å; R162-I164 PolarHBondContact O-N 3.45Å
163	I	41.6	Very low	37.5	Very low	97 Å²	97	90.1 Å²	90.1	50%	0.497	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	100.8	175.4	-64.6	175.7	0	0	0	108.6	I156 L158	I156-I163 HydrophobicContact CD1-CG2 4.12Å; I156-I163 HydrophobicContact CG1-CG2 4.26Å; I156-I163 HydrophobicContact CG2-CG2 3.92Å; L158-I163 HydrophobicContact CD2-CG1 4.04Å
164	I	39.4	Very low	37	Very low	66 Å²	66	95.1 Å²	95.1	34%	0.338	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	116.2	171.1	-55.2	-173.7	0	0	0	108.5	S157 L159 R162 L166	S157-I164 PolarHBondContact N-O 3.09Å; S157-I164 VanDerWaalsContact N-O 3.08Å; S157-I164 PolarHBondContact O-N 2.92Å; L159-I164 HydrophobicContact CB-CD1 3.7Å; L159-I164 HydrophobicContact CB-CG1 4.38Å; L159-I164 HydrophobicContact CD1-CD1 3.77Å; L159-I164 HydrophobicContact CG-CD1 4.38Å; R162-I164 PolarHBondContact O-N 3.45Å; I164-L166 HydrophobicContact CG2-CD2 3.85Å; I164-L166 HydrophobicContact CG2-CG 4.28Å; I164-L166 PolarHBondContact O-N 2.98Å
165	R	40.7	Very low	36.8	Very low	145 Å²	145	99 Å²	99	55%	0.547	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	108.5	166.7	-61.7	-178.8	-176.6	-148	-3.5	108.4	D121	D121-R165 IonicContact OD2-NH1 2.81Å; D121-R165 PolarHBondContact OD2-NH1 3.14Å
166	L	38.8	Very low	36.7	Very low	79 Å²	79	99 Å²	99	41%	0.414	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	121.5	173.6	-63.7	172.9	0	0	0	109.2	R155 I164 A168	R155-L166 HydrophobicContact CB-CB 4.31Å; R155-L166 HydrophobicContact CG-CD1 4.14Å; R155-L166 PolarHBondContact O-N 3.43Å; I164-L166 HydrophobicContact CG2-CD2 3.85Å; I164-L166 HydrophobicContact CG2-CG 4.28Å; I164-L166 PolarHBondContact O-N 2.98Å; L166-A168 PolarHBondContact O-N 3.43Å; L166-A168 VanDerWaalsContact O-N 3.13Å
167	N	34.2	Very low	36.7	Very low	126 Å²	126	104 Å²	104	67%	0.674	58%	0.579	S	S	*	*			trans	-68.4	106.4	177.4	-83.1	-11.1	0	0	0	110.7
168	A	31.5	Very low	36.9	Very low	69 Å²	69	110 Å²	110	57%	0.57	61%	0.608	S	S	*	*			trans	-97.8	75.6	166.1	0	0	0	0	0	109.8	L166	L166-A168 PolarHBondContact O-N 3.43Å; L166-A168 VanDerWaalsContact O-N 3.13Å
169	T	27.7	Very low	37.1	Very low	102 Å²	102	109.4 Å²	109.4	63%	0.626	61%	0.609	S	S	*	*			trans	-98.9	101.8	178.5	43.1	0	0	0	0	111.6
170	N	28.4	Very low	37.3	Very low	134 Å²	134	110.6 Å²	110.6	72%	0.717	62%	0.62	S	S	*	*			trans	-118.6	95.3	160.1	-89.7	-11.1	0	0	0	108.6
171	C	27	Very low	37	Very low	87 Å²	87	115 Å²	115	59%	0.588	64%	0.64	S	S	*	*			trans	-127.1	119.5	172.6	-58.9	0	0	0	0	108.3	V150	V150-C171 HydrophobicContact CG2-CB 4.24Å
172	F	28.3	Very low	36.7	Very low	178 Å²	178	113 Å²	113	78%	0.781	64%	0.636	S	S	*	*			trans	-111.7	130.8	172.9	-66.7	-82.1	0	0	0	109.5
173	G	30.8	Very low	36.2	Very low	76 Å²	76	111.9 Å²	111.9	78%	0.784	64%	0.643	S	S	*	*			trans	-142.4	126.8	172.4	0	0	0	0	0	108.9
174	V	29.3	Very low	35.7	Very low	149 Å²	149	113.3 Å²	113.3	90%	0.903	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-96.4	118.1	-177.8	-178.6	0	0	0	0	109
175	L	33.8	Very low	35.1	Very low	129 Å²	129	115 Å²	115	68%	0.675	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-76.7	129.2	169.2	-86.2	160	0	0	0	110	C179	L175-C179 HydrophobicContact CD2-CB 4.35Å
176	A	39.8	Very low	34.4	Very low	49 Å²	49	111.6 Å²	111.6	41%	0.405	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-69.3	140.7	159.8	0	0	0	0	0	108.9	D178 C179	A176-D178 PolarHBondContact O-N 3.25Å; A176-D178 VanDerWaalsContact O-N 3.09Å; A176-C179 PolarHBondContact O-N 3.3Å
177	P	45.2	Very low	33.8	Very low	125 Å²	125	109.2 Å²	109.2	81%	0.812	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-22.6	-169.7	24.4	-34.7	0	0	0	114.3
178	D	49.2	Very low	33.5	Very low	149 Å²	149	109 Å²	109	80%	0.797	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	2.4	-175.2	-50	-60	0	0	0	114	A176 T180	A176-D178 PolarHBondContact O-N 3.25Å; A176-D178 VanDerWaalsContact O-N 3.09Å; D178-T180 PolarHBondContact O-N 3.25Å
179	C	46.2	Very low	33.3	Very low	43 Å²	43	109.1 Å²	109.1	29%	0.291	65%	0.647	S	S	.	*			trans	-92.9	96.9	178.5	-72	0	0	0	0	111.8	L175 A176	L175-C179 HydrophobicContact CD2-CB 4.35Å; A176-C179 PolarHBondContact O-N 3.3Å
180	T	45.8	Very low	33.3	Very low	123 Å²	123	108.7 Å²	108.7	76%	0.755	65%	0.649	S	S	*	*			trans	-64.5	142.6	175.3	50.2	0	0	0	0	112.8	D178 S182	D178-T180 PolarHBondContact O-N 3.25Å; T180-S182 PolarHBondContact O-N 3.27Å
181	M	36.5	Very low	33.3	Very low	187 Å²	187	106 Å²	106	92%	0.921	65%	0.652	S	S	*	*	S	Bend	trans	-70.4	89.6	-173	-75.9	-177	62.9	0	0	114.4
182	S	36.5	Very low	33.7	Very low	90 Å²	90	106.2 Å²	106.2	63%	0.629	66%	0.655	S	S	*	*			trans	-144.5	137.7	154.2	53.1	0	0	0	0	108.3	T180	T180-S182 PolarHBondContact O-N 3.27Å
183	D	29.4	Very low	33.6	Very low	147 Å²	147	103.6 Å²	103.6	79%	0.786	65%	0.648	S	S	*	*	S	Bend	trans	71.9	123.8	-175.7	-52.5	-31.6	0	0	0	116.8
184	P	30.9	Very low	33.5	Very low	127 Å²	127	107.2 Å²	107.2	83%	0.825	65%	0.645	S	S	*	*			trans	-83.3	131.2	173.8	32.8	-32.5	0	0	0	112
185	I	26.7	Very low	33.4	Very low	102 Å²	102	108.2 Å²	108.2	52%	0.523	63%	0.634	S	S	.	*			trans	-92.3	148.9	-174	-66.7	177.1	0	0	0	112.2	M147	M147-I185 HydrophobicContact CE-CG2 3.65Å; M147-I185 HydrophobicContact CG-CG2 4.21Å; M147-I185 HydrophobicContact SD-CG2 3.41Å; M147-I185 WeakPolarHBondContact SD-CG2 3.3Å
186	V	25.5	Very low	33.1	Very low	72 Å²	72	107.5 Å²	107.5	44%	0.436	64%	0.638	S	S	.	*			trans	-138.1	137.2	-177.5	177.1	0	0	0	0	109.7	W127 C149	W127-V186 HydrophobicContact CZ3-CG1 3.98Å; W127-V186 HydrophobicContact CZ3-CG2 4.18Å; C149-V186 VanDerWaalsContact SG-CG1 3.54Å
187	S	26.5	Very low	32.6	Very low	30 Å²	30	113 Å²	113	21%	0.21	65%	0.653	C	S	.	*			trans	166.8	152.6	136.6	53.8	0	0	0	0	114.7	M147 Q148 C149	M147-S187 CarbonylContact C-O 3.51Å; M147-S187 WeakPolarHBondContact CB-O 3.1Å; M147-S187 WeakPolarHBondContact CB-OG 3.24Å; M147-S187 PolarHBondContact SD-OG 3.42Å; Q148-S187 CarbonylContact C-O 3.57Å; Q148-S187 WeakPolarHBondContact CA-O 3.46Å; Q148-S187 PolarHBondContact N-O 3.45Å; C149-S187 PolarHBondContact N-O 3.32Å; C149-S187 WeakPolarHBondContact SG-CA 3.44Å
188	N	28.6	Very low	31.9	Very low	121 Å²	121	111.7 Å²	111.7	65%	0.647	64%	0.638	S	S	*	*			trans	72.6	99.9	163.7	-76.9	-13.7	0	0	0	121.9	Q148 C149	Q148-N188 VanDerWaalsContact CA-O 3.23Å; Q148-N188 WeakPolarHBondContact CA-O 3.33Å; C149-N188 VanDerWaalsContact N-C 3.31Å; C149-N188 PolarHBondContact N-O 2.92Å; C149-N188 VanDerWaalsContact N-O 3.17Å
189	C	26	Very low	30.9	Very low	71 Å²	71	109.9 Å²	109.9	48%	0.48	63%	0.628	S	S	.	*			trans	-72.5	128.1	159.2	-43.6	0	0	0	0	110.6	C149	C149-C189 VanDerWaalsContact CB-SG 3.58Å; C149-C189 PolarHBondContact O-SG 2.69Å
190	S	29	Very low	30.1	Very low	94 Å²	94	115.5 Å²	115.5	66%	0.657	65%	0.65	S	S	*	*	S	Bend	trans	-79.8	153.1	146.8	55.8	0	0	0	0	109.3
191	G	29	Very low	29.2	Very low	77 Å²	77	119.3 Å²	119.3	79%	0.794	66%	0.66	S	S	*	*	S	Bend	cis	-159.1	99.1	1.4	0	0	0	0	0	111.7
192	S	34.4	Very low	29	Very low	91 Å²	91	113.6 Å²	113.6	64%	0.636	64%	0.635	S	S	*	*			cis	-168.3	168.5	-29.4	42.1	0	0	0	0	107.9
193	L	26	Very low	29.1	Very low	123 Å²	123	112.9 Å²	112.9	64%	0.644	64%	0.635	S	S	*	*			trans	60.7	74.7	166.6	-48.9	178.3	0	0	0	117.4	Y195	L193-Y195 HydrophobicContact CB-CE2 4.27Å; L193-Y195 HydrophobicContact CD2-CE2 4.44Å
194	Q	28.8	Very low	29.9	Very low	153 Å²	153	112.3 Å²	112.3	72%	0.715	62%	0.622	S	S	*	*			trans	-124.2	122.3	139.7	-70.5	-152.7	-51.5	0	0	109.3
195	Y	28.4	Very low	30.8	Very low	170 Å²	170	108.7 Å²	108.7	67%	0.667	60%	0.596	S	S	*	*			trans	-89	115.6	-169	-59.8	-99.5	0	0	0	111.3	F132 L193	F132-Y195 HydrophobicContact CZ-CD1 4.36Å; F132-Y195 HydrophobicContact CZ-CE1 4.31Å; L193-Y195 HydrophobicContact CB-CE2 4.27Å; L193-Y195 HydrophobicContact CD2-CE2 4.44Å
196	C	27	Very low	32	Very low	114 Å²	114	104.3 Å²	104.3	77%	0.77	57%	0.574	S	S	*	*			trans	-85.1	109.9	166.7	-70.7	0	0	0	0	109.9	I198	C196-I198 HydrophobicContact CB-CG1 4.32Å; C196-I198 PolarHBondContact O-N 3.35Å; C196-I198 VanDerWaalsContact O-N 3.15Å
197	K	28.7	Very low	33.7	Very low	163 Å²	163	101.4 Å²	101.4	71%	0.709	56%	0.558	S	S	*	*			trans	-82.6	85.9	177.2	-167.2	-178.6	-168.8	-66.8	0	110.2	D199	K197-D199 IonicContact NZ-OD1 2.74Å; K197-D199 PolarHBondContact NZ-OD1 3.09Å; K197-D199 IonicContact NZ-OD2 3.76Å; K197-D199 PolarHBondContact NZ-OD2 3.31Å; K197-D199 PolarHBondContact O-N 3.28Å
198	I	29.8	Very low	35.5	Very low	99 Å²	99	100 Å²	100	51%	0.508	55%	0.549	S	S	.	.			trans	-85.4	83.7	179.9	-51	179	0	0	0	109.6	C196 Q200 L205	C196-I198 HydrophobicContact CB-CG1 4.32Å; C196-I198 PolarHBondContact O-N 3.35Å; C196-I198 VanDerWaalsContact O-N 3.15Å; I198-Q200 PolarHBondContact O-N 3.16Å; I198-L205 HydrophobicContact CD1-CD1 4.09Å
199	D	28.6	Very low	37.4	Very low	111 Å²	111	96.8 Å²	96.8	59%	0.594	53%	0.528	S	S	*	.			trans	-76.2	57.2	172.2	-68.9	-46.4	0	0	0	112.1	K197	K197-D199 IonicContact NZ-OD1 2.74Å; K197-D199 PolarHBondContact NZ-OD1 3.09Å; K197-D199 IonicContact NZ-OD2 3.76Å; K197-D199 PolarHBondContact NZ-OD2 3.31Å; K197-D199 PolarHBondContact O-N 3.28Å
200	Q	30.1	Very low	39.7	Very low	161 Å²	161	93.5 Å²	93.5	75%	0.752	51%	0.506	S	S	*	.	S	Bend	trans	-176.1	156.6	162.6	-107.6	145.1	78.8	0	0	112.8	I198 V202	I198-Q200 PolarHBondContact O-N 3.16Å; Q200-V202 HydrophobicContact CB-CG2 4.24Å; Q200-V202 PolarHBondContact O-N 3.03Å; Q200-V202 VanDerWaalsContact O-N 3.13Å
201	Q	27.3	Very low	41.8	Very low	203 Å²	203	89.2 Å²	89.2	95%	0.949	48%	0.475	S	S	*	.			trans	-71	100.7	166.3	-74.6	-178.5	-38.8	0	0	109.9
202	V	31.5	Very low	44	Very low	67 Å²	67	85.6 Å²	85.6	41%	0.406	44%	0.437	S	S	.	.			trans	-118.1	104.4	171.9	-171.5	0	0	0	0	108.4	Q200 Y204 L205	Q200-V202 HydrophobicContact CB-CG2 4.24Å; Q200-V202 PolarHBondContact O-N 3.03Å; Q200-V202 VanDerWaalsContact O-N 3.13Å; V202-Y204 VanDerWaalsContact C-N 3.32Å; V202-Y204 WeakPolarHBondContact CG1-O 3.17Å; V202-Y204 PolarHBondContact O-N 3.29Å; V202-L205 HydrophobicContact CB-CD2 4.27Å; V202-L205 HydrophobicContact CB-CG 4.5Å; V202-L205 HydrophobicContact CG1-CD2 3.63Å; V202-L205 HydrophobicContact CG1-CG 4.02Å
203	A	38	Very low	45.6	Very low	75 Å²	75	81.4 Å²	81.4	62%	0.62	41%	0.409	S	S	*	.	S	Bend	trans	-71.3	-24	-171.3	0	0	0	0	0	114.1
204	Y	46.3	Very low	47.5	Very low	135 Å²	135	77.6 Å²	77.6	53%	0.529	39%	0.39	S	S	.	.			trans	-142.3	126.8	177.3	-60.3	-78.4	0	0	0	109.6	V119 V202	V119-Y204 HydrophobicContact CG1-CD1 4.12Å; V202-Y204 VanDerWaalsContact C-N 3.32Å; V202-Y204 WeakPolarHBondContact CG1-O 3.17Å; V202-Y204 PolarHBondContact O-N 3.29Å
205	L	49.7	Very low	48.9	Very low	50 Å²	50	74 Å²	74	26%	0.262	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	109.7	173.5	-73.3	170.2	0	0	0	108.8	I198 V202 G207 F226	I198-L205 HydrophobicContact CD1-CD1 4.09Å; V202-L205 HydrophobicContact CB-CD2 4.27Å; V202-L205 HydrophobicContact CB-CG 4.5Å; V202-L205 HydrophobicContact CG1-CD2 3.63Å; V202-L205 HydrophobicContact CG1-CG 4.02Å; L205-G207 PolarHBondContact O-N 3.49Å; L205-F226 HydrophobicContact CD2-CE1 4.05Å; L205-F226 HydrophobicContact CD2-CE2 4.05Å; L205-F226 HydrophobicContact CD2-CZ 3.37Å
206	P	52.4	Low	50.4	Low	10 Å²	10	76.8 Å²	76.8	7%	0.065	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	93.7	177.6	27.4	-32.3	0	0	0	110.9	F226 C227	P206-F226 HydrophobicContact CG-CD1 4.02Å; P206-F226 HydrophobicContact CG-CE1 4.24Å; P206-F226 WeakPolarHBondContact O-CA 3.22Å; P206-C227 VanDerWaalsContact C-SG 3.57Å; P206-C227 HydrophobicContact CB-CB 4.14Å; P206-C227 PolarHBondContact O-N 3.01Å; P206-C227 PolarHBondContact O-SG 2.82Å
207	G	61.4	Low	51.9	Low	11 Å²	11	72.5 Å²	72.5	11%	0.113	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	130.6	172.2	0	0	0	0	0	111.1	E118 L205 C227	E118-G207 CarbonylContact C-O 3.55Å; E118-G207 PolarHBondContact N-O 3.23Å; E118-G207 CarbonylContact O-C 3.55Å; E118-G207 WeakPolarHBondContact O-CA 3.35Å; E118-G207 PolarHBondContact O-N 3.36Å; L205-G207 PolarHBondContact O-N 3.49Å; G207-C227 PolarHBondContact O-SG 3.11Å; G207-C227 VanDerWaalsContact O-SG 3.42Å
208	C	64.2	Low	53.3	Low	2 Å²	2	68.9 Å²	68.9	1%	0.014	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	136.3	171.5	-82	0	0	0	0	110.7	F114 R225 C227	F114-C208 HydrophobicContact CE2-CB 4.25Å; F114-C208 VanDerWaalsContact CE2-SG 3.55Å; C208-R225 PolarHBondContact N-O 3.42Å; C208-R225 PolarHBondContact O-N 3.46Å; C208-C227 HydrophobicContact CB-CB 3.88Å; C208-C227 WeakPolarHBondContact CB-SG 3.42Å; C208-C227 PolarHBondContact N-SG 3Å; C208-C227 VanDerWaalsContact N-SG 3.39Å; C208-C227 VanDerWaalsContact SG-CA 3.57Å; C208-C227 WeakPolarHBondContact SG-CB 3.48Å; C208-C227 CovalentContact SG-SG 2.03Å; C208-C227 PolarHBondContact SG-SG 3.4Å
209	R	69.5	Low	55.1	Low	52 Å²	52	66 Å²	66	20%	0.196	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	137.1	170.8	-71.9	-169.7	-171.7	-167.1	14.6	109.6	D94 S115 G116 E118 L221 F224	D94-R209 PolarHBondContact O-NH1 3.35Å; S115-R209 PolarHBondContact N-O 2.98Å; G116-R209 PolarHBondContact O-N 3.18Å; E118-R209 VanDerWaalsContact CD-NH2 3.32Å; E118-R209 IonicContact OE1-CZ 2.67Å; E118-R209 VanDerWaalsContact OE1-CZ 3.22Å; E118-R209 IonicContact OE1-NE 3.64Å; E118-R209 PolarHBondContact OE1-NE 3.12Å; E118-R209 IonicContact OE1-NH2 3.58Å; E118-R209 PolarHBondContact OE1-NH2 3.07Å; E118-R209 VanDerWaalsContact OE1-NH2 3.08Å; E118-R209 IonicContact OE2-CZ 3.3Å; E118-R209 IonicContact OE2-NE 2.63Å; E118-R209 PolarHBondContact OE2-NE 3.42Å; E118-R209 IonicContact OE2-NH2 3.5Å; E118-R209 PolarHBondContact OE2-NH2 3.15Å; R209-L221 HydrophobicContact CB-CD2 3.82Å; R209-L221 HydrophobicContact CG-CD2 4.02Å; R209-F224 HydrophobicContact CG-CD1 4.09Å; R209-F224 HydrophobicContact CG-CE1 3.62Å; R209-F224 HydrophobicContact CG-CZ 4.24Å
210	V	73	Confident	57.1	Low	3 Å²	3	65 Å²	65	2%	0.018	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	122.4	174.4	178.7	0	0	0	0	108.1	R112 L113 V212 E222 W232	R112-V210 HydrophobicContact CB-CG1 3.66Å; R112-V210 HydrophobicContact CG-CG1 4.26Å; L113-V210 CarbonylContact O-C 3.55Å; L113-V210 WeakPolarHBondContact O-CA 3.33Å; V210-V212 HydrophobicContact CG1-CG2 4.27Å; V210-E222 HydrophobicContact CB-CB 4.38Å; V210-E222 PolarHBondContact O-N 3.46Å; V210-W232 HydrophobicContact CG1-CB 4.34Å; V210-W232 HydrophobicContact CG2-CB 4.28Å
211	F	74.6	Confident	58.8	Low	4 Å²	4	60.3 Å²	60.3	2%	0.018	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	115.6	171.2	-117.2	-63.7	0	0	0	109.3	F93 N95 A96 L113 H220 L221	F93-F211 HydrophobicContact CB-CD2 3.83Å; F93-F211 HydrophobicContact CB-CE2 3.95Å; N95-F211 WeakPolarHBondContact O-CE2 3.38Å; A96-F211 HydrophobicContact CB-CE1 3.8Å; A96-F211 HydrophobicContact CB-CZ 3.83Å; A96-F211 VanDerWaalsContact N-CZ 3.28Å; L113-F211 HydrophobicContact CB-CB 4.14Å; L113-F211 PolarHBondContact N-O 3.4Å; L113-F211 PolarHBondContact O-N 3.27Å; F211-H220 WeakPolarHBondContact CD1-O 3.4Å; F211-L221 HydrophobicContact CD2-CD1 4.46Å; F211-L221 HydrophobicContact CD2-CD2 4.44Å; F211-L221 HydrophobicContact CD2-CG 4Å; F211-L221 HydrophobicContact CE1-CG 4.17Å; F211-L221 HydrophobicContact CE2-CD1 3.65Å; F211-L221 HydrophobicContact CE2-CD2 4.4Å; F211-L221 HydrophobicContact CE2-CG 3.58Å; F211-L221 HydrophobicContact CG-CG 4.46Å; F211-L221 HydrophobicContact CZ-CB 4.33Å; F211-L221 HydrophobicContact CZ-CD1 3.77Å; F211-L221 HydrophobicContact CZ-CG 3.65Å
212	V	74.4	Confident	60.7	Low	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	105.1	177.4	-176.3	0	0	0	0	108.7	E110 V111 R112 V210 Y219 H220 E222	E110-V212 HydrophobicContact CG-CG1 3.39Å; V111-V212 CarbonylContact O-C 3.21Å; V111-V212 WeakPolarHBondContact O-CA 3.41Å; R112-V212 HydrophobicContact CG-CG2 4.11Å; V210-V212 HydrophobicContact CG1-CG2 4.27Å; V212-Y219 WeakPolarHBondContact O-CA 3.38Å; V212-H220 VanDerWaalsContact CB-CE1 3.45Å; V212-H220 WeakPolarHBondContact CB-CE1 3.41Å; V212-H220 VanDerWaalsContact CG1-CE1 3.46Å; V212-H220 WeakPolarHBondContact CG1-CE1 3.36Å; V212-H220 PolarHBondContact N-O 2.95Å; V212-H220 PolarHBondContact O-N 3.33Å; V212-E222 HydrophobicContact CG2-CB 4.41Å; V212-E222 HydrophobicContact CG2-CG 3.63Å
213	A	67.6	Low	62.1	Low	4 Å²	4	58.2 Å²	58.2	3%	0.033	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	151.6	170.5	0	0	0	0	0	110.3	E110 V111 Y219	E110-A213 WeakPolarHBondContact CA-O 3.35Å; V111-A213 HydrophobicContact CB-CB 4.34Å; V111-A213 PolarHBondContact N-O 3.07Å; V111-A213 PolarHBondContact O-N 3.29Å; A213-Y219 HydrophobicContact CB-CD1 3.59Å; A213-Y219 HydrophobicContact CB-CE1 3.63Å
214	T	66.1	Low	63.2	Low	42 Å²	42	60.1 Å²	60.1	26%	0.258	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	160.1	174.9	60.6	0	0	0	0	109.7	R216 G217 V218	T214-R216 PolarHBondContact O-N 2.92Å; T214-G217 PolarHBondContact O-N 3.11Å; T214-V218 PolarHBondContact N-O 2.84Å; T214-V218 WeakPolarHBondContact OG1-CB 3.33Å; T214-V218 PolarHBondContact OG1-N 2.94Å; T214-V218 PolarHBondContact OG1-O 2.96Å
215	V	58.8	Low	64	Low	79 Å²	79	58 Å²	58	48%	0.479	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	2	179.6	-140.5	0	0	0	0	114.9	T108 K109	T108-V215 WeakPolarHBondContact O-CG2 3.49Å; K109-V215 VanDerWaalsContact CA-CG2 3.5Å; K109-V215 HydrophobicContact CB-CG2 4.49Å; K109-V215 WeakPolarHBondContact O-CG2 3.5Å; K109-V215 PolarHBondContact O-N 3.4Å
216	R	60	Low	64.6	Low	227 Å²	227	60.2 Å²	60.2	86%	0.857	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	14.2	177.5	-67.2	-175.3	172.1	-176.6	-3.3	112.9	T214 V218	T214-R216 PolarHBondContact O-N 2.92Å; R216-V218 HydrophobicContact CB-CG2 4.33Å; R216-V218 PolarHBondContact O-N 2.93Å; R216-V218 VanDerWaalsContact O-N 3.16Å
217	G	58.8	Low	65.2	Low	24 Å²	24	59.8 Å²	59.8	25%	0.247	28%	0.277	C	S	.	.	S	Bend	trans	66	12.5	-176.2	0	0	0	0	0	113.8	T214 Y219	T214-G217 PolarHBondContact O-N 3.11Å; G217-Y219 WeakPolarHBondContact O-CD2 3.46Å; G217-Y219 VanDerWaalsContact O-CE2 3.28Å; G217-Y219 WeakPolarHBondContact O-CE2 3.39Å; G217-Y219 PolarHBondContact O-N 2.98Å
218	V	58.1	Low	65.4	Low	87 Å²	87	63.2 Å²	63.2	53%	0.527	29%	0.292	S	S	.	.			trans	-82	102.2	173.2	-173.5	0	0	0	0	107.4	T214 R216	T214-V218 PolarHBondContact N-O 2.84Å; T214-V218 WeakPolarHBondContact OG1-CB 3.33Å; T214-V218 PolarHBondContact OG1-N 2.94Å; T214-V218 PolarHBondContact OG1-O 2.96Å; R216-V218 HydrophobicContact CB-CG2 4.33Å; R216-V218 PolarHBondContact O-N 2.93Å; R216-V218 VanDerWaalsContact O-N 3.16Å
219	Y	67.2	Low	65.7	Low	40 Å²	40	67.5 Å²	67.5	16%	0.157	32%	0.315	C	S	.	.			trans	-92	134.3	169.7	-52.4	-82.1	0	0	0	109.2	A96 L99 P100 V212 A213 G217	A96-Y219 HydrophobicContact CB-CG 4.5Å; L99-Y219 HydrophobicContact CB-CE1 4.14Å; L99-Y219 HydrophobicContact CB-CE2 4.22Å; L99-Y219 HydrophobicContact CD1-CD1 3.77Å; L99-Y219 HydrophobicContact CD1-CE1 4.04Å; L99-Y219 HydrophobicContact CD1-CG 4.2Å; P100-Y219 PolarHBondContact O-OH 2.77Å; V212-Y219 WeakPolarHBondContact O-CA 3.38Å; A213-Y219 HydrophobicContact CB-CD1 3.59Å; A213-Y219 HydrophobicContact CB-CE1 3.63Å; G217-Y219 WeakPolarHBondContact O-CD2 3.46Å; G217-Y219 VanDerWaalsContact O-CE2 3.28Å; G217-Y219 WeakPolarHBondContact O-CE2 3.39Å; G217-Y219 PolarHBondContact O-N 2.98Å
220	H	69.4	Low	65.7	Low	90 Å²	90	68.1 Å²	68.1	42%	0.417	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	147.5	165.2	66.7	-76.7	0	0	0	111.1	F211 V212	F211-H220 WeakPolarHBondContact CD1-O 3.4Å; V212-H220 VanDerWaalsContact CB-CE1 3.45Å; V212-H220 WeakPolarHBondContact CB-CE1 3.41Å; V212-H220 VanDerWaalsContact CG1-CE1 3.46Å; V212-H220 WeakPolarHBondContact CG1-CE1 3.36Å; V212-H220 PolarHBondContact N-O 2.95Å; V212-H220 PolarHBondContact O-N 3.33Å
221	L	66.7	Low	65.7	Low	61 Å²	61	69 Å²	69	32%	0.319	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	120.6	170.6	-111.7	160.3	0	0	0	108.3	R209 F211	R209-L221 HydrophobicContact CB-CD2 3.82Å; R209-L221 HydrophobicContact CG-CD2 4.02Å; F211-L221 HydrophobicContact CD2-CD1 4.46Å; F211-L221 HydrophobicContact CD2-CD2 4.44Å; F211-L221 HydrophobicContact CD2-CG 4Å; F211-L221 HydrophobicContact CE1-CG 4.17Å; F211-L221 HydrophobicContact CE2-CD1 3.65Å; F211-L221 HydrophobicContact CE2-CD2 4.4Å; F211-L221 HydrophobicContact CE2-CG 3.58Å; F211-L221 HydrophobicContact CG-CG 4.46Å; F211-L221 HydrophobicContact CZ-CB 4.33Å; F211-L221 HydrophobicContact CZ-CD1 3.77Å; F211-L221 HydrophobicContact CZ-CG 3.65Å
222	E	67	Low	65.9	Low	36 Å²	36	69.1 Å²	69.1	17%	0.168	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-66.9	154.5	165.3	-94	-171.5	154.7	0	0	110.5	V210 V212 R225	V210-E222 HydrophobicContact CB-CB 4.38Å; V210-E222 PolarHBondContact O-N 3.46Å; V212-E222 HydrophobicContact CG2-CB 4.41Å; V212-E222 HydrophobicContact CG2-CG 3.63Å; E222-R225 VanDerWaalsContact CD-NH2 3.26Å; E222-R225 IonicContact OE1-CZ 2.83Å; E222-R225 IonicContact OE1-NE 3.06Å; E222-R225 IonicContact OE1-NH2 2.58Å; E222-R225 PolarHBondContact OE1-NH2 2.9Å; E222-R225 IonicContact OE2-CZ 2.77Å; E222-R225 IonicContact OE2-NE 3.08Å; E222-R225 PolarHBondContact OE2-NE 3.15Å; E222-R225 IonicContact OE2-NH2 3.79Å; E222-R225 PolarHBondContact OE2-NH2 3.25Å; E222-R225 VanDerWaalsContact OE2-NH2 3.17Å
223	R	60.4	Low	66.1	Low	191 Å²	191	72.6 Å²	72.6	72%	0.721	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-58.2	147.1	167.6	-62.5	-178.1	178.8	-147.9	-2.7	109.1	R225	R223-R225 PolarHBondContact O-N 2.9Å; R223-R225 VanDerWaalsContact O-N 3.16Å
224	F	62	Low	66.7	Low	115 Å²	115	74 Å²	74	50%	0.504	35%	0.352	S	S	.	.			trans	-45.6	122.5	174.9	-68.3	-82.7	0	0	0	111.8	E118 R209	E118-F224 HydrophobicContact CB-CE1 4.06Å; E118-F224 VanDerWaalsContact OE2-CE1 3.25Å; E118-F224 WeakPolarHBondContact OE2-CE1 3.49Å; E118-F224 VanDerWaalsContact OE2-CZ 3.3Å; E118-F224 WeakPolarHBondContact OE2-CZ 3.39Å; R209-F224 HydrophobicContact CG-CD1 4.09Å; R209-F224 HydrophobicContact CG-CE1 3.62Å; R209-F224 HydrophobicContact CG-CZ 4.24Å
225	R	62.7	Low	67.3	Low	89 Å²	89	72 Å²	72	34%	0.336	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	163.9	168.8	-66.9	-176.4	-176.4	-94.5	5.8	109.2	C208 E222 R223 C227 D229	C208-R225 PolarHBondContact N-O 3.42Å; C208-R225 PolarHBondContact O-N 3.46Å; E222-R225 VanDerWaalsContact CD-NH2 3.26Å; E222-R225 IonicContact OE1-CZ 2.83Å; E222-R225 IonicContact OE1-NE 3.06Å; E222-R225 IonicContact OE1-NH2 2.58Å; E222-R225 PolarHBondContact OE1-NH2 2.9Å; E222-R225 IonicContact OE2-CZ 2.77Å; E222-R225 IonicContact OE2-NE 3.08Å; E222-R225 PolarHBondContact OE2-NE 3.15Å; E222-R225 IonicContact OE2-NH2 3.79Å; E222-R225 PolarHBondContact OE2-NH2 3.25Å; E222-R225 VanDerWaalsContact OE2-NH2 3.17Å; R223-R225 PolarHBondContact O-N 2.9Å; R223-R225 VanDerWaalsContact O-N 3.16Å; R225-C227 PolarHBondContact O-N 2.99Å; R225-D229 HydrophobicContact CB-CB 4.5Å
226	F	63.3	Low	68.2	Low	97 Å²	97	68.2 Å²	68.2	43%	0.425	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	135.1	163.6	-101.8	-97	0	0	0	107.9	L205 P206 L228 D229	L205-F226 HydrophobicContact CD2-CE1 4.05Å; L205-F226 HydrophobicContact CD2-CE2 4.05Å; L205-F226 HydrophobicContact CD2-CZ 3.37Å; P206-F226 HydrophobicContact CG-CD1 4.02Å; P206-F226 HydrophobicContact CG-CE1 4.24Å; P206-F226 WeakPolarHBondContact O-CA 3.22Å; F226-L228 HydrophobicContact CD1-CD1 4.39Å; F226-L228 PolarHBondContact O-N 3.36Å; F226-L228 VanDerWaalsContact O-N 3.15Å; F226-D229 HydrophobicContact CB-CB 4.5Å; F226-D229 PolarHBondContact N-OD2 3.3Å; F226-D229 VanDerWaalsContact O-CB 3.25Å; F226-D229 WeakPolarHBondContact O-CB 2.97Å; F226-D229 PolarHBondContact O-N 3.48Å
227	C	64.5	Low	69.1	Low	2 Å²	2	57.4 Å²	57.4	1%	0.014	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-55.3	-34	173	-62.4	0	0	0	0	111.6	V70 G74 P206 G207 C208 R225 D229 Q230	V70-C227 HydrophobicContact CG1-CB 3.68Å; G74-C227 WeakPolarHBondContact O-CB 3.49Å; P206-C227 VanDerWaalsContact C-SG 3.57Å; P206-C227 HydrophobicContact CB-CB 4.14Å; P206-C227 PolarHBondContact O-N 3.01Å; P206-C227 PolarHBondContact O-SG 2.82Å; G207-C227 PolarHBondContact O-SG 3.11Å; G207-C227 VanDerWaalsContact O-SG 3.42Å; C208-C227 HydrophobicContact CB-CB 3.88Å; C208-C227 WeakPolarHBondContact CB-SG 3.42Å; C208-C227 PolarHBondContact N-SG 3Å; C208-C227 VanDerWaalsContact N-SG 3.39Å; C208-C227 VanDerWaalsContact SG-CA 3.57Å; C208-C227 WeakPolarHBondContact SG-CB 3.48Å; C208-C227 CovalentContact SG-SG 2.03Å; C208-C227 PolarHBondContact SG-SG 3.4Å; R225-C227 PolarHBondContact O-N 2.99Å; C227-D229 VanDerWaalsContact C-N 3.28Å; C227-D229 PolarHBondContact O-N 3.36Å; C227-Q230 PolarHBondContact O-N 3.22Å; C227-Q230 VanDerWaalsContact O-N 3.11Å
228	L	65.4	Low	70.1	Confident	82 Å²	82	57.4 Å²	57.4	43%	0.429	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-65.6	-23.4	176.3	-64.6	171.8	0	0	0	113.8	V70 D71 F226 Q230	V70-L228 HydrophobicContact CG1-CD2 4.18Å; D71-L228 WeakPolarHBondContact O-CD2 3.43Å; F226-L228 HydrophobicContact CD1-CD1 4.39Å; F226-L228 PolarHBondContact O-N 3.36Å; F226-L228 VanDerWaalsContact O-N 3.15Å; L228-Q230 PolarHBondContact O-N 3.47Å; L228-Q230 VanDerWaalsContact O-N 3.16Å
229	D	70.6	Confident	71	Confident	92 Å²	92	53.5 Å²	53.5	49%	0.492	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-63	-19.3	172.5	-61.1	-24.9	0	0	0	111.4	R225 F226 C227 A231	R225-D229 HydrophobicContact CB-CB 4.5Å; F226-D229 HydrophobicContact CB-CB 4.5Å; F226-D229 PolarHBondContact N-OD2 3.3Å; F226-D229 VanDerWaalsContact O-CB 3.25Å; F226-D229 WeakPolarHBondContact O-CB 2.97Å; F226-D229 PolarHBondContact O-N 3.48Å; C227-D229 VanDerWaalsContact C-N 3.28Å; C227-D229 PolarHBondContact O-N 3.36Å; D229-A231 PolarHBondContact O-N 3.5Å
230	Q	68.9	Low	71.5	Confident	65 Å²	65	59.5 Å²	59.5	30%	0.304	27%	0.268	S	S	.	.			trans	57.3	21.4	168.5	-99.6	-167.5	46.3	0	0	114.7	K65 V70 C227 L228 W232	K65-Q230 PolarHBondContact NZ-O 3.18Å; V70-Q230 HydrophobicContact CB-CG 4.33Å; V70-Q230 HydrophobicContact CG2-CG 3.93Å; C227-Q230 PolarHBondContact O-N 3.22Å; C227-Q230 VanDerWaalsContact O-N 3.11Å; L228-Q230 PolarHBondContact O-N 3.47Å; L228-Q230 VanDerWaalsContact O-N 3.16Å; Q230-W232 PolarHBondContact O-N 3.16Å
231	A	73.8	Confident	71.6	Confident	23 Å²	23	55.4 Å²	55.4	19%	0.19	25%	0.25	C	S	.	.			trans	-79.3	37.3	-166.8	0	0	0	0	0	114.6	R112 D229	R112-A231 WeakPolarHBondContact CD-O 3.37Å; D229-A231 PolarHBondContact O-N 3.5Å
232	W	78.4	Confident	71.5	Confident	5 Å²	5	53.4 Å²	53.4	2%	0.019	24%	0.241	C	C	.	.			trans	-129.9	147.1	177.6	51.7	-93.9	0	0	0	109.6	K65 V68 V70 L76 R112 F114 V210 Q230 F235	K65-W232 HydrophobicContact CB-CE3 4.15Å; K65-W232 HydrophobicContact CB-CH2 4.15Å; K65-W232 HydrophobicContact CB-CZ3 3.48Å; K65-W232 VanDerWaalsContact CB-CZ3 3.48Å; K65-W232 HydrophobicContact CD-CD2 4.47Å; K65-W232 HydrophobicContact CD-CE3 3.99Å; K65-W232 HydrophobicContact CD-CH2 3.75Å; K65-W232 HydrophobicContact CD-CZ2 4.26Å; K65-W232 HydrophobicContact CD-CZ3 3.6Å; K65-W232 VanDerWaalsContact CD-O 3.29Å; K65-W232 WeakPolarHBondContact CD-O 3.32Å; K65-W232 HydrophobicContact CG-CE3 4.25Å; K65-W232 HydrophobicContact CG-CH2 3.58Å; K65-W232 HydrophobicContact CG-CZ3 3.43Å; K65-W232 VanDerWaalsContact CG-CZ3 3.43Å; V68-W232 HydrophobicContact CB-CH2 4.23Å; V68-W232 HydrophobicContact CG1-CH2 3.73Å; V68-W232 HydrophobicContact CG1-CZ2 4.34Å; V70-W232 HydrophobicContact CG2-CZ2 4Å; L76-W232 HydrophobicContact CD2-CH2 3.64Å; L76-W232 HydrophobicContact CD2-CZ2 3.3Å; R112-W232 HydrophobicContact CB-CB 4.33Å; R112-W232 CarbonylContact O-C 3.44Å; F114-W232 HydrophobicContact CB-CB 4.33Å; F114-W232 HydrophobicContact CB-CD2 3.91Å; F114-W232 HydrophobicContact CB-CE3 4.13Å; F114-W232 HydrophobicContact CB-CG 3.97Å; F114-W232 AromaticContact CD2-CD1 3.91Å; F114-W232 HydrophobicContact CD2-CD2 4.21Å; F114-W232 AromaticContact CD2-CE2 3.99Å; F114-W232 HydrophobicContact CD2-CG 4.21Å; F114-W232 AromaticContact CD2-NE1 3.75Å; F114-W232 HydrophobicContact CG-CD2 4.49Å; V210-W232 HydrophobicContact CG1-CB 4.34Å; V210-W232 HydrophobicContact CG2-CB 4.28Å; Q230-W232 PolarHBondContact O-N 3.16Å; W232-F235 HydrophobicContact CH2-CD1 4.3Å; W232-F235 AromaticContact CZ3-CD1 3.77Å; W232-F235 HydrophobicContact CZ3-CD1 3.77Å
233	D	79	Confident	71	Confident	73 Å²	73	54.2 Å²	54.2	39%	0.39	25%	0.246	S	C	.	.	S	Bend	trans	-101.3	-30.3	-172.1	-48	-56.5	0	0	0	111.8	K65 R112	K65-D233 VanDerWaalsContact CB-O 3.29Å; K65-D233 WeakPolarHBondContact CB-O 3.42Å; K65-D233 PolarHBondContact N-O 3.23Å; R112-D233 WeakPolarHBondContact CB-OD2 3.15Å; R112-D233 PolarHBondContact N-OD2 3.5Å; R112-D233 PolarHBondContact O-N 3.05Å
234	Y	79.4	Confident	70.7	Confident	33 Å²	33	48.1 Å²	48.1	13%	0.129	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	163.9	-178.5	-52	-92.4	0	0	0	110.3	V42 I63 P64 F106 V111 R112 L113 F114	V42-Y234 HydrophobicContact CB-CD1 4.27Å; V42-Y234 HydrophobicContact CB-CE1 4.1Å; V42-Y234 HydrophobicContact CG1-CD1 4.19Å; V42-Y234 HydrophobicContact CG1-CE1 3.76Å; V42-Y234 HydrophobicContact CG2-CD1 3.94Å; V42-Y234 HydrophobicContact CG2-CE1 3.56Å; I63-Y234 WeakPolarHBondContact O-CA 3.18Å; I63-Y234 WeakPolarHBondContact O-CB 3.28Å; P64-Y234 VanDerWaalsContact CA-CD1 3.5Å; P64-Y234 HydrophobicContact CB-CD1 3.92Å; P64-Y234 HydrophobicContact CB-CE1 3.91Å; F106-Y234 HydrophobicContact CD1-CD2 4.04Å; F106-Y234 HydrophobicContact CD1-CE1 4.19Å; F106-Y234 AromaticContact CD1-CE2 3.66Å; F106-Y234 HydrophobicContact CD1-CE2 3.66Å; F106-Y234 HydrophobicContact CD1-CG 4.46Å; F106-Y234 AromaticContact CD1-CZ 3.75Å; F106-Y234 AromaticContact CE1-CD1 3.93Å; F106-Y234 HydrophobicContact CE1-CD1 3.93Å; F106-Y234 AromaticContact CE1-CD2 3.59Å; F106-Y234 HydrophobicContact CE1-CD2 3.59Å; F106-Y234 HydrophobicContact CE1-CE1 4.07Å; F106-Y234 AromaticContact CE1-CE2 3.72Å; F106-Y234 HydrophobicContact CE1-CE2 3.72Å; F106-Y234 AromaticContact CE1-CG 3.72Å; F106-Y234 HydrophobicContact CE1-CG 3.72Å; F106-Y234 AromaticContact CE1-CZ 3.96Å; F106-Y234 HydrophobicContact CZ-CD2 4.26Å; F106-Y234 HydrophobicContact CZ-CG 4.44Å; V111-Y234 HydrophobicContact CG1-CD2 3.41Å; V111-Y234 VanDerWaalsContact CG1-CD2 3.41Å; V111-Y234 HydrophobicContact CG1-CE2 3.54Å; R112-Y234 PolarHBondContact O-N 3.44Å; R112-Y234 VanDerWaalsContact O-N 3.16Å; L113-Y234 CarbonylContact C-O 3.33Å; L113-Y234 WeakPolarHBondContact CA-O 3.4Å; F114-Y234 PolarHBondContact N-O 3.29Å
235	F	79.7	Confident	70.2	Confident	1 Å²	1	44.6 Å²	44.6	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	178	161	60.4	-91.1	0	0	0	109.2	M62 I63 P64 V68 Y79 Y82 F114 W232 C237	M62-F235 WeakPolarHBondContact CA-O 3.44Å; I63-F235 HydrophobicContact CB-CE1 4.46Å; I63-F235 HydrophobicContact CB-CE2 3.65Å; I63-F235 HydrophobicContact CB-CZ 3.63Å; I63-F235 HydrophobicContact CD1-CE2 3.53Å; I63-F235 HydrophobicContact CD1-CZ 4.25Å; I63-F235 HydrophobicContact CG1-CE2 4.19Å; I63-F235 HydrophobicContact CG2-CE1 3.95Å; I63-F235 HydrophobicContact CG2-CE2 3.93Å; I63-F235 HydrophobicContact CG2-CZ 3.18Å; I63-F235 PolarHBondContact N-O 3.18Å; I63-F235 VanDerWaalsContact N-O 3.14Å; I63-F235 PolarHBondContact O-N 2.92Å; P64-F235 WeakPolarHBondContact O-CE1 3.17Å; V68-F235 HydrophobicContact CG2-CE1 3.77Å; Y79-F235 AromaticContact CD1-CD2 3.9Å; Y79-F235 HydrophobicContact CD1-CD2 3.9Å; Y79-F235 AromaticContact CD1-CE2 3.8Å; Y79-F235 HydrophobicContact CD1-CE2 3.8Å; Y79-F235 HydrophobicContact CD1-CG 4.37Å; Y79-F235 HydrophobicContact CD1-CZ 4.19Å; Y79-F235 AromaticContact CD2-CD1 3.9Å; Y79-F235 HydrophobicContact CD2-CD1 3.9Å; Y79-F235 AromaticContact CD2-CE1 3.77Å; Y79-F235 HydrophobicContact CD2-CE1 3.77Å; Y79-F235 HydrophobicContact CD2-CG 4.38Å; Y79-F235 HydrophobicContact CD2-CZ 4.13Å; Y79-F235 HydrophobicContact CE1-CB 4.31Å; Y79-F235 AromaticContact CE1-CD1 3.73Å; Y79-F235 HydrophobicContact CE1-CD1 3.73Å; Y79-F235 AromaticContact CE1-CD2 2.54Å; Y79-F235 HydrophobicContact CE1-CD2 2.54Å; Y79-F235 AromaticContact CE1-CE1 3.73Å; Y79-F235 HydrophobicContact CE1-CE1 3.73Å; Y79-F235 AromaticContact CE1-CE2 2.53Å; Y79-F235 HydrophobicContact CE1-CE2 2.53Å; Y79-F235 AromaticContact CE1-CG 3.17Å; Y79-F235 HydrophobicContact CE1-CG 3.17Å; Y79-F235 AromaticContact CE1-CZ 3.15Å; Y79-F235 HydrophobicContact CE1-CZ 3.15Å; Y79-F235 HydrophobicContact CE2-CB 4.27Å; Y79-F235 AromaticContact CE2-CD1 2.54Å; Y79-F235 HydrophobicContact CE2-CD1 2.54Å; Y79-F235 AromaticContact CE2-CD2 3.72Å; Y79-F235 HydrophobicContact CE2-CD2 3.72Å; Y79-F235 AromaticContact CE2-CE1 2.53Å; Y79-F235 HydrophobicContact CE2-CE1 2.53Å; Y79-F235 AromaticContact CE2-CE2 3.71Å; Y79-F235 HydrophobicContact CE2-CE2 3.71Å; Y79-F235 AromaticContact CE2-CG 3.16Å; Y79-F235 HydrophobicContact CE2-CG 3.16Å; Y79-F235 AromaticContact CE2-CZ 3.14Å; Y79-F235 HydrophobicContact CE2-CZ 3.14Å; Y79-F235 AromaticContact CZ-CD1 2.29Å; Y79-F235 AromaticContact CZ-CD2 2.28Å; Y79-F235 AromaticContact CZ-CE1 2.29Å; Y79-F235 AromaticContact CZ-CE2 2.28Å; Y79-F235 AromaticContact CZ-CG 2.26Å; Y79-F235 AromaticContact CZ-CZ 2.26Å; Y79-F235 WeakPolarHBondContact OH-CD1 3.48Å; Y79-F235 WeakPolarHBondContact OH-CD2 3.45Å; Y79-F235 WeakPolarHBondContact OH-CE1 3.46Å; Y79-F235 WeakPolarHBondContact OH-CE2 3.34Å; Y79-F235 WeakPolarHBondContact OH-CG 3.01Å; Y79-F235 WeakPolarHBondContact OH-CZ 3.38Å; Y82-F235 HydrophobicContact CD2-CZ 4.17Å; Y82-F235 HydrophobicContact CG-CZ 4.3Å; F114-F235 HydrophobicContact CB-CB 3.75Å; F114-F235 HydrophobicContact CD1-CB 4.24Å; F114-F235 HydrophobicContact CG-CB 4.33Å; W232-F235 HydrophobicContact CH2-CD1 4.3Å; W232-F235 AromaticContact CZ3-CD1 3.77Å; W232-F235 HydrophobicContact CZ3-CD1 3.77Å; F235-C237 VanDerWaalsContact CE2-SG 3.56Å
236	A	77.7	Confident	69.4	Low	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	145.1	173.4	0	0	0	0	0	112.6	V60 T61 M62 A91 F93	V60-A236 HydrophobicContact CG1-CB 3.61Å; T61-A236 CarbonylContact O-C 3.48Å; T61-A236 WeakPolarHBondContact O-CA 3.3Å; M62-A236 HydrophobicContact CG-CB 4.1Å; A91-A236 HydrophobicContact CB-CB 3.95Å; A91-A236 PolarHBondContact N-O 3.41Å; F93-A236 HydrophobicContact CE2-CB 4.16Å; F93-A236 HydrophobicContact CZ-CB 3.81Å
237	C	78.5	Confident	68.5	Low	0 Å²	0	45 Å²	45	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.9	166.6	-62.2	0	0	0	0	109.6	V60 T61 C83 M86 R89 F235 T239	V60-C237 WeakPolarHBondContact CA-O 3.46Å; T61-C237 PolarHBondContact N-O 3.25Å; T61-C237 PolarHBondContact O-N 3.23Å; C83-C237 WeakPolarHBondContact CA-SG 3.34Å; C83-C237 HydrophobicContact CB-CB 3.87Å; C83-C237 WeakPolarHBondContact CB-SG 3.41Å; C83-C237 WeakPolarHBondContact SG-CB 3.49Å; C83-C237 CovalentContact SG-SG 2.04Å; C83-C237 PolarHBondContact SG-SG 3.33Å; M86-C237 HydrophobicContact CE-CB 3.62Å; M86-C237 WeakPolarHBondContact CE-SG 3.49Å; R89-C237 CarbonylContact O-C 3.56Å; R89-C237 VanDerWaalsContact O-CA 3.23Å; R89-C237 WeakPolarHBondContact O-CA 3.48Å; F235-C237 VanDerWaalsContact CE2-SG 3.56Å; C237-T239 HydrophobicContact CB-CG2 4.19Å
238	E	79.9	Confident	67.3	Low	24 Å²	24	54 Å²	54	11%	0.112	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	110.3	166	-169.8	179.1	-128.4	0	0	109	K47 P58 C59 G88 R89 A91	K47-E238 VanDerWaalsContact CD-OE1 3.29Å; K47-E238 WeakPolarHBondContact CD-OE1 3.02Å; K47-E238 WeakPolarHBondContact CE-OE1 3.48Å; K47-E238 IonicContact NZ-OE1 2.92Å; K47-E238 PolarHBondContact NZ-OE1 3.5Å; P58-E238 HydrophobicContact CB-CG 4.47Å; C59-E238 WeakPolarHBondContact O-CA 3.46Å; G88-E238 CarbonylContact C-O 3.57Å; G88-E238 WeakPolarHBondContact CA-O 3.42Å; R89-E238 HydrophobicContact CG-CB 4.19Å; R89-E238 IonicContact CZ-OE2 3.83Å; R89-E238 PolarHBondContact N-O 2.89Å; R89-E238 IonicContact NE-OE2 3.71Å; R89-E238 PolarHBondContact NE-OE2 3.2Å; R89-E238 IonicContact NH2-OE2 3.24Å; R89-E238 PolarHBondContact NH2-OE2 3.23Å; R89-E238 PolarHBondContact O-N 3.24Å; A91-E238 HydrophobicContact CB-CB 4.09Å
239	T	77.5	Confident	66	Low	4 Å²	4	58.8 Å²	58.8	3%	0.025	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	-177.5	179.7	58.4	0	0	0	0	109	P33 P58 C59 M86 C237	P33-T239 HydrophobicContact CG-CG2 4.36Å; P58-T239 WeakPolarHBondContact CA-O 3.35Å; C59-T239 VanDerWaalsContact CB-OG1 3.28Å; C59-T239 WeakPolarHBondContact CB-OG1 3.37Å; C59-T239 PolarHBondContact N-O 3.08Å; C59-T239 PolarHBondContact O-N 2.75Å; C59-T239 PolarHBondContact O-OG1 3.49Å; M86-T239 HydrophobicContact CB-CG2 3.62Å; M86-T239 HydrophobicContact CE-CG2 4.32Å; M86-T239 HydrophobicContact SD-CG2 4.4Å; C237-T239 HydrophobicContact CB-CG2 4.19Å
240	R	76.1	Confident	64.7	Low	166 Å²	166	60.7 Å²	60.7	63%	0.626	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.4	145.8	170.2	-64.5	-177.6	-176.8	-174.7	2.2	110.2	S242	R240-S242 PolarHBondContact O-N 3.43Å
241	A	72.1	Confident	63.9	Low	5 Å²	5	64 Å²	64	4%	0.041	29%	0.294	C	S	.	.			trans	-59.5	128.2	171.8	0	0	0	0	0	109.6	L30 L31 V57 C59	L30-A241 HydrophobicContact CB-CB 3.79Å; L31-A241 CarbonylContact O-C 3.56Å; L31-A241 WeakPolarHBondContact O-CA 3.23Å; V57-A241 HydrophobicContact CB-CB 4.28Å; V57-A241 PolarHBondContact O-N 3.43Å; C59-A241 VanDerWaalsContact SG-CA 3.5Å; C59-A241 VanDerWaalsContact SG-CB 3.59Å; C59-A241 PolarHBondContact SG-N 3.21Å
242	S	64	Low	63.2	Low	18 Å²	18	66.8 Å²	66.8	13%	0.126	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-150.8	150.8	-174.8	179.9	0	0	0	0	111.9	L31 R240 K244	L31-S242 PolarHBondContact N-O 3.19Å; L31-S242 PolarHBondContact O-N 3.43Å; R240-S242 PolarHBondContact O-N 3.43Å; S242-K244 VanDerWaalsContact C-N 3.25Å; S242-K244 WeakPolarHBondContact OG-CB 3.47Å; S242-K244 WeakPolarHBondContact OG-CG 3.41Å; S242-K244 PolarHBondContact OG-N 3.43Å
243	D	56.3	Low	62.8	Low	53 Å²	53	67.9 Å²	67.9	28%	0.283	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-70.1	-13.4	165.9	52.3	-9.3	0	0	0	114	W245 I246	D243-W245 PolarHBondContact O-N 3.49Å; D243-W245 VanDerWaalsContact O-N 3.11Å; D243-I246 HydrophobicContact CB-CD1 4.15Å; D243-I246 WeakPolarHBondContact O-CD1 3.12Å; D243-I246 VanDerWaalsContact O-CG1 3.31Å; D243-I246 WeakPolarHBondContact O-CG1 3.43Å; D243-I246 PolarHBondContact O-N 2.72Å
244	K	54.5	Low	62.2	Low	63 Å²	63	68.7 Å²	68.7	27%	0.274	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-54.1	-26.9	172.2	-75.9	175.5	179	-172.1	0	113.8	E87 S242 I246	E87-K244 IonicContact OE1-NZ 2.94Å; E87-K244 PolarHBondContact OE1-NZ 3.15Å; E87-K244 IonicContact OE2-NZ 2.68Å; E87-K244 PolarHBondContact OE2-NZ 3.47Å; S242-K244 VanDerWaalsContact C-N 3.25Å; S242-K244 WeakPolarHBondContact OG-CB 3.47Å; S242-K244 WeakPolarHBondContact OG-CG 3.41Å; S242-K244 PolarHBondContact OG-N 3.43Å; K244-I246 PolarHBondContact O-N 2.87Å
245	W	52.9	Low	61.8	Low	41 Å²	41	68.1 Å²	68.1	16%	0.155	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-89.3	11	-171.4	-54.5	117.5	0	0	0	115.1	P33 M86 D243 Y247 L275	P33-W245 HydrophobicContact CG-CD2 4.49Å; M86-W245 HydrophobicContact CB-CH2 4.31Å; M86-W245 HydrophobicContact CB-CZ2 4.21Å; M86-W245 HydrophobicContact CG-CH2 4.42Å; D243-W245 PolarHBondContact O-N 3.49Å; D243-W245 VanDerWaalsContact O-N 3.11Å; W245-Y247 PolarHBondContact O-N 3.45Å; W245-L275 HydrophobicContact CE3-CD2 4.39Å; W245-L275 HydrophobicContact CZ3-CD2 4.44Å
246	I	45.7	Very low	61.4	Low	107 Å²	107	69.6 Å²	69.6	55%	0.549	32%	0.324	S	S	.	.			trans	-76.6	109.8	-174.5	-64.6	169.8	0	0	0	111.8	D243 K244 R248	D243-I246 HydrophobicContact CB-CD1 4.15Å; D243-I246 WeakPolarHBondContact O-CD1 3.12Å; D243-I246 VanDerWaalsContact O-CG1 3.31Å; D243-I246 WeakPolarHBondContact O-CG1 3.43Å; D243-I246 PolarHBondContact O-N 2.72Å; K244-I246 PolarHBondContact O-N 2.87Å; I246-R248 PolarHBondContact O-N 2.92Å
247	Y	43.1	Very low	60.9	Low	87 Å²	87	75.4 Å²	75.4	34%	0.341	35%	0.351	S	S	.	.			trans	-62.9	129.7	-179.5	-113.7	-125	0	0	0	114.2	Q38 W245 K249 S274 L275	Q38-Y247 HydrophobicContact CG-CE2 3.76Å; Q38-Y247 VanDerWaalsContact OE1-CZ 3.28Å; Q38-Y247 PolarHBondContact OE1-OH 2.8Å; W245-Y247 PolarHBondContact O-N 3.45Å; Y247-K249 PolarHBondContact O-N 2.98Å; Y247-S274 WeakPolarHBondContact OH-CB 2.77Å; Y247-S274 PolarHBondContact OH-OG 2.85Å; Y247-L275 HydrophobicContact CE2-CD2 4.26Å
248	R	39.1	Very low	60.6	Low	193 Å²	193	80.4 Å²	80.4	73%	0.728	39%	0.386	S	S	*	.	S	Bend	trans	52.1	-2.6	154	-98.9	-177.7	-178.8	167.8	5.5	121.1	I246	I246-R248 PolarHBondContact O-N 2.92Å
249	K	38.8	Very low	60.3	Low	182 Å²	182	82.4 Å²	82.4	79%	0.791	40%	0.401	S	S	*	.			trans	-139.8	61.2	-165.8	-156.1	176	-176.5	176.1	0	116.6	Y247	Y247-K249 PolarHBondContact O-N 2.98Å
250	K	43.6	Very low	59.9	Low	132 Å²	132	88.8 Å²	88.8	57%	0.574	42%	0.424	S	S	*	.			trans	-174.4	100.2	137.1	-103.3	171.9	-162.1	-72.8	0	111.5	E252	K250-E252 HydrophobicContact CB-CB 4.35Å; K250-E252 HydrophobicContact CG-CB 4.21Å; K250-E252 HydrophobicContact CG-CG 4.07Å; K250-E252 WeakPolarHBondContact CG-OE1 3.49Å; K250-E252 IonicContact NZ-OE1 2.63Å; K250-E252 PolarHBondContact NZ-OE1 2.86Å; K250-E252 IonicContact NZ-OE2 3.11Å; K250-E252 PolarHBondContact NZ-OE2 2.91Å; K250-E252 PolarHBondContact O-N 3.3Å
251	V	51.7	Low	59.6	Low	134 Å²	134	83.2 Å²	83.2	81%	0.812	41%	0.408	S	S	*	.			trans	-87.9	64.2	159	-171.8	0	0	0	0	107.4
252	E	59	Low	59.6	Low	82 Å²	82	83.4 Å²	83.4	38%	0.383	41%	0.409	S	S	.	.			trans	-105.9	118.4	-177.7	-91.4	174.7	-145.7	0	0	111.2	K250 T254	K250-E252 HydrophobicContact CB-CB 4.35Å; K250-E252 HydrophobicContact CG-CB 4.21Å; K250-E252 HydrophobicContact CG-CG 4.07Å; K250-E252 WeakPolarHBondContact CG-OE1 3.49Å; K250-E252 IonicContact NZ-OE1 2.63Å; K250-E252 PolarHBondContact NZ-OE1 2.86Å; K250-E252 IonicContact NZ-OE2 3.11Å; K250-E252 PolarHBondContact NZ-OE2 2.91Å; K250-E252 PolarHBondContact O-N 3.3Å; E252-T254 PolarHBondContact O-N 3.3Å; E252-T254 PolarHBondContact O-OG1 2.71Å
253	C	69.5	Low	60.2	Low	27 Å²	27	84.6 Å²	84.6	18%	0.182	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-61.4	116.4	168.8	-59.2	0	0	0	0	109.1	C262 Y263 C286 T287 C288	C253-C262 HydrophobicContact CB-CB 4.34Å; C253-Y263 CarbonylContact C-O 3.5Å; C253-Y263 WeakPolarHBondContact CA-O 3.47Å; C253-C286 HydrophobicContact CB-CB 4.3Å; C253-C286 WeakPolarHBondContact CB-SG 3.48Å; C253-C286 WeakPolarHBondContact SG-CB 3.03Å; C253-C286 CovalentContact SG-SG 2.03Å; C253-C286 PolarHBondContact SG-SG 3.43Å; C253-T287 WeakPolarHBondContact CB-O 3.06Å; C253-T287 PolarHBondContact SG-O 3.09Å; C253-T287 VanDerWaalsContact SG-O 3.32Å; C253-C288 PolarHBondContact O-SG 2.76Å; C253-C288 VanDerWaalsContact O-SG 3.4Å
254	T	67.5	Low	61	Low	91 Å²	91	85.9 Å²	85.9	56%	0.558	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.4	-179.8	-57.3	0	0	0	0	108.7	E252 D256 C262 Y263	E252-T254 PolarHBondContact O-N 3.3Å; E252-T254 PolarHBondContact O-OG1 2.71Å; T254-D256 PolarHBondContact O-N 2.72Å; T254-C262 WeakPolarHBondContact O-CA 3.49Å; T254-Y263 PolarHBondContact N-O 3.04Å; T254-Y263 PolarHBondContact O-N 3.36Å
255	Y	69.8	Low	61.7	Low	21 Å²	21	86.5 Å²	86.5	8%	0.082	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	121.9	175.7	-179.2	-103	0	0	0	109.5	E257 C288 L317 M318 Q320	Y255-E257 HydrophobicContact CD1-CB 4.44Å; Y255-E257 HydrophobicContact CE1-CB 4Å; Y255-E257 HydrophobicContact CE1-CG 4.41Å; Y255-C288 PolarHBondContact N-SG 2.97Å; Y255-C288 VanDerWaalsContact N-SG 3.38Å; Y255-L317 HydrophobicContact CD2-CB 4.32Å; Y255-L317 HydrophobicContact CD2-CD1 3.94Å; Y255-L317 HydrophobicContact CE2-CD1 4.19Å; Y255-M318 VanDerWaalsContact CB-O 3.3Å; Y255-M318 WeakPolarHBondContact CB-O 3.42Å; Y255-Q320 HydrophobicContact CD1-CB 4.03Å; Y255-Q320 HydrophobicContact CE1-CB 3.89Å; Y255-Q320 HydrophobicContact CE1-CG 3.96Å; Y255-Q320 HydrophobicContact CE2-CG 4.39Å; Y255-Q320 HydrophobicContact CG-CB 4.41Å
256	D	72.4	Confident	62.4	Low	31 Å²	31	86.7 Å²	86.7	17%	0.166	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	107.8	172.5	-174	-34.8	0	0	0	108.6	T254 S258 T259 R260 T261 Y263 K283	T254-D256 PolarHBondContact O-N 2.72Å; D256-S258 VanDerWaalsContact C-N 3.25Å; D256-S258 PolarHBondContact O-N 2.04Å; D256-S258 WeakPolarHBondContact OD1-CB 3.35Å; D256-S258 PolarHBondContact OD1-N 2.99Å; D256-S258 PolarHBondContact OD1-OG 3.16Å; D256-T259 WeakPolarHBondContact CB-OG1 3.27Å; D256-T259 VanDerWaalsContact CG-OG1 3.27Å; D256-T259 PolarHBondContact O-N 2.98Å; D256-T259 PolarHBondContact O-OG1 2.83Å; D256-T259 PolarHBondContact OD1-OG1 2.97Å; D256-R260 WeakPolarHBondContact O-CA 2.98Å; D256-R260 PolarHBondContact O-N 3.48Å; D256-T261 WeakPolarHBondContact CB-O 3.36Å; D256-T261 PolarHBondContact N-O 2.92Å; D256-T261 PolarHBondContact O-N 2.8Å; D256-Y263 HydrophobicContact CB-CD2 3.88Å; D256-Y263 HydrophobicContact CB-CE2 4.01Å; D256-K283 IonicContact OD2-NZ 2.76Å; D256-K283 PolarHBondContact OD2-NZ 3.46Å
257	E	66.1	Low	63	Low	122 Å²	122	84 Å²	84	57%	0.57	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-30.9	-176.4	-177.5	169.1	-140.8	0	0	113.1	Y255 T259 H324	Y255-E257 HydrophobicContact CD1-CB 4.44Å; Y255-E257 HydrophobicContact CE1-CB 4Å; Y255-E257 HydrophobicContact CE1-CG 4.41Å; E257-T259 VanDerWaalsContact C-N 3.29Å; E257-T259 PolarHBondContact O-N 3.23Å; E257-H324 IonicContact OE1-CE1 2.72Å; E257-H324 PolarHBondContact OE1-CE1 2.91Å
258	S	72.1	Confident	63.8	Low	105 Å²	105	83.6 Å²	83.6	73%	0.734	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-29.9	-177	73	0	0	0	0	112.9	D256	D256-S258 VanDerWaalsContact C-N 3.25Å; D256-S258 PolarHBondContact O-N 2.04Å; D256-S258 WeakPolarHBondContact OD1-CB 3.35Å; D256-S258 PolarHBondContact OD1-N 2.99Å; D256-S258 PolarHBondContact OD1-OG 3.16Å
259	T	73.6	Confident	64.6	Low	67 Å²	67	79.4 Å²	79.4	41%	0.411	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-11.2	-178.2	48.5	0	0	0	0	112.9	D256 E257 T261 Y263	D256-T259 WeakPolarHBondContact CB-OG1 3.27Å; D256-T259 VanDerWaalsContact CG-OG1 3.27Å; D256-T259 PolarHBondContact O-N 2.98Å; D256-T259 PolarHBondContact O-OG1 2.83Å; D256-T259 PolarHBondContact OD1-OG1 2.97Å; E257-T259 VanDerWaalsContact C-N 3.29Å; E257-T259 PolarHBondContact O-N 3.23Å; T259-T261 VanDerWaalsContact CB-OG1 3.23Å; T259-T261 WeakPolarHBondContact CB-OG1 3.47Å; T259-T261 PolarHBondContact O-N 3.35Å; T259-T261 PolarHBondContact O-OG1 2.81Å; T259-T261 PolarHBondContact OG1-OG1 3.1Å; T259-T261 VanDerWaalsContact OG1-OG1 3.09Å; T259-Y263 WeakPolarHBondContact OG1-CE2 2.99Å
260	R	70.7	Confident	65.5	Low	138 Å²	138	72.6 Å²	72.6	52%	0.521	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	21.3	-174.8	-53.9	-177.9	178.9	-176.6	-0.3	114.3	D256	D256-R260 WeakPolarHBondContact O-CA 2.98Å; D256-R260 PolarHBondContact O-N 3.48Å
261	T	68	Low	66	Low	48 Å²	48	73.3 Å²	73.3	29%	0.294	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	153.8	-176	27.7	0	0	0	0	110.7	D256 T259 Y263	D256-T261 WeakPolarHBondContact CB-O 3.36Å; D256-T261 PolarHBondContact N-O 2.92Å; D256-T261 PolarHBondContact O-N 2.8Å; T259-T261 VanDerWaalsContact CB-OG1 3.23Å; T259-T261 WeakPolarHBondContact CB-OG1 3.47Å; T259-T261 PolarHBondContact O-N 3.35Å; T259-T261 PolarHBondContact O-OG1 2.81Å; T259-T261 PolarHBondContact OG1-OG1 3.1Å; T259-T261 VanDerWaalsContact OG1-OG1 3.09Å; T261-Y263 WeakPolarHBondContact O-CD2 3.5Å; T261-Y263 WeakPolarHBondContact OG1-CE2 3.41Å; T261-Y263 VanDerWaalsContact OG1-CZ 3.24Å; T261-Y263 PolarHBondContact OG1-OH 3.33Å
262	C	73.5	Confident	66.1	Low	9 Å²	9	68.7 Å²	68.7	6%	0.061	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.3	-177.5	-74.6	0	0	0	0	110	C253 T254 V285 C286 C288	C253-C262 HydrophobicContact CB-CB 4.34Å; T254-C262 WeakPolarHBondContact O-CA 3.49Å; C262-V285 WeakPolarHBondContact O-CA 3.36Å; C262-C286 CarbonylContact C-O 3.59Å; C262-C286 WeakPolarHBondContact CB-O 3.32Å; C262-C286 PolarHBondContact O-N 2.95Å; C262-C288 HydrophobicContact CB-CB 3.97Å; C262-C288 WeakPolarHBondContact CB-SG 3.29Å; C262-C288 WeakPolarHBondContact SG-CB 3.49Å; C262-C288 CovalentContact SG-SG 2.02Å; C262-C288 PolarHBondContact SG-SG 2.8Å
263	Y	75.8	Confident	65.5	Low	43 Å²	43	73.1 Å²	73.1	17%	0.169	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	147.3	-174.1	-60.9	-83.5	0	0	0	112.8	C253 T254 D256 T259 T261 K283 I284 V285	C253-Y263 CarbonylContact C-O 3.5Å; C253-Y263 WeakPolarHBondContact CA-O 3.47Å; T254-Y263 PolarHBondContact N-O 3.04Å; T254-Y263 PolarHBondContact O-N 3.36Å; D256-Y263 HydrophobicContact CB-CD2 3.88Å; D256-Y263 HydrophobicContact CB-CE2 4.01Å; T259-Y263 WeakPolarHBondContact OG1-CE2 2.99Å; T261-Y263 WeakPolarHBondContact O-CD2 3.5Å; T261-Y263 WeakPolarHBondContact OG1-CE2 3.41Å; T261-Y263 VanDerWaalsContact OG1-CZ 3.24Å; T261-Y263 PolarHBondContact OG1-OH 3.33Å; Y263-K283 HydrophobicContact CD1-CB 3.47Å; Y263-K283 VanDerWaalsContact CD1-CB 3.47Å; Y263-K283 HydrophobicContact CD1-CD 4.4Å; Y263-K283 HydrophobicContact CD1-CG 4.46Å; Y263-K283 HydrophobicContact CD2-CD 4.14Å; Y263-K283 HydrophobicContact CE1-CB 4.01Å; Y263-K283 HydrophobicContact CE2-CD 4.46Å; Y263-K283 HydrophobicContact CG-CB 3.79Å; Y263-K283 HydrophobicContact CG-CD 4.08Å; Y263-K283 HydrophobicContact CG-CG 4.34Å; Y263-I284 VanDerWaalsContact CA-O 3.32Å; Y263-I284 WeakPolarHBondContact CA-O 3.45Å; Y263-V285 HydrophobicContact CD1-CG2 4Å; Y263-V285 HydrophobicContact CE1-CG2 3.54Å
264	K	73.9	Confident	64.4	Low	81 Å²	81	72.8 Å²	72.8	35%	0.352	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	151.4	159.2	64	-178.2	-178.5	171.5	0	107.8	I284 C286	K264-I284 HydrophobicContact CG-CB 4Å; K264-I284 PolarHBondContact N-O 2.9Å; K264-I284 PolarHBondContact O-N 2.85Å; K264-C286 HydrophobicContact CD-CB 4.33Å; K264-C286 HydrophobicContact CG-CB 4.39Å; K264-C286 PolarHBondContact N-SG 3.47Å
265	Y	69	Low	63.4	Low	75 Å²	75	69.9 Å²	69.9	29%	0.294	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	149.7	173.6	-62.5	-72.7	0	0	0	111	C267 W280 E282 K283	Y265-C267 PolarHBondContact O-N 3.32Å; Y265-W280 HydrophobicContact CD1-CB 4.41Å; Y265-W280 HydrophobicContact CD1-CE3 4.4Å; Y265-W280 WeakPolarHBondContact CD1-O 2.94Å; Y265-W280 HydrophobicContact CD2-CD2 4.24Å; Y265-W280 AromaticContact CD2-CE3 3.48Å; Y265-W280 HydrophobicContact CD2-CE3 3.48Å; Y265-W280 VanDerWaalsContact CD2-CE3 3.48Å; Y265-W280 HydrophobicContact CD2-CH2 4.5Å; Y265-W280 AromaticContact CD2-CZ3 3.64Å; Y265-W280 HydrophobicContact CD2-CZ3 3.64Å; Y265-W280 HydrophobicContact CE1-CB 4.48Å; Y265-W280 HydrophobicContact CE1-CE3 4.26Å; Y265-W280 WeakPolarHBondContact CE1-O 3.46Å; Y265-W280 HydrophobicContact CE2-CD2 4.43Å; Y265-W280 AromaticContact CE2-CE3 3.33Å; Y265-W280 HydrophobicContact CE2-CE3 3.33Å; Y265-W280 AromaticContact CE2-CZ3 3.46Å; Y265-W280 HydrophobicContact CE2-CZ3 3.46Å; Y265-W280 VanDerWaalsContact CE2-CZ3 3.46Å; Y265-W280 HydrophobicContact CG-CD2 4.41Å; Y265-W280 HydrophobicContact CG-CE3 4.02Å; Y265-W280 AromaticContact CZ-CE3 3.73Å; Y265-E282 CarbonylContact C-O 3.54Å; Y265-E282 WeakPolarHBondContact CA-O 3.02Å; Y265-K283 HydrophobicContact CD1-CG 4.32Å; Y265-K283 HydrophobicContact CE1-CG 3.93Å
266	N	66.5	Low	62.4	Low	45 Å²	45	73.1 Å²	73.1	24%	0.241	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	113.9	169.6	-169.5	12.9	0	0	0	108.8	C278 N279 E282 I284	N266-C278 WeakPolarHBondContact O-CA 3.48Å; N266-N279 PolarHBondContact O-N 2.89Å; N266-E282 HydrophobicContact CB-CB 4.03Å; N266-E282 VanDerWaalsContact CB-CD 3.49Å; N266-E282 HydrophobicContact CB-CG 3.81Å; N266-E282 WeakPolarHBondContact CB-OE2 3.33Å; N266-E282 PolarHBondContact N-O 3.1Å; N266-E282 PolarHBondContact ND2-OE1 2.88Å; N266-E282 PolarHBondContact ND2-OE2 3.24Å; N266-I284 HydrophobicContact CB-CD1 3.77Å; N266-I284 HydrophobicContact CB-CG1 4.1Å
267	C	59.3	Low	61.4	Low	51 Å²	51	76.8 Å²	76.8	35%	0.345	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	106.6	-179.5	-59.4	0	0	0	0	109	Y265 C278	Y265-C267 PolarHBondContact O-N 3.32Å; C267-C278 HydrophobicContact CB-CB 4.11Å; C267-C278 WeakPolarHBondContact CB-SG 3.38Å; C267-C278 VanDerWaalsContact SG-CA 3.59Å; C267-C278 WeakPolarHBondContact SG-CB 3.5Å; C267-C278 CovalentContact SG-SG 2.05Å; C267-C278 PolarHBondContact SG-SG 2.92Å
268	T	60.6	Low	60.9	Low	79 Å²	79	72.4 Å²	72.4	49%	0.485	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	139.5	174.2	49.1	0	0	0	0	110.2	Y276 K277	T268-Y276 CarbonylContact O-C 3.52Å; T268-Y276 VanDerWaalsContact O-CA 3.28Å; T268-Y276 WeakPolarHBondContact O-CA 3.46Å; T268-K277 PolarHBondContact N-O 2.84Å; T268-K277 PolarHBondContact O-N 2.7Å
269	E	55.7	Low	60.3	Low	104 Å²	104	70.5 Å²	70.5	49%	0.486	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	129.9	165.3	-163.2	164.8	154	0	0	108	Y276	E269-Y276 HydrophobicContact CB-CD1 4.04Å; E269-Y276 HydrophobicContact CB-CE1 3.67Å; E269-Y276 HydrophobicContact CG-CD1 4.42Å; E269-Y276 HydrophobicContact CG-CE1 3.88Å; E269-Y276 PolarHBondContact OE2-OH 2.9Å; E269-Y276 VanDerWaalsContact OE2-OH 3.06Å
270	T	56.6	Low	59.8	Low	40 Å²	40	71.5 Å²	71.5	25%	0.245	34%	0.339	C	S	.	.			trans	-83.3	174.6	177.8	68	0	0	0	0	110.8	I272 L275 K277	T270-I272 CarbonylContact O-C 3.53Å; T270-I272 PolarHBondContact O-N 3.42Å; T270-I272 VanDerWaalsContact O-N 3.07Å; T270-I272 PolarHBondContact OG1-O 3.27Å; T270-L275 WeakPolarHBondContact CB-O 3.38Å; T270-L275 WeakPolarHBondContact CG2-O 3.41Å; T270-L275 PolarHBondContact N-O 3.42Å; T270-L275 WeakPolarHBondContact OG1-CB 3.25Å; T270-L275 PolarHBondContact OG1-O 3.24Å; T270-K277 HydrophobicContact CG2-CB 3.76Å
271	E	55.3	Low	59.5	Low	146 Å²	146	73.1 Å²	73.1	68%	0.682	35%	0.352	S	S	*	.	S	Bend	trans	-56.4	-24.4	175.3	-60.6	179.5	140.3	0	0	113	K81	K81-E271 VanDerWaalsContact CE-OE2 3.27Å; K81-E271 WeakPolarHBondContact CE-OE2 3.35Å; K81-E271 IonicContact NZ-OE2 2.68Å; K81-E271 PolarHBondContact NZ-OE2 2.92Å
272	I	52.6	Low	59.1	Low	38 Å²	38	75 Å²	75	20%	0.195	36%	0.357	C	S	.	.	S	Bend	trans	-85.9	110.6	171.6	-57.3	169.6	0	0	0	107.5	T270 S274 L275	T270-I272 CarbonylContact O-C 3.53Å; T270-I272 PolarHBondContact O-N 3.42Å; T270-I272 VanDerWaalsContact O-N 3.07Å; T270-I272 PolarHBondContact OG1-O 3.27Å; I272-S274 PolarHBondContact O-N 3.03Å; I272-L275 HydrophobicContact CB-CB 4.46Å; I272-L275 HydrophobicContact CB-CD1 4.2Å; I272-L275 HydrophobicContact CD1-CD1 3.94Å; I272-L275 HydrophobicContact CG2-CD1 4.01Å; I272-L275 HydrophobicContact CG2-CG 4.26Å; I272-L275 PolarHBondContact O-N 3.42Å; I272-L275 VanDerWaalsContact O-N 3.09Å
273	K	46	Very low	59	Low	175 Å²	175	79 Å²	79	76%	0.761	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	39.3	-167.7	-61.9	-177.6	175	179	0	116.5
274	S	48.2	Very low	58.9	Low	19 Å²	19	79.9 Å²	79.9	13%	0.133	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-161.8	-27.9	-174.6	54.8	0	0	0	0	112.3	Y247 I272	Y247-S274 WeakPolarHBondContact OH-CB 2.77Å; Y247-S274 PolarHBondContact OH-OG 2.85Å; I272-S274 PolarHBondContact O-N 3.03Å
275	L	45.1	Very low	59.1	Low	30 Å²	30	80.7 Å²	80.7	16%	0.157	39%	0.392	C	S	.	.			trans	-89.8	122.2	178.3	-71.4	173.2	0	0	0	110.8	W245 Y247 T270 I272	W245-L275 HydrophobicContact CE3-CD2 4.39Å; W245-L275 HydrophobicContact CZ3-CD2 4.44Å; Y247-L275 HydrophobicContact CE2-CD2 4.26Å; T270-L275 WeakPolarHBondContact CB-O 3.38Å; T270-L275 WeakPolarHBondContact CG2-O 3.41Å; T270-L275 PolarHBondContact N-O 3.42Å; T270-L275 WeakPolarHBondContact OG1-CB 3.25Å; T270-L275 PolarHBondContact OG1-O 3.24Å; I272-L275 HydrophobicContact CB-CB 4.46Å; I272-L275 HydrophobicContact CB-CD1 4.2Å; I272-L275 HydrophobicContact CD1-CD1 3.94Å; I272-L275 HydrophobicContact CG2-CD1 4.01Å; I272-L275 HydrophobicContact CG2-CG 4.26Å; I272-L275 PolarHBondContact O-N 3.42Å; I272-L275 VanDerWaalsContact O-N 3.09Å
276	Y	49.9	Very low	59.3	Low	90 Å²	90	78.4 Å²	78.4	35%	0.353	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.8	172.8	-68.5	-84.3	0	0	0	110.1	T268 E269 C278	T268-Y276 CarbonylContact O-C 3.52Å; T268-Y276 VanDerWaalsContact O-CA 3.28Å; T268-Y276 WeakPolarHBondContact O-CA 3.46Å; E269-Y276 HydrophobicContact CB-CD1 4.04Å; E269-Y276 HydrophobicContact CB-CE1 3.67Å; E269-Y276 HydrophobicContact CG-CD1 4.42Å; E269-Y276 HydrophobicContact CG-CE1 3.88Å; E269-Y276 PolarHBondContact OE2-OH 2.9Å; E269-Y276 VanDerWaalsContact OE2-OH 3.06Å; Y276-C278 PolarHBondContact O-N 3.44Å
277	K	51.2	Low	59.5	Low	108 Å²	108	82.4 Å²	82.4	47%	0.47	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	94.9	170.8	-171.9	167.3	-175.8	171	0	108.9	T268 T270 N279	T268-K277 PolarHBondContact N-O 2.84Å; T268-K277 PolarHBondContact O-N 2.7Å; T270-K277 HydrophobicContact CG2-CB 3.76Å; K277-N279 PolarHBondContact O-N 3.2Å
278	C	54.4	Low	60.1	Low	29 Å²	29	80.2 Å²	80.2	20%	0.196	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	119.2	172.9	-67.9	0	0	0	0	111.3	N266 C267 Y276 W280	N266-C278 WeakPolarHBondContact O-CA 3.48Å; C267-C278 HydrophobicContact CB-CB 4.11Å; C267-C278 WeakPolarHBondContact CB-SG 3.38Å; C267-C278 VanDerWaalsContact SG-CA 3.59Å; C267-C278 WeakPolarHBondContact SG-CB 3.5Å; C267-C278 CovalentContact SG-SG 2.05Å; C267-C278 PolarHBondContact SG-SG 2.92Å; Y276-C278 PolarHBondContact O-N 3.44Å; C278-W280 PolarHBondContact O-N 2.82Å
279	N	61.5	Low	60.7	Low	65 Å²	65	79.6 Å²	79.6	35%	0.348	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	92.4	169.3	-175.4	4.3	0	0	0	109.4	N266 K277 H281 E282	N266-N279 PolarHBondContact O-N 2.89Å; K277-N279 PolarHBondContact O-N 3.2Å; N279-H281 PolarHBondContact O-N 2.92Å; N279-H281 PolarHBondContact OD1-N 3.5Å; N279-E282 HydrophobicContact CB-CB 4.08Å; N279-E282 VanDerWaalsContact ND2-CB 3.27Å; N279-E282 WeakPolarHBondContact ND2-CB 3.36Å; N279-E282 PolarHBondContact ND2-OE2 2.03Å; N279-E282 PolarHBondContact O-N 2.92Å
280	W	61.6	Low	61.8	Low	88 Å²	88	76.8 Å²	76.8	33%	0.333	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	-5.2	-177.9	-63.5	84.6	0	0	0	114.4	Y265 C278	Y265-W280 HydrophobicContact CD1-CB 4.41Å; Y265-W280 HydrophobicContact CD1-CE3 4.4Å; Y265-W280 WeakPolarHBondContact CD1-O 2.94Å; Y265-W280 HydrophobicContact CD2-CD2 4.24Å; Y265-W280 AromaticContact CD2-CE3 3.48Å; Y265-W280 HydrophobicContact CD2-CE3 3.48Å; Y265-W280 VanDerWaalsContact CD2-CE3 3.48Å; Y265-W280 HydrophobicContact CD2-CH2 4.5Å; Y265-W280 AromaticContact CD2-CZ3 3.64Å; Y265-W280 HydrophobicContact CD2-CZ3 3.64Å; Y265-W280 HydrophobicContact CE1-CB 4.48Å; Y265-W280 HydrophobicContact CE1-CE3 4.26Å; Y265-W280 WeakPolarHBondContact CE1-O 3.46Å; Y265-W280 HydrophobicContact CE2-CD2 4.43Å; Y265-W280 AromaticContact CE2-CE3 3.33Å; Y265-W280 HydrophobicContact CE2-CE3 3.33Å; Y265-W280 AromaticContact CE2-CZ3 3.46Å; Y265-W280 HydrophobicContact CE2-CZ3 3.46Å; Y265-W280 VanDerWaalsContact CE2-CZ3 3.46Å; Y265-W280 HydrophobicContact CG-CD2 4.41Å; Y265-W280 HydrophobicContact CG-CE3 4.02Å; Y265-W280 AromaticContact CZ-CE3 3.73Å; C278-W280 PolarHBondContact O-N 2.82Å
281	H	64	Low	62.7	Low	172 Å²	172	75.7 Å²	75.7	80%	0.796	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	-24.1	170.5	-58.1	-72.2	0	0	0	112.7	N279	N279-H281 PolarHBondContact O-N 2.92Å; N279-H281 PolarHBondContact OD1-N 3.5Å
282	E	61.5	Low	63.5	Low	87 Å²	87	72.8 Å²	72.8	41%	0.407	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	98.3	-173.5	-172	-177.7	176.6	0	0	110.9	Y265 N266 N279	Y265-E282 CarbonylContact C-O 3.54Å; Y265-E282 WeakPolarHBondContact CA-O 3.02Å; N266-E282 HydrophobicContact CB-CB 4.03Å; N266-E282 VanDerWaalsContact CB-CD 3.49Å; N266-E282 HydrophobicContact CB-CG 3.81Å; N266-E282 WeakPolarHBondContact CB-OE2 3.33Å; N266-E282 PolarHBondContact N-O 3.1Å; N266-E282 PolarHBondContact ND2-OE1 2.88Å; N266-E282 PolarHBondContact ND2-OE2 3.24Å; N279-E282 HydrophobicContact CB-CB 4.08Å; N279-E282 VanDerWaalsContact ND2-CB 3.27Å; N279-E282 WeakPolarHBondContact ND2-CB 3.36Å; N279-E282 PolarHBondContact ND2-OE2 2.03Å; N279-E282 PolarHBondContact O-N 2.92Å
283	K	71.3	Confident	64.5	Low	93 Å²	93	78.4 Å²	78.4	40%	0.404	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	109	-178.5	-67.8	-177.6	179	174.4	0	111.1	D256 Y263 Y265	D256-K283 IonicContact OD2-NZ 2.76Å; D256-K283 PolarHBondContact OD2-NZ 3.46Å; Y263-K283 HydrophobicContact CD1-CB 3.47Å; Y263-K283 VanDerWaalsContact CD1-CB 3.47Å; Y263-K283 HydrophobicContact CD1-CD 4.4Å; Y263-K283 HydrophobicContact CD1-CG 4.46Å; Y263-K283 HydrophobicContact CD2-CD 4.14Å; Y263-K283 HydrophobicContact CE1-CB 4.01Å; Y263-K283 HydrophobicContact CE2-CD 4.46Å; Y263-K283 HydrophobicContact CG-CB 3.79Å; Y263-K283 HydrophobicContact CG-CD 4.08Å; Y263-K283 HydrophobicContact CG-CG 4.34Å; Y265-K283 HydrophobicContact CD1-CG 4.32Å; Y265-K283 HydrophobicContact CE1-CG 3.93Å
284	I	73.7	Confident	65.9	Low	63 Å²	63	70.8 Å²	70.8	32%	0.323	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	125.3	172	-54.4	175.2	0	0	0	109.3	Y263 K264 N266	Y263-I284 VanDerWaalsContact CA-O 3.32Å; Y263-I284 WeakPolarHBondContact CA-O 3.45Å; K264-I284 HydrophobicContact CG-CB 4Å; K264-I284 PolarHBondContact N-O 2.9Å; K264-I284 PolarHBondContact O-N 2.85Å; N266-I284 HydrophobicContact CB-CD1 3.77Å; N266-I284 HydrophobicContact CB-CG1 4.1Å
285	V	78	Confident	67.4	Low	97 Å²	97	77 Å²	77	59%	0.588	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.1	134.7	175.4	-178.9	0	0	0	0	110.6	C262 Y263	C262-V285 WeakPolarHBondContact O-CA 3.36Å; Y263-V285 HydrophobicContact CD1-CG2 4Å; Y263-V285 HydrophobicContact CE1-CG2 3.54Å
286	C	71.6	Confident	69.1	Low	27 Å²	27	79.5 Å²	79.5	18%	0.182	42%	0.416	C	S	.	.			trans	-156.1	174.9	173.7	64.5	0	0	0	0	111.5	C253 C262 K264	C253-C286 HydrophobicContact CB-CB 4.3Å; C253-C286 WeakPolarHBondContact CB-SG 3.48Å; C253-C286 WeakPolarHBondContact SG-CB 3.03Å; C253-C286 CovalentContact SG-SG 2.03Å; C253-C286 PolarHBondContact SG-SG 3.43Å; C262-C286 CarbonylContact C-O 3.59Å; C262-C286 WeakPolarHBondContact CB-O 3.32Å; C262-C286 PolarHBondContact O-N 2.95Å; K264-C286 HydrophobicContact CD-CB 4.33Å; K264-C286 HydrophobicContact CG-CB 4.39Å; K264-C286 PolarHBondContact N-SG 3.47Å
287	T	71	Confident	70.6	Confident	129 Å²	129	77.6 Å²	77.6	79%	0.791	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-90.3	121.3	-173.2	-34.9	0	0	0	0	111.7	C253	C253-T287 WeakPolarHBondContact CB-O 3.06Å; C253-T287 PolarHBondContact SG-O 3.09Å; C253-T287 VanDerWaalsContact SG-O 3.32Å
288	C	72.9	Confident	72.1	Confident	6 Å²	6	81 Å²	81	4%	0.041	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-65.5	148.6	170.5	-71.5	0	0	0	0	111.9	C253 Y255 C262 L317	C253-C288 PolarHBondContact O-SG 2.76Å; C253-C288 VanDerWaalsContact O-SG 3.4Å; Y255-C288 PolarHBondContact N-SG 2.97Å; Y255-C288 VanDerWaalsContact N-SG 3.38Å; C262-C288 HydrophobicContact CB-CB 3.97Å; C262-C288 WeakPolarHBondContact CB-SG 3.29Å; C262-C288 WeakPolarHBondContact SG-CB 3.49Å; C262-C288 CovalentContact SG-SG 2.02Å; C262-C288 PolarHBondContact SG-SG 2.8Å; C288-L317 HydrophobicContact CB-CB 3.92Å; C288-L317 HydrophobicContact CB-CD1 4.25Å; C288-L317 HydrophobicContact CB-CD2 4.14Å; C288-L317 HydrophobicContact CB-CG 4.32Å
289	A	73.3	Confident	73.4	Confident	66 Å²	66	83.3 Å²	83.3	55%	0.545	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-69.1	151.2	160.9	0	0	0	0	0	110.6	M318	A289-M318 HydrophobicContact CB-CG 4.21Å; A289-M318 VanDerWaalsContact O-CG 3.25Å; A289-M318 WeakPolarHBondContact O-CG 3.05Å; A289-M318 PolarHBondContact O-N 2.62Å
290	C	77.7	Confident	74.3	Confident	45 Å²	45	82 Å²	82	30%	0.304	43%	0.434	S	S	.	.	B	Isolated β-bridge	trans	-66	141.4	173.9	-35.6	0	0	0	0	110.2	P292 K315 P316 C334	C290-P292 WeakPolarHBondContact O-CD 3Å; C290-P292 VanDerWaalsContact O-N 3.09Å; C290-K315 HydrophobicContact CB-CD 4.27Å; C290-K315 HydrophobicContact CB-CG 4.33Å; C290-P316 CarbonylContact C-O 3.42Å; C290-P316 WeakPolarHBondContact CA-O 3.16Å; C290-C334 WeakPolarHBondContact CA-SG 3.23Å; C290-C334 HydrophobicContact CB-CB 3.78Å; C290-C334 WeakPolarHBondContact CB-SG 2.85Å; C290-C334 WeakPolarHBondContact SG-CB 3.45Å; C290-C334 CovalentContact SG-SG 2.03Å; C290-C334 PolarHBondContact SG-SG 3.39Å
291	A	75.9	Confident	75	Confident	16 Å²	16	83.7 Å²	83.7	13%	0.132	45%	0.454	C	S	.	.			trans	-58.8	113.3	177.6	0	0	0	0	0	110	D293 A294 K315 P316	A291-D293 VanDerWaalsContact C-N 3.3Å; A291-D293 PolarHBondContact O-N 2.76Å; A291-A294 HydrophobicContact CB-CB 4.04Å; A291-A294 PolarHBondContact O-N 2.82Å; A291-A294 VanDerWaalsContact O-N 3.17Å; A291-K315 WeakPolarHBondContact O-CE 3Å; A291-K315 PolarHBondContact O-NZ 3.13Å; A291-P316 HydrophobicContact CB-CG 4.42Å; A291-P316 PolarHBondContact N-O 2.95Å
292	P	71.3	Confident	75.5	Confident	85 Å²	85	77.9 Å²	77.9	55%	0.552	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-44.1	-165.9	17.7	-30.1	0	0	0	112.3	C290 A294 K315 M318	C290-P292 WeakPolarHBondContact O-CD 3Å; C290-P292 VanDerWaalsContact O-N 3.09Å; P292-A294 PolarHBondContact O-N 3.01Å; P292-K315 PolarHBondContact O-NZ 3.24Å; P292-M318 VanDerWaalsContact CD-SD 3.52Å; P292-M318 HydrophobicContact CG-SD 4.35Å
293	D	74.6	Confident	76.2	Confident	157 Å²	157	78 Å²	78	84%	0.84	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-11.5	-173.8	-47.3	-68.6	0	0	0	114.7	A291	A291-D293 VanDerWaalsContact C-N 3.3Å; A291-D293 PolarHBondContact O-N 2.76Å
294	A	75.3	Confident	75.8	Confident	14 Å²	14	75.4 Å²	75.4	12%	0.116	44%	0.437	C	S	.	.	S	Bend	trans	-72.4	142.6	178.7	0	0	0	0	0	111.7	A291 P292 K315 P316 I322	A291-A294 HydrophobicContact CB-CB 4.04Å; A291-A294 PolarHBondContact O-N 2.82Å; A291-A294 VanDerWaalsContact O-N 3.17Å; P292-A294 PolarHBondContact O-N 3.01Å; A294-K315 HydrophobicContact CB-CG 4.17Å; A294-K315 WeakPolarHBondContact O-CE 2.93Å; A294-K315 PolarHBondContact O-NZ 3.45Å; A294-P316 HydrophobicContact CB-CG 3.54Å; A294-I322 HydrophobicContact CB-CD1 4.43Å; A294-I322 HydrophobicContact CB-CG1 4.2Å
295	Q	79.9	Confident	75.4	Confident	151 Å²	151	75.5 Å²	75.5	71%	0.706	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-75.6	151.7	170.9	-63.6	-171.5	0.1	0	0	110.6
296	W	81.3	Confident	74.8	Confident	81 Å²	81	71.8 Å²	71.8	31%	0.307	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-72.9	150.9	166.4	-70.3	102.8	0	0	0	110.1	R313 Y314 K315 C334 E336	W296-R313 HydrophobicContact CB-CG 4.3Å; W296-R313 HydrophobicContact CD2-CG 4.15Å; W296-R313 HydrophobicContact CE3-CG 3.76Å; W296-R313 HydrophobicContact CG-CG 4.41Å; W296-R313 HydrophobicContact CZ3-CG 4.46Å; W296-Y314 CarbonylContact C-O 3.59Å; W296-Y314 WeakPolarHBondContact CA-O 3.33Å; W296-Y314 VanDerWaalsContact CE3-C 3.47Å; W296-K315 HydrophobicContact CD2-CB 3.71Å; W296-K315 HydrophobicContact CD2-CD 3.87Å; W296-K315 HydrophobicContact CD2-CG 4.42Å; W296-K315 HydrophobicContact CE3-CB 3.32Å; W296-K315 HydrophobicContact CE3-CD 4.34Å; W296-K315 HydrophobicContact CE3-CG 4.45Å; W296-K315 HydrophobicContact CG-CB 4.4Å; W296-K315 HydrophobicContact CG-CD 4.2Å; W296-K315 HydrophobicContact CH2-CB 4.04Å; W296-K315 HydrophobicContact CH2-CD 4.48Å; W296-K315 HydrophobicContact CZ2-CB 4.39Å; W296-K315 HydrophobicContact CZ2-CD 4.05Å; W296-K315 HydrophobicContact CZ3-CB 3.5Å; W296-C334 HydrophobicContact CH2-CB 4.15Å; W296-C334 HydrophobicContact CZ3-CB 4.35Å; W296-E336 HydrophobicContact CE3-CB 4.21Å; W296-E336 HydrophobicContact CH2-CB 3.57Å; W296-E336 HydrophobicContact CZ2-CB 4Å; W296-E336 WeakPolarHBondContact CZ2-OE2 3.48Å; W296-E336 HydrophobicContact CZ3-CB 3.68Å; W296-E336 PolarHBondContact NE1-OE2 2.02Å
297	S	79.9	Confident	74.7	Confident	50 Å²	50	71 Å²	71	35%	0.35	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-61	167	166.8	76	0	0	0	0	111.6	R313 Y314	S297-R313 WeakPolarHBondContact OG-CA 3.43Å; S297-Y314 PolarHBondContact N-O 2.04Å; S297-Y314 PolarHBondContact OG-N 2.94Å
298	E	82.8	Confident	74.7	Confident	181 Å²	181	69.2 Å²	69.2	85%	0.846	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-59.2	155.2	161	-62	-163.2	157.4	0	0	110.8
299	W	82.6	Confident	74.8	Confident	77 Å²	77	69 Å²	69	29%	0.292	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-70.2	137.1	175.9	-73.1	111.2	0	0	0	111	R311 R313 E336 V338	W299-R311 HydrophobicContact CE3-CB 3.91Å; W299-R311 HydrophobicContact CZ3-CB 4.49Å; W299-R311 WeakPolarHBondContact CZ3-O 3.46Å; W299-R313 HydrophobicContact CD2-CB 4.18Å; W299-R313 HydrophobicContact CD2-CG 4.17Å; W299-R313 HydrophobicContact CE3-CB 3.83Å; W299-R313 HydrophobicContact CE3-CG 3.82Å; W299-R313 HydrophobicContact CH2-CG 3.9Å; W299-R313 HydrophobicContact CZ2-CG 4.26Å; W299-R313 HydrophobicContact CZ3-CB 4.15Å; W299-R313 HydrophobicContact CZ3-CG 3.68Å; W299-E336 HydrophobicContact CH2-CG 4.15Å; W299-E336 WeakPolarHBondContact CZ3-O 3.49Å; W299-V338 HydrophobicContact CD2-CG1 4.42Å; W299-V338 HydrophobicContact CE3-CG1 4.04Å; W299-V338 HydrophobicContact CH2-CB 3.73Å; W299-V338 HydrophobicContact CH2-CG1 3.52Å; W299-V338 HydrophobicContact CZ2-CB 4.3Å; W299-V338 HydrophobicContact CZ2-CG1 3.91Å; W299-V338 HydrophobicContact CZ3-CB 4.11Å; W299-V338 HydrophobicContact CZ3-CG1 3.58Å
300	S	80.1	Confident	74.9	Confident	38 Å²	38	69 Å²	69	27%	0.266	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-52.3	164.3	169	74.9	0	0	0	0	112.4	R311 V312	S300-R311 PolarHBondContact O-NE 3.38Å; S300-R311 PolarHBondContact O-NH2 2.92Å; S300-V312 WeakPolarHBondContact CB-O 3.37Å; S300-V312 PolarHBondContact N-O 3.05Å; S300-V312 PolarHBondContact OG-N 3.5Å
301	V	76.6	Confident	75.1	Confident	123 Å²	123	69.9 Å²	69.9	75%	0.745	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-57.1	148.9	158.1	-66.9	0	0	0	0	110.1
302	P	75	Confident	75.5	Confident	50 Å²	50	70.7 Å²	70.7	33%	0.325	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-59.5	142.3	172.4	-22.1	33.1	0	0	0	112.6	A304 T309 R311	P302-A304 WeakPolarHBondContact CB-O 3.25Å; P302-A304 PolarHBondContact O-N 2.76Å; P302-T309 HydrophobicContact CB-CG2 3.96Å; P302-T309 WeakPolarHBondContact CB-OG1 3.25Å; P302-R311 HydrophobicContact CB-CG 4.23Å; P302-R311 HydrophobicContact CG-CG 4.18Å
303	S	74.6	Confident	76.2	Confident	88 Å²	88	69.3 Å²	69.3	62%	0.615	38%	0.379	S	S	*	.	S	Bend	trans	-65.1	-18.4	175.3	69	0	0	0	0	114.5	T309 M310	S303-T309 PolarHBondContact N-OG1 3.22Å; S303-T309 PolarHBondContact OG-OG1 3.03Å; S303-T309 VanDerWaalsContact OG-OG1 3.11Å; S303-M310 PolarHBondContact N-O 3.36Å; S303-M310 PolarHBondContact OG-N 3Å
304	A	64.2	Low	76.6	Confident	39 Å²	39	64.1 Å²	64.1	32%	0.322	35%	0.348	S	S	.	.			trans	-146.8	155.2	177.6	0	0	0	0	0	111.3	P302 T309 L342	P302-A304 WeakPolarHBondContact CB-O 3.25Å; P302-A304 PolarHBondContact O-N 2.76Å; A304-T309 PolarHBondContact N-OG1 3.3Å; A304-T309 PolarHBondContact O-OG1 3.47Å; A304-L342 VanDerWaalsContact O-CD1 3.3Å; A304-L342 WeakPolarHBondContact O-CD1 3.35Å
305	S	64.9	Low	77	Confident	65 Å²	65	64.5 Å²	64.5	46%	0.455	35%	0.348	S	S	.	.	S	Bend	trans	-88.1	-4.4	178.8	51.5	0	0	0	0	114.6	L342	S305-L342 VanDerWaalsContact C-CD1 3.5Å
306	C	64.3	Low	77.1	Confident	19 Å²	19	57.5 Å²	57.5	13%	0.128	32%	0.315	C	S	.	.	S	Bend	trans	-152.4	164.8	-178.7	65.7	0	0	0	0	111	C345 Y348	C306-C345 HydrophobicContact CB-CB 3.96Å; C306-C345 WeakPolarHBondContact CB-SG 3.46Å; C306-C345 PolarHBondContact O-SG 3.4Å; C306-C345 VanDerWaalsContact SG-CA 3.55Å; C306-C345 WeakPolarHBondContact SG-CB 3.41Å; C306-C345 CovalentContact SG-SG 2.05Å; C306-C345 PolarHBondContact SG-SG 2.04Å; C306-Y348 HydrophobicContact CB-CD2 3.3Å; C306-Y348 HydrophobicContact CB-CE2 3.53Å; C306-Y348 HydrophobicContact CB-CG 3.97Å
307	G	70.4	Confident	76.9	Confident	11 Å²	11	54.5 Å²	54.5	11%	0.113	31%	0.305	C	S	.	.	S	Bend	trans	62.1	-142.9	174.5	0	0	0	0	0	113.4	L342 L343 C345	G307-L342 PolarHBondContact O-N 2.84Å; G307-L343 PolarHBondContact N-O 2.91Å; G307-C345 PolarHBondContact N-SG 3.44Å
308	V	70.3	Confident	76.6	Confident	92 Å²	92	55.5 Å²	55.5	56%	0.558	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	120.1	178.4	-179.7	0	0	0	0	109.4	Q339 V341	V308-Q339 HydrophobicContact CG1-CG 3.56Å; V308-V341 HydrophobicContact CG2-CG2 4.49Å
309	T	75.1	Confident	75.9	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	151.7	178.4	-175.4	0	0	0	0	110.9	P302 S303 A304 Q339 E340 L342	P302-T309 HydrophobicContact CB-CG2 3.96Å; P302-T309 WeakPolarHBondContact CB-OG1 3.25Å; S303-T309 PolarHBondContact N-OG1 3.22Å; S303-T309 PolarHBondContact OG-OG1 3.03Å; S303-T309 VanDerWaalsContact OG-OG1 3.11Å; A304-T309 PolarHBondContact N-OG1 3.3Å; A304-T309 PolarHBondContact O-OG1 3.47Å; T309-Q339 CarbonylContact O-C 3.39Å; T309-Q339 WeakPolarHBondContact O-CA 3.3Å; T309-E340 HydrophobicContact CG2-CB 3.84Å; T309-E340 PolarHBondContact N-O 3.29Å; T309-E340 PolarHBondContact O-N 2.93Å; T309-E340 VanDerWaalsContact O-O 3.13Å; T309-L342 HydrophobicContact CG2-CD1 3.78Å; T309-L342 HydrophobicContact CG2-CG 3.8Å
310	M	75.3	Confident	75.2	Confident	66 Å²	66	47.4 Å²	47.4	33%	0.325	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	144.8	171.8	-60.9	-55.7	-61	0	0	110.5	S303 V338 Q339	S303-M310 PolarHBondContact N-O 3.36Å; S303-M310 PolarHBondContact OG-N 3Å; M310-V338 WeakPolarHBondContact CA-O 3.34Å; M310-Q339 HydrophobicContact CE-CB 4.24Å; M310-Q339 HydrophobicContact SD-CB 3.7Å; M310-Q339 HydrophobicContact SD-CG 3.96Å
311	R	83.5	Confident	74.6	Confident	63 Å²	63	51.1 Å²	51.1	24%	0.238	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	148	162.3	-61.2	-178.9	76.7	177.8	2.6	108.9	W299 S300 P302 S337 V338 E340	W299-R311 HydrophobicContact CE3-CB 3.91Å; W299-R311 HydrophobicContact CZ3-CB 4.49Å; W299-R311 WeakPolarHBondContact CZ3-O 3.46Å; S300-R311 PolarHBondContact O-NE 3.38Å; S300-R311 PolarHBondContact O-NH2 2.92Å; P302-R311 HydrophobicContact CB-CG 4.23Å; P302-R311 HydrophobicContact CG-CG 4.18Å; R311-S337 CarbonylContact O-C 3.58Å; R311-S337 VanDerWaalsContact O-CA 3.22Å; R311-S337 WeakPolarHBondContact O-CA 3.46Å; R311-V338 HydrophobicContact CB-CG1 3.97Å; R311-V338 PolarHBondContact N-O 2.95Å; R311-V338 PolarHBondContact O-N 2.97Å; R311-E340 WeakPolarHBondContact CD-OE1 3.33Å; R311-E340 VanDerWaalsContact CD-OE2 3.24Å; R311-E340 WeakPolarHBondContact CD-OE2 3.25Å; R311-E340 IonicContact NH1-OE1 3.2Å; R311-E340 PolarHBondContact NH1-OE1 2.01Å; R311-E340 IonicContact NH1-OE2 3.36Å
312	V	83	Confident	74.1	Confident	34 Å²	34	50.7 Å²	50.7	21%	0.206	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142.8	-177.1	-170.7	0	0	0	0	110.1	S300 Y314 E336	S300-V312 WeakPolarHBondContact CB-O 3.37Å; S300-V312 PolarHBondContact N-O 3.05Å; S300-V312 PolarHBondContact OG-N 3.5Å; V312-Y314 HydrophobicContact CG1-CD1 4.41Å; V312-Y314 HydrophobicContact CG1-CE1 3.68Å; V312-Y314 HydrophobicContact CG1-CE2 4.33Å; V312-E336 CarbonylContact C-O 3.51Å; V312-E336 WeakPolarHBondContact CA-O 3.37Å
313	R	85.6	Confident	73.7	Confident	56 Å²	56	51.8 Å²	51.8	21%	0.211	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	156.9	168.2	65.3	-178	-173.9	-167.8	-7.2	110.6	W296 S297 W299 S335 E336	W296-R313 HydrophobicContact CB-CG 4.3Å; W296-R313 HydrophobicContact CD2-CG 4.15Å; W296-R313 HydrophobicContact CE3-CG 3.76Å; W296-R313 HydrophobicContact CG-CG 4.41Å; W296-R313 HydrophobicContact CZ3-CG 4.46Å; S297-R313 WeakPolarHBondContact OG-CA 3.43Å; W299-R313 HydrophobicContact CD2-CB 4.18Å; W299-R313 HydrophobicContact CD2-CG 4.17Å; W299-R313 HydrophobicContact CE3-CB 3.83Å; W299-R313 HydrophobicContact CE3-CG 3.82Å; W299-R313 HydrophobicContact CH2-CG 3.9Å; W299-R313 HydrophobicContact CZ2-CG 4.26Å; W299-R313 HydrophobicContact CZ3-CB 4.15Å; W299-R313 HydrophobicContact CZ3-CG 3.68Å; R313-S335 WeakPolarHBondContact O-CA 3.41Å; R313-E336 HydrophobicContact CG-CB 4.03Å; R313-E336 IonicContact CZ-OE1 2.7Å; R313-E336 IonicContact CZ-OE2 3.11Å; R313-E336 PolarHBondContact N-O 2.87Å; R313-E336 IonicContact NE-OE1 3.63Å; R313-E336 IonicContact NE-OE2 3.16Å; R313-E336 PolarHBondContact NE-OE2 3.19Å; R313-E336 IonicContact NH2-OE1 3.9Å; R313-E336 PolarHBondContact NH2-OE1 2.84Å; R313-E336 IonicContact NH2-OE2 3.29Å; R313-E336 PolarHBondContact NH2-OE2 2.86Å; R313-E336 PolarHBondContact O-N 3.17Å
314	Y	83.7	Confident	73.3	Confident	47 Å²	47	50.1 Å²	50.1	18%	0.184	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	153.3	-170.9	-54.4	-76	0	0	0	112.6	W296 S297 V312 C334	W296-Y314 CarbonylContact C-O 3.59Å; W296-Y314 WeakPolarHBondContact CA-O 3.33Å; W296-Y314 VanDerWaalsContact CE3-C 3.47Å; S297-Y314 PolarHBondContact N-O 2.04Å; S297-Y314 PolarHBondContact OG-N 2.94Å; V312-Y314 HydrophobicContact CG1-CD1 4.41Å; V312-Y314 HydrophobicContact CG1-CE1 3.68Å; V312-Y314 HydrophobicContact CG1-CE2 4.33Å; Y314-C334 CarbonylContact C-O 3.57Å; Y314-C334 VanDerWaalsContact CA-O 3.27Å; Y314-C334 WeakPolarHBondContact CA-O 3.47Å
315	K	84.2	Confident	73.5	Confident	23 Å²	23	49.6 Å²	49.6	10%	0.1	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	139.6	178.5	175.5	169.2	168.3	151.8	0	109.5	C290 A291 P292 A294 W296 C334	C290-K315 HydrophobicContact CB-CD 4.27Å; C290-K315 HydrophobicContact CB-CG 4.33Å; A291-K315 WeakPolarHBondContact O-CE 3Å; A291-K315 PolarHBondContact O-NZ 3.13Å; P292-K315 PolarHBondContact O-NZ 3.24Å; A294-K315 HydrophobicContact CB-CG 4.17Å; A294-K315 WeakPolarHBondContact O-CE 2.93Å; A294-K315 PolarHBondContact O-NZ 3.45Å; W296-K315 HydrophobicContact CD2-CB 3.71Å; W296-K315 HydrophobicContact CD2-CD 3.87Å; W296-K315 HydrophobicContact CD2-CG 4.42Å; W296-K315 HydrophobicContact CE3-CB 3.32Å; W296-K315 HydrophobicContact CE3-CD 4.34Å; W296-K315 HydrophobicContact CE3-CG 4.45Å; W296-K315 HydrophobicContact CG-CB 4.4Å; W296-K315 HydrophobicContact CG-CD 4.2Å; W296-K315 HydrophobicContact CH2-CB 4.04Å; W296-K315 HydrophobicContact CH2-CD 4.48Å; W296-K315 HydrophobicContact CZ2-CB 4.39Å; W296-K315 HydrophobicContact CZ2-CD 4.05Å; W296-K315 HydrophobicContact CZ3-CB 3.5Å; K315-C334 HydrophobicContact CB-CB 4.43Å; K315-C334 PolarHBondContact N-O 3.2Å; K315-C334 WeakPolarHBondContact O-CA 3.3Å; K315-C334 WeakPolarHBondContact O-CB 3.23Å; K315-C334 PolarHBondContact O-N 3.14Å
316	P	81.5	Confident	73.7	Confident	3 Å²	3	49 Å²	49	2%	0.019	27%	0.274	C	S	.	.			trans	-64.8	157.3	-179.2	27.1	-37.6	0	0	0	113.4	C290 A291 A294 Q320 I322 C325	C290-P316 CarbonylContact C-O 3.42Å; C290-P316 WeakPolarHBondContact CA-O 3.16Å; A291-P316 HydrophobicContact CB-CG 4.42Å; A291-P316 PolarHBondContact N-O 2.95Å; A294-P316 HydrophobicContact CB-CG 3.54Å; P316-Q320 HydrophobicContact CB-CB 4.13Å; P316-Q320 HydrophobicContact CB-CG 4.29Å; P316-I322 HydrophobicContact CG-CG1 3.93Å; P316-C325 WeakPolarHBondContact CA-SG 3.23Å
317	L	78.3	Confident	73.7	Confident	18 Å²	18	55.5 Å²	55.5	9%	0.094	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-75.8	158	172.7	-56	178.3	0	0	0	110.7	Y255 C288 G319 Q320 C334	Y255-L317 HydrophobicContact CD2-CB 4.32Å; Y255-L317 HydrophobicContact CD2-CD1 3.94Å; Y255-L317 HydrophobicContact CE2-CD1 4.19Å; C288-L317 HydrophobicContact CB-CB 3.92Å; C288-L317 HydrophobicContact CB-CD1 4.25Å; C288-L317 HydrophobicContact CB-CD2 4.14Å; C288-L317 HydrophobicContact CB-CG 4.32Å; L317-G319 PolarHBondContact O-N 2.65Å; L317-G319 VanDerWaalsContact O-N 3.09Å; L317-Q320 HydrophobicContact CB-CB 4.27Å; L317-Q320 WeakPolarHBondContact O-CB 3.43Å; L317-Q320 PolarHBondContact O-N 2.98Å; L317-C334 HydrophobicContact CD2-CB 4.5Å
318	M	72	Confident	73.5	Confident	72 Å²	72	60.5 Å²	60.5	36%	0.355	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	114.7	175	-80.6	-100.6	-73.8	0	0	111.7	Y255 A289 P292	Y255-M318 VanDerWaalsContact CB-O 3.3Å; Y255-M318 WeakPolarHBondContact CB-O 3.42Å; A289-M318 HydrophobicContact CB-CG 4.21Å; A289-M318 VanDerWaalsContact O-CG 3.25Å; A289-M318 WeakPolarHBondContact O-CG 3.05Å; A289-M318 PolarHBondContact O-N 2.62Å; P292-M318 VanDerWaalsContact CD-SD 3.52Å; P292-M318 HydrophobicContact CG-SD 4.35Å
319	G	67.7	Low	73.3	Confident	76 Å²	76	58.6 Å²	58.6	78%	0.784	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.2	-7.9	-179.2	0	0	0	0	0	115.4	L317	L317-G319 PolarHBondContact O-N 2.65Å; L317-G319 VanDerWaalsContact O-N 3.09Å
320	Q	68.8	Low	72.9	Confident	12 Å²	12	60.1 Å²	60.1	6%	0.056	32%	0.321	C	S	.	.			trans	-88.8	139.9	176.5	-172.8	-172.6	35	0	0	110.7	Y255 P316 L317 H324 V332	Y255-Q320 HydrophobicContact CD1-CB 4.03Å; Y255-Q320 HydrophobicContact CE1-CB 3.89Å; Y255-Q320 HydrophobicContact CE1-CG 3.96Å; Y255-Q320 HydrophobicContact CE2-CG 4.39Å; Y255-Q320 HydrophobicContact CG-CB 4.41Å; P316-Q320 HydrophobicContact CB-CB 4.13Å; P316-Q320 HydrophobicContact CB-CG 4.29Å; L317-Q320 HydrophobicContact CB-CB 4.27Å; L317-Q320 WeakPolarHBondContact O-CB 3.43Å; L317-Q320 PolarHBondContact O-N 2.98Å; Q320-H324 HydrophobicContact CG-CB 3.94Å; Q320-V332 PolarHBondContact NE2-O 2.74Å; Q320-V332 PolarHBondContact OE1-O 2.72Å
321	E	68.2	Low	72.5	Confident	115 Å²	115	63.1 Å²	63.1	54%	0.537	34%	0.343	S	S	.	.			trans	-66	148.4	171.9	-75.4	-155.1	160.6	0	0	112.8	S323 H324	E321-S323 WeakPolarHBondContact CB-OG 3.09Å; E321-S323 PolarHBondContact O-N 2.76Å; E321-S323 WeakPolarHBondContact OE2-CB 3.34Å; E321-S323 PolarHBondContact OE2-OG 3.32Å; E321-H324 PolarHBondContact O-N 2.03Å; E321-H324 VanDerWaalsContact O-N 3.16Å
322	I	65.7	Low	71.7	Confident	115 Å²	115	61.8 Å²	61.8	59%	0.59	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-56.6	-30.6	170.6	-62.2	167.9	0	0	0	111.3	A294 P316 H324 C325	A294-I322 HydrophobicContact CB-CD1 4.43Å; A294-I322 HydrophobicContact CB-CG1 4.2Å; P316-I322 HydrophobicContact CG-CG1 3.93Å; I322-H324 PolarHBondContact O-N 3.49Å; I322-C325 PolarHBondContact O-N 3.41Å
323	S	66.2	Low	71.5	Confident	73 Å²	73	60.9 Å²	60.9	51%	0.51	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-60.1	-23.1	179	64.4	0	0	0	0	114.2	E321	E321-S323 WeakPolarHBondContact CB-OG 3.09Å; E321-S323 PolarHBondContact O-N 2.76Å; E321-S323 WeakPolarHBondContact OE2-CB 3.34Å; E321-S323 PolarHBondContact OE2-OG 3.32Å
324	H	65.9	Low	71.1	Confident	53 Å²	53	59.1 Å²	59.1	25%	0.245	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-81.5	-21.6	-175.8	-69.2	176	0	0	0	113.9	E257 Q320 E321 I322 T326 N329	E257-H324 IonicContact OE1-CE1 2.72Å; E257-H324 PolarHBondContact OE1-CE1 2.91Å; Q320-H324 HydrophobicContact CG-CB 3.94Å; E321-H324 PolarHBondContact O-N 2.03Å; E321-H324 VanDerWaalsContact O-N 3.16Å; I322-H324 PolarHBondContact O-N 3.49Å; H324-T326 PolarHBondContact O-N 2.92Å; H324-T326 VanDerWaalsContact O-N 3.1Å; H324-N329 VanDerWaalsContact O-CB 3.25Å; H324-N329 WeakPolarHBondContact O-CB 3.42Å; H324-N329 PolarHBondContact O-ND2 2.89Å
325	C	68.7	Low	71	Confident	27 Å²	27	60.4 Å²	60.4	18%	0.182	35%	0.349	C	S	.	.			trans	-87.9	73.9	-175.5	-67.2	0	0	0	0	113.7	P316 I322 C333	P316-C325 WeakPolarHBondContact CA-SG 3.23Å; I322-C325 PolarHBondContact O-N 3.41Å; C325-C333 WeakPolarHBondContact CA-SG 3.3Å; C325-C333 HydrophobicContact CB-CB 4.07Å; C325-C333 WeakPolarHBondContact CB-SG 3.49Å; C325-C333 WeakPolarHBondContact SG-CB 3.23Å; C325-C333 CovalentContact SG-SG 2.04Å; C325-C333 PolarHBondContact SG-SG 2.97Å
326	T	68.4	Low	71	Confident	52 Å²	52	62.4 Å²	62.4	32%	0.319	36%	0.358	S	S	.	.			trans	-87.3	164.8	164.5	68.1	0	0	0	0	111	H324 E328 N329 S330	H324-T326 PolarHBondContact O-N 2.92Å; H324-T326 VanDerWaalsContact O-N 3.1Å; T326-E328 PolarHBondContact O-N 2.79Å; T326-E328 PolarHBondContact OG1-N 2.86Å; T326-N329 CarbonylContact O-C 3.58Å; T326-N329 PolarHBondContact O-N 2.64Å; T326-N329 VanDerWaalsContact O-N 3.14Å; T326-N329 PolarHBondContact OG1-N 3.48Å; T326-N329 VanDerWaalsContact OG1-N 3.17Å; T326-S330 PolarHBondContact O-N 2.76Å; T326-S330 VanDerWaalsContact O-N 3.13Å
327	Q	65.9	Low	71.2	Confident	157 Å²	157	65.9 Å²	65.9	73%	0.734	38%	0.383	S	S	*	.	S	Bend	trans	-59	-30.3	172.9	-172.1	176.1	-2.7	0	0	112.3	S330	Q327-S330 VanDerWaalsContact O-CB 3.29Å; Q327-S330 WeakPolarHBondContact O-CB 3.28Å; Q327-S330 PolarHBondContact O-OG 2.78Å
328	E	64.9	Low	71.5	Confident	116 Å²	116	67.5 Å²	67.5	54%	0.542	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-32	177.5	-59	179.2	153.9	0	0	112.6	T326 R852	T326-E328 PolarHBondContact O-N 2.79Å; T326-E328 PolarHBondContact OG1-N 2.86Å; E328-R852 IonicContact OE1-CZ 2.73Å; E328-R852 VanDerWaalsContact OE1-CZ 3.22Å; E328-R852 IonicContact OE1-NE 3.8Å; E328-R852 PolarHBondContact OE1-NE 3.06Å; E328-R852 IonicContact OE1-NH2 3.67Å; E328-R852 PolarHBondContact OE1-NH2 3.04Å
329	N	67.1	Low	71.9	Confident	52 Å²	52	69.9 Å²	69.9	28%	0.278	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	16.1	174.8	-71.8	-20.7	0	0	0	113	H324 T326 T331 V332	H324-N329 VanDerWaalsContact O-CB 3.25Å; H324-N329 WeakPolarHBondContact O-CB 3.42Å; H324-N329 PolarHBondContact O-ND2 2.89Å; T326-N329 CarbonylContact O-C 3.58Å; T326-N329 PolarHBondContact O-N 2.64Å; T326-N329 VanDerWaalsContact O-N 3.14Å; T326-N329 PolarHBondContact OG1-N 3.48Å; T326-N329 VanDerWaalsContact OG1-N 3.17Å; N329-T331 PolarHBondContact O-N 2.81Å; N329-V332 HydrophobicContact CB-CG2 4.03Å; N329-V332 VanDerWaalsContact O-CG2 3.23Å; N329-V332 WeakPolarHBondContact O-CG2 3.49Å; N329-V332 PolarHBondContact O-N 3Å
330	S	66.5	Low	72.3	Confident	33 Å²	33	69.1 Å²	69.1	23%	0.231	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-57.8	-20.4	-172.7	47.9	0	0	0	0	114.9	T326 Q327	T326-S330 PolarHBondContact O-N 2.76Å; T326-S330 VanDerWaalsContact O-N 3.13Å; Q327-S330 VanDerWaalsContact O-CB 3.29Å; Q327-S330 WeakPolarHBondContact O-CB 3.28Å; Q327-S330 PolarHBondContact O-OG 2.78Å
331	T	66.4	Low	72.7	Confident	129 Å²	129	73.8 Å²	73.8	79%	0.791	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-74.3	-18.8	176	51	0	0	0	0	114.7	N329	N329-T331 PolarHBondContact O-N 2.81Å
332	V	68	Low	72.8	Confident	35 Å²	35	71 Å²	71	21%	0.212	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-110.3	30.1	178.6	-66.2	0	0	0	0	112.4	Q320 N329	Q320-V332 PolarHBondContact NE2-O 2.74Å; Q320-V332 PolarHBondContact OE1-O 2.72Å; N329-V332 HydrophobicContact CB-CG2 4.03Å; N329-V332 VanDerWaalsContact O-CG2 3.23Å; N329-V332 WeakPolarHBondContact O-CG2 3.49Å; N329-V332 PolarHBondContact O-N 3Å
333	C	77.6	Confident	73	Confident	14 Å²	14	69.6 Å²	69.6	10%	0.095	39%	0.391	C	S	.	.	S	Bend	trans	-136.5	159	178.9	-65.7	0	0	0	0	110.6	C325 S335	C325-C333 WeakPolarHBondContact CA-SG 3.3Å; C325-C333 HydrophobicContact CB-CB 4.07Å; C325-C333 WeakPolarHBondContact CB-SG 3.49Å; C325-C333 WeakPolarHBondContact SG-CB 3.23Å; C325-C333 CovalentContact SG-SG 2.04Å; C325-C333 PolarHBondContact SG-SG 2.97Å; C333-S335 PolarHBondContact O-N 3.37Å
334	C	78	Confident	73.1	Confident	19 Å²	19	69.5 Å²	69.5	13%	0.128	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	137.7	161.8	-81.6	0	0	0	0	109.3	C290 W296 Y314 K315 L317	C290-C334 WeakPolarHBondContact CA-SG 3.23Å; C290-C334 HydrophobicContact CB-CB 3.78Å; C290-C334 WeakPolarHBondContact CB-SG 2.85Å; C290-C334 WeakPolarHBondContact SG-CB 3.45Å; C290-C334 CovalentContact SG-SG 2.03Å; C290-C334 PolarHBondContact SG-SG 3.39Å; W296-C334 HydrophobicContact CH2-CB 4.15Å; W296-C334 HydrophobicContact CZ3-CB 4.35Å; Y314-C334 CarbonylContact C-O 3.57Å; Y314-C334 VanDerWaalsContact CA-O 3.27Å; Y314-C334 WeakPolarHBondContact CA-O 3.47Å; K315-C334 HydrophobicContact CB-CB 4.43Å; K315-C334 PolarHBondContact N-O 3.2Å; K315-C334 WeakPolarHBondContact O-CA 3.3Å; K315-C334 WeakPolarHBondContact O-CB 3.23Å; K315-C334 PolarHBondContact O-N 3.14Å; L317-C334 HydrophobicContact CD2-CB 4.5Å
335	S	81.9	Confident	73.1	Confident	75 Å²	75	68.9 Å²	68.9	52%	0.524	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	142.2	168.6	53.5	0	0	0	0	110.1	R313 C333	R313-S335 WeakPolarHBondContact O-CA 3.41Å; C333-S335 PolarHBondContact O-N 3.37Å
336	E	84.2	Confident	73	Confident	64 Å²	64	69.8 Å²	69.8	30%	0.299	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.1	168.3	-179.5	-174.8	164.6	0	0	106.8	W296 W299 V312 R313	W296-E336 HydrophobicContact CE3-CB 4.21Å; W296-E336 HydrophobicContact CH2-CB 3.57Å; W296-E336 HydrophobicContact CZ2-CB 4Å; W296-E336 WeakPolarHBondContact CZ2-OE2 3.48Å; W296-E336 HydrophobicContact CZ3-CB 3.68Å; W296-E336 PolarHBondContact NE1-OE2 2.02Å; W299-E336 HydrophobicContact CH2-CG 4.15Å; W299-E336 WeakPolarHBondContact CZ3-O 3.49Å; V312-E336 CarbonylContact C-O 3.51Å; V312-E336 WeakPolarHBondContact CA-O 3.37Å; R313-E336 HydrophobicContact CG-CB 4.03Å; R313-E336 IonicContact CZ-OE1 2.7Å; R313-E336 IonicContact CZ-OE2 3.11Å; R313-E336 PolarHBondContact N-O 2.87Å; R313-E336 IonicContact NE-OE1 3.63Å; R313-E336 IonicContact NE-OE2 3.16Å; R313-E336 PolarHBondContact NE-OE2 3.19Å; R313-E336 IonicContact NH2-OE1 3.9Å; R313-E336 PolarHBondContact NH2-OE1 2.84Å; R313-E336 IonicContact NH2-OE2 3.29Å; R313-E336 PolarHBondContact NH2-OE2 2.86Å; R313-E336 PolarHBondContact O-N 3.17Å
337	S	85.2	Confident	73.3	Confident	77 Å²	77	70.4 Å²	70.4	54%	0.538	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	137.7	177.3	63.2	0	0	0	0	110.5	R311	R311-S337 CarbonylContact O-C 3.58Å; R311-S337 VanDerWaalsContact O-CA 3.22Å; R311-S337 WeakPolarHBondContact O-CA 3.46Å
338	V	84.3	Confident	73.5	Confident	51 Å²	51	64.6 Å²	64.6	31%	0.309	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.1	175.3	66.7	0	0	0	0	109.5	W299 M310 R311 E340	W299-V338 HydrophobicContact CD2-CG1 4.42Å; W299-V338 HydrophobicContact CE3-CG1 4.04Å; W299-V338 HydrophobicContact CH2-CB 3.73Å; W299-V338 HydrophobicContact CH2-CG1 3.52Å; W299-V338 HydrophobicContact CZ2-CB 4.3Å; W299-V338 HydrophobicContact CZ2-CG1 3.91Å; W299-V338 HydrophobicContact CZ3-CB 4.11Å; W299-V338 HydrophobicContact CZ3-CG1 3.58Å; M310-V338 WeakPolarHBondContact CA-O 3.34Å; R311-V338 HydrophobicContact CB-CG1 3.97Å; R311-V338 PolarHBondContact N-O 2.95Å; R311-V338 PolarHBondContact O-N 2.97Å; V338-E340 HydrophobicContact CG1-CG 4.43Å
339	Q	79.9	Confident	73.9	Confident	122 Å²	122	60 Å²	60	57%	0.57	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	107.4	172	-172.9	-179.2	-40.7	0	0	108.5	V308 T309 M310	V308-Q339 HydrophobicContact CG1-CG 3.56Å; T309-Q339 CarbonylContact O-C 3.39Å; T309-Q339 WeakPolarHBondContact O-CA 3.3Å; M310-Q339 HydrophobicContact CE-CB 4.24Å; M310-Q339 HydrophobicContact SD-CB 3.7Å; M310-Q339 HydrophobicContact SD-CG 3.96Å
340	E	77	Confident	74.2	Confident	61 Å²	61	60.6 Å²	60.6	29%	0.285	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	144.3	169.7	-70.7	178.4	-179.3	0	0	109.1	T309 R311 V338	T309-E340 HydrophobicContact CG2-CB 3.84Å; T309-E340 PolarHBondContact N-O 3.29Å; T309-E340 PolarHBondContact O-N 2.93Å; T309-E340 VanDerWaalsContact O-O 3.13Å; R311-E340 WeakPolarHBondContact CD-OE1 3.33Å; R311-E340 VanDerWaalsContact CD-OE2 3.24Å; R311-E340 WeakPolarHBondContact CD-OE2 3.25Å; R311-E340 IonicContact NH1-OE1 3.2Å; R311-E340 PolarHBondContact NH1-OE1 2.01Å; R311-E340 IonicContact NH1-OE2 3.36Å; V338-E340 HydrophobicContact CG1-CG 4.43Å
341	V	76.6	Confident	74.2	Confident	110 Å²	110	62.7 Å²	62.7	67%	0.667	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	102.8	171.7	-177	0	0	0	0	107.6	V308	V308-V341 HydrophobicContact CG2-CG2 4.49Å
342	L	71.6	Confident	74.3	Confident	57 Å²	57	58.2 Å²	58.2	30%	0.298	35%	0.346	S	S	.	.			trans	-76.1	176.2	172.1	-62	177.8	0	0	0	110.2	A304 S305 G307 T309	A304-L342 VanDerWaalsContact O-CD1 3.3Å; A304-L342 WeakPolarHBondContact O-CD1 3.35Å; S305-L342 VanDerWaalsContact C-CD1 3.5Å; G307-L342 PolarHBondContact O-N 2.84Å; T309-L342 HydrophobicContact CG2-CD1 3.78Å; T309-L342 HydrophobicContact CG2-CG 3.8Å
343	L	69.5	Low	74.2	Confident	85 Å²	85	62.8 Å²	62.8	45%	0.445	37%	0.369	S	S	.	.	S	Bend	trans	-43.5	128.9	167.7	-79.5	162.2	0	0	0	109.8	G307 C345 E347 Y348	G307-L343 PolarHBondContact N-O 2.91Å; L343-C345 PolarHBondContact O-N 3.39Å; L343-E347 HydrophobicContact CD2-CG 4.43Å; L343-Y348 HydrophobicContact CB-CE2 3.86Å
344	P	67.8	Low	73.9	Confident	70 Å²	70	63.8 Å²	63.8	46%	0.455	37%	0.373	S	S	.	.			trans	-59.4	141.9	-173	25.2	-33.9	0	0	0	109.6	S346 E347	P344-S346 PolarHBondContact O-N 2.9Å; P344-E347 HydrophobicContact CG-CG 4.18Å; P344-E347 WeakPolarHBondContact O-CB 3.23Å; P344-E347 PolarHBondContact O-N 3.01Å
345	C	65	Low	73.6	Confident	40 Å²	40	64.1 Å²	64.1	27%	0.27	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-61.3	-9	-174.1	-66.8	0	0	0	0	114.5	C306 G307 L343 E347 Y348 G373	C306-C345 HydrophobicContact CB-CB 3.96Å; C306-C345 WeakPolarHBondContact CB-SG 3.46Å; C306-C345 PolarHBondContact O-SG 3.4Å; C306-C345 VanDerWaalsContact SG-CA 3.55Å; C306-C345 WeakPolarHBondContact SG-CB 3.41Å; C306-C345 CovalentContact SG-SG 2.05Å; C306-C345 PolarHBondContact SG-SG 2.04Å; G307-C345 PolarHBondContact N-SG 3.44Å; L343-C345 PolarHBondContact O-N 3.39Å; C345-E347 PolarHBondContact O-N 2.87Å; C345-Y348 PolarHBondContact O-N 3.38Å; C345-Y348 VanDerWaalsContact O-N 3.16Å; C345-G373 VanDerWaalsContact C-CA 3.47Å; C345-G373 WeakPolarHBondContact O-CA 3.35Å
346	S	68.2	Low	73.4	Confident	46 Å²	46	60.9 Å²	60.9	32%	0.322	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-60.9	-28.8	166.1	50.2	0	0	0	0	113.1	P344 Y348 F356 Q366 S374	P344-S346 PolarHBondContact O-N 2.9Å; S346-Y348 PolarHBondContact O-N 3.36Å; S346-F356 WeakPolarHBondContact O-CD2 2.99Å; S346-Q366 PolarHBondContact O-NE2 3.17Å; S346-S374 WeakPolarHBondContact O-CB 2.97Å; S346-S374 PolarHBondContact O-OG 2.79Å
347	E	73.3	Confident	73.1	Confident	66 Å²	66	65.8 Å²	65.8	31%	0.308	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-74.5	-5.4	174	-65.5	-63.8	147.8	0	0	113.2	L343 P344 C345 E355 F356	L343-E347 HydrophobicContact CD2-CG 4.43Å; P344-E347 HydrophobicContact CG-CG 4.18Å; P344-E347 WeakPolarHBondContact O-CB 3.23Å; P344-E347 PolarHBondContact O-N 3.01Å; C345-E347 PolarHBondContact O-N 2.87Å; E347-E355 CarbonylContact O-C 3.5Å; E347-E355 WeakPolarHBondContact O-CA 3.38Å; E347-F356 PolarHBondContact O-N 3.29Å
348	Y	70.8	Confident	72.9	Confident	34 Å²	34	71.6 Å²	71.6	13%	0.133	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-121.2	141.1	-179.9	-67.9	-94.5	0	0	0	111.4	C306 L343 C345 S346 H350 I354 E355 F356	C306-Y348 HydrophobicContact CB-CD2 3.3Å; C306-Y348 HydrophobicContact CB-CE2 3.53Å; C306-Y348 HydrophobicContact CB-CG 3.97Å; L343-Y348 HydrophobicContact CB-CE2 3.86Å; C345-Y348 PolarHBondContact O-N 3.38Å; C345-Y348 VanDerWaalsContact O-N 3.16Å; S346-Y348 PolarHBondContact O-N 3.36Å; Y348-H350 PolarHBondContact O-N 3.25Å; Y348-I354 CarbonylContact C-O 3.57Å; Y348-I354 VanDerWaalsContact CA-O 3.3Å; Y348-I354 WeakPolarHBondContact CA-O 3.26Å; Y348-E355 HydrophobicContact CD1-CB 4.38Å; Y348-E355 HydrophobicContact CE1-CB 4.07Å; Y348-F356 WeakPolarHBondContact O-CE2 3.1Å
349	H	73.3	Confident	72.7	Confident	20 Å²	20	74.7 Å²	74.7	9%	0.093	39%	0.389	C	S	.	.	B	Isolated β-bridge	trans	-65.8	121	170.3	-176	-68.4	0	0	0	109.4	G351 T352 I354 F356 S374 M385	H349-G351 PolarHBondContact O-N 3.27Å; H349-T352 WeakPolarHBondContact O-CB 3.04Å; H349-T352 PolarHBondContact O-N 3.39Å; H349-T352 PolarHBondContact O-OG1 3.37Å; H349-I354 HydrophobicContact CB-CB 4.39Å; H349-I354 PolarHBondContact N-O 3.16Å; H349-F356 HydrophobicContact CB-CE1 4.24Å; H349-F356 HydrophobicContact CB-CE2 4.19Å; H349-F356 HydrophobicContact CB-CZ 3.79Å; H349-F356 AromaticContact CD2-CZ 3.92Å; H349-S374 CarbonylContact C-O 3.58Å; H349-S374 WeakPolarHBondContact CA-O 3.48Å; H349-M385 PolarHBondContact CD2-O 3.12Å; H349-M385 PolarHBondContact NE2-O 2.81Å; H349-M385 VanDerWaalsContact NE2-O 3.11Å
350	H	72.7	Confident	72.9	Confident	64 Å²	64	73 Å²	73	30%	0.296	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45	132.9	-177.4	176.5	-99.3	0	0	0	112.6	Y348 T352 H369 G372 S374	Y348-H350 PolarHBondContact O-N 3.25Å; H350-T352 VanDerWaalsContact C-N 3.29Å; H350-T352 PolarHBondContact O-N 3.02Å; H350-H369 HydrophobicContact CB-CB 4.21Å; H350-H369 AromaticContact CD2-ND1 3.3Å; H350-H369 PolarHBondContact CD2-ND1 3.33Å; H350-H369 VanDerWaalsContact CD2-ND1 3.3Å; H350-H369 AromaticContact CE1-CE1 3.25Å; H350-H369 PolarHBondContact CE1-CE1 3.35Å; H350-H369 AromaticContact CE1-ND1 3.27Å; H350-H369 PolarHBondContact CE1-ND1 2.95Å; H350-H369 VanDerWaalsContact CE1-ND1 3.27Å; H350-H369 AromaticContact CG-CE1 3.96Å; H350-H369 AromaticContact CG-CG 3.84Å; H350-H369 AromaticContact CG-ND1 3.33Å; H350-H369 VanDerWaalsContact CG-ND1 3.33Å; H350-H369 AromaticContact ND1-CE1 3.45Å; H350-H369 PolarHBondContact ND1-CE1 3.48Å; H350-H369 AromaticContact ND1-ND1 3.32Å; H350-H369 PolarHBondContact ND1-ND1 3.4Å; H350-H369 AromaticContact NE2-CE1 3.65Å; H350-H369 AromaticContact NE2-ND1 3.25Å; H350-H369 PolarHBondContact NE2-ND1 2.76Å; H350-G372 PolarHBondContact CD2-O 2.9Å; H350-S374 PolarHBondContact N-O 3.11Å
351	G	66.3	Low	73.4	Confident	77 Å²	77	71.1 Å²	71.1	79%	0.794	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	7.3	-176.9	0	0	0	0	0	115.4	H349	H349-G351 PolarHBondContact O-N 3.27Å
352	T	68.7	Low	74	Confident	36 Å²	36	70.4 Å²	70.4	22%	0.221	38%	0.377	C	S	.	.	S	Bend	trans	-136.5	168.2	-177.5	80.4	0	0	0	0	112.8	H349 H350 I354 M385	H349-T352 WeakPolarHBondContact O-CB 3.04Å; H349-T352 PolarHBondContact O-N 3.39Å; H349-T352 PolarHBondContact O-OG1 3.37Å; H350-T352 VanDerWaalsContact C-N 3.29Å; H350-T352 PolarHBondContact O-N 3.02Å; T352-I354 VanDerWaalsContact C-N 3.32Å; T352-I354 HydrophobicContact CG2-CD1 4.48Å; T352-I354 WeakPolarHBondContact OG1-CB 3.29Å; T352-I354 PolarHBondContact OG1-N 2.89Å; T352-I354 VanDerWaalsContact OG1-N 3.09Å; T352-M385 HydrophobicContact CG2-SD 4.46Å
353	N	66.1	Low	74.8	Confident	131 Å²	131	69.9 Å²	69.9	70%	0.701	38%	0.375	S	S	*	.			trans	-91.4	15.8	168.5	64.9	-11.3	0	0	0	113.3	E355	N353-E355 PolarHBondContact O-N 3.18Å
354	I	70.8	Confident	75.6	Confident	34 Å²	34	66.3 Å²	66.3	17%	0.174	36%	0.359	C	S	.	.			trans	-82.5	108	-177.6	-58.5	174.1	0	0	0	109.7	Y348 H349 T352 K359	Y348-I354 CarbonylContact C-O 3.57Å; Y348-I354 VanDerWaalsContact CA-O 3.3Å; Y348-I354 WeakPolarHBondContact CA-O 3.26Å; H349-I354 HydrophobicContact CB-CB 4.39Å; H349-I354 PolarHBondContact N-O 3.16Å; T352-I354 VanDerWaalsContact C-N 3.32Å; T352-I354 HydrophobicContact CG2-CD1 4.48Å; T352-I354 WeakPolarHBondContact OG1-CB 3.29Å; T352-I354 PolarHBondContact OG1-N 2.89Å; T352-I354 VanDerWaalsContact OG1-N 3.09Å; I354-K359 HydrophobicContact CG2-CB 3.71Å; I354-K359 HydrophobicContact CG2-CD 4Å; I354-K359 HydrophobicContact CG2-CG 4.26Å
355	E	73.1	Confident	76.5	Confident	26 Å²	26	68.2 Å²	68.2	12%	0.121	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-71.6	119	173.2	-168.5	-173.1	170.3	0	0	110	E347 Y348 N353 K357 R358 K359	E347-E355 CarbonylContact O-C 3.5Å; E347-E355 WeakPolarHBondContact O-CA 3.38Å; Y348-E355 HydrophobicContact CD1-CB 4.38Å; Y348-E355 HydrophobicContact CE1-CB 4.07Å; N353-E355 PolarHBondContact O-N 3.18Å; E355-K357 HydrophobicContact CG-CB 3.98Å; E355-K357 PolarHBondContact O-N 3.2Å; E355-R358 HydrophobicContact CB-CG 4.27Å; E355-R358 PolarHBondContact O-N 3.39Å; E355-R358 IonicContact OE2-CZ 2.74Å; E355-R358 IonicContact OE2-NE 3.95Å; E355-R358 PolarHBondContact OE2-NE 2.72Å; E355-R358 IonicContact OE2-NH2 3.74Å; E355-R358 PolarHBondContact OE2-NH2 3.18Å; E355-R358 VanDerWaalsContact OE2-NH2 3.11Å; E355-K359 PolarHBondContact O-N 2.91Å; E355-K359 VanDerWaalsContact O-N 3.1Å
356	F	76.9	Confident	77.6	Confident	7 Å²	7	70.8 Å²	70.8	3%	0.031	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-34.4	-179.4	-83.4	-64	0	0	0	112.3	S346 E347 Y348 H349 R358 K359 P360 Q366	S346-F356 WeakPolarHBondContact O-CD2 2.99Å; E347-F356 PolarHBondContact O-N 3.29Å; Y348-F356 WeakPolarHBondContact O-CE2 3.1Å; H349-F356 HydrophobicContact CB-CE1 4.24Å; H349-F356 HydrophobicContact CB-CE2 4.19Å; H349-F356 HydrophobicContact CB-CZ 3.79Å; H349-F356 AromaticContact CD2-CZ 3.92Å; F356-R358 PolarHBondContact O-N 3.5Å; F356-R358 VanDerWaalsContact O-N 3.13Å; F356-K359 CarbonylContact O-C 3.49Å; F356-K359 PolarHBondContact O-N 2.96Å; F356-K359 VanDerWaalsContact O-N 3.13Å; F356-P360 VanDerWaalsContact O-N 3.08Å; F356-Q366 HydrophobicContact CD2-CG 4.11Å; F356-Q366 HydrophobicContact CE1-CG 4.42Å; F356-Q366 HydrophobicContact CE2-CG 4.01Å; F356-Q366 HydrophobicContact CG-CG 4.37Å; F356-Q366 HydrophobicContact CZ-CG 4.17Å
357	K	78.4	Confident	78.3	Confident	168 Å²	168	69.9 Å²	69.9	73%	0.73	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.5	173.2	-166.5	174.8	-178.3	175.6	0	114.4	E355	E355-K357 HydrophobicContact CG-CB 3.98Å; E355-K357 PolarHBondContact O-N 3.2Å
358	R	79.6	Confident	78.5	Confident	198 Å²	198	72.1 Å²	72.1	75%	0.747	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-27	173.3	-57.3	-171.6	-161	-145.9	0.5	113.5	E355 F356	E355-R358 HydrophobicContact CB-CG 4.27Å; E355-R358 PolarHBondContact O-N 3.39Å; E355-R358 IonicContact OE2-CZ 2.74Å; E355-R358 IonicContact OE2-NE 3.95Å; E355-R358 PolarHBondContact OE2-NE 2.72Å; E355-R358 IonicContact OE2-NH2 3.74Å; E355-R358 PolarHBondContact OE2-NH2 3.18Å; E355-R358 VanDerWaalsContact OE2-NH2 3.11Å; F356-R358 PolarHBondContact O-N 3.5Å; F356-R358 VanDerWaalsContact O-N 3.13Å
359	K	81.8	Confident	78.6	Confident	117 Å²	117	72.2 Å²	72.2	51%	0.509	39%	0.387	S	S	.	.	S	Bend	trans	-142.5	86.5	-178.8	-70.7	-165.6	177.9	-173.7	0	109.8	I354 E355 F356 L386	I354-K359 HydrophobicContact CG2-CB 3.71Å; I354-K359 HydrophobicContact CG2-CD 4Å; I354-K359 HydrophobicContact CG2-CG 4.26Å; E355-K359 PolarHBondContact O-N 2.91Å; E355-K359 VanDerWaalsContact O-N 3.1Å; F356-K359 CarbonylContact O-C 3.49Å; F356-K359 PolarHBondContact O-N 2.96Å; F356-K359 VanDerWaalsContact O-N 3.13Å; K359-L386 HydrophobicContact CB-CD1 3.87Å; K359-L386 HydrophobicContact CD-CD1 3.91Å; K359-L386 HydrophobicContact CG-CD1 4.45Å
360	P	84.2	Confident	78.4	Confident	87 Å²	87	77 Å²	77	57%	0.565	42%	0.422	S	S	*	.			trans	-71	168.2	175.9	30.7	-35.9	0	0	0	111.2	F356 V362	F356-P360 VanDerWaalsContact O-N 3.08Å; P360-V362 PolarHBondContact O-N 3.09Å
361	C	86.8	Confident	77.7	Confident	20 Å²	20	81.3 Å²	81.3	14%	0.135	44%	0.443	C	S	.	.			trans	-63	127.9	166.7	-53.2	0	0	0	0	109.8	G364 C376	C361-G364 VanDerWaalsContact CB-O 3.23Å; C361-G364 WeakPolarHBondContact CB-O 3.39Å; C361-C376 WeakPolarHBondContact CA-SG 3.47Å; C361-C376 HydrophobicContact CB-CB 3.84Å; C361-C376 WeakPolarHBondContact CB-SG 3.24Å; C361-C376 WeakPolarHBondContact SG-CA 3.41Å; C361-C376 WeakPolarHBondContact SG-CB 3.35Å; C361-C376 CovalentContact SG-SG 2.03Å; C361-C376 PolarHBondContact SG-SG 3.38Å
362	V	88	Confident	77.4	Confident	95 Å²	95	79.5 Å²	79.5	58%	0.576	42%	0.424	S	S	*	.	S	Bend	trans	-79.2	-56	-177.3	-173	0	0	0	0	110.4	P360 L386	P360-V362 PolarHBondContact O-N 3.09Å; V362-L386 PolarHBondContact N-O 2.86Å
363	N	88.6	Confident	77.4	Confident	46 Å²	46	78.6 Å²	78.6	25%	0.246	42%	0.422	C	S	.	.	S	Bend	trans	-123.2	52.7	178.9	-54.6	-71.8	0	0	0	111.3	F379 Y382 C387	N363-F379 HydrophobicContact CB-CD2 4.38Å; N363-F379 VanDerWaalsContact O-CD2 3.31Å; N363-F379 WeakPolarHBondContact O-CD2 3.42Å; N363-F379 PolarHBondContact O-N 2.85Å; N363-Y382 HydrophobicContact CB-CD1 3.51Å; N363-Y382 HydrophobicContact CB-CD2 3.76Å; N363-Y382 HydrophobicContact CB-CE1 3.84Å; N363-Y382 HydrophobicContact CB-CE2 4.06Å; N363-Y382 HydrophobicContact CB-CG 3.47Å; N363-Y382 VanDerWaalsContact CB-CG 3.47Å; N363-Y382 VanDerWaalsContact CG-CE1 3.5Å; N363-C387 VanDerWaalsContact C-CB 3.45Å; N363-C387 HydrophobicContact CB-CB 4.16Å; N363-C387 WeakPolarHBondContact CB-O 3.01Å; N363-C387 PolarHBondContact N-O 3.32Å; N363-C387 PolarHBondContact ND2-O 3Å; N363-C387 WeakPolarHBondContact O-CB 2.96Å
364	G	86.4	Confident	77.9	Confident	11 Å²	11	72.8 Å²	72.8	11%	0.113	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	176.5	-180	0	0	0	0	0	113.2	C361 E377	C361-G364 VanDerWaalsContact CB-O 3.23Å; C361-G364 WeakPolarHBondContact CB-O 3.39Å; G364-E377 CarbonylContact C-O 3.6Å; G364-E377 WeakPolarHBondContact CA-O 3.43Å
365	L	88.1	Confident	78.6	Confident	109 Å²	109	75.9 Å²	75.9	57%	0.571	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	142	179	-67.4	169.5	0	0	0	111	V367 C376 E377 F379	L365-V367 HydrophobicContact CB-CG1 4.32Å; L365-V367 PolarHBondContact O-N 2.68Å; L365-C376 CarbonylContact O-C 3.58Å; L365-C376 WeakPolarHBondContact O-CA 3.25Å; L365-E377 PolarHBondContact N-O 3.1Å; L365-E377 PolarHBondContact O-N 2.04Å; L365-F379 HydrophobicContact CD1-CE1 4.16Å; L365-F379 HydrophobicContact CD2-CZ 4.38Å; L365-F379 HydrophobicContact CG-CE1 3.89Å; L365-F379 HydrophobicContact CG-CZ 4.09Å
366	Q	86.9	Confident	79.2	Confident	95 Å²	95	75.2 Å²	75.2	44%	0.444	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	109.7	170.2	-178.6	-176	-4.3	0	0	108.6	S346 F356	S346-Q366 PolarHBondContact O-NE2 3.17Å; F356-Q366 HydrophobicContact CD2-CG 4.11Å; F356-Q366 HydrophobicContact CE1-CG 4.42Å; F356-Q366 HydrophobicContact CE2-CG 4.01Å; F356-Q366 HydrophobicContact CG-CG 4.37Å; F356-Q366 HydrophobicContact CZ-CG 4.17Å
367	V	83.6	Confident	79.7	Confident	27 Å²	27	79.4 Å²	79.4	16%	0.164	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	150.7	-179.4	-58.3	0	0	0	0	111.2	L365 H369 S374 R375 E377	L365-V367 HydrophobicContact CB-CG1 4.32Å; L365-V367 PolarHBondContact O-N 2.68Å; V367-H369 PolarHBondContact O-N 2.94Å; V367-S374 CarbonylContact O-C 3.26Å; V367-S374 WeakPolarHBondContact O-CA 3.46Å; V367-S374 VanDerWaalsContact O-CB 3.28Å; V367-S374 WeakPolarHBondContact O-CB 3.38Å; V367-S374 PolarHBondContact O-OG 3.4Å; V367-R375 HydrophobicContact CG2-CG 3.69Å; V367-R375 PolarHBondContact N-O 2.02Å; V367-R375 PolarHBondContact O-N 2.73Å; V367-E377 HydrophobicContact CB-CB 4.44Å; V367-E377 HydrophobicContact CG1-CB 3.81Å; V367-E377 HydrophobicContact CG2-CB 3.73Å
368	P	76.7	Confident	80.2	Confident	112 Å²	112	73.2 Å²	73.2	73%	0.727	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.3	136.1	171.3	-22	33.6	0	0	0	111.3
369	H	73.7	Confident	80.5	Confident	36 Å²	36	68.7 Å²	68.7	17%	0.167	38%	0.383	C	S	.	.			trans	-92.1	142.4	172.1	-173.1	-113.5	0	0	0	110.4	H350 V367 Q371 G372 G373	H350-H369 HydrophobicContact CB-CB 4.21Å; H350-H369 AromaticContact CD2-ND1 3.3Å; H350-H369 PolarHBondContact CD2-ND1 3.33Å; H350-H369 VanDerWaalsContact CD2-ND1 3.3Å; H350-H369 AromaticContact CE1-CE1 3.25Å; H350-H369 PolarHBondContact CE1-CE1 3.35Å; H350-H369 AromaticContact CE1-ND1 3.27Å; H350-H369 PolarHBondContact CE1-ND1 2.95Å; H350-H369 VanDerWaalsContact CE1-ND1 3.27Å; H350-H369 AromaticContact CG-CE1 3.96Å; H350-H369 AromaticContact CG-CG 3.84Å; H350-H369 AromaticContact CG-ND1 3.33Å; H350-H369 VanDerWaalsContact CG-ND1 3.33Å; H350-H369 AromaticContact ND1-CE1 3.45Å; H350-H369 PolarHBondContact ND1-CE1 3.48Å; H350-H369 AromaticContact ND1-ND1 3.32Å; H350-H369 PolarHBondContact ND1-ND1 3.4Å; H350-H369 AromaticContact NE2-CE1 3.65Å; H350-H369 AromaticContact NE2-ND1 3.25Å; H350-H369 PolarHBondContact NE2-ND1 2.76Å; V367-H369 PolarHBondContact O-N 2.94Å; H369-Q371 PolarHBondContact ND1-N 3Å; H369-Q371 PolarHBondContact O-N 3.15Å; H369-Q371 VanDerWaalsContact O-N 3.16Å; H369-G372 PolarHBondContact O-N 3.4Å; H369-G373 PolarHBondContact N-O 2.88Å
370	S	69	Low	80.3	Confident	120 Å²	120	70.4 Å²	70.4	84%	0.839	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.1	-173.7	52	0	0	0	0	114.5
371	Q	58.4	Low	80	Confident	155 Å²	155	67.2 Å²	67.2	72%	0.724	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	13.1	173.4	-62.4	176	-33.2	0	0	112.6	H369	H369-Q371 PolarHBondContact ND1-N 3Å; H369-Q371 PolarHBondContact O-N 3.15Å; H369-Q371 VanDerWaalsContact O-N 3.16Å
372	G	58.5	Low	79.9	Confident	39 Å²	39	69.9 Å²	69.9	40%	0.402	38%	0.383	S	S	.	.	S	Bend	trans	93.2	162	-174.9	0	0	0	0	0	113.2	H350 H369	H350-G372 PolarHBondContact CD2-O 2.9Å; H369-G372 PolarHBondContact O-N 3.4Å
373	G	70	Confident	79.4	Confident	18 Å²	18	66.6 Å²	66.6	19%	0.186	37%	0.366	C	S	.	.	S	Bend	trans	71.3	-165	-171.3	0	0	0	0	0	113.7	C345 H369	C345-G373 VanDerWaalsContact C-CA 3.47Å; C345-G373 WeakPolarHBondContact O-CA 3.35Å; H369-G373 PolarHBondContact N-O 2.88Å
374	S	76.3	Confident	79.1	Confident	8 Å²	8	65.8 Å²	65.8	6%	0.056	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	153.4	177.7	-70.2	0	0	0	0	112.2	S346 H349 H350 V367	S346-S374 WeakPolarHBondContact O-CB 2.97Å; S346-S374 PolarHBondContact O-OG 2.79Å; H349-S374 CarbonylContact C-O 3.58Å; H349-S374 WeakPolarHBondContact CA-O 3.48Å; H350-S374 PolarHBondContact N-O 3.11Å; V367-S374 CarbonylContact O-C 3.26Å; V367-S374 WeakPolarHBondContact O-CA 3.46Å; V367-S374 VanDerWaalsContact O-CB 3.28Å; V367-S374 WeakPolarHBondContact O-CB 3.38Å; V367-S374 PolarHBondContact O-OG 3.4Å
375	R	85.2	Confident	78.9	Confident	99 Å²	99	70.2 Å²	70.2	37%	0.374	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	165.4	172.4	68.5	166.5	-170.9	-155.7	5.1	109.9	V367 E377	V367-R375 HydrophobicContact CG2-CG 3.69Å; V367-R375 PolarHBondContact N-O 2.02Å; V367-R375 PolarHBondContact O-N 2.73Å; R375-E377 IonicContact CZ-OE1 2.72Å; R375-E377 IonicContact NE-OE1 3.71Å; R375-E377 IonicContact NH2-OE1 2.62Å; R375-E377 PolarHBondContact NH2-OE1 3.2Å
376	C	86.8	Confident	78.8	Confident	13 Å²	13	66.2 Å²	66.2	9%	0.088	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	130.7	161.5	-61.6	0	0	0	0	110.8	C361 L365 M385 C387	C361-C376 WeakPolarHBondContact CA-SG 3.47Å; C361-C376 HydrophobicContact CB-CB 3.84Å; C361-C376 WeakPolarHBondContact CB-SG 3.24Å; C361-C376 WeakPolarHBondContact SG-CA 3.41Å; C361-C376 WeakPolarHBondContact SG-CB 3.35Å; C361-C376 CovalentContact SG-SG 2.03Å; C361-C376 PolarHBondContact SG-SG 3.38Å; L365-C376 CarbonylContact O-C 3.58Å; L365-C376 WeakPolarHBondContact O-CA 3.25Å; C376-M385 WeakPolarHBondContact CB-O 3.09Å; C376-M385 PolarHBondContact SG-O 2.99Å; C376-M385 VanDerWaalsContact SG-O 3.41Å; C376-C387 WeakPolarHBondContact CB-SG 3.45Å
377	E	87.6	Confident	78.8	Confident	95 Å²	95	61.7 Å²	61.7	44%	0.444	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	105.1	164.9	-173.6	139.4	-93.2	0	0	108.3	G364 L365 V367 R375	G364-E377 CarbonylContact C-O 3.6Å; G364-E377 WeakPolarHBondContact CA-O 3.43Å; L365-E377 PolarHBondContact N-O 3.1Å; L365-E377 PolarHBondContact O-N 2.04Å; V367-E377 HydrophobicContact CB-CB 4.44Å; V367-E377 HydrophobicContact CG1-CB 3.81Å; V367-E377 HydrophobicContact CG2-CB 3.73Å; R375-E377 IonicContact CZ-OE1 2.72Å; R375-E377 IonicContact NE-OE1 3.71Å; R375-E377 IonicContact NH2-OE1 2.62Å; R375-E377 PolarHBondContact NH2-OE1 3.2Å
378	C	87.5	Confident	78.8	Confident	38 Å²	38	64.8 Å²	64.8	26%	0.257	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	142.2	-172.1	-53.9	0	0	0	0	112.2	Y382 C387	C378-Y382 WeakPolarHBondContact CB-O 3.32Å; C378-C387 WeakPolarHBondContact CA-SG 3.32Å; C378-C387 HydrophobicContact CB-CB 3.71Å; C378-C387 WeakPolarHBondContact CB-SG 3.34Å; C378-C387 PolarHBondContact N-SG 3.24Å; C378-C387 WeakPolarHBondContact SG-CA 3.44Å; C378-C387 WeakPolarHBondContact SG-CB 3.19Å; C378-C387 CovalentContact SG-SG 2.03Å; C378-C387 PolarHBondContact SG-SG 3.24Å
379	F	87	Confident	78.9	Confident	103 Å²	103	64.5 Å²	64.5	45%	0.452	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-61.3	157.4	172.2	-60.4	-47.8	0	0	0	110.9	N363 L365 G381 Y382	N363-F379 HydrophobicContact CB-CD2 4.38Å; N363-F379 VanDerWaalsContact O-CD2 3.31Å; N363-F379 WeakPolarHBondContact O-CD2 3.42Å; N363-F379 PolarHBondContact O-N 2.85Å; L365-F379 HydrophobicContact CD1-CE1 4.16Å; L365-F379 HydrophobicContact CD2-CZ 4.38Å; L365-F379 HydrophobicContact CG-CE1 3.89Å; L365-F379 HydrophobicContact CG-CZ 4.09Å; F379-G381 PolarHBondContact O-N 2.95Å; F379-G381 VanDerWaalsContact O-N 3.13Å; F379-Y382 HydrophobicContact CB-CD2 4.1Å; F379-Y382 PolarHBondContact O-N 2.94Å
380	Q	77.7	Confident	79.2	Confident	152 Å²	152	70.2 Å²	70.2	71%	0.71	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	119.7	-179	-165.5	178.7	45.5	0	0	109.8	A396	Q380-A396 HydrophobicContact CG-CB 3.97Å
381	G	77.7	Confident	78.8	Confident	21 Å²	21	67.8 Å²	67.8	22%	0.216	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.4	7.4	-171.2	0	0	0	0	0	115.3	F379 E390 L391	F379-G381 PolarHBondContact O-N 2.95Å; F379-G381 VanDerWaalsContact O-N 3.13Å; G381-E390 CarbonylContact O-C 3.47Å; G381-L391 PolarHBondContact O-N 3.21Å
382	Y	84.2	Confident	78.9	Confident	76 Å²	76	63.2 Å²	63.2	30%	0.298	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	156.9	176.6	-64.1	-86	0	0	0	113.9	N363 C378 F379 M389 E390	N363-Y382 HydrophobicContact CB-CD1 3.51Å; N363-Y382 HydrophobicContact CB-CD2 3.76Å; N363-Y382 HydrophobicContact CB-CE1 3.84Å; N363-Y382 HydrophobicContact CB-CE2 4.06Å; N363-Y382 HydrophobicContact CB-CG 3.47Å; N363-Y382 VanDerWaalsContact CB-CG 3.47Å; N363-Y382 VanDerWaalsContact CG-CE1 3.5Å; C378-Y382 WeakPolarHBondContact CB-O 3.32Å; F379-Y382 HydrophobicContact CB-CD2 4.1Å; F379-Y382 PolarHBondContact O-N 2.94Å; Y382-M389 CarbonylContact C-O 3.13Å; Y382-M389 VanDerWaalsContact CA-O 3.26Å; Y382-M389 WeakPolarHBondContact CA-O 3.37Å; Y382-E390 HydrophobicContact CD1-CB 4.4Å; Y382-E390 HydrophobicContact CD1-CG 4.49Å; Y382-E390 HydrophobicContact CE1-CB 4.25Å; Y382-E390 HydrophobicContact CE1-CG 4.1Å
383	A	78.5	Confident	78.8	Confident	26 Å²	26	65.1 Å²	65.1	22%	0.215	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	-175.1	178.6	0	0	0	0	0	111.4	C387 E388 M389 L391	A383-C387 CarbonylContact O-C 3.49Å; A383-C387 VanDerWaalsContact O-C 3.26Å; A383-C387 WeakPolarHBondContact O-CA 3.27Å; A383-E388 PolarHBondContact O-N 2.84Å; A383-M389 HydrophobicContact CB-CB 4.46Å; A383-M389 PolarHBondContact N-O 2.74Å; A383-M389 WeakPolarHBondContact O-CA 3.46Å; A383-M389 WeakPolarHBondContact O-CB 3.33Å; A383-M389 PolarHBondContact O-N 3.13Å; A383-L391 HydrophobicContact CB-CD1 3.82Å; A383-L391 HydrophobicContact CB-CD2 3.82Å; A383-L391 HydrophobicContact CB-CG 3.62Å
384	G	81.4	Confident	78	Confident	29 Å²	29	68.3 Å²	68.3	30%	0.299	39%	0.391	S	S	.	.	S	Bend	trans	96.2	169.9	-168.4	0	0	0	0	0	111.4	L386 E388	G384-L386 VanDerWaalsContact C-N 3.33Å; G384-E388 VanDerWaalsContact C-OE2 3.3Å; G384-E388 WeakPolarHBondContact CA-OE1 3.43Å; G384-E388 WeakPolarHBondContact CA-OE2 3.44Å
385	M	82.2	Confident	76.7	Confident	104 Å²	104	70.3 Å²	70.3	51%	0.512	41%	0.408	S	S	.	.	S	Bend	trans	-75.4	-26.7	-176.9	-66.9	-172.6	-66.2	0	0	112.4	H349 T352 C376 E388	H349-M385 PolarHBondContact CD2-O 3.12Å; H349-M385 PolarHBondContact NE2-O 2.81Å; H349-M385 VanDerWaalsContact NE2-O 3.11Å; T352-M385 HydrophobicContact CG2-SD 4.46Å; C376-M385 WeakPolarHBondContact CB-O 3.09Å; C376-M385 PolarHBondContact SG-O 2.99Å; C376-M385 VanDerWaalsContact SG-O 3.41Å; M385-E388 PolarHBondContact N-OE1 2.94Å; M385-E388 PolarHBondContact N-OE2 2.88Å; M385-E388 VanDerWaalsContact N-OE2 3.13Å
386	L	85.2	Confident	75.1	Confident	24 Å²	24	67.3 Å²	67.3	13%	0.126	41%	0.405	C	S	.	.	S	Bend	trans	-113.3	15.5	176.9	-58.9	173.1	0	0	0	111.1	K359 V362 G384 E388	K359-L386 HydrophobicContact CB-CD1 3.87Å; K359-L386 HydrophobicContact CD-CD1 3.91Å; K359-L386 HydrophobicContact CG-CD1 4.45Å; V362-L386 PolarHBondContact N-O 2.86Å; G384-L386 VanDerWaalsContact C-N 3.33Å; L386-E388 VanDerWaalsContact C-N 3.25Å; L386-E388 VanDerWaalsContact C-OE2 3.25Å; L386-E388 VanDerWaalsContact CA-OE2 3.29Å; L386-E388 WeakPolarHBondContact CA-OE2 3.37Å; L386-E388 PolarHBondContact N-OE2 3.5Å; L386-E388 PolarHBondContact O-N 3.21Å
387	C	87.2	Confident	73.5	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	44%	0.435	C	S	.	.	S	Bend	trans	58.4	36.6	-174.6	-50.6	0	0	0	0	113.5	N363 C376 C378 A383	N363-C387 VanDerWaalsContact C-CB 3.45Å; N363-C387 HydrophobicContact CB-CB 4.16Å; N363-C387 WeakPolarHBondContact CB-O 3.01Å; N363-C387 PolarHBondContact N-O 3.32Å; N363-C387 PolarHBondContact ND2-O 3Å; N363-C387 WeakPolarHBondContact O-CB 2.96Å; C376-C387 WeakPolarHBondContact CB-SG 3.45Å; C378-C387 WeakPolarHBondContact CA-SG 3.32Å; C378-C387 HydrophobicContact CB-CB 3.71Å; C378-C387 WeakPolarHBondContact CB-SG 3.34Å; C378-C387 PolarHBondContact N-SG 3.24Å; C378-C387 WeakPolarHBondContact SG-CA 3.44Å; C378-C387 WeakPolarHBondContact SG-CB 3.19Å; C378-C387 CovalentContact SG-SG 2.03Å; C378-C387 PolarHBondContact SG-SG 3.24Å; A383-C387 CarbonylContact O-C 3.49Å; A383-C387 VanDerWaalsContact O-C 3.26Å; A383-C387 WeakPolarHBondContact O-CA 3.27Å
388	E	84.7	Confident	72.1	Confident	93 Å²	93	75 Å²	75	44%	0.435	44%	0.443	S	S	.	.			trans	-83.1	-10.9	-177.9	71.8	-79	-171.6	0	0	114.5	A383 G384 M385 L386	A383-E388 PolarHBondContact O-N 2.84Å; G384-E388 VanDerWaalsContact C-OE2 3.3Å; G384-E388 WeakPolarHBondContact CA-OE1 3.43Å; G384-E388 WeakPolarHBondContact CA-OE2 3.44Å; M385-E388 PolarHBondContact N-OE1 2.94Å; M385-E388 PolarHBondContact N-OE2 2.88Å; M385-E388 VanDerWaalsContact N-OE2 3.13Å; L386-E388 VanDerWaalsContact C-N 3.25Å; L386-E388 VanDerWaalsContact C-OE2 3.25Å; L386-E388 VanDerWaalsContact CA-OE2 3.29Å; L386-E388 WeakPolarHBondContact CA-OE2 3.37Å; L386-E388 PolarHBondContact N-OE2 3.5Å; L386-E388 PolarHBondContact O-N 3.21Å
389	M	79.1	Confident	70.5	Confident	105 Å²	105	82.7 Å²	82.7	52%	0.517	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	137.3	-177.1	-46.5	178.7	-174.1	0	0	110.7	Y382 A383	Y382-M389 CarbonylContact C-O 3.13Å; Y382-M389 VanDerWaalsContact CA-O 3.26Å; Y382-M389 WeakPolarHBondContact CA-O 3.37Å; A383-M389 HydrophobicContact CB-CB 4.46Å; A383-M389 PolarHBondContact N-O 2.74Å; A383-M389 WeakPolarHBondContact O-CA 3.46Å; A383-M389 WeakPolarHBondContact O-CB 3.33Å; A383-M389 PolarHBondContact O-N 3.13Å
390	E	78.8	Confident	69.2	Low	156 Å²	156	83.8 Å²	83.8	73%	0.729	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	122.5	173.5	-164.8	179.7	162.4	0	0	110.6	G381 Y382 G392	G381-E390 CarbonylContact O-C 3.47Å; Y382-E390 HydrophobicContact CD1-CB 4.4Å; Y382-E390 HydrophobicContact CD1-CG 4.49Å; Y382-E390 HydrophobicContact CE1-CB 4.25Å; Y382-E390 HydrophobicContact CE1-CG 4.1Å; E390-G392 PolarHBondContact O-N 2.68Å
391	L	62	Low	68.5	Low	69 Å²	69	81.9 Å²	81.9	36%	0.361	47%	0.468	S	S	.	.			trans	-87.7	101.1	172.9	-70.5	-178.6	0	0	0	110.1	G381 A383 G393	G381-L391 PolarHBondContact O-N 3.21Å; A383-L391 HydrophobicContact CB-CD1 3.82Å; A383-L391 HydrophobicContact CB-CD2 3.82Å; A383-L391 HydrophobicContact CB-CG 3.62Å; L391-G393 PolarHBondContact O-N 2.81Å
392	G	60.7	Low	67.7	Low	60 Å²	60	84 Å²	84	62%	0.619	48%	0.479	S	S	*	.			trans	-47.8	137.7	170.7	0	0	0	0	0	112.5	E390 A394	E390-G392 PolarHBondContact O-N 2.68Å; G392-A394 PolarHBondContact O-N 2.72Å
393	G	54.4	Low	66.8	Low	78 Å²	78	83 Å²	83	80%	0.804	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	13.8	-153.8	0	0	0	0	0	120.2	L391	L391-G393 PolarHBondContact O-N 2.81Å
394	A	54.6	Low	66.5	Low	85 Å²	85	87 Å²	87	70%	0.702	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-33.3	174.2	0	0	0	0	0	113.4	G392 A396	G392-A394 PolarHBondContact O-N 2.72Å; A394-A396 PolarHBondContact O-N 3.32Å
395	A	48.5	Very low	66.3	Low	50 Å²	50	90.4 Å²	90.4	41%	0.413	51%	0.513	S	S	.	.	S	Bend	trans	-73.9	-28.7	-168.6	0	0	0	0	0	114.7
396	A	50.9	Low	65.9	Low	36 Å²	36	89.2 Å²	89.2	30%	0.298	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-42.8	-171.2	0	0	0	0	0	113.5	Q380 A394 V398 R399	Q380-A396 HydrophobicContact CG-CB 3.97Å; A394-A396 PolarHBondContact O-N 3.32Å; A396-V398 PolarHBondContact O-N 3.45Å; A396-V398 VanDerWaalsContact O-N 3.15Å; A396-R399 PolarHBondContact O-N 2.93Å
397	K	54.2	Low	65.5	Low	167 Å²	167	91.5 Å²	91.5	73%	0.726	53%	0.53	S	S	*	.	H	α-helix	trans	-64.7	-18.1	-175.3	-93.4	-174	172.1	-179	0	115.2
398	V	58.7	Low	65.2	Low	102 Å²	102	95.6 Å²	95.6	62%	0.618	56%	0.555	S	S	*	*	H	α-helix	trans	-80.8	-27.5	-173.9	-175.1	0	0	0	0	112.2	A396	A396-V398 PolarHBondContact O-N 3.45Å; A396-V398 VanDerWaalsContact O-N 3.15Å
399	R	53.9	Low	65	Low	201 Å²	201	95.7 Å²	95.7	76%	0.758	56%	0.557	S	S	*	*	H	α-helix	trans	-79.6	-31.3	-176.1	-72.1	-176.4	177.3	159.5	0.4	114.2	A396 S402	A396-R399 PolarHBondContact O-N 2.93Å; R399-S402 PolarHBondContact O-OG 3.43Å; R399-S402 VanDerWaalsContact O-OG 3.08Å
400	E	57.8	Low	65.1	Low	125 Å²	125	95.9 Å²	95.9	58%	0.584	56%	0.559	S	S	*	*	H	α-helix	trans	-68.3	-40.2	178.6	-66.1	-179.8	147.8	0	0	111.7	S402	E400-S402 PolarHBondContact O-N 2.94Å
401	L	62.9	Low	65.3	Low	113 Å²	113	92.8 Å²	92.8	59%	0.592	55%	0.551	S	S	*	*	H	α-helix	trans	-64.5	-36.1	-179.1	-76.6	164.3	0	0	0	113.2	I405	L401-I405 WeakPolarHBondContact O-CD1 3.45Å; L401-I405 WeakPolarHBondContact O-CG1 3.23Å; L401-I405 PolarHBondContact O-N 3.36Å
402	S	62.6	Low	66.5	Low	66 Å²	66	93.5 Å²	93.5	46%	0.462	56%	0.558	S	S	.	*	H	α-helix	trans	-72	-30.1	-176.1	58.5	0	0	0	0	114	R399 E400 T406	R399-S402 PolarHBondContact O-OG 3.43Å; R399-S402 VanDerWaalsContact O-OG 3.08Å; E400-S402 PolarHBondContact O-N 2.94Å; S402-T406 PolarHBondContact O-N 2.87Å; S402-T406 PolarHBondContact O-OG1 2.95Å
403	A	63.8	Low	67.6	Low	54 Å²	54	93.8 Å²	93.8	45%	0.446	55%	0.55	S	S	.	.	H	α-helix	trans	-72.6	-36.1	178.3	0	0	0	0	0	112.7	T406 S407	A403-T406 PolarHBondContact O-OG1 2.96Å; A403-S407 WeakPolarHBondContact O-CB 3.04Å; A403-S407 PolarHBondContact O-N 3.02Å; A403-S407 PolarHBondContact O-OG 2.91Å
404	I	73.9	Confident	69.1	Low	111 Å²	111	93.5 Å²	93.5	57%	0.569	53%	0.533	S	S	*	.	H	α-helix	trans	-66.2	-47.2	175.8	-61.5	171.2	0	0	0	109.7	T406 S407 V408	I404-T406 PolarHBondContact O-N 2.93Å; I404-S407 PolarHBondContact O-N 3.09Å; I404-V408 WeakPolarHBondContact O-CG2 3.33Å; I404-V408 PolarHBondContact O-N 2.9Å
405	I	75.7	Confident	70.6	Confident	99 Å²	99	93 Å²	93	51%	0.508	52%	0.521	S	S	.	.	H	α-helix	trans	-61.7	-46.7	-178.3	-67.2	166.6	0	0	0	111.6	L401 S407 V408 I409	L401-I405 WeakPolarHBondContact O-CD1 3.45Å; L401-I405 WeakPolarHBondContact O-CG1 3.23Å; L401-I405 PolarHBondContact O-N 3.36Å; I405-S407 PolarHBondContact O-N 2.74Å; I405-V408 PolarHBondContact O-N 3.07Å; I405-I409 HydrophobicContact CG2-CD1 3.86Å; I405-I409 WeakPolarHBondContact O-CG1 3.47Å; I405-I409 PolarHBondContact O-N 2.86Å; I405-I409 VanDerWaalsContact O-N 3.14Å
406	T	74.2	Confident	72.5	Confident	79 Å²	79	94.9 Å²	94.9	49%	0.485	53%	0.527	S	S	.	.	H	α-helix	trans	-65.2	-39.2	178.8	41.3	0	0	0	0	112.4	S402 A403 I404 V408 I409 I410	S402-T406 PolarHBondContact O-N 2.87Å; S402-T406 PolarHBondContact O-OG1 2.95Å; A403-T406 PolarHBondContact O-OG1 2.96Å; I404-T406 PolarHBondContact O-N 2.93Å; T406-V408 PolarHBondContact O-N 2.66Å; T406-I409 PolarHBondContact O-N 3.43Å; T406-I410 WeakPolarHBondContact O-CG1 3.36Å; T406-I410 PolarHBondContact O-N 2.92Å; T406-I410 VanDerWaalsContact O-N 3.12Å
407	S	76.2	Confident	74.2	Confident	72 Å²	72	98.5 Å²	98.5	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-62.3	-42.8	177.3	-59.7	0	0	0	0	112.3	A403 I404 I405 I410 V411	A403-S407 WeakPolarHBondContact O-CB 3.04Å; A403-S407 PolarHBondContact O-N 3.02Å; A403-S407 PolarHBondContact O-OG 2.91Å; I404-S407 PolarHBondContact O-N 3.09Å; I405-S407 PolarHBondContact O-N 2.74Å; S407-I410 PolarHBondContact O-N 2.58Å; S407-V411 WeakPolarHBondContact O-CG2 3.45Å; S407-V411 PolarHBondContact O-N 3.28Å
408	V	80.9	Confident	75.7	Confident	87 Å²	87	94.8 Å²	94.8	53%	0.527	53%	0.532	S	S	.	.	H	α-helix	trans	-63.9	-43.1	176.2	171.3	0	0	0	0	111.6	I404 I405 T406 I410 V411 V412	I404-V408 WeakPolarHBondContact O-CG2 3.33Å; I404-V408 PolarHBondContact O-N 2.9Å; I405-V408 PolarHBondContact O-N 3.07Å; T406-V408 PolarHBondContact O-N 2.66Å; V408-I410 PolarHBondContact O-N 3.2Å; V408-V411 PolarHBondContact O-N 3.17Å; V408-V412 WeakPolarHBondContact O-CG2 3.33Å; V408-V412 PolarHBondContact O-N 2.89Å
409	I	81.6	Confident	77.1	Confident	94 Å²	94	94.9 Å²	94.9	48%	0.482	53%	0.529	S	S	.	.	H	α-helix	trans	-61.1	-44	179.1	-68.9	165.9	0	0	0	111.2	I405 T406 V411 V412 C413	I405-I409 HydrophobicContact CG2-CD1 3.86Å; I405-I409 WeakPolarHBondContact O-CG1 3.47Å; I405-I409 PolarHBondContact O-N 2.86Å; I405-I409 VanDerWaalsContact O-N 3.14Å; T406-I409 PolarHBondContact O-N 3.43Å; I409-V411 PolarHBondContact O-N 3.5Å; I409-V412 PolarHBondContact O-N 3.35Å; I409-C413 PolarHBondContact O-N 2.76Å; I409-C413 PolarHBondContact O-SG 2.79Å; I409-C413 VanDerWaalsContact O-SG 3.4Å
410	I	80.5	Confident	78.5	Confident	109 Å²	109	88 Å²	88	56%	0.559	51%	0.514	S	S	*	.	H	α-helix	trans	-62.4	-41.8	179.6	-67.7	165.2	0	0	0	111.5	T406 S407 V408 C413 T414	T406-I410 WeakPolarHBondContact O-CG1 3.36Å; T406-I410 PolarHBondContact O-N 2.92Å; T406-I410 VanDerWaalsContact O-N 3.12Å; S407-I410 PolarHBondContact O-N 2.58Å; V408-I410 PolarHBondContact O-N 3.2Å; I410-C413 PolarHBondContact O-N 3.02Å; I410-T414 WeakPolarHBondContact O-CB 3.36Å; I410-T414 WeakPolarHBondContact O-CG2 3.1Å; I410-T414 PolarHBondContact O-N 3.3Å; I410-T414 PolarHBondContact O-OG1 3.22Å
411	V	84.3	Confident	79.9	Confident	91 Å²	91	87 Å²	87	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-64.3	-43	176.5	174.2	0	0	0	0	111.3	S407 V408 I409 T414 V415	S407-V411 WeakPolarHBondContact O-CG2 3.45Å; S407-V411 PolarHBondContact O-N 3.28Å; V408-V411 PolarHBondContact O-N 3.17Å; I409-V411 PolarHBondContact O-N 3.5Å; V411-T414 PolarHBondContact O-OG1 3.16Å; V411-T414 VanDerWaalsContact O-OG1 3.08Å; V411-V415 WeakPolarHBondContact O-CG2 3.49Å; V411-V415 PolarHBondContact O-N 2.86Å; V411-V415 VanDerWaalsContact O-N 3.14Å
412	V	85.9	Confident	80.8	Confident	85 Å²	85	84.3 Å²	84.3	52%	0.515	50%	0.503	S	S	.	.	H	α-helix	trans	-63.8	-47.3	177.2	173.3	0	0	0	0	111.3	V408 I409 T414 V415 V416	V408-V412 WeakPolarHBondContact O-CG2 3.33Å; V408-V412 PolarHBondContact O-N 2.89Å; I409-V412 PolarHBondContact O-N 3.35Å; V412-T414 PolarHBondContact O-N 2.93Å; V412-V415 PolarHBondContact O-N 2.78Å; V412-V416 WeakPolarHBondContact O-CG2 3.38Å; V412-V416 PolarHBondContact O-N 3.01Å
413	C	84.9	Confident	81.9	Confident	65 Å²	65	85.4 Å²	85.4	44%	0.439	51%	0.507	S	S	.	.	H	α-helix	trans	-63.1	-40	179.9	-70.3	0	0	0	0	112.9	I409 I410 V416 L417	I409-C413 PolarHBondContact O-N 2.76Å; I409-C413 PolarHBondContact O-SG 2.79Å; I409-C413 VanDerWaalsContact O-SG 3.4Å; I410-C413 PolarHBondContact O-N 3.02Å; C413-V416 PolarHBondContact O-N 2.88Å; C413-L417 WeakPolarHBondContact O-CB 3.47Å; C413-L417 WeakPolarHBondContact O-CG 3.17Å; C413-L417 PolarHBondContact O-N 3.27Å
414	T	85.1	Confident	82.7	Confident	73 Å²	73	88.2 Å²	88.2	45%	0.448	51%	0.509	S	S	.	.	H	α-helix	trans	-69.3	-36	179	47.3	0	0	0	0	112.9	I410 V411 V412 T418	I410-T414 WeakPolarHBondContact O-CB 3.36Å; I410-T414 WeakPolarHBondContact O-CG2 3.1Å; I410-T414 PolarHBondContact O-N 3.3Å; I410-T414 PolarHBondContact O-OG1 3.22Å; V411-T414 PolarHBondContact O-OG1 3.16Å; V411-T414 VanDerWaalsContact O-OG1 3.08Å; V412-T414 PolarHBondContact O-N 2.93Å; T414-T418 WeakPolarHBondContact O-CB 3.46Å; T414-T418 WeakPolarHBondContact O-CG2 3.04Å; T414-T418 PolarHBondContact O-N 3.37Å; T414-T418 PolarHBondContact O-OG1 3.48Å
415	V	86.8	Confident	83.1	Confident	75 Å²	75	87.3 Å²	87.3	46%	0.455	51%	0.505	S	S	.	.	H	α-helix	trans	-65.5	-42.8	172	172	0	0	0	0	111.4	V411 V412 T418 L419	V411-V415 WeakPolarHBondContact O-CG2 3.49Å; V411-V415 PolarHBondContact O-N 2.86Å; V411-V415 VanDerWaalsContact O-N 3.14Å; V412-V415 PolarHBondContact O-N 2.78Å; V415-T418 PolarHBondContact O-OG1 3.36Å; V415-T418 VanDerWaalsContact O-OG1 3.08Å; V415-L419 HydrophobicContact CG1-CD1 3.99Å; V415-L419 WeakPolarHBondContact O-CB 3.37Å; V415-L419 VanDerWaalsContact O-CG 3.3Å; V415-L419 WeakPolarHBondContact O-CG 3.25Å; V415-L419 PolarHBondContact O-N 2.03Å; V415-L419 VanDerWaalsContact O-N 3.1Å
416	V	87.1	Confident	83.4	Confident	88 Å²	88	89.3 Å²	89.3	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-64.4	-43.9	177.8	171.9	0	0	0	0	111.8	V412 C413 L419 A420	V412-V416 WeakPolarHBondContact O-CG2 3.38Å; V412-V416 PolarHBondContact O-N 3.01Å; C413-V416 PolarHBondContact O-N 2.88Å; V416-L419 PolarHBondContact O-N 2.85Å; V416-A420 WeakPolarHBondContact O-CB 3.42Å; V416-A420 PolarHBondContact O-N 3.28Å
417	L	88	Confident	83.7	Confident	112 Å²	112	93.2 Å²	93.2	59%	0.586	52%	0.52	S	S	*	.	H	α-helix	trans	-66.3	-40.5	179.4	-73.3	169.1	0	0	0	113	C413 A420 L421	C413-L417 WeakPolarHBondContact O-CB 3.47Å; C413-L417 WeakPolarHBondContact O-CG 3.17Å; C413-L417 PolarHBondContact O-N 3.27Å; L417-A420 PolarHBondContact O-N 2.64Å; L417-L421 WeakPolarHBondContact O-CB 3.22Å; L417-L421 PolarHBondContact O-N 3.14Å
418	T	85.3	Confident	83.7	Confident	89 Å²	89	97.1 Å²	97.1	55%	0.546	52%	0.524	S	S	.	.	H	α-helix	trans	-68.4	-38.1	177.9	47.2	0	0	0	0	112.2	T414 V415 S422	T414-T418 WeakPolarHBondContact O-CB 3.46Å; T414-T418 WeakPolarHBondContact O-CG2 3.04Å; T414-T418 PolarHBondContact O-N 3.37Å; T414-T418 PolarHBondContact O-OG1 3.48Å; V415-T418 PolarHBondContact O-OG1 3.36Å; V415-T418 VanDerWaalsContact O-OG1 3.08Å; T418-S422 PolarHBondContact O-N 3.33Å
419	L	86.8	Confident	83.6	Confident	105 Å²	105	97.5 Å²	97.5	55%	0.55	52%	0.522	S	S	.	.	H	α-helix	trans	-62.4	-47.5	171.1	-72.2	171.2	0	0	0	111.7	V415 V416 L421 S422 V423	V415-L419 HydrophobicContact CG1-CD1 3.99Å; V415-L419 WeakPolarHBondContact O-CB 3.37Å; V415-L419 VanDerWaalsContact O-CG 3.3Å; V415-L419 WeakPolarHBondContact O-CG 3.25Å; V415-L419 PolarHBondContact O-N 2.03Å; V415-L419 VanDerWaalsContact O-N 3.1Å; V416-L419 PolarHBondContact O-N 2.85Å; L419-L421 PolarHBondContact O-N 2.89Å; L419-S422 PolarHBondContact O-N 2.85Å; L419-S422 VanDerWaalsContact O-N 3.14Å; L419-S422 PolarHBondContact O-OG 3.44Å; L419-V423 PolarHBondContact O-N 2.84Å; L419-V423 VanDerWaalsContact O-N 3.14Å
420	A	84.6	Confident	83.4	Confident	56 Å²	56	101.3 Å²	101.3	46%	0.463	53%	0.532	S	S	.	.	H	α-helix	trans	-59.1	-45.4	178.6	0	0	0	0	0	112.5	V416 L417 S422 V423 F424	V416-A420 WeakPolarHBondContact O-CB 3.42Å; V416-A420 PolarHBondContact O-N 3.28Å; L417-A420 PolarHBondContact O-N 2.64Å; A420-S422 VanDerWaalsContact C-N 3.34Å; A420-S422 PolarHBondContact O-N 2.95Å; A420-V423 PolarHBondContact O-N 3.25Å; A420-F424 PolarHBondContact O-N 3.04Å
421	L	86.4	Confident	82.9	Confident	105 Å²	105	99.1 Å²	99.1	55%	0.55	53%	0.53	S	S	.	.	H	α-helix	trans	-58.7	-43	173.5	-88.7	163.1	0	0	0	112.3	L417 L419 V423 F424 I425	L417-L421 WeakPolarHBondContact O-CB 3.22Å; L417-L421 PolarHBondContact O-N 3.14Å; L419-L421 PolarHBondContact O-N 2.89Å; L421-V423 VanDerWaalsContact C-N 3.3Å; L421-V423 PolarHBondContact O-N 2.86Å; L421-F424 PolarHBondContact O-N 3.3Å; L421-I425 WeakPolarHBondContact O-CB 3.32Å; L421-I425 VanDerWaalsContact O-CG1 3.3Å; L421-I425 WeakPolarHBondContact O-CG1 3.48Å; L421-I425 PolarHBondContact O-N 2.83Å
422	S	83.1	Confident	82.3	Confident	55 Å²	55	100.6 Å²	100.6	39%	0.385	53%	0.526	S	S	.	.	H	α-helix	trans	-63.1	-34.8	179.7	80	0	0	0	0	113.2	T418 L419 A420 K426	T418-S422 PolarHBondContact O-N 3.33Å; L419-S422 PolarHBondContact O-N 2.85Å; L419-S422 VanDerWaalsContact O-N 3.14Å; L419-S422 PolarHBondContact O-OG 3.44Å; A420-S422 VanDerWaalsContact C-N 3.34Å; A420-S422 PolarHBondContact O-N 2.95Å; S422-K426 WeakPolarHBondContact O-CG 3.46Å; S422-K426 PolarHBondContact O-N 3.46Å
423	V	85.5	Confident	81.6	Confident	90 Å²	90	103.6 Å²	103.6	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-73.4	-41.2	175.5	176	0	0	0	0	110.8	L419 A420 L421 K426 K427	L419-V423 PolarHBondContact O-N 2.84Å; L419-V423 VanDerWaalsContact O-N 3.14Å; A420-V423 PolarHBondContact O-N 3.25Å; L421-V423 VanDerWaalsContact C-N 3.3Å; L421-V423 PolarHBondContact O-N 2.86Å; V423-K426 PolarHBondContact O-N 3.42Å; V423-K427 PolarHBondContact O-N 3.38Å
424	F	80.9	Confident	80.7	Confident	113 Å²	113	106.4 Å²	106.4	50%	0.496	54%	0.54	S	S	.	.	H	α-helix	trans	-64.2	-46.8	178.6	-165	-89.6	0	0	0	111.8	A420 L421 K426 K427 W428 L461	A420-F424 PolarHBondContact O-N 3.04Å; L421-F424 PolarHBondContact O-N 3.3Å; F424-K426 VanDerWaalsContact C-N 3.33Å; F424-K426 PolarHBondContact O-N 2.91Å; F424-K427 PolarHBondContact O-N 3.32Å; F424-W428 WeakPolarHBondContact O-CB 3.5Å; F424-W428 PolarHBondContact O-N 2.85Å; F424-L461 HydrophobicContact CE2-CD1 4.23Å; F424-L461 HydrophobicContact CE2-CD2 4.12Å
425	I	81.4	Confident	79.4	Confident	92 Å²	92	106.9 Å²	106.9	47%	0.472	55%	0.547	S	S	.	.	H	α-helix	trans	-60.3	-42	176.9	-68	165.3	0	0	0	110.9	L421 W428 L429	L421-I425 WeakPolarHBondContact O-CB 3.32Å; L421-I425 VanDerWaalsContact O-CG1 3.3Å; L421-I425 WeakPolarHBondContact O-CG1 3.48Å; L421-I425 PolarHBondContact O-N 2.83Å; I425-W428 PolarHBondContact O-N 3.09Å; I425-L429 HydrophobicContact CG2-CD1 3.93Å; I425-L429 HydrophobicContact CG2-CG 4.44Å; I425-L429 WeakPolarHBondContact O-CB 3.31Å; I425-L429 WeakPolarHBondContact O-CG 3.43Å; I425-L429 PolarHBondContact O-N 3.29Å
426	K	81.4	Confident	77.8	Confident	141 Å²	141	107.6 Å²	107.6	61%	0.613	55%	0.547	S	S	*	.	H	α-helix	trans	-60.8	-49.3	174.4	-80.5	-177.5	175.7	-176	0	112.3	S422 V423 F424 W428 L429 Y430	S422-K426 WeakPolarHBondContact O-CG 3.46Å; S422-K426 PolarHBondContact O-N 3.46Å; V423-K426 PolarHBondContact O-N 3.42Å; F424-K426 VanDerWaalsContact C-N 3.33Å; F424-K426 PolarHBondContact O-N 2.91Å; K426-W428 VanDerWaalsContact C-N 3.32Å; K426-W428 PolarHBondContact O-N 3.46Å; K426-L429 PolarHBondContact O-N 3.43Å; K426-Y430 VanDerWaalsContact O-CD2 3.24Å; K426-Y430 WeakPolarHBondContact O-CD2 3.46Å; K426-Y430 PolarHBondContact O-N 2.83Å; K426-Y430 VanDerWaalsContact O-N 3.12Å
427	K	80.6	Confident	76.4	Confident	161 Å²	161	110.7 Å²	110.7	70%	0.7	55%	0.551	S	S	*	*	H	α-helix	trans	-60.1	-41.3	177.2	-88.1	-163.1	169.2	-167.4	0	112.3	V423 F424 Y430 A431	V423-K427 PolarHBondContact O-N 3.38Å; F424-K427 PolarHBondContact O-N 3.32Å; K427-Y430 PolarHBondContact O-N 3.43Å; K427-A431 PolarHBondContact O-N 3.13Å; K427-A431 VanDerWaalsContact O-N 3.09Å
428	W	77.1	Confident	74.4	Confident	153 Å²	153	111 Å²	111	58%	0.58	56%	0.559	S	S	*	*	H	α-helix	trans	-65.7	-41.8	179.4	-168.2	85.5	0	0	0	112.1	F424 I425 K426 A431 Y432	F424-W428 WeakPolarHBondContact O-CB 3.5Å; F424-W428 PolarHBondContact O-N 2.85Å; I425-W428 PolarHBondContact O-N 3.09Å; K426-W428 VanDerWaalsContact C-N 3.32Å; K426-W428 PolarHBondContact O-N 3.46Å; W428-A431 PolarHBondContact O-N 3.47Å; W428-Y432 HydrophobicContact CH2-CD2 4.44Å; W428-Y432 WeakPolarHBondContact O-CB 3.36Å; W428-Y432 PolarHBondContact O-N 3.47Å
429	L	78.6	Confident	72.7	Confident	95 Å²	95	113.1 Å²	113.1	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-63.8	-39.6	175.5	-74.9	169.8	0	0	0	113.1	I425 K426 Y432 Y433	I425-L429 HydrophobicContact CG2-CD1 3.93Å; I425-L429 HydrophobicContact CG2-CG 4.44Å; I425-L429 WeakPolarHBondContact O-CB 3.31Å; I425-L429 WeakPolarHBondContact O-CG 3.43Å; I425-L429 PolarHBondContact O-N 3.29Å; K426-L429 PolarHBondContact O-N 3.43Å; L429-Y432 PolarHBondContact O-N 3.36Å; L429-Y433 PolarHBondContact O-N 2.78Å
430	Y	77.1	Confident	70.5	Confident	175 Å²	175	117.8 Å²	117.8	69%	0.686	59%	0.591	S	S	*	*	H	α-helix	trans	-63.1	-50.2	173.9	-82.7	-68.4	0	0	0	111.7	K426 K427 Y432 Y433 D434	K426-Y430 VanDerWaalsContact O-CD2 3.24Å; K426-Y430 WeakPolarHBondContact O-CD2 3.46Å; K426-Y430 PolarHBondContact O-N 2.83Å; K426-Y430 VanDerWaalsContact O-N 3.12Å; K427-Y430 PolarHBondContact O-N 3.43Å; Y430-Y432 VanDerWaalsContact C-N 3.27Å; Y430-Y432 PolarHBondContact O-N 3.38Å; Y430-Y433 PolarHBondContact O-N 2.97Å; Y430-D434 PolarHBondContact O-N 3.41Å; Y430-D434 VanDerWaalsContact O-N 3.09Å
431	A	70.8	Confident	68.6	Low	62 Å²	62	119.8 Å²	119.8	51%	0.512	61%	0.608	S	S	.	*	H	α-helix	trans	-61.7	-34.5	178.8	0	0	0	0	0	113	K427 W428 S435	K427-A431 PolarHBondContact O-N 3.13Å; K427-A431 VanDerWaalsContact O-N 3.09Å; W428-A431 PolarHBondContact O-N 3.47Å; A431-S435 PolarHBondContact O-N 3.16Å
432	Y	71.8	Confident	66.3	Low	122 Å²	122	118.2 Å²	118.2	48%	0.478	62%	0.617	S	S	.	*	H	α-helix	trans	-66.9	-39	173.4	-175.4	-107.4	0	0	0	112.1	W428 L429 Y430 S435 L436	W428-Y432 HydrophobicContact CH2-CD2 4.44Å; W428-Y432 WeakPolarHBondContact O-CB 3.36Å; W428-Y432 PolarHBondContact O-N 3.47Å; L429-Y432 PolarHBondContact O-N 3.36Å; Y430-Y432 VanDerWaalsContact C-N 3.27Å; Y430-Y432 PolarHBondContact O-N 3.38Å; Y432-S435 PolarHBondContact O-N 3.2Å; Y432-S435 PolarHBondContact O-OG 2.96Å; Y432-L436 HydrophobicContact CD1-CD1 4.05Å; Y432-L436 HydrophobicContact CE1-CD1 3.59Å
433	Y	69.8	Low	64.1	Low	148 Å²	148	121.4 Å²	121.4	58%	0.58	64%	0.636	S	S	*	*	H	α-helix	trans	-68.9	-41.5	-179.9	-146.3	-80.4	0	0	0	112.6	L429 Y430 S435 L436 Y437	L429-Y433 PolarHBondContact O-N 2.78Å; Y430-Y433 PolarHBondContact O-N 2.97Å; Y433-S435 VanDerWaalsContact C-N 3.27Å; Y433-S435 PolarHBondContact O-N 3.07Å; Y433-L436 PolarHBondContact O-N 3.43Å; Y433-Y437 HydrophobicContact CD1-CD2 4.11Å; Y433-Y437 HydrophobicContact CD1-CE2 4.33Å; Y433-Y437 AromaticContact CE1-CD2 3.85Å; Y433-Y437 HydrophobicContact CE1-CD2 3.85Å; Y433-Y437 AromaticContact CE1-CE2 3.73Å; Y433-Y437 HydrophobicContact CE1-CE2 3.73Å
434	D	66	Low	61.9	Low	124 Å²	124	126.7 Å²	126.7	66%	0.663	66%	0.655	S	S	*	*	H	α-helix	trans	-61.9	-36.4	174.2	-72.3	-17.9	0	0	0	111.5	Y430 L436 Y437	Y430-D434 PolarHBondContact O-N 3.41Å; Y430-D434 VanDerWaalsContact O-N 3.09Å; D434-L436 PolarHBondContact O-N 3.43Å; D434-L436 VanDerWaalsContact O-N 3.16Å; D434-Y437 PolarHBondContact O-N 3.42Å
435	S	57.8	Low	59.7	Low	84 Å²	84	125 Å²	125	59%	0.587	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-14.8	178.2	79.3	0	0	0	0	114.7	A431 Y432 Y433	A431-S435 PolarHBondContact O-N 3.16Å; Y432-S435 PolarHBondContact O-N 3.2Å; Y432-S435 PolarHBondContact O-OG 2.96Å; Y433-S435 VanDerWaalsContact C-N 3.27Å; Y433-S435 PolarHBondContact O-N 3.07Å
436	L	54.6	Low	57.5	Low	90 Å²	90	124.3 Å²	124.3	47%	0.471	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95	-14.1	-179.5	-86.4	158.6	0	0	0	114.1	Y432 Y433 D434	Y432-L436 HydrophobicContact CD1-CD1 4.05Å; Y432-L436 HydrophobicContact CE1-CD1 3.59Å; Y433-L436 PolarHBondContact O-N 3.43Å; D434-L436 PolarHBondContact O-N 3.43Å; D434-L436 VanDerWaalsContact O-N 3.16Å
437	Y	57.8	Low	55.4	Low	153 Å²	153	125.4 Å²	125.4	60%	0.6	69%	0.69	S	S	*	*			trans	-139.5	70	-175.4	-63.5	-78.3	0	0	0	112.5	Y433 D434 T439	Y433-Y437 HydrophobicContact CD1-CD2 4.11Å; Y433-Y437 HydrophobicContact CD1-CE2 4.33Å; Y433-Y437 AromaticContact CE1-CD2 3.85Å; Y433-Y437 HydrophobicContact CE1-CD2 3.85Å; Y433-Y437 AromaticContact CE1-CE2 3.73Å; Y433-Y437 HydrophobicContact CE1-CE2 3.73Å; D434-Y437 PolarHBondContact O-N 3.42Å; Y437-T439 PolarHBondContact O-N 3.43Å
438	P	44.2	Very low	53.5	Low	118 Å²	118	122.4 Å²	122.4	77%	0.766	69%	0.689	S	S	*	*			trans	-69.2	101.9	177.9	29	-34.6	0	0	0	111.4
439	T	50.2	Low	51.8	Low	134 Å²	134	123.1 Å²	123.1	82%	0.822	70%	0.699	S	S	*	*			trans	-76	135.4	172.1	51	0	0	0	0	111.4	Y437 A441	Y437-T439 PolarHBondContact O-N 3.43Å; T439-A441 PolarHBondContact O-N 3.43Å
440	E	41.6	Very low	49.9	Very low	202 Å²	202	126.2 Å²	126.2	94%	0.944	72%	0.715	S	S	*	*			trans	-68.3	112	-170	-56.7	176.4	140.4	0	0	114
441	A	43.1	Very low	48.1	Very low	98 Å²	98	125 Å²	125	81%	0.81	72%	0.719	S	S	*	*			trans	-160.9	128.5	158.4	0	0	0	0	0	113	T439	T439-A441 PolarHBondContact O-N 3.43Å
442	G	38.6	Very low	46.3	Very low	72 Å²	72	125.2 Å²	125.2	74%	0.742	73%	0.726	S	S	*	*			trans	43.5	112.6	148.2	0	0	0	0	0	121.2
443	P	38	Very low	44.6	Very low	122 Å²	122	128.4 Å²	128.4	79%	0.792	75%	0.746	S	S	*	*	S	Bend	trans	-69.9	168.4	156.1	34.1	-35.2	0	0	0	111.3
444	E	37.6	Very low	43	Very low	201 Å²	201	125.8 Å²	125.8	94%	0.939	75%	0.749	S	S	*	*	S	Bend	trans	69.7	98.1	178.2	-55	-175.7	-167.3	0	0	115.8
445	G	34.7	Very low	41.8	Very low	79 Å²	79	130.9 Å²	130.9	81%	0.814	76%	0.759	S	S	*	*	S	Bend	trans	135	42	161.8	0	0	0	0	0	119
446	A	36.8	Very low	41.3	Very low	77 Å²	77	132.5 Å²	132.5	64%	0.636	76%	0.761	S	S	*	*			trans	-138.2	-6.5	179.6	0	0	0	0	0	117.2	S448	A446-S448 PolarHBondContact O-N 3.11Å
447	L	36.7	Very low	40.8	Very low	164 Å²	164	129.8 Å²	129.8	86%	0.859	76%	0.755	S	S	*	*	S	Bend	trans	-85.6	-4	-173	-154.8	68.2	0	0	0	114.4
448	S	41.3	Very low	40.2	Very low	97 Å²	97	125.4 Å²	125.4	68%	0.678	75%	0.751	S	S	*	*	S	Bend	trans	-96.8	-17.4	-172.4	45.7	0	0	0	0	115.7	A446	A446-S448 PolarHBondContact O-N 3.11Å
449	E	41.6	Very low	40.5	Very low	169 Å²	169	128.3 Å²	128.3	79%	0.79	75%	0.746	S	S	*	*	S	Bend	trans	-99.7	-21.5	-174.6	-67.4	-169.6	125.6	0	0	114.3	I451 G452	E449-I451 PolarHBondContact O-N 3.36Å; E449-G452 PolarHBondContact O-N 3.09Å; E449-G452 VanDerWaalsContact O-N 3.16Å
450	L	37.1	Very low	40.7	Very low	159 Å²	159	128.8 Å²	128.8	83%	0.832	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	2.8	179.9	-80	165.9	0	0	0	115.1	G452	L450-G452 VanDerWaalsContact C-N 3.33Å
451	I	40.7	Very low	41.1	Very low	151 Å²	151	123.2 Å²	123.2	77%	0.774	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-7.8	173.3	-62	173.2	0	0	0	111	E449 E453	E449-I451 PolarHBondContact O-N 3.36Å; I451-E453 PolarHBondContact O-N 2.82Å
452	G	32.2	Very low	41.7	Very low	65 Å²	65	124.4 Å²	124.4	67%	0.67	71%	0.707	S	S	*	*	S	Bend	trans	-81	-7.3	-164.6	0	0	0	0	0	119.2	E449 L450	E449-G452 PolarHBondContact O-N 3.09Å; E449-G452 VanDerWaalsContact O-N 3.16Å; L450-G452 VanDerWaalsContact C-N 3.33Å
453	E	35.5	Very low	42.5	Very low	190 Å²	190	126.2 Å²	126.2	89%	0.888	70%	0.699	S	S	*	*	S	Bend	trans	-155.7	165.7	-177.4	-121.4	168.3	-154.4	0	0	115.4	I451	I451-E453 PolarHBondContact O-N 2.82Å
454	S	36.3	Very low	43.3	Very low	93 Å²	93	125.3 Å²	125.3	65%	0.65	69%	0.687	S	S	*	*			trans	66.5	58.4	179.8	-150.4	0	0	0	0	117.1	D456	S454-D456 PolarHBondContact O-N 3.3Å
455	R	41.7	Very low	44	Very low	231 Å²	231	122.1 Å²	122.1	87%	0.872	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-14.7	-178	-150.5	171.6	-170.8	170.4	3	115.9
456	D	47.6	Very low	44.9	Very low	117 Å²	117	125.6 Å²	125.6	63%	0.626	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	-30.7	-175.7	-64.7	-58.4	0	0	0	114.5	S454 A458 R459	S454-D456 PolarHBondContact O-N 3.3Å; D456-A458 PolarHBondContact O-N 2.05Å; D456-R459 WeakPolarHBondContact O-CB 3.33Å; D456-R459 PolarHBondContact O-N 3.33Å
457	G	44.4	Very low	45.7	Very low	34 Å²	34	127.4 Å²	127.4	35%	0.351	66%	0.662	S	S	.	*	H	α-helix	trans	-65.9	-40.1	-177.4	0	0	0	0	0	113.2	R459 Q460 L461	G457-R459 PolarHBondContact O-N 2.74Å; G457-Q460 PolarHBondContact O-N 3.03Å; G457-L461 PolarHBondContact O-N 2.91Å
458	A	44.8	Very low	46.3	Very low	61 Å²	61	126.6 Å²	126.6	50%	0.504	66%	0.658	S	S	.	*	H	α-helix	trans	-62.7	-29.7	176.6	0	0	0	0	0	112.7	D456 L461 L462	D456-A458 PolarHBondContact O-N 2.05Å; A458-L461 PolarHBondContact O-N 3.25Å; A458-L462 WeakPolarHBondContact O-CB 3.36Å; A458-L462 WeakPolarHBondContact O-CG 3.29Å; A458-L462 PolarHBondContact O-N 3.22Å
459	R	49.9	Very low	46.5	Very low	179 Å²	179	126.1 Å²	126.1	68%	0.675	65%	0.651	S	S	*	*	H	α-helix	trans	-67.3	-38.9	-179.9	-117.5	174	173.7	175.7	-3.9	112.5	D456 G457 L463	D456-R459 WeakPolarHBondContact O-CB 3.33Å; D456-R459 PolarHBondContact O-N 3.33Å; G457-R459 PolarHBondContact O-N 2.74Å; R459-L463 WeakPolarHBondContact O-CB 3.2Å; R459-L463 WeakPolarHBondContact O-CG 3.25Å; R459-L463 PolarHBondContact O-N 3.17Å
460	Q	53.8	Low	46.7	Very low	144 Å²	144	123.3 Å²	123.3	67%	0.673	64%	0.64	S	S	*	*	H	α-helix	trans	-73.5	-36.9	177.5	-69.3	-178.1	-23.3	0	0	112.2	G457 L463 L464	G457-Q460 PolarHBondContact O-N 3.03Å; Q460-L463 PolarHBondContact O-N 3.24Å; Q460-L464 PolarHBondContact O-N 2.79Å
461	L	50.2	Low	46.7	Very low	85 Å²	85	120.5 Å²	120.5	45%	0.445	63%	0.632	S	S	.	*	H	α-helix	trans	-69.5	-38.8	174.7	-104.6	157.4	0	0	0	112.5	F424 G457 A458 L464 F465	F424-L461 HydrophobicContact CE2-CD1 4.23Å; F424-L461 HydrophobicContact CE2-CD2 4.12Å; G457-L461 PolarHBondContact O-N 2.91Å; A458-L461 PolarHBondContact O-N 3.25Å; L461-L464 PolarHBondContact O-N 3.49Å; L461-F465 PolarHBondContact O-N 2.84Å
462	L	55.4	Low	46.4	Very low	123 Å²	123	122.2 Å²	122.2	64%	0.644	64%	0.637	S	S	*	*	H	α-helix	trans	-63	-41.1	170.7	-84.1	164.5	0	0	0	112	A458 F465 F466	A458-L462 WeakPolarHBondContact O-CB 3.36Å; A458-L462 WeakPolarHBondContact O-CG 3.29Å; A458-L462 PolarHBondContact O-N 3.22Å; L462-F465 PolarHBondContact O-N 2.79Å; L462-F466 WeakPolarHBondContact O-CB 3.45Å; L462-F466 PolarHBondContact O-N 2.9Å
463	L	57.1	Low	46.5	Very low	110 Å²	110	126.5 Å²	126.5	58%	0.576	64%	0.644	S	S	*	*	H	α-helix	trans	-62.7	-40.5	174.4	-82.6	164.6	0	0	0	112.6	R459 Q460 F466 L467	R459-L463 WeakPolarHBondContact O-CB 3.2Å; R459-L463 WeakPolarHBondContact O-CG 3.25Å; R459-L463 PolarHBondContact O-N 3.17Å; Q460-L463 PolarHBondContact O-N 3.24Å; L463-F466 PolarHBondContact O-N 3.23Å; L463-L467 WeakPolarHBondContact O-CB 3.28Å; L463-L467 VanDerWaalsContact O-CG 3.3Å; L463-L467 WeakPolarHBondContact O-CG 3.44Å; L463-L467 PolarHBondContact O-N 2.66Å
464	L	54.4	Low	46.4	Very low	102 Å²	102	126.5 Å²	126.5	53%	0.534	64%	0.643	S	S	.	*	H	α-helix	trans	-65.7	-39.7	174.9	-87	162.6	0	0	0	112.4	Q460 L461 L467 L468	Q460-L464 PolarHBondContact O-N 2.79Å; L461-L464 PolarHBondContact O-N 3.49Å; L464-L467 PolarHBondContact O-N 2.9Å; L464-L468 WeakPolarHBondContact O-CG 3.14Å; L464-L468 PolarHBondContact O-N 2.75Å; L464-L468 VanDerWaalsContact O-N 3.16Å
465	F	52.6	Low	46.6	Very low	134 Å²	134	127.4 Å²	127.4	59%	0.588	64%	0.64	S	S	*	*	H	α-helix	trans	-63.9	-46.4	171.3	-115.5	-88.6	0	0	0	111.3	L461 L462 L467 L468 T469	L461-F465 PolarHBondContact O-N 2.84Å; L462-F465 PolarHBondContact O-N 2.79Å; F465-L467 PolarHBondContact O-N 3.17Å; F465-L468 CarbonylContact O-C 3.54Å; F465-L468 PolarHBondContact O-N 2.87Å; F465-T469 HydrophobicContact CD1-CG2 3.9Å; F465-T469 HydrophobicContact CE1-CG2 4.33Å; F465-T469 PolarHBondContact O-N 2.03Å; F465-T469 PolarHBondContact O-OG1 2.99Å; F465-T469 VanDerWaalsContact O-OG1 3.1Å
466	F	53.4	Low	46.6	Very low	152 Å²	152	120.5 Å²	120.5	67%	0.667	63%	0.632	S	S	*	*	H	α-helix	trans	-61	-31.1	179.6	-145.5	-87.4	0	0	0	112.8	L462 L463 T469 L470	L462-F466 WeakPolarHBondContact O-CB 3.45Å; L462-F466 PolarHBondContact O-N 2.9Å; L463-F466 PolarHBondContact O-N 3.23Å; F466-T469 CarbonylContact O-C 3.49Å; F466-L470 WeakPolarHBondContact O-CG 3.32Å; F466-L470 PolarHBondContact O-N 2.68Å
467	L	53.6	Low	46.7	Very low	116 Å²	116	123.3 Å²	123.3	61%	0.607	63%	0.634	S	S	*	*	H	α-helix	trans	-77.5	-26.7	174	-73.1	167.8	0	0	0	113.6	L463 L464 F465 L470	L463-L467 WeakPolarHBondContact O-CB 3.28Å; L463-L467 VanDerWaalsContact O-CG 3.3Å; L463-L467 WeakPolarHBondContact O-CG 3.44Å; L463-L467 PolarHBondContact O-N 2.66Å; L464-L467 PolarHBondContact O-N 2.9Å; F465-L467 PolarHBondContact O-N 3.17Å; L467-L470 HydrophobicContact CD2-CD1 4.23Å
468	L	49.2	Very low	47.8	Very low	147 Å²	147	124.6 Å²	124.6	77%	0.77	64%	0.635	S	S	*	*	H	α-helix	trans	-91.4	-18.6	176.3	-70.4	170	0	0	0	113.2	L464 F465	L464-L468 WeakPolarHBondContact O-CG 3.14Å; L464-L468 PolarHBondContact O-N 2.75Å; L464-L468 VanDerWaalsContact O-N 3.16Å; F465-L468 CarbonylContact O-C 3.54Å; F465-L468 PolarHBondContact O-N 2.87Å
469	T	44.7	Very low	49.4	Very low	87 Å²	87	122.2 Å²	122.2	53%	0.534	61%	0.614	S	S	.	*	S	Bend	trans	-114.2	27.5	172.2	73.3	0	0	0	0	111.4	F465 F466 P471	F465-T469 HydrophobicContact CD1-CG2 3.9Å; F465-T469 HydrophobicContact CE1-CG2 4.33Å; F465-T469 PolarHBondContact O-N 2.03Å; F465-T469 PolarHBondContact O-OG1 2.99Å; F465-T469 VanDerWaalsContact O-OG1 3.1Å; F466-T469 CarbonylContact O-C 3.49Å; T469-P471 WeakPolarHBondContact O-CD 3.48Å
470	L	45.8	Very low	51	Low	109 Å²	109	113.7 Å²	113.7	57%	0.571	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-57.9	117.4	158.9	-94.2	168.8	0	0	0	106	F466 L467	F466-L470 WeakPolarHBondContact O-CG 3.32Å; F466-L470 PolarHBondContact O-N 2.68Å; L467-L470 HydrophobicContact CD2-CD1 4.23Å
471	P	37	Very low	52.7	Low	101 Å²	101	106.8 Å²	106.8	66%	0.656	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-60.1	150.5	171.8	27.7	-33.8	0	0	0	108.3	T469 L473	T469-P471 WeakPolarHBondContact O-CD 3.48Å; P471-L473 PolarHBondContact O-N 3.45Å
472	E	34.6	Very low	54.4	Low	186 Å²	186	102.8 Å²	102.8	87%	0.869	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-53.1	118.7	161.1	-68.7	-174.9	115.6	0	0	106.7	E474	E472-E474 PolarHBondContact O-N 2.66Å
473	L	35.3	Very low	55.8	Low	156 Å²	156	99.1 Å²	99.1	82%	0.817	51%	0.509	S	S	*	.			trans	-61.3	105.7	-172.8	-173.8	81.8	0	0	0	107.4	P471 I475	P471-L473 PolarHBondContact O-N 3.45Å; L473-I475 WeakPolarHBondContact O-CG1 3.49Å; L473-I475 PolarHBondContact O-N 2.88Å
474	E	32.5	Very low	57	Low	189 Å²	189	96.6 Å²	96.6	88%	0.883	49%	0.494	S	S	*	.			trans	-56.8	100.1	-175.8	-71.1	-173	144.9	0	0	109	E472 A476	E472-E474 PolarHBondContact O-N 2.66Å; E474-A476 PolarHBondContact O-N 2.94Å
475	I	40.5	Very low	58.2	Low	112 Å²	112	92.8 Å²	92.8	57%	0.574	47%	0.474	S	S	*	.			trans	-71.6	106.9	-179.4	-57.7	-175.3	0	0	0	105.7	L473 W477 T478	L473-I475 WeakPolarHBondContact O-CG1 3.49Å; L473-I475 PolarHBondContact O-N 2.88Å; I475-W477 PolarHBondContact O-N 3.44Å; I475-T478 HydrophobicContact CG2-CG2 3.81Å
476	A	41.9	Very low	59	Low	86 Å²	86	92.5 Å²	92.5	71%	0.711	49%	0.485	S	S	*	.			trans	-44.7	130.5	177.3	0	0	0	0	0	110.6	E474 T478	E474-A476 PolarHBondContact O-N 2.94Å; A476-T478 PolarHBondContact O-N 3.49Å
477	W	48.4	Very low	59.9	Low	177 Å²	177	92.8 Å²	92.8	67%	0.67	49%	0.486	S	S	*	.			trans	-15.4	105.1	-169.6	-56.9	85.8	0	0	0	114.5	I475 T479 N710	I475-W477 PolarHBondContact O-N 3.44Å; W477-T479 PolarHBondContact O-N 2.9Å; W477-N710 PolarHBondContact O-ND2 2.88Å
478	T	68.4	Low	60.7	Low	61 Å²	61	91.4 Å²	91.4	37%	0.374	47%	0.473	S	S	.	.	S	Bend	trans	-69.1	6.6	176.5	46.4	0	0	0	0	113.5	I475 A476 N710	I475-T478 HydrophobicContact CG2-CG2 3.81Å; A476-T478 PolarHBondContact O-N 3.49Å; T478-N710 PolarHBondContact O-N 2.81Å
479	T	79.4	Confident	61.9	Low	10 Å²	10	91.8 Å²	91.8	6%	0.061	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	159.8	179.5	55.7	0	0	0	0	112.3	W477 A707 Y708 N710	W477-T479 PolarHBondContact O-N 2.9Å; T479-A707 HydrophobicContact CG2-CB 4.17Å; T479-Y708 CarbonylContact C-O 3.51Å; T479-Y708 WeakPolarHBondContact CA-O 3.4Å; T479-Y708 WeakPolarHBondContact CB-O 3.26Å; T479-N710 PolarHBondContact O-ND2 3.31Å
480	S	83.5	Confident	63.8	Low	0 Å²	0	88.1 Å²	88.1	0%	0	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	156.5	172.5	58.5	0	0	0	0	112.4	E484 Y708 N710 F743 G744	S480-E484 WeakPolarHBondContact CA-OE2 3.23Å; S480-E484 VanDerWaalsContact CB-OE2 3.32Å; S480-E484 WeakPolarHBondContact CB-OE2 3.35Å; S480-Y708 PolarHBondContact N-O 2.68Å; S480-Y708 PolarHBondContact O-N 2.92Å; S480-N710 WeakPolarHBondContact CB-OD1 3.07Å; S480-N710 PolarHBondContact OG-OD1 2.97Å; S480-F743 PolarHBondContact OG-O 2.89Å; S480-G744 WeakPolarHBondContact OG-CA 3.49Å
481	C	87.7	Confident	65.8	Low	0 Å²	0	84.1 Å²	84.1	0%	0	43%	0.432	C	S	.	.			trans	-104.7	152.6	170.4	-68.5	0	0	0	0	112.2	H483 E484 H494 C500	C481-H483 WeakPolarHBondContact CB-CE1 3.37Å; C481-H483 WeakPolarHBondContact CB-ND1 3.39Å; C481-H483 PolarHBondContact O-N 3.45Å; C481-H483 VanDerWaalsContact O-N 3.15Å; C481-E484 HydrophobicContact CB-CG 4.07Å; C481-E484 PolarHBondContact N-OE2 3.06Å; C481-E484 WeakPolarHBondContact O-CB 3.44Å; C481-E484 PolarHBondContact O-N 2.67Å; C481-H494 PolarHBondContact SG-CD2 2.82Å; C481-C500 WeakPolarHBondContact CA-SG 3.48Å; C481-C500 HydrophobicContact CB-CB 3.86Å; C481-C500 WeakPolarHBondContact CB-SG 3.05Å; C481-C500 WeakPolarHBondContact SG-CB 2.92Å; C481-C500 CovalentContact SG-SG 2.03Å; C481-C500 PolarHBondContact SG-SG 3.16Å
482	P	87.9	Confident	68.2	Low	0 Å²	0	79.4 Å²	79.4	0%	0	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-54.1	-32.7	179.5	-31.3	36.7	0	0	0	115.7	E484 D485 F490 T502 H705 Y708 F743	P482-E484 PolarHBondContact O-N 3.29Å; P482-D485 PolarHBondContact O-N 2.96Å; P482-F490 HydrophobicContact CB-CD2 3.78Å; P482-F490 HydrophobicContact CB-CE2 4.29Å; P482-T502 HydrophobicContact CB-CG2 4.1Å; P482-T502 HydrophobicContact CG-CG2 4.48Å; P482-H705 WeakPolarHBondContact CD-CE1 3.36Å; P482-Y708 HydrophobicContact CG-CE2 4.37Å; P482-F743 HydrophobicContact CB-CD1 3.73Å; P482-F743 HydrophobicContact CB-CD2 4.4Å; P482-F743 HydrophobicContact CB-CE1 3.64Å; P482-F743 HydrophobicContact CB-CE2 4.32Å; P482-F743 HydrophobicContact CB-CG 4.11Å; P482-F743 HydrophobicContact CB-CZ 3.95Å; P482-F743 HydrophobicContact CG-CD1 4.08Å; P482-F743 HydrophobicContact CG-CD2 3.87Å; P482-F743 HydrophobicContact CG-CE1 4.13Å; P482-F743 HydrophobicContact CG-CE2 3.91Å; P482-F743 HydrophobicContact CG-CG 3.95Å; P482-F743 HydrophobicContact CG-CZ 4.04Å
483	H	84.8	Confident	70.6	Confident	47 Å²	47	71.6 Å²	71.6	22%	0.218	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-73.6	-7.3	178.3	71.9	-93.3	0	0	0	114.1	C481 F490 G492 Y493	C481-H483 WeakPolarHBondContact CB-CE1 3.37Å; C481-H483 WeakPolarHBondContact CB-ND1 3.39Å; C481-H483 PolarHBondContact O-N 3.45Å; C481-H483 VanDerWaalsContact O-N 3.15Å; H483-F490 WeakPolarHBondContact CA-O 3.47Å; H483-F490 HydrophobicContact CB-CB 4.26Å; H483-F490 VanDerWaalsContact CB-O 3.26Å; H483-F490 WeakPolarHBondContact CB-O 3.14Å; H483-G492 PolarHBondContact CD2-O 3.44Å; H483-G492 VanDerWaalsContact CE1-C 3.48Å; H483-G492 VanDerWaalsContact CG-C 3.42Å; H483-G492 VanDerWaalsContact CG-CA 3.49Å; H483-G492 PolarHBondContact NE2-O 3.11Å; H483-Y493 WeakPolarHBondContact CE1-CA 3.48Å; H483-Y493 PolarHBondContact CE1-N 3.23Å; H483-Y493 VanDerWaalsContact CE1-N 3.33Å; H483-Y493 PolarHBondContact ND1-N 2.96Å
484	E	81.9	Confident	72.9	Confident	57 Å²	57	66.3 Å²	66.3	27%	0.266	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-101.3	-13.7	179.6	-47.4	173.6	149.6	0	0	112.7	S480 C481 P482 P486 H494 R745	S480-E484 WeakPolarHBondContact CA-OE2 3.23Å; S480-E484 VanDerWaalsContact CB-OE2 3.32Å; S480-E484 WeakPolarHBondContact CB-OE2 3.35Å; C481-E484 HydrophobicContact CB-CG 4.07Å; C481-E484 PolarHBondContact N-OE2 3.06Å; C481-E484 WeakPolarHBondContact O-CB 3.44Å; C481-E484 PolarHBondContact O-N 2.67Å; P482-E484 PolarHBondContact O-N 3.29Å; E484-P486 WeakPolarHBondContact O-CD 3.28Å; E484-H494 IonicContact OE1-CD2 3.22Å; E484-R745 VanDerWaalsContact CB-NH2 3.26Å; E484-R745 PolarHBondContact O-NH1 3.09Å; E484-R745 IonicContact OE2-CZ 3.72Å; E484-R745 IonicContact OE2-NH2 2.79Å; E484-R745 PolarHBondContact OE2-NH2 3.4Å
485	D	78.4	Confident	75.2	Confident	21 Å²	21	59.5 Å²	59.5	11%	0.112	31%	0.305	C	S	.	.			trans	-82.5	111.4	175.6	179	1	0	0	0	108.8	P482 K487 W488	P482-D485 PolarHBondContact O-N 2.96Å; D485-K487 PolarHBondContact O-N 3.25Å; D485-K487 WeakPolarHBondContact OD1-CB 3.38Å; D485-K487 PolarHBondContact OD1-N 2.94Å; D485-W488 PolarHBondContact O-N 2.91Å; D485-W488 PolarHBondContact OD2-NE1 2.03Å
486	P	70.7	Confident	76.8	Confident	128 Å²	128	62.3 Å²	62.3	83%	0.831	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-3	-177	29.6	-37.3	0	0	0	113.9	E484 W488	E484-P486 WeakPolarHBondContact O-CD 3.28Å; P486-W488 VanDerWaalsContact C-N 3.34Å
487	K	70.7	Confident	78.1	Confident	158 Å²	158	64.7 Å²	64.7	69%	0.687	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-20	168.5	-171.6	178.7	174.6	-174.3	0	113.3	D485	D485-K487 PolarHBondContact O-N 3.25Å; D485-K487 WeakPolarHBondContact OD1-CB 3.38Å; D485-K487 PolarHBondContact OD1-N 2.94Å
488	W	71.9	Confident	79.6	Confident	88 Å²	88	59.8 Å²	59.8	33%	0.333	30%	0.3	S	S	.	.	S	Bend	trans	-124.5	122.2	-174.8	-57.7	93	0	0	0	111.7	D485 P486 F490 P742 F743	D485-W488 PolarHBondContact O-N 2.91Å; D485-W488 PolarHBondContact OD2-NE1 2.03Å; P486-W488 VanDerWaalsContact C-N 3.34Å; W488-F490 HydrophobicContact CB-CD2 3.54Å; W488-F490 HydrophobicContact CB-CE2 3.8Å; W488-F490 HydrophobicContact CB-CG 4.45Å; W488-F490 HydrophobicContact CD2-CE2 4.05Å; W488-F490 AromaticContact CE3-CE2 3.8Å; W488-F490 HydrophobicContact CE3-CE2 3.8Å; W488-F490 HydrophobicContact CE3-CZ 4.17Å; W488-F490 HydrophobicContact CG-CD2 4.27Å; W488-F490 HydrophobicContact CG-CE2 4.09Å; W488-F490 PolarHBondContact O-N 3.39Å; W488-P742 HydrophobicContact CZ2-CB 4.49Å; W488-F743 HydrophobicContact CB-CE1 4.46Å; W488-F743 AromaticContact CD1-CD1 3.53Å; W488-F743 AromaticContact CD1-CE1 3.49Å; W488-F743 VanDerWaalsContact CD1-CE1 3.49Å; W488-F743 AromaticContact CD2-CE1 3.74Å; W488-F743 HydrophobicContact CD2-CE1 3.74Å; W488-F743 AromaticContact CE2-CE1 3.57Å; W488-F743 HydrophobicContact CG-CD1 4.15Å; W488-F743 AromaticContact CG-CE1 3.69Å; W488-F743 HydrophobicContact CG-CE1 3.69Å; W488-F743 HydrophobicContact CZ2-CE1 4.23Å; W488-F743 AromaticContact NE1-CD1 3.5Å; W488-F743 AromaticContact NE1-CE1 3.4Å
489	D	74	Confident	80.4	Confident	154 Å²	154	59.4 Å²	59.4	82%	0.824	29%	0.294	S	S	*	.			trans	-81.8	54.9	-179.4	-160.4	22.9	0	0	0	111.4
490	F	84.5	Confident	80.9	Confident	10 Å²	10	59 Å²	59	4%	0.044	29%	0.291	C	S	.	.			trans	-96.2	138.1	175.6	-68.9	-54.8	0	0	0	110.8	P482 H483 W488 T502 V504 M508 F743	P482-F490 HydrophobicContact CB-CD2 3.78Å; P482-F490 HydrophobicContact CB-CE2 4.29Å; H483-F490 WeakPolarHBondContact CA-O 3.47Å; H483-F490 HydrophobicContact CB-CB 4.26Å; H483-F490 VanDerWaalsContact CB-O 3.26Å; H483-F490 WeakPolarHBondContact CB-O 3.14Å; W488-F490 HydrophobicContact CB-CD2 3.54Å; W488-F490 HydrophobicContact CB-CE2 3.8Å; W488-F490 HydrophobicContact CB-CG 4.45Å; W488-F490 HydrophobicContact CD2-CE2 4.05Å; W488-F490 AromaticContact CE3-CE2 3.8Å; W488-F490 HydrophobicContact CE3-CE2 3.8Å; W488-F490 HydrophobicContact CE3-CZ 4.17Å; W488-F490 HydrophobicContact CG-CD2 4.27Å; W488-F490 HydrophobicContact CG-CE2 4.09Å; W488-F490 PolarHBondContact O-N 3.39Å; F490-T502 HydrophobicContact CB-CG2 4.13Å; F490-T502 HydrophobicContact CD1-CG2 4.27Å; F490-T502 HydrophobicContact CD2-CG2 4.39Å; F490-T502 HydrophobicContact CG-CG2 4.04Å; F490-V504 HydrophobicContact CE1-CG1 4.37Å; F490-V504 HydrophobicContact CE1-CG2 4.42Å; F490-M508 HydrophobicContact CE1-CE 4.39Å; F490-M508 HydrophobicContact CE1-SD 3.79Å; F490-M508 HydrophobicContact CZ-SD 4.19Å; F490-F743 HydrophobicContact CD2-CE1 4.4Å; F490-F743 AromaticContact CE2-CE1 3.95Å; F490-F743 HydrophobicContact CE2-CE1 3.95Å; F490-F743 HydrophobicContact CE2-CZ 4.16Å
491	L	87.1	Confident	81.2	Confident	25 Å²	25	59 Å²	59	13%	0.131	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	150.3	163.8	-60	175.3	0	0	0	109.2	F503 F555 I558 Y700	L491-F503 HydrophobicContact CB-CB 4.17Å; L491-F503 HydrophobicContact CB-CD2 4.34Å; L491-F503 PolarHBondContact O-N 2.91Å; L491-F555 HydrophobicContact CD1-CD2 3.94Å; L491-F555 HydrophobicContact CD1-CE2 3.99Å; L491-F555 HydrophobicContact CD2-CD2 4.39Å; L491-F555 HydrophobicContact CD2-CE2 4.21Å; L491-I558 HydrophobicContact CD1-CG2 3.87Å; L491-Y700 HydrophobicContact CD1-CE1 4.17Å; L491-Y700 HydrophobicContact CD1-CE2 4.3Å
492	G	87.4	Confident	81.3	Confident	3 Å²	3	59 Å²	59	3%	0.031	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.8	173.8	-178.8	0	0	0	0	0	114.1	H483 M501 W551	H483-G492 PolarHBondContact CD2-O 3.44Å; H483-G492 VanDerWaalsContact CE1-C 3.48Å; H483-G492 VanDerWaalsContact CG-C 3.42Å; H483-G492 VanDerWaalsContact CG-CA 3.49Å; H483-G492 PolarHBondContact NE2-O 3.11Å; G492-M501 CarbonylContact C-O 3.57Å; G492-M501 WeakPolarHBondContact CA-O 3.38Å; G492-W551 WeakPolarHBondContact O-CB 3.27Å
493	Y	85.5	Confident	81.3	Confident	22 Å²	22	59.1 Å²	59.1	9%	0.086	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	151.6	175.3	57.7	-96.8	0	0	0	111.3	H483 I495 M501 F503 L545 P546 W551	H483-Y493 WeakPolarHBondContact CE1-CA 3.48Å; H483-Y493 PolarHBondContact CE1-N 3.23Å; H483-Y493 VanDerWaalsContact CE1-N 3.33Å; H483-Y493 PolarHBondContact ND1-N 2.96Å; Y493-I495 HydrophobicContact CD2-CG1 4.19Å; Y493-I495 HydrophobicContact CE2-CG1 3.89Å; Y493-M501 HydrophobicContact CD1-CB 3.98Å; Y493-M501 HydrophobicContact CD1-CG 4.27Å; Y493-M501 HydrophobicContact CD2-CB 3.92Å; Y493-M501 HydrophobicContact CE1-CB 3.72Å; Y493-M501 HydrophobicContact CE1-CG 3.65Å; Y493-M501 HydrophobicContact CE2-CB 3.66Å; Y493-M501 HydrophobicContact CE2-CG 4.3Å; Y493-M501 HydrophobicContact CG-CB 4.08Å; Y493-M501 PolarHBondContact N-O 2.75Å; Y493-M501 PolarHBondContact O-N 2.87Å; Y493-F503 HydrophobicContact CD1-CE2 4.09Å; Y493-F503 AromaticContact CE1-CE2 3.9Å; Y493-F503 HydrophobicContact CE1-CE2 3.9Å; Y493-F503 HydrophobicContact CE1-CZ 4.09Å; Y493-L545 HydrophobicContact CE1-CD2 4Å; Y493-P546 HydrophobicContact CD1-CG 3.99Å; Y493-P546 HydrophobicContact CD2-CG 3.83Å; Y493-P546 HydrophobicContact CE1-CG 4.18Å; Y493-P546 HydrophobicContact CE2-CG 4.03Å; Y493-P546 HydrophobicContact CG-CG 3.82Å; Y493-P546 VanDerWaalsContact CZ-CD 3.48Å; Y493-W551 AromaticContact CD1-CD2 3.84Å; Y493-W551 HydrophobicContact CD1-CD2 3.84Å; Y493-W551 HydrophobicContact CD1-CE3 4.26Å; Y493-W551 AromaticContact CD1-CG 3.95Å; Y493-W551 HydrophobicContact CD1-CG 3.95Å; Y493-W551 HydrophobicContact CE1-CD2 4.46Å; Y493-W551 HydrophobicContact CE1-CZ2 4.48Å; Y493-W551 HydrophobicContact CG-CG 4.5Å
494	H	84	Confident	81.5	Confident	45 Å²	45	56.9 Å²	56.9	21%	0.208	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	131	171.1	-134.2	-64.3	0	0	0	109.7	C481 E484 F499	C481-H494 PolarHBondContact SG-CD2 2.82Å; E484-H494 IonicContact OE1-CD2 3.22Å; H494-F499 PolarHBondContact ND1-O 2.83Å; H494-F499 VanDerWaalsContact ND1-O 3.1Å
495	I	80.6	Confident	81.8	Confident	46 Å²	46	55 Å²	55	24%	0.236	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-91.1	166	169.2	-54.1	169.6	0	0	0	107	Y493 F499 M501 E704	Y493-I495 HydrophobicContact CD2-CG1 4.19Å; Y493-I495 HydrophobicContact CE2-CG1 3.89Å; I495-F499 WeakPolarHBondContact CA-O 3.47Å; I495-F499 HydrophobicContact CB-CB 3.76Å; I495-F499 WeakPolarHBondContact CB-O 3.34Å; I495-F499 HydrophobicContact CD1-CB 4.14Å; I495-F499 HydrophobicContact CG1-CB 4.45Å; I495-F499 HydrophobicContact CG2-CB 4.13Å; I495-F499 PolarHBondContact N-O 2.89Å; I495-M501 HydrophobicContact CD1-CB 4.07Å; I495-M501 HydrophobicContact CD1-CE 4.09Å; I495-M501 HydrophobicContact CG1-CB 4.25Å; I495-E704 HydrophobicContact CD1-CG 4.01Å
496	K	73.9	Confident	81.9	Confident	170 Å²	170	54.1 Å²	54.1	74%	0.739	27%	0.27	S	S	*	.	S	Bend	trans	-57	160.7	166.9	-78.5	-166.3	170.3	-167	0	111.9	D498 F499	K496-D498 PolarHBondContact O-N 2.87Å; K496-F499 PolarHBondContact O-N 2.86Å
497	D	69.4	Low	82.2	Confident	136 Å²	136	53.5 Å²	53.5	73%	0.727	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	45	166.8	-43.9	-36.3	0	0	0	113.5	F499	D497-F499 VanDerWaalsContact C-N 3.29Å; D497-F499 VanDerWaalsContact O-CD2 3.23Å; D497-F499 WeakPolarHBondContact O-CD2 2.96Å; D497-F499 PolarHBondContact O-N 3.42Å
498	D	79.6	Confident	82.5	Confident	75 Å²	75	49.6 Å²	49.6	40%	0.401	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	30	179.1	-63	-10.8	0	0	0	115.8	K496 A707	K496-D498 PolarHBondContact O-N 2.87Å; D498-A707 WeakPolarHBondContact O-CB 3.02Å; D498-A707 PolarHBondContact O-N 2.8Å
499	F	86.2	Confident	82.7	Confident	53 Å²	53	45.8 Å²	45.8	23%	0.232	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	155	170	-76.9	-89.6	0	0	0	113	H494 I495 K496 D497 E704 H705 Y706	H494-F499 PolarHBondContact ND1-O 2.83Å; H494-F499 VanDerWaalsContact ND1-O 3.1Å; I495-F499 WeakPolarHBondContact CA-O 3.47Å; I495-F499 HydrophobicContact CB-CB 3.76Å; I495-F499 WeakPolarHBondContact CB-O 3.34Å; I495-F499 HydrophobicContact CD1-CB 4.14Å; I495-F499 HydrophobicContact CG1-CB 4.45Å; I495-F499 HydrophobicContact CG2-CB 4.13Å; I495-F499 PolarHBondContact N-O 2.89Å; K496-F499 PolarHBondContact O-N 2.86Å; D497-F499 VanDerWaalsContact C-N 3.29Å; D497-F499 VanDerWaalsContact O-CD2 3.23Å; D497-F499 WeakPolarHBondContact O-CD2 2.96Å; D497-F499 PolarHBondContact O-N 3.42Å; F499-E704 HydrophobicContact CD1-CG 4.35Å; F499-H705 CarbonylContact C-O 3.51Å; F499-H705 WeakPolarHBondContact CA-O 3.25Å; F499-H705 WeakPolarHBondContact CD1-O 3.4Å; F499-Y706 HydrophobicContact CD1-CD1 4.26Å; F499-Y706 HydrophobicContact CD1-CE1 4.42Å; F499-Y706 HydrophobicContact CD2-CD1 4.5Å; F499-Y706 HydrophobicContact CD2-CE1 4.32Å; F499-Y706 AromaticContact CE1-CD1 3.93Å; F499-Y706 HydrophobicContact CE1-CD1 3.93Å; F499-Y706 HydrophobicContact CE1-CD2 4.28Å; F499-Y706 AromaticContact CE1-CE1 3.71Å; F499-Y706 HydrophobicContact CE1-CE1 3.71Å; F499-Y706 HydrophobicContact CE1-CE2 4.06Å; F499-Y706 HydrophobicContact CE1-CG 4.22Å; F499-Y706 AromaticContact CE1-CZ 3.77Å; F499-Y706 HydrophobicContact CE2-CD1 4.19Å; F499-Y706 AromaticContact CE2-CE1 3.6Å; F499-Y706 HydrophobicContact CE2-CE1 3.6Å; F499-Y706 AromaticContact CZ-CD1 3.91Å; F499-Y706 HydrophobicContact CZ-CD1 3.91Å; F499-Y706 AromaticContact CZ-CE1 3.25Å; F499-Y706 HydrophobicContact CZ-CE1 3.25Å; F499-Y706 HydrophobicContact CZ-CE2 4.12Å; F499-Y706 AromaticContact CZ-CZ 3.37Å
500	C	89.4	Confident	82.4	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	140	176.2	-60.4	0	0	0	0	110.5	C481 E704 H705 A707	C481-C500 WeakPolarHBondContact CA-SG 3.48Å; C481-C500 HydrophobicContact CB-CB 3.86Å; C481-C500 WeakPolarHBondContact CB-SG 3.05Å; C481-C500 WeakPolarHBondContact SG-CB 2.92Å; C481-C500 CovalentContact SG-SG 2.03Å; C481-C500 PolarHBondContact SG-SG 3.16Å; C500-E704 WeakPolarHBondContact O-CA 3.4Å; C500-H705 VanDerWaalsContact CB-CE1 3.45Å; C500-H705 WeakPolarHBondContact CB-CE1 3.38Å; C500-H705 PolarHBondContact N-O 3.29Å; C500-H705 PolarHBondContact O-N 2.7Å; C500-H705 VanDerWaalsContact O-N 3.11Å; C500-A707 VanDerWaalsContact SG-CA 3.55Å; C500-A707 VanDerWaalsContact SG-CB 3.58Å
501	M	89	Confident	81.2	Confident	1 Å²	1	45 Å²	45	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122.5	157.4	-169.9	60.8	69.1	0	0	108.5	G492 Y493 I495 F503 Y537 F539 A702 E704	G492-M501 CarbonylContact C-O 3.57Å; G492-M501 WeakPolarHBondContact CA-O 3.38Å; Y493-M501 HydrophobicContact CD1-CB 3.98Å; Y493-M501 HydrophobicContact CD1-CG 4.27Å; Y493-M501 HydrophobicContact CD2-CB 3.92Å; Y493-M501 HydrophobicContact CE1-CB 3.72Å; Y493-M501 HydrophobicContact CE1-CG 3.65Å; Y493-M501 HydrophobicContact CE2-CB 3.66Å; Y493-M501 HydrophobicContact CE2-CG 4.3Å; Y493-M501 HydrophobicContact CG-CB 4.08Å; Y493-M501 PolarHBondContact N-O 2.75Å; Y493-M501 PolarHBondContact O-N 2.87Å; I495-M501 HydrophobicContact CD1-CB 4.07Å; I495-M501 HydrophobicContact CD1-CE 4.09Å; I495-M501 HydrophobicContact CG1-CB 4.25Å; M501-F503 HydrophobicContact CG-CE2 3.9Å; M501-F503 HydrophobicContact CG-CZ 3.97Å; M501-Y537 HydrophobicContact CE-CD1 3.66Å; M501-Y537 HydrophobicContact CE-CD2 3.74Å; M501-Y537 HydrophobicContact CE-CE1 4.04Å; M501-Y537 HydrophobicContact CE-CE2 4.1Å; M501-Y537 HydrophobicContact CE-CG 3.5Å; M501-Y537 VanDerWaalsContact CE-CG 3.5Å; M501-Y537 HydrophobicContact SD-CD1 4.45Å; M501-Y537 HydrophobicContact SD-CG 4.21Å; M501-F539 HydrophobicContact CE-CZ 4.32Å; M501-F539 HydrophobicContact SD-CZ 4.28Å; M501-A702 HydrophobicContact SD-CB 3.9Å; M501-E704 HydrophobicContact CE-CB 4.36Å
502	T	90.1	Very high	79.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121.5	179.2	-61.6	0	0	0	0	109.8	P482 F490 V504 L531 C703 H705	P482-T502 HydrophobicContact CB-CG2 4.1Å; P482-T502 HydrophobicContact CG-CG2 4.48Å; F490-T502 HydrophobicContact CB-CG2 4.13Å; F490-T502 HydrophobicContact CD1-CG2 4.27Å; F490-T502 HydrophobicContact CD2-CG2 4.39Å; F490-T502 HydrophobicContact CG-CG2 4.04Å; T502-V504 HydrophobicContact CG2-CG2 4.37Å; T502-L531 HydrophobicContact CG2-CD1 4.29Å; T502-C703 PolarHBondContact N-O 3.13Å; T502-C703 PolarHBondContact O-N 3.16Å; T502-H705 PolarHBondContact OG1-NE2 2.93Å
503	F	89.1	Confident	78.1	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.009	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	101	178.2	-64.1	-85.3	0	0	0	110	L491 Y493 M501 F539 W551 I558 V560 Y700 F701 A702	L491-F503 HydrophobicContact CB-CB 4.17Å; L491-F503 HydrophobicContact CB-CD2 4.34Å; L491-F503 PolarHBondContact O-N 2.91Å; Y493-F503 HydrophobicContact CD1-CE2 4.09Å; Y493-F503 AromaticContact CE1-CE2 3.9Å; Y493-F503 HydrophobicContact CE1-CE2 3.9Å; Y493-F503 HydrophobicContact CE1-CZ 4.09Å; M501-F503 HydrophobicContact CG-CE2 3.9Å; M501-F503 HydrophobicContact CG-CZ 3.97Å; F503-F539 AromaticContact CE1-CE2 3.9Å; F503-F539 HydrophobicContact CE1-CE2 3.9Å; F503-F539 AromaticContact CE1-CZ 3.79Å; F503-F539 HydrophobicContact CE1-CZ 3.79Å; F503-F539 HydrophobicContact CZ-CE2 4.45Å; F503-F539 AromaticContact CZ-CZ 3.88Å; F503-F539 HydrophobicContact CZ-CZ 3.88Å; F503-W551 HydrophobicContact CD2-CE3 4.18Å; F503-W551 AromaticContact CD2-CZ3 3.97Å; F503-W551 HydrophobicContact CD2-CZ3 3.97Å; F503-W551 HydrophobicContact CE1-CZ3 4.44Å; F503-W551 AromaticContact CE2-CE3 3.61Å; F503-W551 HydrophobicContact CE2-CE3 3.61Å; F503-W551 HydrophobicContact CE2-CH2 4.01Å; F503-W551 AromaticContact CE2-CZ3 3.27Å; F503-W551 HydrophobicContact CE2-CZ3 3.27Å; F503-W551 HydrophobicContact CZ-CE3 4.32Å; F503-W551 AromaticContact CZ-CH2 3.88Å; F503-W551 HydrophobicContact CZ-CH2 3.88Å; F503-W551 AromaticContact CZ-CZ3 3.56Å; F503-W551 HydrophobicContact CZ-CZ3 3.56Å; F503-I558 HydrophobicContact CD1-CD1 4.03Å; F503-I558 HydrophobicContact CE1-CD1 4.22Å; F503-I558 HydrophobicContact CG-CD1 4.19Å; F503-V560 HydrophobicContact CD1-CG1 4.06Å; F503-V560 HydrophobicContact CD1-CG2 4.02Å; F503-V560 HydrophobicContact CE1-CG1 4.13Å; F503-V560 HydrophobicContact CE1-CG2 3.95Å; F503-Y700 HydrophobicContact CB-CD1 4.14Å; F503-Y700 HydrophobicContact CB-CG 4.35Å; F503-F701 CarbonylContact C-O 3.47Å; F503-F701 VanDerWaalsContact CA-O 3.3Å; F503-F701 WeakPolarHBondContact CA-O 3.26Å; F503-A702 HydrophobicContact CD1-CB 3.92Å; F503-A702 HydrophobicContact CE1-CB 3.89Å
504	V	88.9	Confident	76.3	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	126	-178.5	-178	0	0	0	0	110.1	F490 T502 A506 M508 I509 Y527 L531 Y700 F701	F490-V504 HydrophobicContact CE1-CG1 4.37Å; F490-V504 HydrophobicContact CE1-CG2 4.42Å; T502-V504 HydrophobicContact CG2-CG2 4.37Å; V504-A506 PolarHBondContact O-N 2.67Å; V504-M508 HydrophobicContact CG1-CB 4.24Å; V504-I509 HydrophobicContact CB-CD1 4.01Å; V504-I509 HydrophobicContact CG1-CD1 3.61Å; V504-I509 HydrophobicContact CG1-CG1 3.92Å; V504-Y527 HydrophobicContact CB-CD1 4.4Å; V504-Y527 HydrophobicContact CB-CE1 4.19Å; V504-Y527 HydrophobicContact CG1-CD1 3.82Å; V504-Y527 HydrophobicContact CG1-CE1 3.46Å; V504-Y527 VanDerWaalsContact CG1-CE1 3.46Å; V504-Y527 HydrophobicContact CG1-CE2 4.2Å; V504-Y527 HydrophobicContact CG1-CG 4.34Å; V504-Y527 HydrophobicContact CG2-CD1 3.84Å; V504-Y527 HydrophobicContact CG2-CE1 3.61Å; V504-L531 HydrophobicContact CG2-CD1 4.34Å; V504-Y700 CarbonylContact O-C 3.58Å; V504-Y700 VanDerWaalsContact O-CA 3.31Å; V504-Y700 WeakPolarHBondContact O-CA 3.48Å; V504-F701 PolarHBondContact N-O 2.57Å; V504-F701 PolarHBondContact O-N 3.3Å
505	P	86.9	Confident	75	Confident	17 Å²	17	65.1 Å²	65.1	11%	0.11	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	132.6	174.2	-26.5	35.6	0	0	0	112.8	N507 M508 Y700	P505-N507 WeakPolarHBondContact CB-OD1 3.44Å; P505-N507 PolarHBondContact O-N 2.81Å; P505-N507 VanDerWaalsContact O-N 3.14Å; P505-M508 HydrophobicContact CB-CG 4.33Å; P505-M508 HydrophobicContact CG-CE 4.34Å; P505-M508 HydrophobicContact CG-SD 4.42Å; P505-M508 WeakPolarHBondContact O-CB 3.38Å; P505-M508 PolarHBondContact O-N 3.22Å; P505-Y700 HydrophobicContact CG-CD1 4.35Å; P505-Y700 HydrophobicContact CG-CE1 4.14Å
506	A	80.1	Confident	73.7	Confident	3 Å²	3	71 Å²	71	3%	0.025	33%	0.332	C	S	.	.	H	α-helix	trans	-60.9	-27.9	-173.8	0	0	0	0	0	113.6	V504 M508 I509 I510 K699 F701	V504-A506 PolarHBondContact O-N 2.67Å; A506-M508 VanDerWaalsContact C-N 3.3Å; A506-M508 PolarHBondContact O-N 3.37Å; A506-I509 PolarHBondContact O-N 3.39Å; A506-I510 WeakPolarHBondContact O-CB 3.07Å; A506-I510 PolarHBondContact O-N 2.58Å; A506-K699 WeakPolarHBondContact CB-O 3.46Å; A506-K699 PolarHBondContact N-O 2.77Å; A506-F701 HydrophobicContact CB-CD2 4.16Å; A506-F701 HydrophobicContact CB-CE2 3.89Å
507	N	77.8	Confident	72.7	Confident	116 Å²	116	63.6 Å²	63.6	62%	0.62	30%	0.301	S	S	*	.	H	α-helix	trans	-72	-16.3	175.3	64.4	-35.7	0	0	0	114.2	P505 I509	P505-N507 WeakPolarHBondContact CB-OD1 3.44Å; P505-N507 PolarHBondContact O-N 2.81Å; P505-N507 VanDerWaalsContact O-N 3.14Å; N507-I509 VanDerWaalsContact C-N 3.35Å
508	M	78.3	Confident	71.9	Confident	76 Å²	76	59.9 Å²	59.9	37%	0.374	28%	0.279	S	S	.	.	H	α-helix	trans	-77.9	-22.3	169.5	-66	-170.6	178	0	0	112.6	F490 V504 P505 A506 Y527	F490-M508 HydrophobicContact CE1-CE 4.39Å; F490-M508 HydrophobicContact CE1-SD 3.79Å; F490-M508 HydrophobicContact CZ-SD 4.19Å; V504-M508 HydrophobicContact CG1-CB 4.24Å; P505-M508 HydrophobicContact CB-CG 4.33Å; P505-M508 HydrophobicContact CG-CE 4.34Å; P505-M508 HydrophobicContact CG-SD 4.42Å; P505-M508 WeakPolarHBondContact O-CB 3.38Å; P505-M508 PolarHBondContact O-N 3.22Å; A506-M508 VanDerWaalsContact C-N 3.3Å; A506-M508 PolarHBondContact O-N 3.37Å; M508-Y527 HydrophobicContact CB-CE2 4.11Å
509	I	75.3	Confident	71.1	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.041	28%	0.278	C	S	.	.	H	α-helix	trans	-101.3	-36.1	-177.1	-64.4	165.4	0	0	0	111.1	V504 A506 N507 K523 A524 Y527 F701	V504-I509 HydrophobicContact CB-CD1 4.01Å; V504-I509 HydrophobicContact CG1-CD1 3.61Å; V504-I509 HydrophobicContact CG1-CG1 3.92Å; A506-I509 PolarHBondContact O-N 3.39Å; N507-I509 VanDerWaalsContact C-N 3.35Å; I509-K523 HydrophobicContact CG2-CB 3.63Å; I509-K523 WeakPolarHBondContact O-CD 2.99Å; I509-A524 HydrophobicContact CD1-CB 4.31Å; I509-A524 HydrophobicContact CG2-CB 4.3Å; I509-Y527 HydrophobicContact CD1-CG 4.35Å; I509-Y527 HydrophobicContact CG1-CD2 3.8Å; I509-Y527 HydrophobicContact CG1-CE2 4.48Å; I509-Y527 HydrophobicContact CG1-CG 3.87Å; I509-F701 HydrophobicContact CD1-CB 3.94Å; I509-F701 HydrophobicContact CD1-CD2 3.6Å; I509-F701 HydrophobicContact CD1-CE2 4.35Å; I509-F701 HydrophobicContact CD1-CG 3.95Å
510	I	67.4	Low	70.2	Confident	10 Å²	10	57.5 Å²	57.5	5%	0.051	27%	0.268	C	S	.	.			trans	-120.2	107.4	-170.8	-54.9	167.8	0	0	0	109.4	A506 H512 Y520 Q696 F701	A506-I510 WeakPolarHBondContact O-CB 3.07Å; A506-I510 PolarHBondContact O-N 2.58Å; I510-H512 WeakPolarHBondContact CG2-O 3.27Å; I510-Y520 HydrophobicContact CD1-CD1 3.37Å; I510-Y520 HydrophobicContact CD1-CE1 3.71Å; I510-Y520 HydrophobicContact CD1-CG 3.83Å; I510-Y520 HydrophobicContact CG1-CD1 3.74Å; I510-Y520 HydrophobicContact CG1-CE1 4.09Å; I510-Y520 HydrophobicContact CG2-CD1 4.13Å; I510-Y520 HydrophobicContact CG2-CE1 3.62Å; I510-Q696 VanDerWaalsContact CD1-NE2 3.3Å; I510-F701 HydrophobicContact CD1-CE2 3.78Å; I510-F701 HydrophobicContact CD1-CZ 3.84Å
511	H	59	Low	69.1	Low	137 Å²	137	57.9 Å²	57.9	63%	0.634	27%	0.271	S	S	*	.			trans	-86.8	-19.7	-176.8	-57.9	-40	0	0	0	113.9
512	H	57	Low	68	Low	128 Å²	128	60 Å²	60	59%	0.593	28%	0.282	S	S	*	.			trans	-136.5	137.5	-176.8	-64.7	-35	0	0	0	112.5	I510 W514 E515	I510-H512 WeakPolarHBondContact CG2-O 3.27Å; H512-W514 PolarHBondContact O-N 3.04Å; H512-W514 VanDerWaalsContact O-N 3.1Å; H512-E515 HydrophobicContact CB-CG 4.14Å
513	T	52.3	Low	67.3	Low	108 Å²	108	62.4 Å²	62.4	66%	0.663	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	13.1	-176.6	60.7	0	0	0	0	114.7
514	W	49.1	Very low	66.8	Low	239 Å²	239	62.3 Å²	62.3	91%	0.905	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	6.4	-173.7	-63.2	79.9	0	0	0	112.3	H512	H512-W514 PolarHBondContact O-N 3.04Å; H512-W514 VanDerWaalsContact O-N 3.1Å
515	E	54.9	Low	66.1	Low	43 Å²	43	63.7 Å²	63.7	20%	0.201	30%	0.301	C	S	.	.	S	Bend	trans	-76.2	141.6	177.6	-60	-172.7	127	0	0	110	H512 L519 Y520 K523	H512-E515 HydrophobicContact CB-CG 4.14Å; E515-L519 HydrophobicContact CB-CD1 4.3Å; E515-Y520 HydrophobicContact CB-CE1 4.06Å; E515-Y520 PolarHBondContact O-OH 3.38Å; E515-K523 IonicContact OE1-NZ 2.82Å; E515-K523 PolarHBondContact OE1-NZ 2.89Å; E515-K523 IonicContact OE2-NZ 2.75Å; E515-K523 PolarHBondContact OE2-NZ 3.14Å
516	R	54.1	Low	65.7	Low	170 Å²	170	68.1 Å²	68.1	64%	0.642	32%	0.321	S	S	*	.			trans	-64.2	145.6	-179.5	-64.1	-168.6	-170.7	173.3	2.6	111.3	E518 L519	R516-E518 HydrophobicContact CB-CB 4.46Å; R516-E518 HydrophobicContact CB-CG 4.38Å; R516-E518 WeakPolarHBondContact CD-OE1 3.23Å; R516-E518 IonicContact CZ-OE1 2.69Å; R516-E518 IonicContact NE-OE1 2.58Å; R516-E518 IonicContact NH1-OE1 3.72Å; R516-E518 PolarHBondContact NH1-OE1 2.97Å; R516-E518 PolarHBondContact O-N 2.97Å; R516-E518 VanDerWaalsContact O-N 3.11Å; R516-L519 HydrophobicContact CB-CD1 4.5Å; R516-L519 WeakPolarHBondContact O-CB 3.48Å; R516-L519 PolarHBondContact O-N 3.41Å
517	S	52.9	Low	65.9	Low	13 Å²	13	70.5 Å²	70.5	9%	0.091	33%	0.329	C	S	.	.	H	α-helix	trans	-41.5	-45.1	172.5	58.6	0	0	0	0	114.4	L519 Y520	S517-L519 PolarHBondContact O-N 2.85Å; S517-L519 VanDerWaalsContact O-N 3.15Å; S517-Y520 WeakPolarHBondContact O-CB 3.41Å; S517-Y520 PolarHBondContact O-N 3.34Å
518	E	52.9	Low	66.3	Low	58 Å²	58	65 Å²	65	27%	0.271	30%	0.3	S	S	.	.	H	α-helix	trans	-47.8	-38.5	176.5	-49.6	177.4	-97.3	0	0	112.3	R516 I522 F671	R516-E518 HydrophobicContact CB-CB 4.46Å; R516-E518 HydrophobicContact CB-CG 4.38Å; R516-E518 WeakPolarHBondContact CD-OE1 3.23Å; R516-E518 IonicContact CZ-OE1 2.69Å; R516-E518 IonicContact NE-OE1 2.58Å; R516-E518 IonicContact NH1-OE1 3.72Å; R516-E518 PolarHBondContact NH1-OE1 2.97Å; R516-E518 PolarHBondContact O-N 2.97Å; R516-E518 VanDerWaalsContact O-N 3.11Å; E518-I522 WeakPolarHBondContact O-CD1 3.41Å; E518-I522 WeakPolarHBondContact O-CG1 3.09Å; E518-F671 HydrophobicContact CG-CD2 4.48Å; E518-F671 HydrophobicContact CG-CE2 4.04Å; E518-F671 HydrophobicContact CG-CZ 4.45Å
519	L	62.9	Low	66.5	Low	72 Å²	72	64.7 Å²	64.7	38%	0.377	30%	0.3	S	S	.	.	H	α-helix	trans	-82.2	-24.3	-175.9	-60.9	168.7	0	0	0	113.1	E515 R516 S517 V521 I522 K523	E515-L519 HydrophobicContact CB-CD1 4.3Å; R516-L519 HydrophobicContact CB-CD1 4.5Å; R516-L519 WeakPolarHBondContact O-CB 3.48Å; R516-L519 PolarHBondContact O-N 3.41Å; S517-L519 PolarHBondContact O-N 2.85Å; S517-L519 VanDerWaalsContact O-N 3.15Å; L519-V521 PolarHBondContact O-N 3.21Å; L519-I522 PolarHBondContact O-N 2.91Å; L519-K523 WeakPolarHBondContact O-CB 3.26Å; L519-K523 WeakPolarHBondContact O-CG 3.07Å; L519-K523 PolarHBondContact O-N 2.63Å
520	Y	67.6	Low	67	Low	6 Å²	6	68.2 Å²	68.2	2%	0.024	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-43.3	-176.7	-63.4	-28.8	0	0	0	111.9	I510 E515 S517 A524 W698	I510-Y520 HydrophobicContact CD1-CD1 3.37Å; I510-Y520 HydrophobicContact CD1-CE1 3.71Å; I510-Y520 HydrophobicContact CD1-CG 3.83Å; I510-Y520 HydrophobicContact CG1-CD1 3.74Å; I510-Y520 HydrophobicContact CG1-CE1 4.09Å; I510-Y520 HydrophobicContact CG2-CD1 4.13Å; I510-Y520 HydrophobicContact CG2-CE1 3.62Å; E515-Y520 HydrophobicContact CB-CE1 4.06Å; E515-Y520 PolarHBondContact O-OH 3.38Å; S517-Y520 WeakPolarHBondContact O-CB 3.41Å; S517-Y520 PolarHBondContact O-N 3.34Å; Y520-A524 VanDerWaalsContact O-CB 3.26Å; Y520-A524 WeakPolarHBondContact O-CB 3.22Å; Y520-A524 PolarHBondContact O-N 3.29Å; Y520-W698 HydrophobicContact CD2-CZ2 4.07Å; Y520-W698 HydrophobicContact CE2-CZ2 4.31Å
521	V	65.1	Low	67.9	Low	8 Å²	8	68 Å²	68	5%	0.048	32%	0.324	C	S	.	.	H	α-helix	trans	-70.9	-39.1	178.4	-171.6	0	0	0	0	110.9	L519 A524 S525 F561 W608	L519-V521 PolarHBondContact O-N 3.21Å; V521-A524 PolarHBondContact O-N 3Å; V521-S525 WeakPolarHBondContact O-CB 3.39Å; V521-S525 PolarHBondContact O-N 3.32Å; V521-F561 HydrophobicContact CG2-CE1 3.95Å; V521-F561 HydrophobicContact CG2-CZ 3.87Å; V521-W608 HydrophobicContact CB-CG 4.37Å; V521-W608 HydrophobicContact CG1-CB 3.82Å; V521-W608 HydrophobicContact CG1-CD2 4.38Å; V521-W608 HydrophobicContact CG1-CG 3.66Å
522	I	66.8	Low	69.2	Low	46 Å²	46	64 Å²	64	24%	0.236	31%	0.305	C	S	.	.	H	α-helix	trans	-61.1	-49	176.2	-63.5	171	0	0	0	110.7	E518 L519 S525 Q526 W608	E518-I522 WeakPolarHBondContact O-CD1 3.41Å; E518-I522 WeakPolarHBondContact O-CG1 3.09Å; L519-I522 PolarHBondContact O-N 2.91Å; I522-S525 PolarHBondContact O-N 3.03Å; I522-Q526 WeakPolarHBondContact O-CG 3.49Å; I522-Q526 PolarHBondContact O-N 3.05Å; I522-W608 HydrophobicContact CD1-CH2 4.07Å; I522-W608 HydrophobicContact CD1-CZ2 4.19Å; I522-W608 HydrophobicContact CG1-CH2 3.95Å; I522-W608 HydrophobicContact CG1-CZ2 4.04Å; I522-W608 HydrophobicContact CG1-CZ3 4.48Å
523	K	75.8	Confident	70.2	Confident	50 Å²	50	66 Å²	66	22%	0.217	31%	0.314	C	S	.	.	H	α-helix	trans	-66.3	-40.5	177.9	-71.2	-171	180	-171.2	0	112.6	I509 E515 L519 S525 Q526 Y527	I509-K523 HydrophobicContact CG2-CB 3.63Å; I509-K523 WeakPolarHBondContact O-CD 2.99Å; E515-K523 IonicContact OE1-NZ 2.82Å; E515-K523 PolarHBondContact OE1-NZ 2.89Å; E515-K523 IonicContact OE2-NZ 2.75Å; E515-K523 PolarHBondContact OE2-NZ 3.14Å; L519-K523 WeakPolarHBondContact O-CB 3.26Å; L519-K523 WeakPolarHBondContact O-CG 3.07Å; L519-K523 PolarHBondContact O-N 2.63Å; K523-S525 VanDerWaalsContact C-N 3.31Å; K523-S525 PolarHBondContact O-N 2.86Å; K523-Q526 PolarHBondContact O-N 3.19Å; K523-Y527 WeakPolarHBondContact O-CB 3.03Å; K523-Y527 PolarHBondContact O-N 3.35Å
524	A	77.2	Confident	71.6	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-40.5	174.5	0	0	0	0	0	111.3	I509 Y520 V521 Y527 C528 V536 F701	I509-A524 HydrophobicContact CD1-CB 4.31Å; I509-A524 HydrophobicContact CG2-CB 4.3Å; Y520-A524 VanDerWaalsContact O-CB 3.26Å; Y520-A524 WeakPolarHBondContact O-CB 3.22Å; Y520-A524 PolarHBondContact O-N 3.29Å; V521-A524 PolarHBondContact O-N 3Å; A524-Y527 PolarHBondContact O-N 3.06Å; A524-C528 PolarHBondContact O-N 3.03Å; A524-C528 PolarHBondContact O-SG 3.07Å; A524-V536 HydrophobicContact CB-CG2 3.76Å; A524-F701 HydrophobicContact CB-CB 4.48Å; A524-F701 HydrophobicContact CB-CD1 3.63Å; A524-F701 HydrophobicContact CB-CE1 3.93Å; A524-F701 HydrophobicContact CB-CG 4.03Å
525	S	74.8	Confident	73.3	Confident	29 Å²	29	55.1 Å²	55.1	20%	0.203	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-40.8	175	-167.4	0	0	0	0	112.7	V521 I522 K523 Y527 C528 D529	V521-S525 WeakPolarHBondContact O-CB 3.39Å; V521-S525 PolarHBondContact O-N 3.32Å; I522-S525 PolarHBondContact O-N 3.03Å; K523-S525 VanDerWaalsContact C-N 3.31Å; K523-S525 PolarHBondContact O-N 2.86Å; S525-Y527 VanDerWaalsContact C-N 3.31Å; S525-Y527 PolarHBondContact O-N 3.34Å; S525-C528 PolarHBondContact O-N 2.92Å; S525-D529 WeakPolarHBondContact O-CB 3.44Å; S525-D529 PolarHBondContact O-N 3.19Å
526	Q	77.8	Confident	74.4	Confident	111 Å²	111	54.1 Å²	54.1	52%	0.519	26%	0.263	S	S	.	.	H	α-helix	trans	-64	-36.6	174.5	-73.1	171.2	-7.9	0	0	111.9	I522 K523 S530	I522-Q526 WeakPolarHBondContact O-CG 3.49Å; I522-Q526 PolarHBondContact O-N 3.05Å; K523-Q526 PolarHBondContact O-N 3.19Å; Q526-S530 PolarHBondContact O-N 2.87Å
527	Y	85.2	Confident	75.6	Confident	53 Å²	53	47.4 Å²	47.4	21%	0.208	24%	0.238	C	C	.	.	H	α-helix	trans	-68.2	-48	174.5	-164.1	-73.2	0	0	0	111.4	V504 M508 I509 K523 A524 S525 D529 S530 L531	V504-Y527 HydrophobicContact CB-CD1 4.4Å; V504-Y527 HydrophobicContact CB-CE1 4.19Å; V504-Y527 HydrophobicContact CG1-CD1 3.82Å; V504-Y527 HydrophobicContact CG1-CE1 3.46Å; V504-Y527 VanDerWaalsContact CG1-CE1 3.46Å; V504-Y527 HydrophobicContact CG1-CE2 4.2Å; V504-Y527 HydrophobicContact CG1-CG 4.34Å; V504-Y527 HydrophobicContact CG2-CD1 3.84Å; V504-Y527 HydrophobicContact CG2-CE1 3.61Å; M508-Y527 HydrophobicContact CB-CE2 4.11Å; I509-Y527 HydrophobicContact CD1-CG 4.35Å; I509-Y527 HydrophobicContact CG1-CD2 3.8Å; I509-Y527 HydrophobicContact CG1-CE2 4.48Å; I509-Y527 HydrophobicContact CG1-CG 3.87Å; K523-Y527 WeakPolarHBondContact O-CB 3.03Å; K523-Y527 PolarHBondContact O-N 3.35Å; A524-Y527 PolarHBondContact O-N 3.06Å; S525-Y527 VanDerWaalsContact C-N 3.31Å; S525-Y527 PolarHBondContact O-N 3.34Å; Y527-D529 VanDerWaalsContact C-N 3.32Å; Y527-D529 PolarHBondContact O-N 3.38Å; Y527-S530 WeakPolarHBondContact O-CB 3.31Å; Y527-S530 PolarHBondContact O-N 3.23Å; Y527-S530 PolarHBondContact O-OG 3.25Å; Y527-L531 HydrophobicContact CE1-CD1 4.41Å
528	C	86.3	Confident	76.4	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-36.5	178	-60.9	0	0	0	0	112.3	A524 S525 S530 L531 G534 C703	A524-C528 PolarHBondContact O-N 3.03Å; A524-C528 PolarHBondContact O-SG 3.07Å; S525-C528 PolarHBondContact O-N 2.92Å; C528-S530 PolarHBondContact O-N 3.06Å; C528-L531 CarbonylContact O-C 3.58Å; C528-L531 WeakPolarHBondContact O-CA 3.42Å; C528-L531 WeakPolarHBondContact O-CB 3.48Å; C528-L531 PolarHBondContact O-N 2.86Å; C528-G534 CarbonylContact C-O 3.59Å; C528-G534 WeakPolarHBondContact CB-O 3.34Å; C528-G534 CarbonylContact O-C 3.57Å; C528-G534 WeakPolarHBondContact O-CA 3.41Å; C528-G534 PolarHBondContact O-N 3.28Å; C528-C703 WeakPolarHBondContact CA-SG 3.36Å; C528-C703 HydrophobicContact CB-CB 3.74Å; C528-C703 WeakPolarHBondContact CB-SG 3.44Å; C528-C703 VanDerWaalsContact SG-CA 3.57Å; C528-C703 WeakPolarHBondContact SG-CB 3.39Å; C528-C703 CovalentContact SG-SG 2.04Å; C528-C703 PolarHBondContact SG-SG 2.96Å
529	D	82.5	Confident	76.9	Confident	70 Å²	70	45.5 Å²	45.5	37%	0.374	23%	0.227	S	C	.	.	H	α-helix	trans	-60.4	-33	177	-172.5	41.6	0	0	0	111.8	S525 Y527 L531 Q533 G534	S525-D529 WeakPolarHBondContact O-CB 3.44Å; S525-D529 PolarHBondContact O-N 3.19Å; Y527-D529 VanDerWaalsContact C-N 3.32Å; Y527-D529 PolarHBondContact O-N 3.38Å; D529-L531 VanDerWaalsContact C-N 3.26Å; D529-L531 PolarHBondContact O-N 2.83Å; D529-Q533 WeakPolarHBondContact O-CA 3.35Å; D529-Q533 PolarHBondContact O-N 3.29Å; D529-Q533 WeakPolarHBondContact OD1-CA 3.44Å; D529-G534 WeakPolarHBondContact CA-O 3.35Å; D529-G534 PolarHBondContact N-O 2.79Å; D529-G534 VanDerWaalsContact N-O 3.14Å
530	S	84.9	Confident	76.5	Confident	82 Å²	82	48.3 Å²	48.3	57%	0.573	23%	0.234	S	C	*	.	H	α-helix	trans	-65.9	-27	173.7	82.3	0	0	0	0	113.6	Q526 Y527 C528 K532	Q526-S530 PolarHBondContact O-N 2.87Å; Y527-S530 WeakPolarHBondContact O-CB 3.31Å; Y527-S530 PolarHBondContact O-N 3.23Å; Y527-S530 PolarHBondContact O-OG 3.25Å; C528-S530 PolarHBondContact O-N 3.06Å; S530-K532 VanDerWaalsContact C-N 3.34Å; S530-K532 PolarHBondContact O-N 3.34Å; S530-K532 VanDerWaalsContact O-N 3.11Å
531	L	87.3	Confident	75.7	Confident	6 Å²	6	52 Å²	52	3%	0.031	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	75.4	171.7	-58.7	178.5	0	0	0	109.4	T502 V504 Y527 C528 D529 Q533 G534 C703 H705 F743	T502-L531 HydrophobicContact CG2-CD1 4.29Å; V504-L531 HydrophobicContact CG2-CD1 4.34Å; Y527-L531 HydrophobicContact CE1-CD1 4.41Å; C528-L531 CarbonylContact O-C 3.58Å; C528-L531 WeakPolarHBondContact O-CA 3.42Å; C528-L531 WeakPolarHBondContact O-CB 3.48Å; C528-L531 PolarHBondContact O-N 2.86Å; D529-L531 VanDerWaalsContact C-N 3.26Å; D529-L531 PolarHBondContact O-N 2.83Å; L531-Q533 PolarHBondContact O-N 2.9Å; L531-G534 WeakPolarHBondContact O-CA 2.96Å; L531-G534 PolarHBondContact O-N 3.1Å; L531-C703 HydrophobicContact CD1-CB 4.08Å; L531-H705 HydrophobicContact CB-CB 4.34Å; L531-H705 WeakPolarHBondContact O-CB 3.37Å; L531-F743 HydrophobicContact CD2-CE2 3.65Å; L531-F743 HydrophobicContact CD2-CZ 3.87Å
532	K	85.2	Confident	75.1	Confident	51 Å²	51	53.1 Å²	53.1	22%	0.222	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	46.1	175.3	-89.8	-169.6	172.3	-155.8	0	114.8	S530 G534 Y706 A707 Y708 E740	S530-K532 VanDerWaalsContact C-N 3.34Å; S530-K532 PolarHBondContact O-N 3.34Å; S530-K532 VanDerWaalsContact O-N 3.11Å; K532-G534 PolarHBondContact O-N 2.86Å; K532-Y706 WeakPolarHBondContact CD-O 3.01Å; K532-A707 WeakPolarHBondContact CE-O 3.39Å; K532-A707 PolarHBondContact NZ-O 2.75Å; K532-Y708 HydrophobicContact CD-CD1 4.35Å; K532-Y708 HydrophobicContact CD-CD2 4.25Å; K532-Y708 HydrophobicContact CD-CE1 4.22Å; K532-Y708 HydrophobicContact CD-CE2 4.1Å; K532-Y708 HydrophobicContact CD-CG 4.36Å; K532-Y708 HydrophobicContact CG-CE1 3.96Å; K532-Y708 HydrophobicContact CG-CE2 4.11Å; K532-Y708 PolarHBondContact N-OH 2.8Å; K532-E740 WeakPolarHBondContact CE-OE1 3.3Å; K532-E740 WeakPolarHBondContact CE-OE2 3.31Å; K532-E740 IonicContact NZ-OE1 3.16Å; K532-E740 PolarHBondContact NZ-OE1 3.02Å; K532-E740 VanDerWaalsContact NZ-OE1 3.17Å; K532-E740 IonicContact NZ-OE2 2.7Å; K532-E740 PolarHBondContact NZ-OE2 3.16Å
533	Q	79.6	Confident	74.5	Confident	170 Å²	170	55.1 Å²	55.1	79%	0.794	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	34.3	-176.6	-56.5	175	-5.2	0	0	112.3	D529 L531	D529-Q533 WeakPolarHBondContact O-CA 3.35Å; D529-Q533 PolarHBondContact O-N 3.29Å; D529-Q533 WeakPolarHBondContact OD1-CA 3.44Å; L531-Q533 PolarHBondContact O-N 2.9Å
534	G	81.7	Confident	73.6	Confident	6 Å²	6	59.4 Å²	59.4	6%	0.062	30%	0.299	C	S	.	.			trans	-68.1	162.7	176.4	0	0	0	0	0	113	C528 D529 L531 K532 E704	C528-G534 CarbonylContact C-O 3.59Å; C528-G534 WeakPolarHBondContact CB-O 3.34Å; C528-G534 CarbonylContact O-C 3.57Å; C528-G534 WeakPolarHBondContact O-CA 3.41Å; C528-G534 PolarHBondContact O-N 3.28Å; D529-G534 WeakPolarHBondContact CA-O 3.35Å; D529-G534 PolarHBondContact N-O 2.79Å; D529-G534 VanDerWaalsContact N-O 3.14Å; L531-G534 WeakPolarHBondContact O-CA 2.96Å; L531-G534 PolarHBondContact O-N 3.1Å; K532-G534 PolarHBondContact O-N 2.86Å; G534-E704 VanDerWaalsContact CA-O 3.24Å; G534-E704 WeakPolarHBondContact CA-O 3.36Å
535	K	83	Confident	73.1	Confident	114 Å²	114	60.4 Å²	60.4	50%	0.496	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	154.3	-178.4	71.9	-159.2	-178.7	-150.9	0	111.2	Y537 C703 E704	K535-Y537 PolarHBondContact O-N 2.74Å; K535-C703 WeakPolarHBondContact O-CA 3.11Å; K535-E704 WeakPolarHBondContact CE-OE2 3.44Å; K535-E704 PolarHBondContact N-O 3.42Å; K535-E704 IonicContact NZ-OE2 3.22Å; K535-E704 PolarHBondContact NZ-OE2 3.31Å; K535-E704 PolarHBondContact O-N 3.36Å
536	V	79.1	Confident	72.7	Confident	21 Å²	21	61 Å²	61	13%	0.127	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	131	172.8	-178.3	0	0	0	0	109.2	A524 A702	A524-V536 HydrophobicContact CB-CG2 3.76Å; V536-A702 CarbonylContact C-O 3.48Å; V536-A702 WeakPolarHBondContact CA-O 3.43Å
537	Y	78.6	Confident	72	Confident	30 Å²	30	61.7 Å²	61.7	12%	0.118	32%	0.319	C	S	.	.			trans	-101	129.3	-178.3	-169.8	-88.5	0	0	0	111.9	M501 K535 F539 K544 A702 E704	M501-Y537 HydrophobicContact CE-CD1 3.66Å; M501-Y537 HydrophobicContact CE-CD2 3.74Å; M501-Y537 HydrophobicContact CE-CE1 4.04Å; M501-Y537 HydrophobicContact CE-CE2 4.1Å; M501-Y537 HydrophobicContact CE-CG 3.5Å; M501-Y537 VanDerWaalsContact CE-CG 3.5Å; M501-Y537 HydrophobicContact SD-CD1 4.45Å; M501-Y537 HydrophobicContact SD-CG 4.21Å; K535-Y537 PolarHBondContact O-N 2.74Å; Y537-F539 AromaticContact CD1-CD1 3.96Å; Y537-F539 HydrophobicContact CD1-CD1 3.96Å; Y537-F539 HydrophobicContact CD1-CD2 4.11Å; Y537-F539 AromaticContact CD1-CE1 3.75Å; Y537-F539 HydrophobicContact CD1-CE1 3.75Å; Y537-F539 AromaticContact CD1-CE2 3.93Å; Y537-F539 HydrophobicContact CD1-CE2 3.93Å; Y537-F539 HydrophobicContact CD1-CG 4.12Å; Y537-F539 AromaticContact CD1-CZ 3.74Å; Y537-F539 HydrophobicContact CD1-CZ 3.74Å; Y537-F539 AromaticContact CE1-CD1 3.64Å; Y537-F539 HydrophobicContact CE1-CD1 3.64Å; Y537-F539 AromaticContact CE1-CE1 3.65Å; Y537-F539 HydrophobicContact CE1-CE1 3.65Å; Y537-F539 HydrophobicContact CE1-CG 4.11Å; Y537-F539 HydrophobicContact CE1-CZ 4.14Å; Y537-K544 WeakPolarHBondContact OH-CD 3.22Å; Y537-A702 PolarHBondContact N-O 3.19Å; Y537-E704 HydrophobicContact CD2-CB 3.9Å; Y537-E704 HydrophobicContact CD2-CG 4.43Å; Y537-E704 WeakPolarHBondContact CE2-OE1 3.08Å; Y537-E704 HydrophobicContact CG-CB 4.48Å
538	H	70	Confident	71	Confident	28 Å²	28	62.5 Å²	62.5	13%	0.13	33%	0.327	C	S	.	.			trans	-105.5	117.8	-178.6	-65.4	-79.4	0	0	0	110.9	Y540 Y562	H538-Y540 VanDerWaalsContact C-N 3.35Å; H538-Y540 HydrophobicContact CB-CD2 4.26Å; H538-Y540 HydrophobicContact CB-CE2 3.66Å; H538-Y540 WeakPolarHBondContact O-CD2 3.43Å; H538-Y540 PolarHBondContact O-N 3.16Å; H538-Y562 PolarHBondContact ND1-O 3.11Å
539	F	63.6	Low	70	Confident	3 Å²	3	64.1 Å²	64.1	1%	0.013	34%	0.337	C	S	.	.			trans	-82.8	66.1	-174.3	-71.4	-80.4	0	0	0	113.6	M501 F503 Y537 D541 L545 V560 Y562 Y676 A702	M501-F539 HydrophobicContact CE-CZ 4.32Å; M501-F539 HydrophobicContact SD-CZ 4.28Å; F503-F539 AromaticContact CE1-CE2 3.9Å; F503-F539 HydrophobicContact CE1-CE2 3.9Å; F503-F539 AromaticContact CE1-CZ 3.79Å; F503-F539 HydrophobicContact CE1-CZ 3.79Å; F503-F539 HydrophobicContact CZ-CE2 4.45Å; F503-F539 AromaticContact CZ-CZ 3.88Å; F503-F539 HydrophobicContact CZ-CZ 3.88Å; Y537-F539 AromaticContact CD1-CD1 3.96Å; Y537-F539 HydrophobicContact CD1-CD1 3.96Å; Y537-F539 HydrophobicContact CD1-CD2 4.11Å; Y537-F539 AromaticContact CD1-CE1 3.75Å; Y537-F539 HydrophobicContact CD1-CE1 3.75Å; Y537-F539 AromaticContact CD1-CE2 3.93Å; Y537-F539 HydrophobicContact CD1-CE2 3.93Å; Y537-F539 HydrophobicContact CD1-CG 4.12Å; Y537-F539 AromaticContact CD1-CZ 3.74Å; Y537-F539 HydrophobicContact CD1-CZ 3.74Å; Y537-F539 AromaticContact CE1-CD1 3.64Å; Y537-F539 HydrophobicContact CE1-CD1 3.64Å; Y537-F539 AromaticContact CE1-CE1 3.65Å; Y537-F539 HydrophobicContact CE1-CE1 3.65Å; Y537-F539 HydrophobicContact CE1-CG 4.11Å; Y537-F539 HydrophobicContact CE1-CZ 4.14Å; F539-D541 PolarHBondContact O-N 3.44Å; F539-D541 VanDerWaalsContact O-N 3.16Å; F539-L545 HydrophobicContact CD1-CD2 4.21Å; F539-L545 HydrophobicContact CE1-CD2 3.57Å; F539-L545 HydrophobicContact CE1-CG 4.32Å; F539-L545 HydrophobicContact CZ-CD2 4.26Å; F539-V560 HydrophobicContact CE2-CG1 4.23Å; F539-Y562 WeakPolarHBondContact O-CE2 3.47Å; F539-Y676 HydrophobicContact CB-CD2 4.41Å; F539-Y676 HydrophobicContact CB-CG 4.45Å; F539-A702 HydrophobicContact CE2-CB 3.56Å; F539-A702 HydrophobicContact CZ-CB 4.04Å
540	Y	54.9	Low	69.3	Low	131 Å²	131	68.7 Å²	68.7	51%	0.514	35%	0.353	S	S	.	.	S	Bend	trans	-52.8	-35.9	178.7	-63.9	-83	0	0	0	114.1	H538 F607	H538-Y540 VanDerWaalsContact C-N 3.35Å; H538-Y540 HydrophobicContact CB-CD2 4.26Å; H538-Y540 HydrophobicContact CB-CE2 3.66Å; H538-Y540 WeakPolarHBondContact O-CD2 3.43Å; H538-Y540 PolarHBondContact O-N 3.16Å; Y540-F607 HydrophobicContact CE1-CD1 4.06Å; Y540-F607 AromaticContact CE1-CE1 3.47Å; Y540-F607 HydrophobicContact CE1-CE1 3.47Å; Y540-F607 VanDerWaalsContact CE1-CE1 3.47Å; Y540-F607 AromaticContact CE1-CZ 3.8Å; Y540-F607 HydrophobicContact CE1-CZ 3.8Å; Y540-F607 AromaticContact CZ-CE1 3.88Å; Y540-F607 WeakPolarHBondContact OH-CD1 3.49Å
541	D	51.2	Low	68.6	Low	84 Å²	84	66.1 Å²	66.1	45%	0.449	33%	0.331	S	S	.	.			trans	-143.9	140.7	176.7	179.2	7.8	0	0	0	110.4	F539 S543	F539-D541 PolarHBondContact O-N 3.44Å; F539-D541 VanDerWaalsContact O-N 3.16Å; D541-S543 PolarHBondContact O-N 3.14Å; D541-S543 PolarHBondContact OD1-N 2.97Å; D541-S543 WeakPolarHBondContact OD2-CB 2.2Å; D541-S543 PolarHBondContact OD2-OG 2.98Å
542	S	51.6	Low	67.7	Low	30 Å²	30	65.9 Å²	65.9	21%	0.21	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-59.9	-21.9	170.7	59.9	0	0	0	0	115.2	K544 L545 H684	S542-K544 PolarHBondContact O-N 2.83Å; S542-L545 PolarHBondContact O-N 2.94Å; S542-H684 WeakPolarHBondContact CB-ND1 3.29Å; S542-H684 PolarHBondContact OG-CE1 3.02Å; S542-H684 VanDerWaalsContact OG-CE1 3.25Å; S542-H684 PolarHBondContact OG-ND1 2.8Å
543	S	54.3	Low	66.8	Low	88 Å²	88	65.9 Å²	65.9	62%	0.615	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-58.7	-15.6	178.8	66.4	0	0	0	0	114.7	D541	D541-S543 PolarHBondContact O-N 3.14Å; D541-S543 PolarHBondContact OD1-N 2.97Å; D541-S543 WeakPolarHBondContact OD2-CB 2.2Å; D541-S543 PolarHBondContact OD2-OG 2.98Å
544	K	56.9	Low	66.1	Low	141 Å²	141	63.4 Å²	63.4	61%	0.613	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-93.1	-2.4	175.5	-70.8	-165.4	172.2	-168.8	0	115.3	Y537 S542	Y537-K544 WeakPolarHBondContact OH-CD 3.22Å; S542-K544 PolarHBondContact O-N 2.83Å
545	L	66.5	Low	65.6	Low	20 Å²	20	67.3 Å²	67.3	11%	0.105	36%	0.359	C	S	.	.	S	Bend	trans	-77.9	141.4	166.5	-72	177.7	0	0	0	109.8	Y493 F539 S542 W551 Y676 A678	Y493-L545 HydrophobicContact CE1-CD2 4Å; F539-L545 HydrophobicContact CD1-CD2 4.21Å; F539-L545 HydrophobicContact CE1-CD2 3.57Å; F539-L545 HydrophobicContact CE1-CG 4.32Å; F539-L545 HydrophobicContact CZ-CD2 4.26Å; S542-L545 PolarHBondContact O-N 2.94Å; L545-W551 HydrophobicContact CD1-CZ2 4.31Å; L545-W551 HydrophobicContact CD2-CH2 4.1Å; L545-W551 HydrophobicContact CD2-CZ2 3.86Å; L545-Y676 HydrophobicContact CD1-CE1 4.04Å; L545-Y676 WeakPolarHBondContact CD1-OH 3.48Å; L545-A678 HydrophobicContact CD1-CB 4.4Å
546	P	65.8	Low	65.1	Low	42 Å²	42	68 Å²	68	27%	0.273	37%	0.367	S	S	.	.			trans	-63	144.4	175.5	27.7	-34.9	0	0	0	110.5	Y493 D548 L682	Y493-P546 HydrophobicContact CD1-CG 3.99Å; Y493-P546 HydrophobicContact CD2-CG 3.83Å; Y493-P546 HydrophobicContact CE1-CG 4.18Å; Y493-P546 HydrophobicContact CE2-CG 4.03Å; Y493-P546 HydrophobicContact CG-CG 3.82Å; Y493-P546 VanDerWaalsContact CZ-CD 3.48Å; P546-D548 PolarHBondContact O-N 2.02Å; P546-L682 WeakPolarHBondContact O-CD2 3.43Å
547	T	63.6	Low	65	Low	125 Å²	125	71.7 Å²	71.7	77%	0.767	38%	0.38	S	S	*	.	S	Bend	trans	-66.6	-22.5	179.3	45.2	0	0	0	0	113.2	L682	T547-L682 HydrophobicContact CG2-CD1 4.07Å
548	D	65.5	Low	65.2	Low	71 Å²	71	70.5 Å²	70.5	38%	0.38	38%	0.375	S	S	.	.			trans	-84.3	120.5	168.6	-167.6	-25.4	0	0	0	110	P546 K550 W551	P546-D548 PolarHBondContact O-N 2.02Å; D548-K550 WeakPolarHBondContact OD1-CB 2.18Å; D548-K550 WeakPolarHBondContact OD1-CD 3.23Å; D548-K550 WeakPolarHBondContact OD1-CG 3.43Å; D548-K550 PolarHBondContact OD1-N 3.01Å; D548-K550 IonicContact OD1-NZ 2.68Å; D548-K550 WeakPolarHBondContact OD2-CD 3.41Å; D548-K550 VanDerWaalsContact OD2-CE 3.24Å; D548-K550 WeakPolarHBondContact OD2-CE 3.21Å; D548-K550 IonicContact OD2-NZ 3.68Å; D548-K550 PolarHBondContact OD2-NZ 3.29Å; D548-W551 PolarHBondContact O-NE1 2.91Å
549	T	64.9	Low	65.9	Low	34 Å²	34	69.6 Å²	69.6	21%	0.209	37%	0.371	C	S	.	.			trans	-97.3	10.5	-178.2	54	0	0	0	0	114.2	W551 L552 T680 L682	T549-W551 PolarHBondContact O-N 2.86Å; T549-L552 HydrophobicContact CG2-CD1 4.47Å; T549-L552 WeakPolarHBondContact O-CB 3.5Å; T549-L552 PolarHBondContact O-N 2.78Å; T549-T680 PolarHBondContact OG1-O 3.43Å; T549-L682 HydrophobicContact CG2-CD2 3.84Å; T549-L682 HydrophobicContact CG2-CG 4.4Å
550	K	66.6	Low	66.8	Low	165 Å²	165	69.4 Å²	69.4	72%	0.717	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-50.6	-30.8	177.2	-79.5	164.7	-162.4	148.1	0	114.1	D548 L552 G553	D548-K550 WeakPolarHBondContact OD1-CB 2.18Å; D548-K550 WeakPolarHBondContact OD1-CD 3.23Å; D548-K550 WeakPolarHBondContact OD1-CG 3.43Å; D548-K550 PolarHBondContact OD1-N 3.01Å; D548-K550 IonicContact OD1-NZ 2.68Å; D548-K550 WeakPolarHBondContact OD2-CD 3.41Å; D548-K550 VanDerWaalsContact OD2-CE 3.24Å; D548-K550 WeakPolarHBondContact OD2-CE 3.21Å; D548-K550 IonicContact OD2-NZ 3.68Å; D548-K550 PolarHBondContact OD2-NZ 3.29Å; K550-L552 PolarHBondContact O-N 2.96Å; K550-G553 WeakPolarHBondContact O-CA 3.41Å; K550-G553 PolarHBondContact O-N 2.85Å
551	W	70.3	Confident	68	Low	28 Å²	28	63.4 Å²	63.4	11%	0.106	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-64.9	-16.6	178.2	62.4	-92	0	0	0	114.6	G492 Y493 F503 L545 D548 T549 G553 I558 A678	G492-W551 WeakPolarHBondContact O-CB 3.27Å; Y493-W551 AromaticContact CD1-CD2 3.84Å; Y493-W551 HydrophobicContact CD1-CD2 3.84Å; Y493-W551 HydrophobicContact CD1-CE3 4.26Å; Y493-W551 AromaticContact CD1-CG 3.95Å; Y493-W551 HydrophobicContact CD1-CG 3.95Å; Y493-W551 HydrophobicContact CE1-CD2 4.46Å; Y493-W551 HydrophobicContact CE1-CZ2 4.48Å; Y493-W551 HydrophobicContact CG-CG 4.5Å; F503-W551 HydrophobicContact CD2-CE3 4.18Å; F503-W551 AromaticContact CD2-CZ3 3.97Å; F503-W551 HydrophobicContact CD2-CZ3 3.97Å; F503-W551 HydrophobicContact CE1-CZ3 4.44Å; F503-W551 AromaticContact CE2-CE3 3.61Å; F503-W551 HydrophobicContact CE2-CE3 3.61Å; F503-W551 HydrophobicContact CE2-CH2 4.01Å; F503-W551 AromaticContact CE2-CZ3 3.27Å; F503-W551 HydrophobicContact CE2-CZ3 3.27Å; F503-W551 HydrophobicContact CZ-CE3 4.32Å; F503-W551 AromaticContact CZ-CH2 3.88Å; F503-W551 HydrophobicContact CZ-CH2 3.88Å; F503-W551 AromaticContact CZ-CZ3 3.56Å; F503-W551 HydrophobicContact CZ-CZ3 3.56Å; L545-W551 HydrophobicContact CD1-CZ2 4.31Å; L545-W551 HydrophobicContact CD2-CH2 4.1Å; L545-W551 HydrophobicContact CD2-CZ2 3.86Å; D548-W551 PolarHBondContact O-NE1 2.91Å; T549-W551 PolarHBondContact O-N 2.86Å; W551-G553 VanDerWaalsContact C-N 3.26Å; W551-I558 HydrophobicContact CH2-CD1 4.42Å; W551-I558 HydrophobicContact CZ3-CD1 3.8Å; W551-A678 HydrophobicContact CH2-CB 4.05Å
552	L	69.1	Low	69	Low	1 Å²	1	60.7 Å²	60.7	1%	0.005	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-78.6	-11.5	169	-70.5	169	0	0	0	112.4	T549 K550 F555 I558 A678 T680	T549-L552 HydrophobicContact CG2-CD1 4.47Å; T549-L552 WeakPolarHBondContact O-CB 3.5Å; T549-L552 PolarHBondContact O-N 2.78Å; K550-L552 PolarHBondContact O-N 2.96Å; L552-F555 WeakPolarHBondContact O-CB 3.42Å; L552-F555 WeakPolarHBondContact O-CD2 3.22Å; L552-F555 PolarHBondContact O-N 3.32Å; L552-I558 HydrophobicContact CD2-CB 4.35Å; L552-I558 HydrophobicContact CD2-CD1 3.96Å; L552-I558 HydrophobicContact CD2-CG1 3.68Å; L552-I558 HydrophobicContact CD2-CG2 3.94Å; L552-A678 HydrophobicContact CD2-CB 4.43Å; L552-T680 HydrophobicContact CB-CG2 4.09Å; L552-T680 HydrophobicContact CD1-CG2 3.88Å
553	G	65.7	Low	69.8	Low	51 Å²	51	59.5 Å²	59.5	53%	0.526	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	-123.8	174.8	0	0	0	0	0	112.9	K550 W551 F555	K550-G553 WeakPolarHBondContact O-CA 3.41Å; K550-G553 PolarHBondContact O-N 2.85Å; W551-G553 VanDerWaalsContact C-N 3.26Å; G553-F555 VanDerWaalsContact C-N 3.3Å; G553-F555 PolarHBondContact O-N 2.69Å
554	P	65.5	Low	70.3	Confident	119 Å²	119	56.1 Å²	56.1	77%	0.773	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	2.3	-179.3	36.1	-36.9	0	0	0	114.3
555	F	71.1	Confident	70.6	Confident	88 Å²	88	49.5 Å²	49.5	39%	0.386	27%	0.271	S	S	.	.			trans	-94.3	124	-174.7	-59.5	-72.8	0	0	0	112.2	L491 L552 G553 Y557 I558 T680	L491-F555 HydrophobicContact CD1-CD2 3.94Å; L491-F555 HydrophobicContact CD1-CE2 3.99Å; L491-F555 HydrophobicContact CD2-CD2 4.39Å; L491-F555 HydrophobicContact CD2-CE2 4.21Å; L552-F555 WeakPolarHBondContact O-CB 3.42Å; L552-F555 WeakPolarHBondContact O-CD2 3.22Å; L552-F555 PolarHBondContact O-N 3.32Å; G553-F555 VanDerWaalsContact C-N 3.3Å; G553-F555 PolarHBondContact O-N 2.69Å; F555-Y557 PolarHBondContact O-N 2.88Å; F555-I558 HydrophobicContact CB-CG2 4.22Å; F555-I558 HydrophobicContact CD2-CG2 4.49Å; F555-I558 HydrophobicContact CG-CG2 4.42Å; F555-T680 WeakPolarHBondContact O-CG2 3.42Å
556	D	72.5	Confident	70.3	Confident	127 Å²	127	49.7 Å²	49.7	68%	0.679	27%	0.272	S	S	*	.	S	Bend	trans	-56.4	-34.4	169.9	-75.9	-51.5	0	0	0	112.5	K679 T680	D556-K679 WeakPolarHBondContact O-CA 3.43Å; D556-T680 PolarHBondContact O-N 3.01Å
557	Y	77.7	Confident	70	Confident	100 Å²	100	47.8 Å²	47.8	39%	0.392	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	158.1	177.7	68	-88.7	0	0	0	112.5	F555 D559 R677 A678	F555-Y557 PolarHBondContact O-N 2.88Å; Y557-D559 WeakPolarHBondContact CE2-OD2 3.15Å; Y557-R677 HydrophobicContact CD2-CG 3.97Å; Y557-R677 VanDerWaalsContact CD2-NE 3.28Å; Y557-R677 VanDerWaalsContact CE2-NH2 3.27Å; Y557-R677 HydrophobicContact CG-CG 4.15Å; Y557-A678 CarbonylContact C-O 3.27Å; Y557-A678 WeakPolarHBondContact CA-O 3.4Å; Y557-A678 WeakPolarHBondContact CB-O 3.36Å
558	I	82.7	Confident	70	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	148.9	163.3	66.3	170	0	0	0	110.8	L491 F503 W551 L552 F555 V560 R677 A678 Y700	L491-I558 HydrophobicContact CD1-CG2 3.87Å; F503-I558 HydrophobicContact CD1-CD1 4.03Å; F503-I558 HydrophobicContact CE1-CD1 4.22Å; F503-I558 HydrophobicContact CG-CD1 4.19Å; W551-I558 HydrophobicContact CH2-CD1 4.42Å; W551-I558 HydrophobicContact CZ3-CD1 3.8Å; L552-I558 HydrophobicContact CD2-CB 4.35Å; L552-I558 HydrophobicContact CD2-CD1 3.96Å; L552-I558 HydrophobicContact CD2-CG1 3.68Å; L552-I558 HydrophobicContact CD2-CG2 3.94Å; F555-I558 HydrophobicContact CB-CG2 4.22Å; F555-I558 HydrophobicContact CD2-CG2 4.49Å; F555-I558 HydrophobicContact CG-CG2 4.42Å; I558-V560 HydrophobicContact CD1-CG2 3.69Å; I558-V560 HydrophobicContact CG1-CG2 3.82Å; I558-R677 WeakPolarHBondContact O-CA 3.15Å; I558-A678 HydrophobicContact CG1-CB 4Å; I558-A678 PolarHBondContact N-O 2.85Å; I558-A678 PolarHBondContact O-N 2.95Å; I558-Y700 HydrophobicContact CB-CD2 3.92Å; I558-Y700 HydrophobicContact CB-CE2 3.83Å; I558-Y700 HydrophobicContact CD1-CD2 4.27Å; I558-Y700 HydrophobicContact CG2-CD2 4.32Å; I558-Y700 HydrophobicContact CG2-CE2 3.76Å
559	D	83.4	Confident	69.6	Low	9 Å²	9	44.4 Å²	44.4	5%	0.048	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	114	178.1	-62.6	-30.9	0	0	0	109.1	Y557 R677 F687 K699 Y700	Y557-D559 WeakPolarHBondContact CE2-OD2 3.15Å; D559-R677 WeakPolarHBondContact OD1-CB 3.04Å; D559-R677 WeakPolarHBondContact OD1-CG 3.29Å; D559-R677 IonicContact OD1-CZ 2.68Å; D559-R677 IonicContact OD1-NE 3.2Å; D559-R677 PolarHBondContact OD1-NE 2.04Å; D559-R677 IonicContact OD1-NH2 3.8Å; D559-R677 PolarHBondContact OD1-NH2 2.79Å; D559-R677 IonicContact OD2-CZ 2.71Å; D559-R677 IonicContact OD2-NE 3.31Å; D559-R677 IonicContact OD2-NH2 3.42Å; D559-R677 PolarHBondContact OD2-NH2 2.81Å; D559-F687 HydrophobicContact CB-CE2 4.16Å; D559-F687 HydrophobicContact CB-CZ 4.34Å; D559-F687 WeakPolarHBondContact OD1-CE2 3.29Å; D559-F687 WeakPolarHBondContact OD1-CZ 3.49Å; D559-K699 PolarHBondContact O-N 3.23Å; D559-Y700 PolarHBondContact O-N 3.31Å
560	V	82.7	Confident	69.2	Low	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	145.1	-171.6	-167.2	0	0	0	0	110	F503 F539 I558 Y562 A675 Y676 Y700 A702	F503-V560 HydrophobicContact CD1-CG1 4.06Å; F503-V560 HydrophobicContact CD1-CG2 4.02Å; F503-V560 HydrophobicContact CE1-CG1 4.13Å; F503-V560 HydrophobicContact CE1-CG2 3.95Å; F539-V560 HydrophobicContact CE2-CG1 4.23Å; I558-V560 HydrophobicContact CD1-CG2 3.69Å; I558-V560 HydrophobicContact CG1-CG2 3.82Å; V560-Y562 PolarHBondContact O-N 3.15Å; V560-A675 CarbonylContact O-C 3.52Å; V560-A675 VanDerWaalsContact O-CA 3.28Å; V560-A675 WeakPolarHBondContact O-CA 3.39Å; V560-Y676 PolarHBondContact N-O 2.86Å; V560-Y676 PolarHBondContact O-N 2.82Å; V560-Y700 CarbonylContact C-O 3.5Å; V560-Y700 WeakPolarHBondContact CA-O 3.46Å; V560-A702 HydrophobicContact CG1-CB 4.23Å
561	F	79.9	Confident	68.5	Low	4 Å²	4	45.6 Å²	45.6	2%	0.018	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	132.7	171.4	-176.9	-105.8	0	0	0	111.2	V521 G563 C673 W698 Y700 F701	V521-F561 HydrophobicContact CG2-CE1 3.95Å; V521-F561 HydrophobicContact CG2-CZ 3.87Å; F561-G563 VanDerWaalsContact CZ-C 3.48Å; F561-C673 HydrophobicContact CE2-CB 4.26Å; F561-W698 HydrophobicContact CB-CB 4.48Å; F561-W698 HydrophobicContact CB-CD2 4.4Å; F561-W698 HydrophobicContact CB-CG 3.98Å; F561-W698 AromaticContact CD2-CD2 3.89Å; F561-W698 HydrophobicContact CD2-CD2 3.89Å; F561-W698 AromaticContact CD2-CE2 3.68Å; F561-W698 HydrophobicContact CD2-CE3 4.28Å; F561-W698 HydrophobicContact CD2-CG 4.36Å; F561-W698 HydrophobicContact CD2-CH2 4.35Å; F561-W698 AromaticContact CD2-CZ2 3.94Å; F561-W698 HydrophobicContact CD2-CZ2 3.94Å; F561-W698 AromaticContact CD2-NE1 3.98Å; F561-W698 HydrophobicContact CE2-CH2 4.43Å; F561-W698 HydrophobicContact CE2-CZ2 4.22Å; F561-Y700 PolarHBondContact N-O 2.95Å; F561-F701 HydrophobicContact CB-CD1 3.59Å; F561-F701 HydrophobicContact CB-CE1 3.66Å; F561-F701 HydrophobicContact CB-CG 4.28Å; F561-F701 HydrophobicContact CB-CZ 4.4Å; F561-F701 AromaticContact CD1-CD1 3.81Å; F561-F701 HydrophobicContact CD1-CD1 3.81Å; F561-F701 AromaticContact CD1-CE1 3.67Å; F561-F701 HydrophobicContact CD1-CE1 3.67Å; F561-F701 HydrophobicContact CD2-CE1 4.1Å; F561-F701 HydrophobicContact CE1-CE1 4.32Å; F561-F701 AromaticContact CG-CD1 3.84Å; F561-F701 HydrophobicContact CG-CD1 3.84Å; F561-F701 AromaticContact CG-CE1 3.53Å; F561-F701 HydrophobicContact CG-CE1 3.53Å; F561-F701 HydrophobicContact CG-CZ 4.42Å
562	Y	73.6	Confident	67.6	Low	28 Å²	28	49.8 Å²	49.8	11%	0.11	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-42.8	179.4	-178.5	-79.3	0	0	0	111.9	H538 F539 V560 R674 Y676 V686	H538-Y562 PolarHBondContact ND1-O 3.11Å; F539-Y562 WeakPolarHBondContact O-CE2 3.47Å; V560-Y562 PolarHBondContact O-N 3.15Å; Y562-R674 WeakPolarHBondContact CB-O 3.32Å; Y562-R674 HydrophobicContact CD1-CB 4.23Å; Y562-R674 PolarHBondContact N-O 2.62Å; Y562-Y676 HydrophobicContact CD2-CD2 4.39Å; Y562-V686 HydrophobicContact CE2-CG1 4.47Å
563	G	68.1	Low	66.4	Low	5 Å²	5	55.1 Å²	55.1	5%	0.052	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.3	-175.3	-176.3	0	0	0	0	0	113.8	F561 R674	F561-G563 VanDerWaalsContact CZ-C 3.48Å; G563-R674 PolarHBondContact O-N 2.72Å
564	S	64.2	Low	65.4	Low	16 Å²	16	55.3 Å²	55.3	11%	0.112	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.9	-178.7	50.5	0	0	0	0	111.9	F606 F672	S564-F606 CarbonylContact O-C 3.59Å; S564-F606 PolarHBondContact O-N 3.01Å; S564-F606 VanDerWaalsContact O-O 3.08Å; S564-F606 PolarHBondContact OG-O 2.76Å; S564-F672 CarbonylContact C-O 3.45Å; S564-F672 WeakPolarHBondContact CA-O 3.4Å
565	S	63.4	Low	64.2	Low	2 Å²	2	54.2 Å²	54.2	1%	0.014	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	141	176.2	-43.7	0	0	0	0	109.7	M649 F672	S565-M649 WeakPolarHBondContact OG-CE 3.16Å; S565-F672 PolarHBondContact N-O 3.2Å; S565-F672 PolarHBondContact O-N 2.93Å
566	L	60.4	Low	63	Low	25 Å²	25	53.4 Å²	53.4	13%	0.131	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	110.3	171.9	-176.7	61.4	0	0	0	108.6	M604 F606 F671	L566-M604 CarbonylContact C-O 3.53Å; L566-M604 HydrophobicContact CD2-CE 4.03Å; L566-M604 HydrophobicContact CG-CE 4.38Å; L566-M604 PolarHBondContact N-O 3.47Å; L566-M604 PolarHBondContact O-N 3.18Å; L566-M604 VanDerWaalsContact O-N 3.12Å; L566-F606 HydrophobicContact CB-CD2 3.51Å; L566-F606 HydrophobicContact CB-CE2 3.55Å; L566-F606 HydrophobicContact CD2-CD2 4.44Å; L566-F606 HydrophobicContact CD2-CE2 3.76Å; L566-F606 HydrophobicContact CD2-CZ 4.16Å; L566-F606 HydrophobicContact CG-CE2 4.26Å; L566-F671 HydrophobicContact CB-CD1 4.41Å; L566-F671 HydrophobicContact CB-CE1 4.3Å; L566-F671 HydrophobicContact CD1-CD1 4.2Å; L566-F671 HydrophobicContact CD1-CD2 4.43Å; L566-F671 HydrophobicContact CD1-CE1 4.21Å; L566-F671 HydrophobicContact CD1-CE2 4.43Å; L566-F671 HydrophobicContact CD1-CG 4.32Å; L566-F671 HydrophobicContact CD1-CZ 4.33Å
567	L	59.8	Low	61.5	Low	1 Å²	1	53.6 Å²	53.6	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	126	176.6	-94.5	151.6	0	0	0	109.1	L603 F650 L663 G669 T670 F672 L689	L567-L603 HydrophobicContact CD2-CB 4.31Å; L567-L603 HydrophobicContact CD2-CD1 3.96Å; L567-L603 HydrophobicContact CD2-CG 3.66Å; L567-L603 HydrophobicContact CG-CD1 4.48Å; L567-L603 HydrophobicContact CG-CG 3.98Å; L567-F650 HydrophobicContact CD1-CE1 3.99Å; L567-F650 HydrophobicContact CD2-CE1 3.74Å; L567-F650 HydrophobicContact CD2-CZ 3.9Å; L567-L663 HydrophobicContact CB-CD1 3.62Å; L567-L663 HydrophobicContact CD2-CD1 4.19Å; L567-L663 HydrophobicContact CG-CD1 4.34Å; L567-G669 CarbonylContact O-C 3.01Å; L567-G669 WeakPolarHBondContact O-CA 3.44Å; L567-T670 PolarHBondContact N-O 2.85Å; L567-T670 VanDerWaalsContact N-O 3.12Å; L567-T670 PolarHBondContact O-N 3.27Å; L567-F672 HydrophobicContact CB-CD2 3.82Å; L567-F672 HydrophobicContact CB-CE2 3.76Å; L567-F672 HydrophobicContact CD1-CD2 3.49Å; L567-F672 VanDerWaalsContact CD1-CD2 3.49Å; L567-F672 HydrophobicContact CD1-CE2 3.77Å; L567-F672 HydrophobicContact CD1-CG 4.12Å; L567-F672 HydrophobicContact CG-CD2 4.23Å; L567-F672 HydrophobicContact CG-CE2 4.41Å; L567-L689 HydrophobicContact CD1-CD1 3.72Å
568	K	62	Low	59.7	Low	92 Å²	92	55.7 Å²	55.7	40%	0.4	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	122.2	175.8	-168.5	175.2	179.6	179.4	0	110.5	L602	K568-L602 PolarHBondContact N-O 3.11Å; K568-L602 PolarHBondContact O-N 3.44Å; K568-L602 VanDerWaalsContact O-N 3.07Å
569	P	57.4	Low	57.6	Low	34 Å²	34	56.9 Å²	56.9	22%	0.221	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	145.4	173.1	28.2	-33.9	0	0	0	110.3	S666	P569-S666 WeakPolarHBondContact CD-O 3.44Å; P569-S666 WeakPolarHBondContact CG-O 3.37Å
570	T	56.7	Low	55.4	Low	55 Å²	55	65.6 Å²	65.6	34%	0.337	34%	0.344	S	S	.	.			trans	-104.6	138	175.1	28.9	0	0	0	0	109.9	N572 S600 L602	T570-N572 PolarHBondContact O-N 2.85Å; T570-S600 PolarHBondContact OG1-O 2.77Å; T570-S600 PolarHBondContact OG1-OG 3.16Å; T570-L602 HydrophobicContact CG2-CB 3.99Å
571	D	53.2	Low	53.3	Low	169 Å²	169	71.2 Å²	71.2	90%	0.904	38%	0.378	S	S	*	.	S	Bend	trans	-63.8	-2.6	-171.2	-56.7	-66.5	0	0	0	115.3
572	N	49.6	Very low	51.1	Low	115 Å²	115	82.2 Å²	82.2	62%	0.615	42%	0.42	S	S	*	.			trans	-97.7	103.7	-178.4	-77.3	-23.7	0	0	0	112.4	T570 T574 S600	T570-N572 PolarHBondContact O-N 2.85Å; N572-T574 HydrophobicContact CB-CG2 4.41Å; N572-T574 PolarHBondContact O-N 2.04Å; N572-S600 PolarHBondContact O-OG 2.84Å
573	I	44.6	Very low	49	Very low	114 Å²	114	90.6 Å²	90.6	59%	0.585	46%	0.46	S	S	*	.			trans	-78	88.5	159.4	-54.2	176.9	0	0	0	108	Y599	I573-Y599 HydrophobicContact CD1-CE1 3.95Å; I573-Y599 HydrophobicContact CG1-CD1 4.12Å; I573-Y599 HydrophobicContact CG1-CE1 3.99Å
574	T	45	Very low	47.3	Very low	54 Å²	54	94.3 Å²	94.3	33%	0.331	50%	0.498	S	S	.	.			trans	-92.6	116.8	174.3	37.9	0	0	0	0	111.1	N572 H576	N572-T574 HydrophobicContact CB-CG2 4.41Å; N572-T574 PolarHBondContact O-N 2.04Å; T574-H576 WeakPolarHBondContact CB-NE2 3.38Å; T574-H576 PolarHBondContact O-CD2 3.17Å; T574-H576 PolarHBondContact O-N 3.42Å; T574-H576 PolarHBondContact OG1-CD2 2.94Å; T574-H576 VanDerWaalsContact OG1-CD2 3.23Å; T574-H576 PolarHBondContact OG1-NE2 2.78Å
575	V	41.3	Very low	45.8	Very low	97 Å²	97	97.1 Å²	97.1	59%	0.588	53%	0.529	S	S	*	.			trans	-73.4	89	173.2	-176.9	0	0	0	0	109.4	K577	V575-K577 PolarHBondContact O-N 3.22Å
576	H	45.8	Very low	44.4	Very low	70 Å²	70	100.9 Å²	100.9	32%	0.324	56%	0.561	S	S	.	*			trans	-81.3	106.2	175.7	-73.4	-88.5	0	0	0	110.6	T574 N578 F634	T574-H576 WeakPolarHBondContact CB-NE2 3.38Å; T574-H576 PolarHBondContact O-CD2 3.17Å; T574-H576 PolarHBondContact O-N 3.42Å; T574-H576 PolarHBondContact OG1-CD2 2.94Å; T574-H576 VanDerWaalsContact OG1-CD2 3.23Å; T574-H576 PolarHBondContact OG1-NE2 2.78Å; H576-N578 PolarHBondContact O-N 3Å; H576-F634 AromaticContact CD2-CE1 3.69Å; H576-F634 AromaticContact NE2-CE1 3.8Å
577	K	40.4	Very low	43.3	Very low	131 Å²	131	104.9 Å²	104.9	57%	0.57	59%	0.587	S	S	*	*	S	Bend	trans	-63.3	-31.2	165.2	-83.3	-157.4	168.2	-142.6	0	112.7	V575	V575-K577 PolarHBondContact O-N 3.22Å
578	N	40.1	Very low	42.4	Very low	145 Å²	145	112.6 Å²	112.6	78%	0.775	63%	0.628	S	S	*	*			trans	-122.1	97	-172.2	-59.1	19.2	0	0	0	109.7	H576	H576-N578 PolarHBondContact O-N 3Å
579	A	38.2	Very low	41.8	Very low	29 Å²	29	115.4 Å²	115.4	24%	0.24	65%	0.647	C	S	.	*			trans	-111.1	136.2	153.8	0	0	0	0	0	107.2	V581 Y645	A579-V581 PolarHBondContact O-N 3.14Å; A579-V581 VanDerWaalsContact O-N 3.14Å; A579-Y645 HydrophobicContact CB-CD1 4.49Å; A579-Y645 HydrophobicContact CB-CE1 3.61Å; A579-Y645 PolarHBondContact O-OH 3.34Å
580	E	37.1	Very low	41.3	Very low	191 Å²	191	116.3 Å²	116.3	89%	0.893	65%	0.652	S	S	*	*			trans	-72.3	112.4	-169.5	-66.9	-172.1	150	0	0	111.8	R582	E580-R582 PolarHBondContact O-N 3.05Å
581	V	37.8	Very low	41.1	Very low	119 Å²	119	123 Å²	123	72%	0.721	68%	0.68	S	S	*	*			trans	-68.6	100.9	171.2	-178.5	0	0	0	0	108.5	A579 Q583	A579-V581 PolarHBondContact O-N 3.14Å; A579-V581 VanDerWaalsContact O-N 3.14Å; V581-Q583 PolarHBondContact O-N 2.95Å
582	R	34.9	Very low	41.2	Very low	235 Å²	235	118.1 Å²	118.1	89%	0.887	66%	0.658	S	S	*	*			trans	-57.1	130.4	169.1	-84.6	-173.6	167.2	-172.4	-3.7	109.5	E580 G584	E580-R582 PolarHBondContact O-N 3.05Å; R582-G584 PolarHBondContact O-N 3.3Å
583	Q	29.7	Very low	41.4	Very low	203 Å²	203	115.6 Å²	115.6	95%	0.949	65%	0.648	S	S	*	*	S	Bend	trans	-59.8	128.2	-177.6	-68.1	179.2	-19.4	0	0	111.6	V581	V581-Q583 PolarHBondContact O-N 2.95Å
584	G	32	Very low	41.7	Very low	83 Å²	83	117.8 Å²	117.8	86%	0.856	66%	0.655	S	S	*	*	S	Bend	trans	130.2	88.7	173	0	0	0	0	0	113.6	R582	R582-G584 PolarHBondContact O-N 3.3Å
585	G	32.6	Very low	42	Very low	75 Å²	75	119.3 Å²	119.3	77%	0.773	67%	0.665	S	S	*	*			trans	171.9	-50.5	170.9	0	0	0	0	0	115	T587	G585-T587 PolarHBondContact O-N 2.91Å
586	A	34.5	Very low	42.7	Very low	82 Å²	82	115.7 Å²	115.7	68%	0.678	64%	0.643	S	S	*	*			trans	-77.1	115.1	-175.5	0	0	0	0	0	112.5
587	T	36.5	Very low	43.2	Very low	109 Å²	109	115.4 Å²	115.4	67%	0.669	65%	0.649	S	S	*	*			trans	-70.4	149.9	156.2	49	0	0	0	0	109.9	G585 D589	G585-T587 PolarHBondContact O-N 2.91Å; T587-D589 PolarHBondContact O-N 3.44Å
588	N	40	Very low	44	Very low	163 Å²	163	109.5 Å²	109.5	87%	0.872	62%	0.624	S	S	*	*	S	Bend	trans	-56.2	-3.2	-161.2	-66	-3.1	0	0	0	119.5
589	D	49.4	Very low	44.8	Very low	151 Å²	151	105.3 Å²	105.3	81%	0.807	60%	0.598	S	S	*	*	S	Bend	trans	-120.2	33.2	-165.1	-58.7	-68	0	0	0	114.5	T587	T587-D589 PolarHBondContact O-N 3.44Å
590	T	47.2	Very low	45.8	Very low	52 Å²	52	104.5 Å²	104.5	32%	0.319	59%	0.59	S	S	.	*			trans	-139.3	116.2	175.1	48.3	0	0	0	0	114.1	K642	T590-K642 HydrophobicContact CG2-CD 3.81Å
591	E	53.7	Low	46.7	Very low	196 Å²	196	95.5 Å²	95.5	92%	0.916	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-71.2	128.5	168.4	-63	178.3	133.3	0	0	110.8
592	C	54.3	Low	47.6	Very low	67 Å²	67	92.3 Å²	92.3	45%	0.453	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-101.5	143.1	164.1	-62.4	0	0	0	0	108.7	C643	C592-C643 VanDerWaalsContact CA-SG 3.55Å; C592-C643 HydrophobicContact CB-CB 3.87Å; C592-C643 WeakPolarHBondContact CB-SG 3.47Å; C592-C643 WeakPolarHBondContact SG-CB 3.48Å; C592-C643 CovalentContact SG-SG 2.04Å; C592-C643 PolarHBondContact SG-SG 3.36Å
593	P	53.7	Low	48.6	Very low	61 Å²	61	81.5 Å²	81.5	40%	0.396	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-66.8	137.1	-173.9	25.2	-34.2	0	0	0	113.3	T595 V596	P593-T595 PolarHBondContact O-N 2.94Å; P593-T595 VanDerWaalsContact O-N 3.13Å; P593-V596 HydrophobicContact CG-CG1 3.93Å
594	E	51.2	Low	49.7	Very low	160 Å²	160	74.6 Å²	74.6	75%	0.748	46%	0.455	S	S	*	.	S	Bend	trans	-64.7	-13.4	179.8	-64.2	-165	164.5	0	0	115.1
595	T	51.6	Low	50.5	Low	87 Å²	87	74.3 Å²	74.3	53%	0.534	43%	0.432	S	S	.	.			trans	-138.6	121.9	-178.1	52.1	0	0	0	0	109.8	P593	P593-T595 PolarHBondContact O-N 2.94Å; P593-T595 VanDerWaalsContact O-N 3.13Å
596	V	56.4	Low	51.3	Low	20 Å²	20	74.1 Å²	74.1	12%	0.121	41%	0.41	C	S	.	.			trans	-130.7	137.6	177.1	-85.3	0	0	0	0	110.5	P593 C598 V639	P593-V596 HydrophobicContact CG-CG1 3.93Å; V596-C598 PolarHBondContact O-N 3.41Å; V596-V639 HydrophobicContact CB-CG2 4.47Å; V596-V639 HydrophobicContact CG1-CG2 3.83Å
597	S	56.2	Low	51.9	Low	65 Å²	65	71.7 Å²	71.7	46%	0.455	38%	0.384	S	S	.	.			trans	-81.9	110.9	173.9	-65.7	0	0	0	0	108.8	C636 I637	S597-C636 CarbonylContact O-C 3.6Å; S597-C636 VanDerWaalsContact O-CA 3.32Å; S597-C636 WeakPolarHBondContact O-CA 3.17Å; S597-I637 PolarHBondContact O-N 3.33Å
598	C	56.5	Low	52.4	Low	7 Å²	7	71.3 Å²	71.3	5%	0.047	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133	-178.2	-55.9	0	0	0	0	111.3	V596 N635 C636	V596-C598 PolarHBondContact O-N 3.41Å; C598-N635 CarbonylContact C-O 3.59Å; C598-N635 WeakPolarHBondContact CA-O 3.42Å; C598-C636 HydrophobicContact CB-CB 4.06Å; C598-C636 WeakPolarHBondContact CB-SG 3.24Å; C598-C636 WeakPolarHBondContact SG-CB 3.23Å; C598-C636 CovalentContact SG-SG 2.04Å; C598-C636 PolarHBondContact SG-SG 3.05Å
599	Y	58.2	Low	52.4	Low	57 Å²	57	69.2 Å²	69.2	22%	0.224	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	132.8	167.8	-62.8	-82.1	0	0	0	109.6	I573 F634 N635 I637 F660 L664	I573-Y599 HydrophobicContact CD1-CE1 3.95Å; I573-Y599 HydrophobicContact CG1-CD1 4.12Å; I573-Y599 HydrophobicContact CG1-CE1 3.99Å; Y599-F634 WeakPolarHBondContact O-CA 3.2Å; Y599-N635 PolarHBondContact N-O 2.91Å; Y599-N635 PolarHBondContact O-N 2.93Å; Y599-I637 HydrophobicContact CD2-CG1 4.4Å; Y599-I637 HydrophobicContact CE2-CD1 3.59Å; Y599-I637 HydrophobicContact CE2-CG1 3.78Å; Y599-F660 HydrophobicContact CD2-CE2 4.47Å; Y599-F660 AromaticContact CD2-CZ 3.72Å; Y599-F660 HydrophobicContact CD2-CZ 3.72Å; Y599-F660 HydrophobicContact CE2-CE1 4.45Å; Y599-F660 AromaticContact CE2-CZ 3.88Å; Y599-F660 HydrophobicContact CE2-CZ 3.88Å; Y599-L664 HydrophobicContact CD1-CD2 4.24Å; Y599-L664 HydrophobicContact CE1-CD2 4.23Å; Y599-L664 HydrophobicContact CG-CD2 4.44Å
600	S	57.3	Low	51.7	Low	12 Å²	12	64.1 Å²	64.1	8%	0.084	34%	0.341	C	S	.	.			trans	-75.7	144.5	158.3	63.9	0	0	0	0	109.2	T570 N572	T570-S600 PolarHBondContact OG1-O 2.77Å; T570-S600 PolarHBondContact OG1-OG 3.16Å; N572-S600 PolarHBondContact O-OG 2.84Å
601	S	57.9	Low	51.3	Low	2 Å²	2	65.4 Å²	65.4	1%	0.014	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	135.3	168.2	-71.2	0	0	0	0	109.3	A633	S601-A633 PolarHBondContact N-O 2.91Å; S601-A633 PolarHBondContact O-N 3.28Å
602	L	56.8	Low	50.6	Low	52 Å²	52	58.3 Å²	58.3	27%	0.272	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	118.2	176.2	-154.3	90.4	0	0	0	108.5	K568 T570 M604 N630	K568-L602 PolarHBondContact N-O 3.11Å; K568-L602 PolarHBondContact O-N 3.44Å; K568-L602 VanDerWaalsContact O-N 3.07Å; T570-L602 HydrophobicContact CG2-CB 3.99Å; L602-M604 HydrophobicContact CD2-CG 4.31Å; L602-M604 HydrophobicContact CD2-SD 4.4Å; L602-N630 HydrophobicContact CD1-CB 4.21Å
603	L	54.7	Low	49.9	Very low	7 Å²	7	62 Å²	62	4%	0.037	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	117.9	-177.6	-146.8	162.3	0	0	0	109.5	L567 A633 M649	L567-L603 HydrophobicContact CD2-CB 4.31Å; L567-L603 HydrophobicContact CD2-CD1 3.96Å; L567-L603 HydrophobicContact CD2-CG 3.66Å; L567-L603 HydrophobicContact CG-CD1 4.48Å; L567-L603 HydrophobicContact CG-CG 3.98Å; L603-A633 HydrophobicContact CD1-CB 4.19Å; L603-M649 HydrophobicContact CD1-CB 4.19Å; L603-M649 HydrophobicContact CD1-CE 4.4Å; L603-M649 HydrophobicContact CD1-CG 3.97Å; L603-M649 HydrophobicContact CD1-SD 3.4Å; L603-M649 WeakPolarHBondContact CD1-SD 3.33Å; L603-M649 HydrophobicContact CD2-CE 3.47Å; L603-M649 VanDerWaalsContact CD2-CE 3.47Å; L603-M649 HydrophobicContact CD2-SD 3.51Å; L603-M649 VanDerWaalsContact CD2-SD 3.51Å; L603-M649 HydrophobicContact CG-SD 4.09Å
604	M	52.3	Low	49.2	Very low	58 Å²	58	62.2 Å²	62.2	29%	0.286	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	113.9	176	-60.6	-174.6	-63.2	0	0	108.9	L566 L602 F606	L566-M604 CarbonylContact C-O 3.53Å; L566-M604 HydrophobicContact CD2-CE 4.03Å; L566-M604 HydrophobicContact CG-CE 4.38Å; L566-M604 PolarHBondContact N-O 3.47Å; L566-M604 PolarHBondContact O-N 3.18Å; L566-M604 VanDerWaalsContact O-N 3.12Å; L602-M604 HydrophobicContact CD2-CG 4.31Å; L602-M604 HydrophobicContact CD2-SD 4.4Å; M604-F606 HydrophobicContact CB-CD2 4.22Å; M604-F606 HydrophobicContact CB-CE2 3.67Å; M604-F606 HydrophobicContact CE-CE2 4.33Å; M604-F606 WeakPolarHBondContact O-CD2 3.02Å
605	E	49.4	Very low	48.4	Very low	78 Å²	78	66.1 Å²	66.1	36%	0.364	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	124.4	-179.9	-158.3	164.4	-151	0	0	110.4	F607 M649	E605-F607 HydrophobicContact CB-CE2 3.88Å; E605-F607 HydrophobicContact CB-CZ 4.35Å; E605-F607 HydrophobicContact CG-CD2 4.32Å; E605-F607 HydrophobicContact CG-CE1 4.29Å; E605-F607 HydrophobicContact CG-CE2 3.54Å; E605-F607 HydrophobicContact CG-CZ 3.53Å; E605-F607 WeakPolarHBondContact OE2-CZ 3.43Å; E605-M649 HydrophobicContact CB-CE 4.38Å; E605-M649 HydrophobicContact CG-CE 3.96Å; E605-M649 WeakPolarHBondContact OE1-CE 3.49Å
606	F	48.9	Very low	47.4	Very low	70 Å²	70	66.4 Å²	66.4	31%	0.307	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	91.8	-171	-85.9	-96.4	0	0	0	110.8	S564 L566 M604 L619	S564-F606 CarbonylContact O-C 3.59Å; S564-F606 PolarHBondContact O-N 3.01Å; S564-F606 VanDerWaalsContact O-O 3.08Å; S564-F606 PolarHBondContact OG-O 2.76Å; L566-F606 HydrophobicContact CB-CD2 3.51Å; L566-F606 HydrophobicContact CB-CE2 3.55Å; L566-F606 HydrophobicContact CD2-CD2 4.44Å; L566-F606 HydrophobicContact CD2-CE2 3.76Å; L566-F606 HydrophobicContact CD2-CZ 4.16Å; L566-F606 HydrophobicContact CG-CE2 4.26Å; M604-F606 HydrophobicContact CB-CD2 4.22Å; M604-F606 HydrophobicContact CB-CE2 3.67Å; M604-F606 HydrophobicContact CE-CE2 4.33Å; M604-F606 WeakPolarHBondContact O-CD2 3.02Å; F606-L619 HydrophobicContact CE1-CD2 4.45Å; F606-L619 HydrophobicContact CZ-CD2 4.37Å
607	F	47.5	Very low	46.2	Very low	32 Å²	32	73.3 Å²	73.3	14%	0.14	37%	0.367	C	S	.	.			trans	-86.3	126.7	170.8	-58.2	-76.9	0	0	0	110.2	Y540 E605 I609 P626	Y540-F607 HydrophobicContact CE1-CD1 4.06Å; Y540-F607 AromaticContact CE1-CE1 3.47Å; Y540-F607 HydrophobicContact CE1-CE1 3.47Å; Y540-F607 VanDerWaalsContact CE1-CE1 3.47Å; Y540-F607 AromaticContact CE1-CZ 3.8Å; Y540-F607 HydrophobicContact CE1-CZ 3.8Å; Y540-F607 AromaticContact CZ-CE1 3.88Å; Y540-F607 WeakPolarHBondContact OH-CD1 3.49Å; E605-F607 HydrophobicContact CB-CE2 3.88Å; E605-F607 HydrophobicContact CB-CZ 4.35Å; E605-F607 HydrophobicContact CG-CD2 4.32Å; E605-F607 HydrophobicContact CG-CE1 4.29Å; E605-F607 HydrophobicContact CG-CE2 3.54Å; E605-F607 HydrophobicContact CG-CZ 3.53Å; E605-F607 WeakPolarHBondContact OE2-CZ 3.43Å; F607-I609 HydrophobicContact CB-CG1 4.36Å; F607-I609 PolarHBondContact O-N 3.11Å; F607-P626 HydrophobicContact CB-CG 4.09Å; F607-P626 HydrophobicContact CD2-CB 3.76Å; F607-P626 HydrophobicContact CD2-CG 3.79Å; F607-P626 HydrophobicContact CE2-CB 4.16Å; F607-P626 HydrophobicContact CG-CG 4.23Å
608	W	47.6	Very low	44.9	Very low	101 Å²	101	76.5 Å²	76.5	38%	0.383	37%	0.374	S	S	.	.			trans	-76.9	89.3	176.2	-90.2	83.3	0	0	0	110.9	V521 I522	V521-W608 HydrophobicContact CB-CG 4.37Å; V521-W608 HydrophobicContact CG1-CB 3.82Å; V521-W608 HydrophobicContact CG1-CD2 4.38Å; V521-W608 HydrophobicContact CG1-CG 3.66Å; I522-W608 HydrophobicContact CD1-CH2 4.07Å; I522-W608 HydrophobicContact CD1-CZ2 4.19Å; I522-W608 HydrophobicContact CG1-CH2 3.95Å; I522-W608 HydrophobicContact CG1-CZ2 4.04Å; I522-W608 HydrophobicContact CG1-CZ3 4.48Å
609	I	39.4	Very low	43.6	Very low	119 Å²	119	83.3 Å²	83.3	61%	0.61	41%	0.409	S	S	*	.			trans	-106.7	70.5	169.7	-49.4	-178.3	0	0	0	108	F607 P626	F607-I609 HydrophobicContact CB-CG1 4.36Å; F607-I609 PolarHBondContact O-N 3.11Å; I609-P626 HydrophobicContact CD1-CG 3.49Å; I609-P626 VanDerWaalsContact CD1-CG 3.49Å
610	G	34.6	Very low	42.1	Very low	43 Å²	43	85.3 Å²	85.3	44%	0.443	42%	0.424	S	S	.	.	S	Bend	trans	-157.2	144.8	-176.9	0	0	0	0	0	113.2
611	D	38.8	Very low	40.7	Very low	80 Å²	80	91.8 Å²	91.8	43%	0.428	46%	0.458	S	S	.	.			trans	-65.7	128	173.3	-177.3	-18.1	0	0	0	109	K613 S614	D611-K613 PolarHBondContact O-N 2.85Å; D611-K613 WeakPolarHBondContact OD1-CB 3.48Å; D611-K613 VanDerWaalsContact OD1-CG 3.27Å; D611-K613 WeakPolarHBondContact OD1-CG 3.28Å; D611-K613 PolarHBondContact OD1-N 3.15Å; D611-K613 IonicContact OD1-NZ 2.74Å; D611-K613 PolarHBondContact OD1-NZ 2.97Å; D611-K613 IonicContact OD2-NZ 3.13Å; D611-S614 PolarHBondContact O-N 3.5Å; D611-S614 PolarHBondContact O-OG 3.19Å
612	P	40	Very low	39.3	Very low	47 Å²	47	98.5 Å²	98.5	31%	0.305	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-6.8	176.7	24.7	-35.4	0	0	0	114.5
613	K	38.8	Very low	37.9	Very low	145 Å²	145	103.9 Å²	103.9	63%	0.63	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-20.8	173.2	-59.7	174.4	-159.6	80	0	113.9	D611 W615	D611-K613 PolarHBondContact O-N 2.85Å; D611-K613 WeakPolarHBondContact OD1-CB 3.48Å; D611-K613 VanDerWaalsContact OD1-CG 3.27Å; D611-K613 WeakPolarHBondContact OD1-CG 3.28Å; D611-K613 PolarHBondContact OD1-N 3.15Å; D611-K613 IonicContact OD1-NZ 2.74Å; D611-K613 PolarHBondContact OD1-NZ 2.97Å; D611-K613 IonicContact OD2-NZ 3.13Å; K613-W615 PolarHBondContact O-N 2.78Å
614	S	38.5	Very low	36.6	Very low	65 Å²	65	110.7 Å²	110.7	46%	0.455	55%	0.551	S	S	.	*			trans	-88.7	92.2	178.2	58	0	0	0	0	111.5	D611 T616	D611-S614 PolarHBondContact O-N 3.5Å; D611-S614 PolarHBondContact O-OG 3.19Å; S614-T616 PolarHBondContact O-N 2.95Å
615	W	35.3	Very low	35.5	Very low	241 Å²	241	111.6 Å²	111.6	91%	0.913	56%	0.56	S	S	*	*			trans	-63.7	2.2	176.4	-73.5	82.3	0	0	0	115.2	K613 F617	K613-W615 PolarHBondContact O-N 2.78Å; W615-F617 PolarHBondContact O-N 3.16Å
616	T	29.8	Very low	34.5	Very low	94 Å²	94	110.2 Å²	110.2	58%	0.577	56%	0.558	S	S	*	*			trans	-86.4	94	-175.7	47.4	0	0	0	0	111.9	S614 Q618	S614-T616 PolarHBondContact O-N 2.95Å; T616-Q618 PolarHBondContact O-N 3.01Å
617	F	32.6	Very low	33.7	Very low	165 Å²	165	114.7 Å²	114.7	72%	0.724	58%	0.578	S	S	*	*			trans	-60	98.4	155	-74.4	-93.5	0	0	0	108.9	W615	W615-F617 PolarHBondContact O-N 3.16Å
618	Q	27.4	Very low	33.2	Very low	131 Å²	131	117.6 Å²	117.6	61%	0.612	60%	0.6	S	S	*	*			trans	-120.8	105.5	171.4	-79.2	-170.6	-6.9	0	0	110.1	T616 N620	T616-Q618 PolarHBondContact O-N 3.01Å; Q618-N620 HydrophobicContact CB-CB 4.23Å; Q618-N620 VanDerWaalsContact CD-ND2 3.27Å; Q618-N620 PolarHBondContact O-N 3.22Å; Q618-N620 PolarHBondContact OE1-ND2 3.03Å
619	L	30.9	Very low	32.8	Very low	151 Å²	151	117.9 Å²	117.9	79%	0.791	61%	0.609	S	S	*	*			trans	-71.1	70.8	159.5	-68.9	166.2	0	0	0	108.4	F606	F606-L619 HydrophobicContact CE1-CD2 4.45Å; F606-L619 HydrophobicContact CZ-CD2 4.37Å
620	N	25.1	Very low	33.2	Very low	98 Å²	98	116.7 Å²	116.7	52%	0.524	60%	0.604	S	S	.	*			trans	-117.2	117.7	178.1	-82.4	-15.3	0	0	0	108.5	Q618 N622	Q618-N620 HydrophobicContact CB-CB 4.23Å; Q618-N620 VanDerWaalsContact CD-ND2 3.27Å; Q618-N620 PolarHBondContact O-N 3.22Å; Q618-N620 PolarHBondContact OE1-ND2 3.03Å; N620-N622 PolarHBondContact O-N 2.63Å
621	D	29.1	Very low	34	Very low	149 Å²	149	117.3 Å²	117.3	80%	0.797	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	9.4	-161.4	-58.8	-69	0	0	0	117.7
622	N	27.3	Very low	34.5	Very low	143 Å²	143	116.6 Å²	116.6	77%	0.765	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.2	7.4	-161	-80.4	-45.5	0	0	0	117	N620	N620-N622 PolarHBondContact O-N 2.63Å
623	H	28.1	Very low	35.2	Very low	165 Å²	165	114.4 Å²	114.4	76%	0.764	58%	0.583	S	S	*	*	S	Bend	trans	-131.5	92.6	175.3	-72.9	90.6	0	0	0	112.9	V625	H623-V625 PolarHBondContact O-N 2.87Å
624	I	27.4	Very low	36.1	Very low	149 Å²	149	110.2 Å²	110.2	76%	0.764	57%	0.565	S	S	*	*			trans	39.7	64	165.6	-40.1	-177.2	0	0	0	114.5	P626	I624-P626 WeakPolarHBondContact O-CD 3.27Å
625	V	29.4	Very low	37	Very low	78 Å²	78	107.8 Å²	107.8	47%	0.473	55%	0.547	S	S	.	.			trans	-62.6	128	161	-172.9	0	0	0	0	108.5	H623 F627 P628	H623-V625 PolarHBondContact O-N 2.87Å; V625-F627 PolarHBondContact O-N 2.03Å; V625-P628 HydrophobicContact CG1-CB 4.08Å; V625-P628 HydrophobicContact CG1-CG 4.23Å
626	P	28.6	Very low	38.2	Very low	48 Å²	48	97.2 Å²	97.2	31%	0.312	51%	0.51	S	S	.	.	S	Bend	trans	-71.1	81.9	170	-19.5	35.6	0	0	0	109.8	F607 I609 I624	F607-P626 HydrophobicContact CB-CG 4.09Å; F607-P626 HydrophobicContact CD2-CB 3.76Å; F607-P626 HydrophobicContact CD2-CG 3.79Å; F607-P626 HydrophobicContact CE2-CB 4.16Å; F607-P626 HydrophobicContact CG-CG 4.23Å; I609-P626 HydrophobicContact CD1-CG 3.49Å; I609-P626 VanDerWaalsContact CD1-CG 3.49Å; I624-P626 WeakPolarHBondContact O-CD 3.27Å
627	F	31	Very low	39.6	Very low	164 Å²	164	94.9 Å²	94.9	72%	0.719	49%	0.493	S	S	*	.			trans	45.3	104.9	-174.5	-74.6	-93.4	0	0	0	114.4	V625 N629	V625-F627 PolarHBondContact O-N 2.03Å; F627-N629 PolarHBondContact O-N 3.34Å
628	P	37.5	Very low	41	Very low	94 Å²	94	93.9 Å²	93.9	61%	0.61	50%	0.495	S	S	*	.			trans	-72	61.9	161.8	33	-32	0	0	0	109.6	V625 N630	V625-P628 HydrophobicContact CG1-CB 4.08Å; V625-P628 HydrophobicContact CG1-CG 4.23Å; P628-N630 PolarHBondContact O-N 3.5Å
629	N	39.7	Very low	42.5	Very low	106 Å²	106	88.5 Å²	88.5	57%	0.567	47%	0.472	S	S	*	.			trans	-62.7	88.6	155.7	-68.6	-25.4	0	0	0	105.2	F627 V631	F627-N629 PolarHBondContact O-N 3.34Å; N629-V631 HydrophobicContact CB-CG2 3.72Å; N629-V631 WeakPolarHBondContact O-CG2 3.36Å; N629-V631 PolarHBondContact O-N 3.33Å
630	N	47.9	Very low	43.8	Very low	94 Å²	94	84.2 Å²	84.2	50%	0.503	45%	0.453	S	S	.	.			trans	-66.5	68.1	164.5	-78.5	-21.1	0	0	0	107.8	L602 P628 T632	L602-N630 HydrophobicContact CD1-CB 4.21Å; P628-N630 PolarHBondContact O-N 3.5Å; N630-T632 PolarHBondContact O-N 3.28Å
631	V	50	Low	45.2	Very low	56 Å²	56	87.1 Å²	87.1	34%	0.339	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	105.1	-178.9	-171.3	0	0	0	0	105.9	N629 A633 H647	N629-V631 HydrophobicContact CB-CG2 3.72Å; N629-V631 WeakPolarHBondContact O-CG2 3.36Å; N629-V631 PolarHBondContact O-N 3.33Å; V631-A633 PolarHBondContact O-N 2.67Å; V631-H647 WeakPolarHBondContact CG1-NE2 3.5Å
632	T	51	Low	46.3	Very low	65 Å²	65	88 Å²	88	40%	0.399	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	92.5	170.8	-56.6	0	0	0	0	106	N630 F634	N630-T632 PolarHBondContact O-N 3.28Å; T632-F634 HydrophobicContact CG2-CE1 4.03Å; T632-F634 HydrophobicContact CG2-CE2 4.22Å; T632-F634 HydrophobicContact CG2-CZ 3.74Å; T632-F634 VanDerWaalsContact O-CD2 3.31Å; T632-F634 WeakPolarHBondContact O-CD2 3.36Å; T632-F634 VanDerWaalsContact O-CE2 3.26Å; T632-F634 WeakPolarHBondContact O-CE2 3.48Å
633	A	54.4	Low	47.6	Very low	1 Å²	1	82.3 Å²	82.3	1%	0.008	43%	0.431	C	S	.	.			trans	-89.4	119.2	-172.1	0	0	0	0	0	108.4	S601 L603 V631 F650	S601-A633 PolarHBondContact N-O 2.91Å; S601-A633 PolarHBondContact O-N 3.28Å; L603-A633 HydrophobicContact CD1-CB 4.19Å; V631-A633 PolarHBondContact O-N 2.67Å; A633-F650 HydrophobicContact CB-CD2 4.26Å; A633-F650 HydrophobicContact CB-CE2 3.34Å; A633-F650 HydrophobicContact CB-CZ 3.72Å
634	F	56.7	Low	48.7	Very low	58 Å²	58	78.7 Å²	78.7	25%	0.254	41%	0.414	S	S	.	.			trans	-91.1	123.4	-174.2	-61.8	-82.1	0	0	0	111.2	H576 Y599 T632	H576-F634 AromaticContact CD2-CE1 3.69Å; H576-F634 AromaticContact NE2-CE1 3.8Å; Y599-F634 WeakPolarHBondContact O-CA 3.2Å; T632-F634 HydrophobicContact CG2-CE1 4.03Å; T632-F634 HydrophobicContact CG2-CE2 4.22Å; T632-F634 HydrophobicContact CG2-CZ 3.74Å; T632-F634 VanDerWaalsContact O-CD2 3.31Å; T632-F634 WeakPolarHBondContact O-CD2 3.36Å; T632-F634 VanDerWaalsContact O-CE2 3.26Å; T632-F634 WeakPolarHBondContact O-CE2 3.48Å
635	N	58.2	Low	49.7	Very low	14 Å²	14	75.7 Å²	75.7	8%	0.075	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	118.1	171.1	-85.8	-35.6	0	0	0	109.5	C598 Y599 F650 F660	C598-N635 CarbonylContact C-O 3.59Å; C598-N635 WeakPolarHBondContact CA-O 3.42Å; Y599-N635 PolarHBondContact N-O 2.91Å; Y599-N635 PolarHBondContact O-N 2.93Å; N635-F650 WeakPolarHBondContact ND2-CD2 3.29Å; N635-F650 WeakPolarHBondContact ND2-CE2 2.18Å; N635-F650 VanDerWaalsContact ND2-CZ 3.27Å; N635-F650 WeakPolarHBondContact ND2-CZ 2.19Å; N635-F650 WeakPolarHBondContact OD1-CD2 2.18Å; N635-F660 HydrophobicContact CB-CD2 4.44Å; N635-F660 HydrophobicContact CB-CE2 3.68Å; N635-F660 HydrophobicContact CB-CZ 4.44Å
636	C	59.4	Low	50.2	Low	19 Å²	19	79.6 Å²	79.6	13%	0.128	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	140.3	-172.7	-53.9	0	0	0	0	112.3	S597 C598 V639 A655	S597-C636 CarbonylContact O-C 3.6Å; S597-C636 VanDerWaalsContact O-CA 3.32Å; S597-C636 WeakPolarHBondContact O-CA 3.17Å; C598-C636 HydrophobicContact CB-CB 4.06Å; C598-C636 WeakPolarHBondContact CB-SG 3.24Å; C598-C636 WeakPolarHBondContact SG-CB 3.23Å; C598-C636 CovalentContact SG-SG 2.04Å; C598-C636 PolarHBondContact SG-SG 3.05Å; C636-V639 HydrophobicContact CB-CG2 3.42Å; C636-V639 VanDerWaalsContact CB-CG2 3.42Å; C636-A655 WeakPolarHBondContact O-CB 3.41Å
637	I	60.3	Low	51.1	Low	44 Å²	44	79.7 Å²	79.7	23%	0.226	40%	0.397	C	S	.	.	S	Bend	trans	-88	153.1	178.2	-32.4	173.8	0	0	0	109.9	S597 Y599 V639	S597-I637 PolarHBondContact O-N 3.33Å; Y599-I637 HydrophobicContact CD2-CG1 4.4Å; Y599-I637 HydrophobicContact CE2-CD1 3.59Å; Y599-I637 HydrophobicContact CE2-CG1 3.78Å; I637-V639 WeakPolarHBondContact O-CG2 3.11Å; I637-V639 PolarHBondContact O-N 3.41Å
638	D	61.8	Low	51.9	Low	144 Å²	144	75.9 Å²	75.9	77%	0.77	39%	0.389	S	S	*	.	S	Bend	trans	55.4	25.6	172	-58.3	-37.4	0	0	0	115.7
639	V	59.1	Low	52.4	Low	19 Å²	19	72.3 Å²	72.3	12%	0.115	37%	0.365	C	S	.	.			trans	-85	126	177.8	-168.9	0	0	0	0	110.5	V596 C636 I637 C643 Q644	V596-V639 HydrophobicContact CB-CG2 4.47Å; V596-V639 HydrophobicContact CG1-CG2 3.83Å; C636-V639 HydrophobicContact CB-CG2 3.42Å; C636-V639 VanDerWaalsContact CB-CG2 3.42Å; I637-V639 WeakPolarHBondContact O-CG2 3.11Å; I637-V639 PolarHBondContact O-N 3.41Å; V639-C643 VanDerWaalsContact CG1-C 3.46Å; V639-C643 HydrophobicContact CG1-CB 3.63Å; V639-C643 VanDerWaalsContact CG1-O 3.28Å; V639-C643 WeakPolarHBondContact CG1-O 3.48Å; V639-Q644 HydrophobicContact CB-CG 4.33Å; V639-Q644 HydrophobicContact CG1-CG 4.33Å
640	P	57.4	Low	53	Low	61 Å²	61	68 Å²	68	40%	0.396	34%	0.341	S	S	.	.			trans	-53.3	143.2	172.7	-25.7	34	0	0	0	111.4	K642 C643 Q644	P640-K642 PolarHBondContact O-N 3.22Å; P640-C643 HydrophobicContact CB-CB 4.39Å; P640-C643 CarbonylContact O-C 3.59Å; P640-C643 WeakPolarHBondContact O-CA 3.23Å; P640-C643 WeakPolarHBondContact O-CB 3.13Å; P640-C643 PolarHBondContact O-N 3.03Å; P640-Q644 PolarHBondContact O-N 3.42Å
641	E	54.6	Low	53	Low	158 Å²	158	68.8 Å²	68.8	74%	0.738	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-53.2	-32.8	-174.8	-165.8	173.3	-136.7	0	0	113.5	C643	E641-C643 VanDerWaalsContact C-N 3.31Å; E641-C643 PolarHBondContact O-N 2.84Å
642	K	53	Low	52.9	Low	168 Å²	168	68.4 Å²	68.4	73%	0.73	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-73.5	-16.3	176.7	-54.5	178.8	-176.5	178.8	0	114.7	T590 P640	T590-K642 HydrophobicContact CG2-CD 3.81Å; P640-K642 PolarHBondContact O-N 3.22Å
643	C	53.4	Low	53	Low	23 Å²	23	65.4 Å²	65.4	16%	0.155	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-111.7	1.1	-176.1	-57.8	0	0	0	0	112.5	C592 V639 P640 E641 Y645	C592-C643 VanDerWaalsContact CA-SG 3.55Å; C592-C643 HydrophobicContact CB-CB 3.87Å; C592-C643 WeakPolarHBondContact CB-SG 3.47Å; C592-C643 WeakPolarHBondContact SG-CB 3.48Å; C592-C643 CovalentContact SG-SG 2.04Å; C592-C643 PolarHBondContact SG-SG 3.36Å; V639-C643 VanDerWaalsContact CG1-C 3.46Å; V639-C643 HydrophobicContact CG1-CB 3.63Å; V639-C643 VanDerWaalsContact CG1-O 3.28Å; V639-C643 WeakPolarHBondContact CG1-O 3.48Å; P640-C643 HydrophobicContact CB-CB 4.39Å; P640-C643 CarbonylContact O-C 3.59Å; P640-C643 WeakPolarHBondContact O-CA 3.23Å; P640-C643 WeakPolarHBondContact O-CB 3.13Å; P640-C643 PolarHBondContact O-N 3.03Å; E641-C643 VanDerWaalsContact C-N 3.31Å; E641-C643 PolarHBondContact O-N 2.84Å; C643-Y645 PolarHBondContact O-N 2.85Å
644	Q	51.6	Low	53	Low	90 Å²	90	70.2 Å²	70.2	42%	0.421	35%	0.353	S	S	.	.			trans	-65	130.1	-174.5	-74.9	-179.3	6.9	0	0	112.4	V639 P640 Y646	V639-Q644 HydrophobicContact CB-CG 4.33Å; V639-Q644 HydrophobicContact CG1-CG 4.33Å; P640-Q644 PolarHBondContact O-N 3.42Å; Q644-Y646 PolarHBondContact O-N 2.99Å
645	Y	48.6	Very low	52.7	Low	86 Å²	86	68.5 Å²	68.5	34%	0.337	35%	0.349	S	S	.	.			trans	-65.7	104.5	177.4	-82.3	-89.4	0	0	0	111.2	A579 C643 H647	A579-Y645 HydrophobicContact CB-CD1 4.49Å; A579-Y645 HydrophobicContact CB-CE1 3.61Å; A579-Y645 PolarHBondContact O-OH 3.34Å; C643-Y645 PolarHBondContact O-N 2.85Å; Y645-H647 PolarHBondContact O-N 3.33Å
646	Y	40.8	Very low	52.5	Low	159 Å²	159	74.8 Å²	74.8	62%	0.624	38%	0.383	S	S	*	.			trans	-81.3	79.2	-175.1	-155	-85.6	0	0	0	112	Q644 P648 K651	Q644-Y646 PolarHBondContact O-N 2.99Å; Y646-P648 WeakPolarHBondContact O-CD 3.39Å; Y646-K651 VanDerWaalsContact OH-CD 3.26Å; Y646-K651 WeakPolarHBondContact OH-CD 3.42Å; Y646-K651 VanDerWaalsContact OH-CE 3.22Å; Y646-K651 WeakPolarHBondContact OH-CE 3.46Å; Y646-K651 PolarHBondContact OH-NZ 2.91Å
647	H	47.8	Very low	52.6	Low	50 Å²	50	75.2 Å²	75.2	23%	0.231	39%	0.386	C	S	.	.			trans	-75.3	120.3	164.1	-163.9	-117.5	0	0	0	109.5	V631 Y645 M649 F650	V631-H647 WeakPolarHBondContact CG1-NE2 3.5Å; Y645-H647 PolarHBondContact O-N 3.33Å; H647-M649 WeakPolarHBondContact ND1-CB 3.2Å; H647-M649 PolarHBondContact O-N 2.82Å; H647-F650 HydrophobicContact CB-CD2 4.02Å; H647-F650 PolarHBondContact O-N 2.97Å
648	P	47.7	Very low	52.7	Low	84 Å²	84	77.3 Å²	77.3	55%	0.545	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-13.2	-173.3	-26	35.7	0	0	0	115.4	Y646 R674	Y646-P648 WeakPolarHBondContact O-CD 3.39Å; P648-R674 PolarHBondContact O-NH2 2.85Å
649	M	48	Very low	52.6	Low	20 Å²	20	71 Å²	71	10%	0.099	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-27.4	179	-147	156.4	-173.6	0	0	113.5	S565 L603 E605 H647 L689	S565-M649 WeakPolarHBondContact OG-CE 3.16Å; L603-M649 HydrophobicContact CD1-CB 4.19Å; L603-M649 HydrophobicContact CD1-CE 4.4Å; L603-M649 HydrophobicContact CD1-CG 3.97Å; L603-M649 HydrophobicContact CD1-SD 3.4Å; L603-M649 WeakPolarHBondContact CD1-SD 3.33Å; L603-M649 HydrophobicContact CD2-CE 3.47Å; L603-M649 VanDerWaalsContact CD2-CE 3.47Å; L603-M649 HydrophobicContact CD2-SD 3.51Å; L603-M649 VanDerWaalsContact CD2-SD 3.51Å; L603-M649 HydrophobicContact CG-SD 4.09Å; E605-M649 HydrophobicContact CB-CE 4.38Å; E605-M649 HydrophobicContact CG-CE 3.96Å; E605-M649 WeakPolarHBondContact OE1-CE 3.49Å; H647-M649 WeakPolarHBondContact ND1-CB 3.2Å; H647-M649 PolarHBondContact O-N 2.82Å; M649-L689 HydrophobicContact CG-CD1 3.98Å
650	F	51.7	Low	52.6	Low	15 Å²	15	70.6 Å²	70.6	7%	0.066	37%	0.368	C	S	.	.	S	Bend	trans	-92.5	7.3	178.7	-68.3	-43	0	0	0	114	L567 A633 N635 H647 G652 C653	L567-F650 HydrophobicContact CD1-CE1 3.99Å; L567-F650 HydrophobicContact CD2-CE1 3.74Å; L567-F650 HydrophobicContact CD2-CZ 3.9Å; A633-F650 HydrophobicContact CB-CD2 4.26Å; A633-F650 HydrophobicContact CB-CE2 3.34Å; A633-F650 HydrophobicContact CB-CZ 3.72Å; N635-F650 WeakPolarHBondContact ND2-CD2 3.29Å; N635-F650 WeakPolarHBondContact ND2-CE2 2.18Å; N635-F650 VanDerWaalsContact ND2-CZ 3.27Å; N635-F650 WeakPolarHBondContact ND2-CZ 2.19Å; N635-F650 WeakPolarHBondContact OD1-CD2 2.18Å; H647-F650 HydrophobicContact CB-CD2 4.02Å; H647-F650 PolarHBondContact O-N 2.97Å; F650-G652 PolarHBondContact O-N 3.31Å; F650-C653 PolarHBondContact O-N 2.82Å
651	K	48.7	Very low	52.9	Low	110 Å²	110	73.9 Å²	73.9	48%	0.478	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	94.9	177.2	-177.1	178.3	-176.6	162	0	111.3	Y646 P688	Y646-K651 VanDerWaalsContact OH-CD 3.26Å; Y646-K651 WeakPolarHBondContact OH-CD 3.42Å; Y646-K651 VanDerWaalsContact OH-CE 3.22Å; Y646-K651 WeakPolarHBondContact OH-CE 3.46Å; Y646-K651 PolarHBondContact OH-NZ 2.91Å; K651-P688 WeakPolarHBondContact O-CA 2.18Å; K651-P688 WeakPolarHBondContact O-CB 3.12Å; K651-P688 VanDerWaalsContact O-CG 3.3Å; K651-P688 WeakPolarHBondContact O-CG 3.39Å
652	G	47.5	Very low	53.3	Low	48 Å²	48	70.4 Å²	70.4	50%	0.495	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	109.2	-10.4	-177.9	0	0	0	0	0	116.4	F650	F650-G652 PolarHBondContact O-N 3.31Å
653	C	52.6	Low	53.8	Low	2 Å²	2	62.4 Å²	62.4	1%	0.014	33%	0.327	C	S	.	.			trans	-103.7	67.8	172.8	-167.5	0	0	0	0	109.5	F650 C659	F650-C653 PolarHBondContact O-N 2.82Å; C653-C659 HydrophobicContact CB-CB 4.08Å; C653-C659 WeakPolarHBondContact CB-SG 3.45Å; C653-C659 VanDerWaalsContact SG-C 3.56Å; C653-C659 WeakPolarHBondContact SG-CB 3.08Å; C653-C659 CovalentContact SG-SG 2.04Å; C653-C659 PolarHBondContact SG-SG 2.96Å
654	M	55	Low	54	Low	103 Å²	103	64.4 Å²	64.4	51%	0.507	34%	0.336	S	S	.	.			trans	-69.1	157.5	-176.2	-62.7	176.8	177.2	0	0	112.4	N656 S657 F660	M654-N656 PolarHBondContact O-N 3.43Å; M654-S657 PolarHBondContact N-OG 2.78Å; M654-S657 VanDerWaalsContact O-CB 3.28Å; M654-S657 WeakPolarHBondContact O-CB 3.33Å; M654-S657 PolarHBondContact O-N 2.77Å; M654-S657 PolarHBondContact O-OG 3.32Å; M654-F660 WeakPolarHBondContact O-CB 3.18Å
655	A	50.4	Low	54.6	Low	22 Å²	22	66.1 Å²	66.1	18%	0.182	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-11.9	179.8	0	0	0	0	0	115.9	C636 F660	C636-A655 WeakPolarHBondContact O-CB 3.41Å; A655-F660 VanDerWaalsContact C-CD1 3.49Å; A655-F660 HydrophobicContact CB-CD1 4.48Å; A655-F660 HydrophobicContact CB-CE1 4.23Å; A655-F660 HydrophobicContact CB-CZ 4.3Å; A655-F660 WeakPolarHBondContact O-CD1 3.39Å; A655-F660 WeakPolarHBondContact O-CE1 3.43Å
656	N	54.1	Low	55.2	Low	145 Å²	145	63 Å²	63	78%	0.775	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.6	17.2	174.2	-69.9	-13.4	0	0	0	113.1	M654	M654-N656 PolarHBondContact O-N 3.43Å
657	S	60	Low	55.8	Low	28 Å²	28	64.4 Å²	64.4	20%	0.196	35%	0.348	C	S	.	.	S	Bend	trans	-92.9	158.8	179.7	69.5	0	0	0	0	113	M654 C659 F660 Q661	M654-S657 PolarHBondContact N-OG 2.78Å; M654-S657 VanDerWaalsContact O-CB 3.28Å; M654-S657 WeakPolarHBondContact O-CB 3.33Å; M654-S657 PolarHBondContact O-N 2.77Å; M654-S657 PolarHBondContact O-OG 3.32Å; S657-C659 VanDerWaalsContact C-N 3.29Å; S657-C659 PolarHBondContact O-N 3.01Å; S657-F660 PolarHBondContact O-N 2.99Å; S657-F660 VanDerWaalsContact O-N 3.1Å; S657-F660 PolarHBondContact OG-N 2.9Å; S657-Q661 PolarHBondContact O-N 2.92Å
658	S	62.3	Low	56.2	Low	88 Å²	88	69 Å²	69	62%	0.615	37%	0.374	S	S	*	.	H	α-helix	trans	-59.1	-41.7	172.6	58.7	0	0	0	0	111.9	F660 Q661 E662	S658-F660 PolarHBondContact O-N 2.92Å; S658-Q661 PolarHBondContact O-N 2.85Å; S658-E662 WeakPolarHBondContact O-CG 3.2Å; S658-E662 PolarHBondContact O-N 3.32Å
659	C	59.9	Low	56.8	Low	13 Å²	13	65.7 Å²	65.7	9%	0.088	36%	0.356	C	S	.	.	H	α-helix	trans	-49.8	-39	172.5	174	0	0	0	0	112.6	C653 S657 L663 F672	C653-C659 HydrophobicContact CB-CB 4.08Å; C653-C659 WeakPolarHBondContact CB-SG 3.45Å; C653-C659 VanDerWaalsContact SG-C 3.56Å; C653-C659 WeakPolarHBondContact SG-CB 3.08Å; C653-C659 CovalentContact SG-SG 2.04Å; C653-C659 PolarHBondContact SG-SG 2.96Å; S657-C659 VanDerWaalsContact C-N 3.29Å; S657-C659 PolarHBondContact O-N 3.01Å; C659-L663 WeakPolarHBondContact O-CB 3.16Å; C659-L663 PolarHBondContact O-N 2.91Å; C659-F672 WeakPolarHBondContact SG-CE1 3.38Å
660	F	60.3	Low	57.5	Low	10 Å²	10	65.9 Å²	65.9	4%	0.044	36%	0.358	C	S	.	.	H	α-helix	trans	-78.5	-32	178.3	-178.4	-100.3	0	0	0	113.4	Y599 N635 M654 A655 S657 S658 L663 L664	Y599-F660 HydrophobicContact CD2-CE2 4.47Å; Y599-F660 AromaticContact CD2-CZ 3.72Å; Y599-F660 HydrophobicContact CD2-CZ 3.72Å; Y599-F660 HydrophobicContact CE2-CE1 4.45Å; Y599-F660 AromaticContact CE2-CZ 3.88Å; Y599-F660 HydrophobicContact CE2-CZ 3.88Å; N635-F660 HydrophobicContact CB-CD2 4.44Å; N635-F660 HydrophobicContact CB-CE2 3.68Å; N635-F660 HydrophobicContact CB-CZ 4.44Å; M654-F660 WeakPolarHBondContact O-CB 3.18Å; A655-F660 VanDerWaalsContact C-CD1 3.49Å; A655-F660 HydrophobicContact CB-CD1 4.48Å; A655-F660 HydrophobicContact CB-CE1 4.23Å; A655-F660 HydrophobicContact CB-CZ 4.3Å; A655-F660 WeakPolarHBondContact O-CD1 3.39Å; A655-F660 WeakPolarHBondContact O-CE1 3.43Å; S657-F660 PolarHBondContact O-N 2.99Å; S657-F660 VanDerWaalsContact O-N 3.1Å; S657-F660 PolarHBondContact OG-N 2.9Å; S658-F660 PolarHBondContact O-N 2.92Å; F660-L663 HydrophobicContact CD2-CD2 4.08Å; F660-L663 HydrophobicContact CE2-CD2 4.43Å; F660-L663 WeakPolarHBondContact O-CB 2.9Å; F660-L663 PolarHBondContact O-N 3.33Å; F660-L664 HydrophobicContact CD1-CD1 3.9Å; F660-L664 HydrophobicContact CD1-CG 4.37Å; F660-L664 HydrophobicContact CE1-CD1 3.39Å; F660-L664 HydrophobicContact CE1-CG 4.04Å; F660-L664 HydrophobicContact CZ-CD1 3.83Å; F660-L664 HydrophobicContact CZ-CD2 4.3Å; F660-L664 HydrophobicContact CZ-CG 4.1Å; F660-L664 WeakPolarHBondContact O-CG 3.46Å; F660-L664 PolarHBondContact O-N 3.17Å
661	Q	63.5	Low	58.2	Low	130 Å²	130	68 Å²	68	61%	0.607	37%	0.368	S	S	*	.	H	α-helix	trans	-68.7	-38.7	169	-71.6	-143.6	-16.6	0	0	112.2	S657 S658 L663 L664 N665	S657-Q661 PolarHBondContact O-N 2.92Å; S658-Q661 PolarHBondContact O-N 2.85Å; Q661-L663 VanDerWaalsContact C-N 3.3Å; Q661-L663 PolarHBondContact O-N 3.49Å; Q661-L664 PolarHBondContact O-N 2.71Å; Q661-N665 WeakPolarHBondContact O-CB 3.37Å; Q661-N665 VanDerWaalsContact O-CG 3.27Å; Q661-N665 PolarHBondContact O-N 2.73Å; Q661-N665 PolarHBondContact O-ND2 2.87Å
662	E	63.5	Low	59.1	Low	84 Å²	84	62.8 Å²	62.8	39%	0.393	35%	0.345	S	S	.	.	H	α-helix	trans	-64.1	-35.5	174.4	-71.8	161.9	164.6	0	0	111.7	S658 S666	S658-E662 WeakPolarHBondContact O-CG 3.2Å; S658-E662 PolarHBondContact O-N 3.32Å; E662-S666 WeakPolarHBondContact O-CB 3.24Å
663	L	62.1	Low	60.3	Low	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-62.5	-53.1	169.7	176.7	67.1	0	0	0	112.1	L567 C659 F660 Q661 N665 S666 F672	L567-L663 HydrophobicContact CB-CD1 3.62Å; L567-L663 HydrophobicContact CD2-CD1 4.19Å; L567-L663 HydrophobicContact CG-CD1 4.34Å; C659-L663 WeakPolarHBondContact O-CB 3.16Å; C659-L663 PolarHBondContact O-N 2.91Å; F660-L663 HydrophobicContact CD2-CD2 4.08Å; F660-L663 HydrophobicContact CE2-CD2 4.43Å; F660-L663 WeakPolarHBondContact O-CB 2.9Å; F660-L663 PolarHBondContact O-N 3.33Å; Q661-L663 VanDerWaalsContact C-N 3.3Å; Q661-L663 PolarHBondContact O-N 3.49Å; L663-N665 VanDerWaalsContact C-N 3.35Å; L663-N665 PolarHBondContact O-N 2.65Å; L663-S666 WeakPolarHBondContact O-CB 3.45Å; L663-S666 PolarHBondContact O-N 3.44Å; L663-F672 HydrophobicContact CB-CZ 4.22Å; L663-F672 HydrophobicContact CD1-CE2 4.17Å
664	L	58.7	Low	61.3	Low	66 Å²	66	61.8 Å²	61.8	35%	0.346	33%	0.326	S	S	.	.	H	α-helix	trans	-65.5	-34	-176.6	-75.2	178.7	0	0	0	113.4	Y599 F660 Q661 S666	Y599-L664 HydrophobicContact CD1-CD2 4.24Å; Y599-L664 HydrophobicContact CE1-CD2 4.23Å; Y599-L664 HydrophobicContact CG-CD2 4.44Å; F660-L664 HydrophobicContact CD1-CD1 3.9Å; F660-L664 HydrophobicContact CD1-CG 4.37Å; F660-L664 HydrophobicContact CE1-CD1 3.39Å; F660-L664 HydrophobicContact CE1-CG 4.04Å; F660-L664 HydrophobicContact CZ-CD1 3.83Å; F660-L664 HydrophobicContact CZ-CD2 4.3Å; F660-L664 HydrophobicContact CZ-CG 4.1Å; F660-L664 WeakPolarHBondContact O-CG 3.46Å; F660-L664 PolarHBondContact O-N 3.17Å; Q661-L664 PolarHBondContact O-N 2.71Å; L664-S666 PolarHBondContact O-N 2.93Å
665	N	64.4	Low	62.3	Low	126 Å²	126	56.9 Å²	56.9	67%	0.674	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-6.2	179.1	-71.8	-40.8	0	0	0	113.4	Q661 L663 K667	Q661-N665 WeakPolarHBondContact O-CB 3.37Å; Q661-N665 VanDerWaalsContact O-CG 3.27Å; Q661-N665 PolarHBondContact O-N 2.73Å; Q661-N665 PolarHBondContact O-ND2 2.87Å; L663-N665 VanDerWaalsContact C-N 3.35Å; L663-N665 PolarHBondContact O-N 2.65Å; N665-K667 PolarHBondContact O-N 2.89Å
666	S	60.8	Low	63.6	Low	19 Å²	19	56 Å²	56	13%	0.133	29%	0.294	C	S	.	.			trans	-93.1	92.5	-168.1	-164.8	0	0	0	0	114.5	P569 E662 L663 L664 N668 G669 T670	P569-S666 WeakPolarHBondContact CD-O 3.44Å; P569-S666 WeakPolarHBondContact CG-O 3.37Å; E662-S666 WeakPolarHBondContact O-CB 3.24Å; L663-S666 WeakPolarHBondContact O-CB 3.45Å; L663-S666 PolarHBondContact O-N 3.44Å; L664-S666 PolarHBondContact O-N 2.93Å; S666-N668 VanDerWaalsContact C-N 3.29Å; S666-N668 PolarHBondContact O-N 2.9Å; S666-G669 PolarHBondContact O-N 2.91Å; S666-G669 WeakPolarHBondContact OG-CA 3.34Å; S666-G669 PolarHBondContact OG-N 3.23Å; S666-G669 PolarHBondContact OG-O 3.28Å; S666-T670 WeakPolarHBondContact CB-OG1 3.39Å; S666-T670 PolarHBondContact OG-N 3.42Å; S666-T670 PolarHBondContact OG-OG1 3.4Å
667	K	52	Low	64.9	Low	189 Å²	189	51.5 Å²	51.5	82%	0.822	27%	0.266	S	S	*	.	S	Bend	trans	-64.7	-28.3	177.7	-64.1	-170.4	176.2	-173.2	0	114.4	N665	N665-K667 PolarHBondContact O-N 2.89Å
668	N	56.4	Low	65.7	Low	146 Å²	146	50.2 Å²	50.2	78%	0.781	26%	0.257	S	S	*	.	S	Bend	trans	-101.6	-9.3	-177.9	-70.5	0.4	0	0	0	113.4	S666	S666-N668 VanDerWaalsContact C-N 3.29Å; S666-N668 PolarHBondContact O-N 2.9Å
669	G	61.8	Low	66.2	Low	15 Å²	15	49.2 Å²	49.2	16%	0.155	24%	0.242	C	C	.	.			trans	93.7	145.7	-170.7	0	0	0	0	0	112.3	L567 S666	L567-G669 CarbonylContact O-C 3.01Å; L567-G669 WeakPolarHBondContact O-CA 3.44Å; S666-G669 PolarHBondContact O-N 2.91Å; S666-G669 WeakPolarHBondContact OG-CA 3.34Å; S666-G669 PolarHBondContact OG-N 3.23Å; S666-G669 PolarHBondContact OG-O 3.28Å
670	T	62.8	Low	66.5	Low	24 Å²	24	51 Å²	51	15%	0.147	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	136.4	-176.8	-59.8	0	0	0	0	110.5	L567 S666 F672	L567-T670 PolarHBondContact N-O 2.85Å; L567-T670 VanDerWaalsContact N-O 3.12Å; L567-T670 PolarHBondContact O-N 3.27Å; S666-T670 WeakPolarHBondContact CB-OG1 3.39Å; S666-T670 PolarHBondContact OG-N 3.42Å; S666-T670 PolarHBondContact OG-OG1 3.4Å; T670-F672 HydrophobicContact CG2-CD2 4.2Å; T670-F672 HydrophobicContact CG2-CE1 4.45Å; T670-F672 HydrophobicContact CG2-CE2 3.74Å; T670-F672 HydrophobicContact CG2-CZ 3.87Å; T670-F672 VanDerWaalsContact O-CD2 3.32Å; T670-F672 WeakPolarHBondContact O-CD2 2.88Å; T670-F672 PolarHBondContact O-N 2.79Å
671	F	66.1	Low	66.6	Low	61 Å²	61	60.7 Å²	60.7	27%	0.268	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	112.5	173.1	-75.3	-73.2	0	0	0	110.4	E518 L566 C692	E518-F671 HydrophobicContact CG-CD2 4.48Å; E518-F671 HydrophobicContact CG-CE2 4.04Å; E518-F671 HydrophobicContact CG-CZ 4.45Å; L566-F671 HydrophobicContact CB-CD1 4.41Å; L566-F671 HydrophobicContact CB-CE1 4.3Å; L566-F671 HydrophobicContact CD1-CD1 4.2Å; L566-F671 HydrophobicContact CD1-CD2 4.43Å; L566-F671 HydrophobicContact CD1-CE1 4.21Å; L566-F671 HydrophobicContact CD1-CE2 4.43Å; L566-F671 HydrophobicContact CD1-CG 4.32Å; L566-F671 HydrophobicContact CD1-CZ 4.33Å; F671-C692 HydrophobicContact CB-CB 4.44Å; F671-C692 WeakPolarHBondContact O-CB 3.46Å; F671-C692 PolarHBondContact O-N 2.88Å; F671-C692 PolarHBondContact O-SG 2.98Å; F671-C692 VanDerWaalsContact O-SG 3.36Å
672	F	67.9	Low	66.3	Low	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	134.2	171.6	-66.6	-90.6	0	0	0	110.4	S564 S565 L567 C659 L663 T670 L689 H690	S564-F672 CarbonylContact C-O 3.45Å; S564-F672 WeakPolarHBondContact CA-O 3.4Å; S565-F672 PolarHBondContact N-O 3.2Å; S565-F672 PolarHBondContact O-N 2.93Å; L567-F672 HydrophobicContact CB-CD2 3.82Å; L567-F672 HydrophobicContact CB-CE2 3.76Å; L567-F672 HydrophobicContact CD1-CD2 3.49Å; L567-F672 VanDerWaalsContact CD1-CD2 3.49Å; L567-F672 HydrophobicContact CD1-CE2 3.77Å; L567-F672 HydrophobicContact CD1-CG 4.12Å; L567-F672 HydrophobicContact CG-CD2 4.23Å; L567-F672 HydrophobicContact CG-CE2 4.41Å; C659-F672 WeakPolarHBondContact SG-CE1 3.38Å; L663-F672 HydrophobicContact CB-CZ 4.22Å; L663-F672 HydrophobicContact CD1-CE2 4.17Å; T670-F672 HydrophobicContact CG2-CD2 4.2Å; T670-F672 HydrophobicContact CG2-CE1 4.45Å; T670-F672 HydrophobicContact CG2-CE2 3.74Å; T670-F672 HydrophobicContact CG2-CZ 3.87Å; T670-F672 VanDerWaalsContact O-CD2 3.32Å; T670-F672 WeakPolarHBondContact O-CD2 2.88Å; T670-F672 PolarHBondContact O-N 2.79Å; F672-L689 HydrophobicContact CB-CB 3.92Å; F672-L689 HydrophobicContact CB-CD1 4.24Å; F672-L689 HydrophobicContact CB-CD2 3.95Å; F672-L689 HydrophobicContact CB-CG 4.26Å; F672-L689 HydrophobicContact CD1-CB 4.28Å; F672-L689 HydrophobicContact CG-CB 4.33Å; F672-H690 CarbonylContact C-O 2.87Å; F672-H690 VanDerWaalsContact CA-O 3.22Å; F672-H690 WeakPolarHBondContact CA-O 3.46Å
673	C	71.9	Confident	66.1	Low	2 Å²	2	58.2 Å²	58.2	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	145.2	179	-79.8	0	0	0	0	109.5	F561 H690 C692 W698	F561-C673 HydrophobicContact CE2-CB 4.26Å; C673-H690 PolarHBondContact N-O 3.3Å; C673-H690 PolarHBondContact O-N 3.01Å; C673-H690 VanDerWaalsContact O-N 3.09Å; C673-C692 WeakPolarHBondContact CA-SG 3.42Å; C673-C692 HydrophobicContact CB-CB 3.91Å; C673-C692 WeakPolarHBondContact CB-SG 3.37Å; C673-C692 PolarHBondContact N-SG 2.79Å; C673-C692 WeakPolarHBondContact SG-CB 3.34Å; C673-C692 CovalentContact SG-SG 2.03Å; C673-C692 PolarHBondContact SG-SG 3.2Å; C673-W698 HydrophobicContact CB-CH2 3.52Å; C673-W698 HydrophobicContact CB-CZ3 3.56Å
674	R	72.6	Confident	66.2	Low	26 Å²	26	62.3 Å²	62.3	10%	0.098	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	141	178.8	-150.8	169.1	-159.6	178.2	2.5	110.5	Y562 G563 P648 V686 F687 L689	Y562-R674 WeakPolarHBondContact CB-O 3.32Å; Y562-R674 HydrophobicContact CD1-CB 4.23Å; Y562-R674 PolarHBondContact N-O 2.62Å; G563-R674 PolarHBondContact O-N 2.72Å; P648-R674 PolarHBondContact O-NH2 2.85Å; R674-V686 HydrophobicContact CG-CG1 4.03Å; R674-V686 VanDerWaalsContact NE-CG1 3.33Å; R674-F687 PolarHBondContact NE-O 3.43Å; R674-L689 HydrophobicContact CB-CD2 4.03Å; R674-L689 HydrophobicContact CG-CD2 4.22Å
675	A	76.7	Confident	66.7	Low	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	162	172.8	0	0	0	0	0	110.9	V560 F687 W698	V560-A675 CarbonylContact O-C 3.52Å; V560-A675 VanDerWaalsContact O-CA 3.28Å; V560-A675 WeakPolarHBondContact O-CA 3.39Å; A675-F687 HydrophobicContact CB-CB 4.07Å; A675-F687 HydrophobicContact CB-CD2 3.51Å; A675-F687 HydrophobicContact CB-CE2 3.99Å; A675-F687 HydrophobicContact CB-CG 3.92Å; A675-F687 WeakPolarHBondContact O-CB 3.48Å; A675-F687 PolarHBondContact O-N 3.15Å; A675-W698 HydrophobicContact CB-CB 4.19Å; A675-W698 HydrophobicContact CB-CE3 4.38Å
676	Y	77.8	Confident	66.8	Low	5 Å²	5	59 Å²	59	2%	0.02	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	120.6	-179.6	173.2	-92.8	0	0	0	109.1	F539 L545 V560 Y562 A678 H684 V686	F539-Y676 HydrophobicContact CB-CD2 4.41Å; F539-Y676 HydrophobicContact CB-CG 4.45Å; L545-Y676 HydrophobicContact CD1-CE1 4.04Å; L545-Y676 WeakPolarHBondContact CD1-OH 3.48Å; V560-Y676 PolarHBondContact N-O 2.86Å; V560-Y676 PolarHBondContact O-N 2.82Å; Y562-Y676 HydrophobicContact CD2-CD2 4.39Å; Y676-A678 HydrophobicContact CD1-CB 4.4Å; Y676-A678 HydrophobicContact CE1-CB 3.82Å; Y676-H684 HydrophobicContact CE2-CB 3.54Å; Y676-H684 VanDerWaalsContact OH-CB 3.29Å; Y676-H684 WeakPolarHBondContact OH-CB 3.04Å; Y676-V686 HydrophobicContact CD2-CG2 4.42Å
677	R	81.7	Confident	67.1	Low	49 Å²	49	59.5 Å²	59.5	19%	0.185	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	109.7	174.2	-179.2	166.1	-75.3	171.4	-10	110.3	Y557 I558 D559 K679 H684 E685 F687	Y557-R677 HydrophobicContact CD2-CG 3.97Å; Y557-R677 VanDerWaalsContact CD2-NE 3.28Å; Y557-R677 VanDerWaalsContact CE2-NH2 3.27Å; Y557-R677 HydrophobicContact CG-CG 4.15Å; I558-R677 WeakPolarHBondContact O-CA 3.15Å; D559-R677 WeakPolarHBondContact OD1-CB 3.04Å; D559-R677 WeakPolarHBondContact OD1-CG 3.29Å; D559-R677 IonicContact OD1-CZ 2.68Å; D559-R677 IonicContact OD1-NE 3.2Å; D559-R677 PolarHBondContact OD1-NE 2.04Å; D559-R677 IonicContact OD1-NH2 3.8Å; D559-R677 PolarHBondContact OD1-NH2 2.79Å; D559-R677 IonicContact OD2-CZ 2.71Å; D559-R677 IonicContact OD2-NE 3.31Å; D559-R677 IonicContact OD2-NH2 3.42Å; D559-R677 PolarHBondContact OD2-NH2 2.81Å; R677-K679 VanDerWaalsContact CD-CE 3.48Å; R677-K679 HydrophobicContact CG-CG 4.01Å; R677-H684 WeakPolarHBondContact O-CA 3.46Å; R677-E685 HydrophobicContact CB-CB 4.06Å; R677-E685 WeakPolarHBondContact CB-O 2.92Å; R677-E685 PolarHBondContact N-O 2.94Å; R677-E685 IonicContact NH1-OE2 2.88Å; R677-E685 PolarHBondContact O-N 2.94Å; R677-E685 VanDerWaalsContact O-N 3.07Å; R677-F687 HydrophobicContact CB-CD2 4.4Å; R677-F687 HydrophobicContact CB-CE2 3.78Å
678	A	75.7	Confident	67.6	Low	2 Å²	2	52.1 Å²	52.1	2%	0.017	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	133	167.6	0	0	0	0	0	109.2	L545 W551 L552 Y557 I558 Y676	L545-A678 HydrophobicContact CD1-CB 4.4Å; W551-A678 HydrophobicContact CH2-CB 4.05Å; L552-A678 HydrophobicContact CD2-CB 4.43Å; Y557-A678 CarbonylContact C-O 3.27Å; Y557-A678 WeakPolarHBondContact CA-O 3.4Å; Y557-A678 WeakPolarHBondContact CB-O 3.36Å; I558-A678 HydrophobicContact CG1-CB 4Å; I558-A678 PolarHBondContact N-O 2.85Å; I558-A678 PolarHBondContact O-N 2.95Å; Y676-A678 HydrophobicContact CD1-CB 4.4Å; Y676-A678 HydrophobicContact CE1-CB 3.82Å
679	K	74.3	Confident	68.1	Low	67 Å²	67	45.3 Å²	45.3	29%	0.291	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	152.5	176.7	-51.4	177.7	-179.9	175.1	0	111	D556 R677 R681 L682 T683 E685	D556-K679 WeakPolarHBondContact O-CA 3.43Å; R677-K679 VanDerWaalsContact CD-CE 3.48Å; R677-K679 HydrophobicContact CG-CG 4.01Å; K679-R681 PolarHBondContact O-N 3.33Å; K679-L682 PolarHBondContact O-N 2.91Å; K679-T683 VanDerWaalsContact CB-O 3.27Å; K679-T683 WeakPolarHBondContact CB-O 3.28Å; K679-T683 WeakPolarHBondContact CG-O 3.13Å; K679-T683 PolarHBondContact N-O 3.11Å; K679-E685 VanDerWaalsContact CE-OE2 3.26Å; K679-E685 WeakPolarHBondContact CE-OE2 3.37Å; K679-E685 IonicContact NZ-OE2 3.86Å; K679-E685 PolarHBondContact NZ-OE2 3.4Å
680	T	65.3	Low	68.3	Low	49 Å²	49	47.5 Å²	47.5	30%	0.301	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	6.4	-177.7	52.6	0	0	0	0	116.7	T549 L552 F555 D556	T549-T680 PolarHBondContact OG1-O 3.43Å; L552-T680 HydrophobicContact CB-CG2 4.09Å; L552-T680 HydrophobicContact CD1-CG2 3.88Å; F555-T680 WeakPolarHBondContact O-CG2 3.42Å; D556-T680 PolarHBondContact O-N 3.01Å
681	R	61.6	Low	68.4	Low	215 Å²	215	47.7 Å²	47.7	81%	0.811	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126.2	28	180	-59.5	-172.7	-177.3	-175.3	1.2	113.2	K679 T683	K679-R681 PolarHBondContact O-N 3.33Å; R681-T683 PolarHBondContact O-N 3.16Å
682	L	58.4	Low	68.4	Low	84 Å²	84	44.8 Å²	44.8	44%	0.44	21%	0.213	S	C	.	.	S	Bend	trans	54.3	16.9	-175	-55.1	172.6	0	0	0	114.2	P546 T547 T549 K679	P546-L682 WeakPolarHBondContact O-CD2 3.43Å; T547-L682 HydrophobicContact CG2-CD1 4.07Å; T549-L682 HydrophobicContact CG2-CD2 3.84Å; T549-L682 HydrophobicContact CG2-CG 4.4Å; K679-L682 PolarHBondContact O-N 2.91Å
683	T	59	Low	68.1	Low	78 Å²	78	48.9 Å²	48.9	48%	0.479	24%	0.242	S	C	.	.			trans	-92.2	126.6	173.9	38.9	0	0	0	0	108.1	K679 R681	K679-T683 VanDerWaalsContact CB-O 3.27Å; K679-T683 WeakPolarHBondContact CB-O 3.28Å; K679-T683 WeakPolarHBondContact CG-O 3.13Å; K679-T683 PolarHBondContact N-O 3.11Å; R681-T683 PolarHBondContact O-N 3.16Å
684	H	64.2	Low	67.6	Low	86 Å²	86	51.1 Å²	51.1	40%	0.398	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	151.6	179.3	71.6	-90.3	0	0	0	110.7	S542 Y676 R677	S542-H684 WeakPolarHBondContact CB-ND1 3.29Å; S542-H684 PolarHBondContact OG-CE1 3.02Å; S542-H684 VanDerWaalsContact OG-CE1 3.25Å; S542-H684 PolarHBondContact OG-ND1 2.8Å; Y676-H684 HydrophobicContact CE2-CB 3.54Å; Y676-H684 VanDerWaalsContact OH-CB 3.29Å; Y676-H684 WeakPolarHBondContact OH-CB 3.04Å; R677-H684 WeakPolarHBondContact O-CA 3.46Å
685	E	69.2	Low	66.9	Low	85 Å²	85	59.5 Å²	59.5	40%	0.397	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	102.5	176	169.4	172.6	-142	0	0	108	R677 K679 F687	R677-E685 HydrophobicContact CB-CB 4.06Å; R677-E685 WeakPolarHBondContact CB-O 2.92Å; R677-E685 PolarHBondContact N-O 2.94Å; R677-E685 IonicContact NH1-OE2 2.88Å; R677-E685 PolarHBondContact O-N 2.94Å; R677-E685 VanDerWaalsContact O-N 3.07Å; K679-E685 VanDerWaalsContact CE-OE2 3.26Å; K679-E685 WeakPolarHBondContact CE-OE2 3.37Å; K679-E685 IonicContact NZ-OE2 3.86Å; K679-E685 PolarHBondContact NZ-OE2 3.4Å; E685-F687 PolarHBondContact O-N 2.87Å
686	V	66.4	Low	66.2	Low	37 Å²	37	62.6 Å²	62.6	22%	0.224	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	124	172.7	-166.7	0	0	0	0	107.7	Y562 R674 Y676	Y562-V686 HydrophobicContact CE2-CG1 4.47Å; R674-V686 HydrophobicContact CG-CG1 4.03Å; R674-V686 VanDerWaalsContact NE-CG1 3.33Å; Y676-V686 HydrophobicContact CD2-CG2 4.42Å
687	F	67.4	Low	65.7	Low	29 Å²	29	64.3 Å²	64.3	13%	0.127	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	164.7	-178.9	-81.7	-98.6	0	0	0	112.3	D559 R674 A675 R677 E685	D559-F687 HydrophobicContact CB-CE2 4.16Å; D559-F687 HydrophobicContact CB-CZ 4.34Å; D559-F687 WeakPolarHBondContact OD1-CE2 3.29Å; D559-F687 WeakPolarHBondContact OD1-CZ 3.49Å; R674-F687 PolarHBondContact NE-O 3.43Å; A675-F687 HydrophobicContact CB-CB 4.07Å; A675-F687 HydrophobicContact CB-CD2 3.51Å; A675-F687 HydrophobicContact CB-CE2 3.99Å; A675-F687 HydrophobicContact CB-CG 3.92Å; A675-F687 WeakPolarHBondContact O-CB 3.48Å; A675-F687 PolarHBondContact O-N 3.15Å; R677-F687 HydrophobicContact CB-CD2 4.4Å; R677-F687 HydrophobicContact CB-CE2 3.78Å; E685-F687 PolarHBondContact O-N 2.87Å
688	P	62.9	Low	65.5	Low	35 Å²	35	62.4 Å²	62.4	23%	0.227	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.1	159.2	158.7	-22.8	33.2	0	0	0	112.7	K651 H690	K651-P688 WeakPolarHBondContact O-CA 2.18Å; K651-P688 WeakPolarHBondContact O-CB 3.12Å; K651-P688 VanDerWaalsContact O-CG 3.3Å; K651-P688 WeakPolarHBondContact O-CG 3.39Å; P688-H690 PolarHBondContact O-CD2 3Å; P688-H690 VanDerWaalsContact O-CD2 3.26Å
689	L	66.3	Low	65.9	Low	3 Å²	3	68.4 Å²	68.4	2%	0.016	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	126.3	156.1	-75	-178.2	0	0	0	108.5	L567 M649 F672 R674	L567-L689 HydrophobicContact CD1-CD1 3.72Å; M649-L689 HydrophobicContact CG-CD1 3.98Å; F672-L689 HydrophobicContact CB-CB 3.92Å; F672-L689 HydrophobicContact CB-CD1 4.24Å; F672-L689 HydrophobicContact CB-CD2 3.95Å; F672-L689 HydrophobicContact CB-CG 4.26Å; F672-L689 HydrophobicContact CD1-CB 4.28Å; F672-L689 HydrophobicContact CG-CB 4.33Å; R674-L689 HydrophobicContact CB-CD2 4.03Å; R674-L689 HydrophobicContact CG-CD2 4.22Å
690	H	67	Low	66.4	Low	61 Å²	61	66.7 Å²	66.7	28%	0.282	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	148.8	172.2	-62.7	-80.8	0	0	0	108.4	F672 C673 P688 C692	F672-H690 CarbonylContact C-O 2.87Å; F672-H690 VanDerWaalsContact CA-O 3.22Å; F672-H690 WeakPolarHBondContact CA-O 3.46Å; C673-H690 PolarHBondContact N-O 3.3Å; C673-H690 PolarHBondContact O-N 3.01Å; C673-H690 VanDerWaalsContact O-N 3.09Å; P688-H690 PolarHBondContact O-CD2 3Å; P688-H690 VanDerWaalsContact O-CD2 3.26Å; H690-C692 PolarHBondContact O-N 2.81Å
691	D	64.1	Low	67.4	Low	27 Å²	27	64.4 Å²	64.4	14%	0.144	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	127.5	167.8	167.1	29	0	0	0	108.7	S693 A694	D691-S693 VanDerWaalsContact CG-N 3.34Å; D691-S693 PolarHBondContact O-N 3.31Å; D691-S693 WeakPolarHBondContact OD1-CB 3.47Å; D691-S693 PolarHBondContact OD1-N 3.44Å; D691-S693 PolarHBondContact OD1-OG 3.5Å; D691-S693 WeakPolarHBondContact OD2-CB 3.1Å; D691-S693 PolarHBondContact OD2-OG 2.62Å; D691-A694 HydrophobicContact CB-CB 4.19Å; D691-A694 VanDerWaalsContact O-CB 3.31Å; D691-A694 WeakPolarHBondContact O-CB 3.45Å; D691-A694 PolarHBondContact O-N 2.79Å; D691-A694 PolarHBondContact OD2-N 3.05Å
692	C	66.8	Low	68.5	Low	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.1	177.4	-68.1	0	0	0	0	113.1	F671 C673 H690 A694	F671-C692 HydrophobicContact CB-CB 4.44Å; F671-C692 WeakPolarHBondContact O-CB 3.46Å; F671-C692 PolarHBondContact O-N 2.88Å; F671-C692 PolarHBondContact O-SG 2.98Å; F671-C692 VanDerWaalsContact O-SG 3.36Å; C673-C692 WeakPolarHBondContact CA-SG 3.42Å; C673-C692 HydrophobicContact CB-CB 3.91Å; C673-C692 WeakPolarHBondContact CB-SG 3.37Å; C673-C692 PolarHBondContact N-SG 2.79Å; C673-C692 WeakPolarHBondContact SG-CB 3.34Å; C673-C692 CovalentContact SG-SG 2.03Å; C673-C692 PolarHBondContact SG-SG 3.2Å; H690-C692 PolarHBondContact O-N 2.81Å; C692-A694 VanDerWaalsContact C-N 3.33Å
693	S	61.3	Low	70	Confident	87 Å²	87	50.2 Å²	50.2	61%	0.608	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-17.2	176.1	-23.7	0	0	0	0	112	D691	D691-S693 VanDerWaalsContact CG-N 3.34Å; D691-S693 PolarHBondContact O-N 3.31Å; D691-S693 WeakPolarHBondContact OD1-CB 3.47Å; D691-S693 PolarHBondContact OD1-N 3.44Å; D691-S693 PolarHBondContact OD1-OG 3.5Å; D691-S693 WeakPolarHBondContact OD2-CB 3.1Å; D691-S693 PolarHBondContact OD2-OG 2.62Å
694	A	61	Low	71.3	Confident	49 Å²	49	48.3 Å²	48.3	41%	0.405	25%	0.246	S	C	.	.	S	Bend	trans	-75.2	160.3	172.4	0	0	0	0	0	111.6	D691 C692 Q696	D691-A694 HydrophobicContact CB-CB 4.19Å; D691-A694 VanDerWaalsContact O-CB 3.31Å; D691-A694 WeakPolarHBondContact O-CB 3.45Å; D691-A694 PolarHBondContact O-N 2.79Å; D691-A694 PolarHBondContact OD2-N 3.05Å; C692-A694 VanDerWaalsContact C-N 3.33Å; A694-Q696 PolarHBondContact O-N 2.97Å
695	K	57.1	Low	72.6	Confident	201 Å²	201	44.3 Å²	44.3	87%	0.874	23%	0.227	S	C	*	.			trans	-52.4	123.6	-172.7	-162.8	177.5	-172.5	178.9	0	112.1	T697	K695-T697 PolarHBondContact O-N 3.01Å
696	Q	63.2	Low	73.6	Confident	66 Å²	66	46.3 Å²	46.3	31%	0.308	23%	0.232	S	C	.	.			trans	-44	123.2	-175.4	-71.3	174.2	-2.6	0	0	113.3	I510 A694	I510-Q696 VanDerWaalsContact CD1-NE2 3.3Å; A694-Q696 PolarHBondContact O-N 2.97Å
697	T	66.6	Low	74.6	Confident	41 Å²	41	44.8 Å²	44.8	25%	0.252	22%	0.223	S	C	.	.			trans	-95.2	-25	176.5	52.5	0	0	0	0	112.9	K695	K695-T697 PolarHBondContact O-N 3.01Å
698	W	77.4	Confident	75.6	Confident	8 Å²	8	43.9 Å²	43.9	3%	0.03	22%	0.219	C	C	.	.			trans	-89.8	147.6	172.8	57.6	96.7	0	0	0	111.5	Y520 F561 C673 A675 F701	Y520-W698 HydrophobicContact CD2-CZ2 4.07Å; Y520-W698 HydrophobicContact CE2-CZ2 4.31Å; F561-W698 HydrophobicContact CB-CB 4.48Å; F561-W698 HydrophobicContact CB-CD2 4.4Å; F561-W698 HydrophobicContact CB-CG 3.98Å; F561-W698 AromaticContact CD2-CD2 3.89Å; F561-W698 HydrophobicContact CD2-CD2 3.89Å; F561-W698 AromaticContact CD2-CE2 3.68Å; F561-W698 HydrophobicContact CD2-CE3 4.28Å; F561-W698 HydrophobicContact CD2-CG 4.36Å; F561-W698 HydrophobicContact CD2-CH2 4.35Å; F561-W698 AromaticContact CD2-CZ2 3.94Å; F561-W698 HydrophobicContact CD2-CZ2 3.94Å; F561-W698 AromaticContact CD2-NE1 3.98Å; F561-W698 HydrophobicContact CE2-CH2 4.43Å; F561-W698 HydrophobicContact CE2-CZ2 4.22Å; C673-W698 HydrophobicContact CB-CH2 3.52Å; C673-W698 HydrophobicContact CB-CZ3 3.56Å; A675-W698 HydrophobicContact CB-CB 4.19Å; A675-W698 HydrophobicContact CB-CE3 4.38Å; W698-F701 AromaticContact CD1-CE2 3.94Å; W698-F701 AromaticContact CD1-CZ 3.97Å; W698-F701 AromaticContact NE1-CE1 4Å; W698-F701 AromaticContact NE1-CE2 3.59Å; W698-F701 AromaticContact NE1-CZ 3.29Å; W698-F701 VanDerWaalsContact NE1-CZ 3.29Å
699	K	83.6	Confident	76.6	Confident	128 Å²	128	48.1 Å²	48.1	56%	0.557	24%	0.236	S	C	*	.			trans	-104.4	-18.9	174.7	-67.2	-178.7	-178.6	175.4	0	113.1	A506 D559	A506-K699 WeakPolarHBondContact CB-O 3.46Å; A506-K699 PolarHBondContact N-O 2.77Å; D559-K699 PolarHBondContact O-N 3.23Å
700	Y	85.4	Confident	77.2	Confident	32 Å²	32	49.4 Å²	49.4	13%	0.125	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	152.3	-174.3	-58.5	-84.4	0	0	0	112.5	L491 F503 V504 P505 I558 D559 V560 F561	L491-Y700 HydrophobicContact CD1-CE1 4.17Å; L491-Y700 HydrophobicContact CD1-CE2 4.3Å; F503-Y700 HydrophobicContact CB-CD1 4.14Å; F503-Y700 HydrophobicContact CB-CG 4.35Å; V504-Y700 CarbonylContact O-C 3.58Å; V504-Y700 VanDerWaalsContact O-CA 3.31Å; V504-Y700 WeakPolarHBondContact O-CA 3.48Å; P505-Y700 HydrophobicContact CG-CD1 4.35Å; P505-Y700 HydrophobicContact CG-CE1 4.14Å; I558-Y700 HydrophobicContact CB-CD2 3.92Å; I558-Y700 HydrophobicContact CB-CE2 3.83Å; I558-Y700 HydrophobicContact CD1-CD2 4.27Å; I558-Y700 HydrophobicContact CG2-CD2 4.32Å; I558-Y700 HydrophobicContact CG2-CE2 3.76Å; D559-Y700 PolarHBondContact O-N 3.31Å; V560-Y700 CarbonylContact C-O 3.5Å; V560-Y700 WeakPolarHBondContact CA-O 3.46Å; F561-Y700 PolarHBondContact N-O 2.95Å
701	F	85.8	Confident	77.7	Confident	1 Å²	1	47.1 Å²	47.1	0%	0.004	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	149.5	159.4	-68.7	-94.8	0	0	0	108.5	F503 V504 A506 I509 I510 A524 F561 W698	F503-F701 CarbonylContact C-O 3.47Å; F503-F701 VanDerWaalsContact CA-O 3.3Å; F503-F701 WeakPolarHBondContact CA-O 3.26Å; V504-F701 PolarHBondContact N-O 2.57Å; V504-F701 PolarHBondContact O-N 3.3Å; A506-F701 HydrophobicContact CB-CD2 4.16Å; A506-F701 HydrophobicContact CB-CE2 3.89Å; I509-F701 HydrophobicContact CD1-CB 3.94Å; I509-F701 HydrophobicContact CD1-CD2 3.6Å; I509-F701 HydrophobicContact CD1-CE2 4.35Å; I509-F701 HydrophobicContact CD1-CG 3.95Å; I510-F701 HydrophobicContact CD1-CE2 3.78Å; I510-F701 HydrophobicContact CD1-CZ 3.84Å; A524-F701 HydrophobicContact CB-CB 4.48Å; A524-F701 HydrophobicContact CB-CD1 3.63Å; A524-F701 HydrophobicContact CB-CE1 3.93Å; A524-F701 HydrophobicContact CB-CG 4.03Å; F561-F701 HydrophobicContact CB-CD1 3.59Å; F561-F701 HydrophobicContact CB-CE1 3.66Å; F561-F701 HydrophobicContact CB-CG 4.28Å; F561-F701 HydrophobicContact CB-CZ 4.4Å; F561-F701 AromaticContact CD1-CD1 3.81Å; F561-F701 HydrophobicContact CD1-CD1 3.81Å; F561-F701 AromaticContact CD1-CE1 3.67Å; F561-F701 HydrophobicContact CD1-CE1 3.67Å; F561-F701 HydrophobicContact CD2-CE1 4.1Å; F561-F701 HydrophobicContact CE1-CE1 4.32Å; F561-F701 AromaticContact CG-CD1 3.84Å; F561-F701 HydrophobicContact CG-CD1 3.84Å; F561-F701 AromaticContact CG-CE1 3.53Å; F561-F701 HydrophobicContact CG-CE1 3.53Å; F561-F701 HydrophobicContact CG-CZ 4.42Å; W698-F701 AromaticContact CD1-CE2 3.94Å; W698-F701 AromaticContact CD1-CZ 3.97Å; W698-F701 AromaticContact NE1-CE1 4Å; W698-F701 AromaticContact NE1-CE2 3.59Å; W698-F701 AromaticContact NE1-CZ 3.29Å; W698-F701 VanDerWaalsContact NE1-CZ 3.29Å
702	A	86	Confident	78.4	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.008	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	130.9	176.3	0	0	0	0	0	110.9	M501 F503 V536 Y537 F539 V560	M501-A702 HydrophobicContact SD-CB 3.9Å; F503-A702 HydrophobicContact CD1-CB 3.92Å; F503-A702 HydrophobicContact CE1-CB 3.89Å; V536-A702 CarbonylContact C-O 3.48Å; V536-A702 WeakPolarHBondContact CA-O 3.43Å; Y537-A702 PolarHBondContact N-O 3.19Å; F539-A702 HydrophobicContact CE2-CB 3.56Å; F539-A702 HydrophobicContact CZ-CB 4.04Å; V560-A702 HydrophobicContact CG1-CB 4.23Å
703	C	88.9	Confident	78.8	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.5	171.9	-61.2	0	0	0	0	110	T502 C528 L531 K535	T502-C703 PolarHBondContact N-O 3.13Å; T502-C703 PolarHBondContact O-N 3.16Å; C528-C703 WeakPolarHBondContact CA-SG 3.36Å; C528-C703 HydrophobicContact CB-CB 3.74Å; C528-C703 WeakPolarHBondContact CB-SG 3.44Å; C528-C703 VanDerWaalsContact SG-CA 3.57Å; C528-C703 WeakPolarHBondContact SG-CB 3.39Å; C528-C703 CovalentContact SG-SG 2.04Å; C528-C703 PolarHBondContact SG-SG 2.96Å; L531-C703 HydrophobicContact CD1-CB 4.08Å; K535-C703 WeakPolarHBondContact O-CA 3.11Å
704	E	87.5	Confident	79.6	Confident	37 Å²	37	56.9 Å²	56.9	17%	0.173	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	124.6	167.2	-179.5	178.2	-100.2	0	0	108.8	I495 F499 C500 M501 G534 K535 Y537	I495-E704 HydrophobicContact CD1-CG 4.01Å; F499-E704 HydrophobicContact CD1-CG 4.35Å; C500-E704 WeakPolarHBondContact O-CA 3.4Å; M501-E704 HydrophobicContact CE-CB 4.36Å; G534-E704 VanDerWaalsContact CA-O 3.24Å; G534-E704 WeakPolarHBondContact CA-O 3.36Å; K535-E704 WeakPolarHBondContact CE-OE2 3.44Å; K535-E704 PolarHBondContact N-O 3.42Å; K535-E704 IonicContact NZ-OE2 3.22Å; K535-E704 PolarHBondContact NZ-OE2 3.31Å; K535-E704 PolarHBondContact O-N 3.36Å; Y537-E704 HydrophobicContact CD2-CB 3.9Å; Y537-E704 HydrophobicContact CD2-CG 4.43Å; Y537-E704 WeakPolarHBondContact CE2-OE1 3.08Å; Y537-E704 HydrophobicContact CG-CB 4.48Å
705	H	90.4	Very high	80.5	Confident	3 Å²	3	59 Å²	59	1%	0.014	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	169.5	-176.5	67.5	88.3	0	0	0	113.3	P482 F499 C500 T502 L531	P482-H705 WeakPolarHBondContact CD-CE1 3.36Å; F499-H705 CarbonylContact C-O 3.51Å; F499-H705 WeakPolarHBondContact CA-O 3.25Å; F499-H705 WeakPolarHBondContact CD1-O 3.4Å; C500-H705 VanDerWaalsContact CB-CE1 3.45Å; C500-H705 WeakPolarHBondContact CB-CE1 3.38Å; C500-H705 PolarHBondContact N-O 3.29Å; C500-H705 PolarHBondContact O-N 2.7Å; C500-H705 VanDerWaalsContact O-N 3.11Å; T502-H705 PolarHBondContact OG1-NE2 2.93Å; L531-H705 HydrophobicContact CB-CB 4.34Å; L531-H705 WeakPolarHBondContact O-CB 3.37Å
706	Y	89.6	Confident	81.5	Confident	127 Å²	127	51 Å²	51	50%	0.498	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	147.8	173.9	-71	-76.3	0	0	0	112.8	F499 K532	F499-Y706 HydrophobicContact CD1-CD1 4.26Å; F499-Y706 HydrophobicContact CD1-CE1 4.42Å; F499-Y706 HydrophobicContact CD2-CD1 4.5Å; F499-Y706 HydrophobicContact CD2-CE1 4.32Å; F499-Y706 AromaticContact CE1-CD1 3.93Å; F499-Y706 HydrophobicContact CE1-CD1 3.93Å; F499-Y706 HydrophobicContact CE1-CD2 4.28Å; F499-Y706 AromaticContact CE1-CE1 3.71Å; F499-Y706 HydrophobicContact CE1-CE1 3.71Å; F499-Y706 HydrophobicContact CE1-CE2 4.06Å; F499-Y706 HydrophobicContact CE1-CG 4.22Å; F499-Y706 AromaticContact CE1-CZ 3.77Å; F499-Y706 HydrophobicContact CE2-CD1 4.19Å; F499-Y706 AromaticContact CE2-CE1 3.6Å; F499-Y706 HydrophobicContact CE2-CE1 3.6Å; F499-Y706 AromaticContact CZ-CD1 3.91Å; F499-Y706 HydrophobicContact CZ-CD1 3.91Å; F499-Y706 AromaticContact CZ-CE1 3.25Å; F499-Y706 HydrophobicContact CZ-CE1 3.25Å; F499-Y706 HydrophobicContact CZ-CE2 4.12Å; F499-Y706 AromaticContact CZ-CZ 3.37Å; K532-Y706 WeakPolarHBondContact CD-O 3.01Å
707	A	88.6	Confident	82.2	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.033	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-70.9	156.3	174.8	0	0	0	0	0	112.7	T479 D498 C500 K532	T479-A707 HydrophobicContact CG2-CB 4.17Å; D498-A707 WeakPolarHBondContact O-CB 3.02Å; D498-A707 PolarHBondContact O-N 2.8Å; C500-A707 VanDerWaalsContact SG-CA 3.55Å; C500-A707 VanDerWaalsContact SG-CB 3.58Å; K532-A707 WeakPolarHBondContact CE-O 3.39Å; K532-A707 PolarHBondContact NZ-O 2.75Å
708	Y	88.7	Confident	82.3	Confident	11 Å²	11	53.7 Å²	53.7	4%	0.043	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	139.1	-177.2	-74.1	-102.6	0	0	0	110.6	T479 S480 P482 K532 N710 E740 F743	T479-Y708 CarbonylContact C-O 3.51Å; T479-Y708 WeakPolarHBondContact CA-O 3.4Å; T479-Y708 WeakPolarHBondContact CB-O 3.26Å; S480-Y708 PolarHBondContact N-O 2.68Å; S480-Y708 PolarHBondContact O-N 2.92Å; P482-Y708 HydrophobicContact CG-CE2 4.37Å; K532-Y708 HydrophobicContact CD-CD1 4.35Å; K532-Y708 HydrophobicContact CD-CD2 4.25Å; K532-Y708 HydrophobicContact CD-CE1 4.22Å; K532-Y708 HydrophobicContact CD-CE2 4.1Å; K532-Y708 HydrophobicContact CD-CG 4.36Å; K532-Y708 HydrophobicContact CG-CE1 3.96Å; K532-Y708 HydrophobicContact CG-CE2 4.11Å; K532-Y708 PolarHBondContact N-OH 2.8Å; Y708-N710 PolarHBondContact O-N 2.95Å; Y708-E740 HydrophobicContact CD1-CB 4.47Å; Y708-E740 HydrophobicContact CD1-CG 4.17Å; Y708-F743 HydrophobicContact CD1-CB 4.43Å; Y708-F743 HydrophobicContact CD1-CD2 4.17Å; Y708-F743 HydrophobicContact CD2-CB 4.06Å; Y708-F743 AromaticContact CD2-CD2 3.83Å; Y708-F743 HydrophobicContact CD2-CD2 3.83Å; Y708-F743 HydrophobicContact CD2-CG 4.39Å; Y708-F743 AromaticContact CE1-CD2 3.85Å; Y708-F743 HydrophobicContact CE1-CD2 3.85Å; Y708-F743 AromaticContact CE2-CD2 3.49Å; Y708-F743 HydrophobicContact CE2-CD2 3.49Å; Y708-F743 VanDerWaalsContact CE2-CD2 3.49Å; Y708-F743 HydrophobicContact CE2-CE2 4.07Å; Y708-F743 HydrophobicContact CE2-CG 4.43Å; Y708-F743 HydrophobicContact CG-CB 4Å; Y708-F743 HydrophobicContact CG-CD2 4.17Å; Y708-F743 AromaticContact CZ-CD2 3.49Å; Y708-F743 VanDerWaalsContact CZ-CD2 3.49Å; Y708-F743 AromaticContact CZ-CE2 3.91Å
709	Q	83.6	Confident	82.2	Confident	124 Å²	124	55.8 Å²	55.8	58%	0.579	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	129.9	-176.2	-65.4	-176.8	-3.2	0	0	112.2	A739 E740	Q709-A739 WeakPolarHBondContact O-CA 3.43Å; Q709-E740 HydrophobicContact CB-CB 4.14Å; Q709-E740 PolarHBondContact N-OE2 2.98Å; Q709-E740 PolarHBondContact O-N 2.7Å
710	N	79.2	Confident	81.8	Confident	30 Å²	30	50.4 Å²	50.4	16%	0.16	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-76.7	154.3	171.1	-73.9	-30.4	0	0	0	110.5	W477 T478 T479 S480 Y708 R745	W477-N710 PolarHBondContact O-ND2 2.88Å; T478-N710 PolarHBondContact O-N 2.81Å; T479-N710 PolarHBondContact O-ND2 3.31Å; S480-N710 WeakPolarHBondContact CB-OD1 3.07Å; S480-N710 PolarHBondContact OG-OD1 2.97Å; Y708-N710 PolarHBondContact O-N 2.95Å; N710-R745 WeakPolarHBondContact CA-O 3.37Å; N710-R745 PolarHBondContact OD1-N 3.46Å; N710-R745 PolarHBondContact OD1-O 2.89Å
711	C	77.2	Confident	81.2	Confident	12 Å²	12	52.2 Å²	52.2	8%	0.081	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-72.1	144.1	-179.7	88.5	0	0	0	0	111.7	A737 A739 R745 C746	C711-A737 CarbonylContact C-O 3.56Å; C711-A737 VanDerWaalsContact CA-O 3.32Å; C711-A737 WeakPolarHBondContact CA-O 3.26Å; C711-A737 VanDerWaalsContact CB-O 3.24Å; C711-A737 WeakPolarHBondContact CB-O 3.41Å; C711-A739 HydrophobicContact CB-CB 3.88Å; C711-A739 VanDerWaalsContact CB-N 3.31Å; C711-R745 PolarHBondContact N-O 3.03Å; C711-C746 HydrophobicContact CB-CB 4.25Å; C711-C746 WeakPolarHBondContact CB-SG 3.34Å; C711-C746 WeakPolarHBondContact SG-CA 3.26Å; C711-C746 WeakPolarHBondContact SG-CB 3.36Å; C711-C746 CovalentContact SG-SG 2.03Å; C711-C746 PolarHBondContact SG-SG 2.97Å
712	R	77.4	Confident	80.7	Confident	141 Å²	141	53.4 Å²	53.4	53%	0.532	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123.4	176.7	-52.7	-173.6	88.6	178.9	9	107.9	I736 A737	R712-I736 WeakPolarHBondContact O-CA 3.47Å; R712-I736 WeakPolarHBondContact O-CB 3.43Å; R712-I736 PolarHBondContact O-N 3.12Å; R712-A737 HydrophobicContact CB-CB 4.27Å; R712-A737 HydrophobicContact CG-CB 4.48Å; R712-A737 PolarHBondContact N-O 2.8Å; R712-A737 PolarHBondContact O-N 2.91Å
713	Y	75.4	Confident	79.8	Confident	75 Å²	75	57.9 Å²	57.9	29%	0.294	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	164.3	-178.9	68	-100.5	0	0	0	111.6	K715 Y733 E734 E747 M748	Y713-K715 HydrophobicContact CE2-CB 4.46Å; Y713-Y733 AromaticContact CD2-CD1 3.54Å; Y713-Y733 HydrophobicContact CD2-CD1 3.54Å; Y713-Y733 HydrophobicContact CD2-CE1 4.2Å; Y713-Y733 HydrophobicContact CD2-CG 4.4Å; Y713-Y733 AromaticContact CE2-CD1 3.5Å; Y713-Y733 HydrophobicContact CE2-CD1 3.5Å; Y713-Y733 VanDerWaalsContact CE2-CD1 3.5Å; Y713-Y733 AromaticContact CE2-CE1 3.68Å; Y713-Y733 HydrophobicContact CE2-CE1 3.68Å; Y713-E734 CarbonylContact C-O 3.6Å; Y713-E734 VanDerWaalsContact CA-O 3.3Å; Y713-E734 WeakPolarHBondContact CA-O 3.33Å; Y713-E747 WeakPolarHBondContact CE1-O 3.07Å; Y713-E747 PolarHBondContact OH-O 3.25Å; Y713-M748 HydrophobicContact CD1-CE 4.29Å; Y713-M748 HydrophobicContact CD1-CG 4.19Å; Y713-M748 HydrophobicContact CE1-CG 3.97Å; Y713-M748 HydrophobicContact CG-CE 4.43Å
714	K	78	Confident	78.8	Confident	104 Å²	104	62.9 Å²	62.9	45%	0.452	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	116.8	175.2	176.3	172.7	155.6	-141.4	0	109.7	I716 E734 I736	K714-I716 HydrophobicContact CG-CD1 4.45Å; K714-I716 HydrophobicContact CG-CG1 4.06Å; K714-E734 HydrophobicContact CB-CB 4.33Å; K714-E734 WeakPolarHBondContact CD-OE2 3.44Å; K714-E734 PolarHBondContact N-O 2.89Å; K714-E734 IonicContact NZ-OE2 3.81Å; K714-E734 PolarHBondContact NZ-OE2 2.89Å; K714-E734 PolarHBondContact O-N 2.78Å; K714-I736 HydrophobicContact CB-CD1 4.18Å
715	K	80.7	Confident	78.1	Confident	93 Å²	93	65.9 Å²	65.9	40%	0.404	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	126.5	170.4	-173.1	174.2	-175	-174.3	0	108.8	Y713 A731 Y733 E749	Y713-K715 HydrophobicContact CE2-CB 4.46Å; K715-A731 HydrophobicContact CG-CB 4.27Å; K715-Y733 HydrophobicContact CB-CD1 4.06Å; K715-Y733 HydrophobicContact CB-CE1 3.75Å; K715-Y733 HydrophobicContact CD-CE1 3.94Å; K715-Y733 HydrophobicContact CG-CD1 4.22Å; K715-Y733 HydrophobicContact CG-CE1 3.55Å; K715-E749 IonicContact NZ-OE2 3.67Å; K715-E749 PolarHBondContact NZ-OE2 3Å
716	I	77.4	Confident	77.3	Confident	34 Å²	34	70 Å²	70	17%	0.174	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	114.4	179	-63.5	175	0	0	0	107.2	K714 A731 R732 E734	K714-I716 HydrophobicContact CG-CD1 4.45Å; K714-I716 HydrophobicContact CG-CG1 4.06Å; I716-A731 CarbonylContact O-C 3.59Å; I716-A731 VanDerWaalsContact O-CA 3.23Å; I716-A731 WeakPolarHBondContact O-CA 3.5Å; I716-R732 HydrophobicContact CB-CG 3.92Å; I716-R732 HydrophobicContact CG2-CG 4.28Å; I716-R732 PolarHBondContact N-O 3.47Å; I716-R732 PolarHBondContact O-N 3.38Å; I716-E734 HydrophobicContact CD1-CB 4.18Å
717	I	77.9	Confident	76.8	Confident	138 Å²	138	68.5 Å²	68.5	71%	0.708	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	133	-175.1	-56.8	172.9	0	0	0	109.3
718	G	70.4	Confident	76.4	Confident	25 Å²	25	68.8 Å²	68.8	26%	0.258	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	155.5	149.2	-178.7	0	0	0	0	0	110.7	H720 V729 T730	G718-H720 PolarHBondContact O-CD2 3.42Å; G718-H720 PolarHBondContact O-N 3.42Å; G718-V729 VanDerWaalsContact O-O 3.13Å; G718-T730 CarbonylContact C-O 3.45Å; G718-T730 PolarHBondContact N-O 3.16Å; G718-T730 CarbonylContact O-C 3.38Å; G718-T730 VanDerWaalsContact O-O 3.07Å
719	C	75.4	Confident	76.2	Confident	51 Å²	51	68.8 Å²	68.8	35%	0.345	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	118.9	177.4	-168.1	0	0	0	0	110.2	V729 C754 I755	C719-V729 WeakPolarHBondContact CA-O 3.33Å; C719-C754 WeakPolarHBondContact CA-SG 3.09Å; C719-C754 HydrophobicContact CB-CB 3.99Å; C719-C754 WeakPolarHBondContact CB-SG 3.04Å; C719-C754 WeakPolarHBondContact SG-CB 3.42Å; C719-C754 CovalentContact SG-SG 2.04Å; C719-C754 PolarHBondContact SG-SG 3.25Å; C719-I755 PolarHBondContact SG-O 3.16Å; C719-I755 VanDerWaalsContact SG-O 3.36Å
720	H	73.6	Confident	76.2	Confident	16 Å²	16	65 Å²	65	7%	0.074	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	136	-174.1	-60.4	-40.8	0	0	0	110.4	G718 N722 C728 V729	G718-H720 PolarHBondContact O-CD2 3.42Å; G718-H720 PolarHBondContact O-N 3.42Å; H720-N722 PolarHBondContact O-N 2.9Å; H720-C728 CarbonylContact O-C 3.55Å; H720-C728 VanDerWaalsContact O-CA 3.23Å; H720-C728 WeakPolarHBondContact O-CA 3.24Å; H720-V729 PolarHBondContact N-O 3.41Å; H720-V729 PolarHBondContact O-N 2.86Å
721	F	74.1	Confident	76.2	Confident	70 Å²	70	63.7 Å²	63.7	31%	0.307	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	113.6	174.4	-170.9	-81.3	0	0	0	109.7	K723 C728 T802 E803 V804	F721-K723 HydrophobicContact CE1-CB 4.38Å; F721-C728 VanDerWaalsContact CA-SG 3.54Å; F721-C728 WeakPolarHBondContact CD2-SG 3.39Å; F721-T802 PolarHBondContact N-O 2.92Å; F721-E803 HydrophobicContact CB-CG 4.39Å; F721-E803 HydrophobicContact CD1-CG 3.88Å; F721-E803 HydrophobicContact CG-CG 4.48Å; F721-V804 PolarHBondContact O-N 3.13Å
722	N	74	Confident	76.2	Confident	26 Å²	26	65.6 Å²	65.6	14%	0.139	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	117.5	170.7	178.6	-49.8	0	0	0	108.9	H720 Q724 L725 S726 K727 V729	H720-N722 PolarHBondContact O-N 2.9Å; N722-Q724 PolarHBondContact OD1-N 3.33Å; N722-L725 HydrophobicContact CB-CB 4.2Å; N722-L725 HydrophobicContact CB-CD1 4.17Å; N722-L725 HydrophobicContact CB-CG 4.34Å; N722-L725 PolarHBondContact OD1-N 2.99Å; N722-S726 PolarHBondContact O-N 3.24Å; N722-K727 PolarHBondContact N-O 2.94Å; N722-K727 PolarHBondContact O-N 3.44Å; N722-V729 HydrophobicContact CB-CG2 4.25Å
723	K	68.3	Low	76.2	Confident	94 Å²	94	61.2 Å²	61.2	41%	0.409	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-28.7	-174.2	-170.6	-179	172.3	-169.4	0	114.6	F721 V804 M805	F721-K723 HydrophobicContact CE1-CB 4.38Å; K723-V804 VanDerWaalsContact CB-O 3.25Å; K723-V804 WeakPolarHBondContact CB-O 3.36Å; K723-V804 PolarHBondContact N-O 2.92Å; K723-M805 HydrophobicContact CB-CB 4.4Å; K723-M805 HydrophobicContact CD-CB 3.9Å; K723-M805 HydrophobicContact CD-CG 3.87Å; K723-M805 HydrophobicContact CD-SD 3.92Å; K723-M805 PolarHBondContact NZ-SD 3.28Å
724	Q	68.3	Low	76.2	Confident	106 Å²	106	61.3 Å²	61.3	50%	0.495	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-47.7	175	-64.5	154.6	-61.4	0	0	110.8	N722 S726 E806	N722-Q724 PolarHBondContact OD1-N 3.33Å; Q724-S726 PolarHBondContact O-N 3.42Å; Q724-E806 HydrophobicContact CG-CB 4.38Å; Q724-E806 PolarHBondContact NE2-OE2 2.03Å; Q724-E806 PolarHBondContact OE1-OE1 3.12Å; Q724-E806 PolarHBondContact OE1-OE2 2.85Å
725	L	70.9	Confident	75.9	Confident	100 Å²	100	60.4 Å²	60.4	52%	0.524	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-14.7	178.4	-61.4	178.2	0	0	0	112.2	N722 K727 V729	N722-L725 HydrophobicContact CB-CB 4.2Å; N722-L725 HydrophobicContact CB-CD1 4.17Å; N722-L725 HydrophobicContact CB-CG 4.34Å; N722-L725 PolarHBondContact OD1-N 2.99Å; L725-K727 HydrophobicContact CB-CB 4.28Å; L725-K727 WeakPolarHBondContact O-CG 3.13Å; L725-K727 PolarHBondContact O-N 3.39Å; L725-V729 HydrophobicContact CD1-CG1 4.02Å
726	S	73.8	Confident	75.6	Confident	89 Å²	89	61.9 Å²	61.9	62%	0.622	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	31.9	-174.4	-60.5	0	0	0	0	112.7	N722 Q724	N722-S726 PolarHBondContact O-N 3.24Å; Q724-S726 PolarHBondContact O-N 3.42Å
727	K	80.6	Confident	75.3	Confident	96 Å²	96	62.4 Å²	62.4	42%	0.417	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	161.7	-169.3	-77.5	-174.7	174.1	-150	0	110.3	N722 L725 E753	N722-K727 PolarHBondContact N-O 2.94Å; N722-K727 PolarHBondContact O-N 3.44Å; L725-K727 HydrophobicContact CB-CB 4.28Å; L725-K727 WeakPolarHBondContact O-CG 3.13Å; L725-K727 PolarHBondContact O-N 3.39Å; K727-E753 HydrophobicContact CD-CG 4.44Å; K727-E753 WeakPolarHBondContact CD-OE1 3.36Å; K727-E753 WeakPolarHBondContact CD-OE2 3.2Å; K727-E753 IonicContact NZ-OE1 3.67Å; K727-E753 PolarHBondContact NZ-OE1 3.31Å; K727-E753 IonicContact NZ-OE2 3.63Å; K727-E753 PolarHBondContact NZ-OE2 2.94Å
728	C	80.3	Confident	75.1	Confident	10 Å²	10	61.3 Å²	61.3	7%	0.068	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	140.2	174.1	-68.5	0	0	0	0	112.3	H720 F721 E753 C754 C756	H720-C728 CarbonylContact O-C 3.55Å; H720-C728 VanDerWaalsContact O-CA 3.23Å; H720-C728 WeakPolarHBondContact O-CA 3.24Å; F721-C728 VanDerWaalsContact CA-SG 3.54Å; F721-C728 WeakPolarHBondContact CD2-SG 3.39Å; C728-E753 CarbonylContact O-C 3.28Å; C728-E753 WeakPolarHBondContact O-CA 3.19Å; C728-C754 VanDerWaalsContact C-SG 3.52Å; C728-C754 WeakPolarHBondContact CB-O 3.49Å; C728-C754 PolarHBondContact O-N 3.23Å; C728-C756 HydrophobicContact CB-CB 4.02Å; C728-C756 WeakPolarHBondContact CB-SG 3.46Å; C728-C756 WeakPolarHBondContact SG-CB 3.45Å; C728-C756 CovalentContact SG-SG 2.01Å; C728-C756 PolarHBondContact SG-SG 2.79Å
729	V	84.1	Confident	75.5	Confident	11 Å²	11	61.5 Å²	61.5	7%	0.067	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	144.9	-173.3	-66.7	0	0	0	0	112	G718 C719 H720 N722 L725 A731 P751 E752 C754	G718-V729 VanDerWaalsContact O-O 3.13Å; C719-V729 WeakPolarHBondContact CA-O 3.33Å; H720-V729 PolarHBondContact N-O 3.41Å; H720-V729 PolarHBondContact O-N 2.86Å; N722-V729 HydrophobicContact CB-CG2 4.25Å; L725-V729 HydrophobicContact CD1-CG1 4.02Å; V729-A731 VanDerWaalsContact C-N 3.31Å; V729-A731 PolarHBondContact O-N 2.81Å; V729-P751 HydrophobicContact CB-CB 4.07Å; V729-P751 HydrophobicContact CB-CG 3.98Å; V729-P751 HydrophobicContact CG1-CG 4.18Å; V729-P751 HydrophobicContact CG2-CG 4.43Å; V729-E752 CarbonylContact C-O 3.59Å; V729-E752 WeakPolarHBondContact CA-O 3.2Å; V729-C754 PolarHBondContact N-SG 2.67Å; V729-C754 VanDerWaalsContact N-SG 3.44Å; V729-C754 PolarHBondContact O-SG 3.08Å; V729-C754 VanDerWaalsContact O-SG 3.4Å
730	T	82.4	Confident	75.7	Confident	44 Å²	44	62.1 Å²	62.1	27%	0.27	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	-12.4	-173.2	54.5	0	0	0	0	115.2	G718 E752 C754	G718-T730 CarbonylContact C-O 3.45Å; G718-T730 PolarHBondContact N-O 3.16Å; G718-T730 CarbonylContact O-C 3.38Å; G718-T730 VanDerWaalsContact O-O 3.07Å; T730-E752 HydrophobicContact CG2-CB 4Å; T730-E752 PolarHBondContact N-O 2.7Å; T730-E752 PolarHBondContact OG1-N 2.86Å; T730-E752 PolarHBondContact OG1-O 3.45Å; T730-C754 HydrophobicContact CG2-CB 3.82Å
731	A	79.8	Confident	75.7	Confident	3 Å²	3	65.2 Å²	65.2	3%	0.025	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	157.4	175.7	0	0	0	0	0	112	K715 I716 V729 P751	K715-A731 HydrophobicContact CG-CB 4.27Å; I716-A731 CarbonylContact O-C 3.59Å; I716-A731 VanDerWaalsContact O-CA 3.23Å; I716-A731 WeakPolarHBondContact O-CA 3.5Å; V729-A731 VanDerWaalsContact C-N 3.31Å; V729-A731 PolarHBondContact O-N 2.81Å; A731-P751 HydrophobicContact CB-CB 4.28Å
732	R	78.5	Confident	75.8	Confident	51 Å²	51	65 Å²	65	19%	0.192	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	158.7	166.7	69	-177.6	-179.1	90.2	-2.2	110.8	I716	I716-R732 HydrophobicContact CB-CG 3.92Å; I716-R732 HydrophobicContact CG2-CG 4.28Å; I716-R732 PolarHBondContact N-O 3.47Å; I716-R732 PolarHBondContact O-N 3.38Å
733	Y	77.1	Confident	76	Confident	49 Å²	49	64 Å²	64	19%	0.192	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	144.4	178.8	-59.5	-72	0	0	0	111.4	Y713 K715 M748 E749	Y713-Y733 AromaticContact CD2-CD1 3.54Å; Y713-Y733 HydrophobicContact CD2-CD1 3.54Å; Y713-Y733 HydrophobicContact CD2-CE1 4.2Å; Y713-Y733 HydrophobicContact CD2-CG 4.4Å; Y713-Y733 AromaticContact CE2-CD1 3.5Å; Y713-Y733 HydrophobicContact CE2-CD1 3.5Å; Y713-Y733 VanDerWaalsContact CE2-CD1 3.5Å; Y713-Y733 AromaticContact CE2-CE1 3.68Å; Y713-Y733 HydrophobicContact CE2-CE1 3.68Å; K715-Y733 HydrophobicContact CB-CD1 4.06Å; K715-Y733 HydrophobicContact CB-CE1 3.75Å; K715-Y733 HydrophobicContact CD-CE1 3.94Å; K715-Y733 HydrophobicContact CG-CD1 4.22Å; K715-Y733 HydrophobicContact CG-CE1 3.55Å; Y733-M748 HydrophobicContact CD2-CB 4.11Å; Y733-M748 HydrophobicContact CD2-CG 4.34Å; Y733-M748 HydrophobicContact CD2-SD 3.8Å; Y733-M748 HydrophobicContact CE2-CB 4.03Å; Y733-M748 HydrophobicContact CG-CB 4.47Å; Y733-M748 HydrophobicContact CG-CG 4.28Å; Y733-M748 HydrophobicContact CG-SD 3.76Å; Y733-E749 VanDerWaalsContact CE2-O 3.27Å; Y733-E749 WeakPolarHBondContact CE2-O 3.27Å; Y733-E749 VanDerWaalsContact CZ-O 3.32Å; Y733-E749 PolarHBondContact OH-O 2.99Å
734	E	73.7	Confident	76.5	Confident	77 Å²	77	60.4 Å²	60.4	36%	0.36	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	105.1	178	174.3	169.8	-107.4	0	0	107.2	Y713 K714 I716 I736	Y713-E734 CarbonylContact C-O 3.6Å; Y713-E734 VanDerWaalsContact CA-O 3.3Å; Y713-E734 WeakPolarHBondContact CA-O 3.33Å; K714-E734 HydrophobicContact CB-CB 4.33Å; K714-E734 WeakPolarHBondContact CD-OE2 3.44Å; K714-E734 PolarHBondContact N-O 2.89Å; K714-E734 IonicContact NZ-OE2 3.81Å; K714-E734 PolarHBondContact NZ-OE2 2.89Å; K714-E734 PolarHBondContact O-N 2.78Å; I716-E734 HydrophobicContact CD1-CB 4.18Å; E734-I736 PolarHBondContact O-N 3.49Å
735	I	73	Confident	76.8	Confident	86 Å²	86	58.6 Å²	58.6	44%	0.441	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	125.8	-177.7	-56.3	176	0	0	0	108.9	A737 E738 M748	I735-A737 WeakPolarHBondContact CG2-O 3.09Å; I735-E738 HydrophobicContact CG2-CG 4.37Å; I735-M748 HydrophobicContact CD1-CE 3.9Å; I735-M748 HydrophobicContact CG1-CE 3.76Å
736	I	75.1	Confident	76.9	Confident	124 Å²	124	56.6 Å²	56.6	64%	0.636	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	-40.7	178.9	-55.2	171.8	0	0	0	110.2	R712 K714 E734	R712-I736 WeakPolarHBondContact O-CA 3.47Å; R712-I736 WeakPolarHBondContact O-CB 3.43Å; R712-I736 PolarHBondContact O-N 3.12Å; K714-I736 HydrophobicContact CB-CD1 4.18Å; E734-I736 PolarHBondContact O-N 3.49Å
737	A	70.3	Confident	76.7	Confident	44 Å²	44	60 Å²	60	36%	0.364	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	137.8	174.5	0	0	0	0	0	109	C711 R712 I735	C711-A737 CarbonylContact C-O 3.56Å; C711-A737 VanDerWaalsContact CA-O 3.32Å; C711-A737 WeakPolarHBondContact CA-O 3.26Å; C711-A737 VanDerWaalsContact CB-O 3.24Å; C711-A737 WeakPolarHBondContact CB-O 3.41Å; R712-A737 HydrophobicContact CB-CB 4.27Å; R712-A737 HydrophobicContact CG-CB 4.48Å; R712-A737 PolarHBondContact N-O 2.8Å; R712-A737 PolarHBondContact O-N 2.91Å; I735-A737 WeakPolarHBondContact CG2-O 3.09Å
738	E	73.7	Confident	76.3	Confident	116 Å²	116	58.6 Å²	58.6	54%	0.542	31%	0.313	S	S	.	.			trans	-76	164	179.1	-56.8	-163.3	97.5	0	0	112	I735 R771	I735-E738 HydrophobicContact CG2-CG 4.37Å; E738-R771 IonicContact OE1-CZ 2.82Å; E738-R771 IonicContact OE1-NH1 2.65Å; E738-R771 PolarHBondContact OE1-NH1 2.83Å; E738-R771 IonicContact OE1-NH2 2.8Å; E738-R771 PolarHBondContact OE1-NH2 3.06Å; E738-R771 VanDerWaalsContact OE1-NH2 3.13Å; E738-R771 IonicContact OE2-CZ 2.62Å; E738-R771 IonicContact OE2-NH1 3.57Å; E738-R771 IonicContact OE2-NH2 3.39Å; E738-R771 PolarHBondContact OE2-NH2 3.06Å
739	A	77.9	Confident	76	Confident	29 Å²	29	63.9 Å²	63.9	24%	0.24	34%	0.337	C	S	.	.			trans	-78.1	152.1	174.2	0	0	0	0	0	111.5	Q709 C711 P741 G744	Q709-A739 WeakPolarHBondContact O-CA 3.43Å; C711-A739 HydrophobicContact CB-CB 3.88Å; C711-A739 VanDerWaalsContact CB-N 3.31Å; A739-P741 WeakPolarHBondContact O-CD 3.41Å; A739-G744 WeakPolarHBondContact CB-O 2.99Å
740	E	81	Confident	75.6	Confident	63 Å²	63	72.8 Å²	72.8	29%	0.294	37%	0.374	S	S	.	.			trans	-83	114.7	-177.4	-169.1	177.2	-172.1	0	0	111.7	K532 Y708 Q709 G744	K532-E740 WeakPolarHBondContact CE-OE1 3.3Å; K532-E740 WeakPolarHBondContact CE-OE2 3.31Å; K532-E740 IonicContact NZ-OE1 3.16Å; K532-E740 PolarHBondContact NZ-OE1 3.02Å; K532-E740 VanDerWaalsContact NZ-OE1 3.17Å; K532-E740 IonicContact NZ-OE2 2.7Å; K532-E740 PolarHBondContact NZ-OE2 3.16Å; Y708-E740 HydrophobicContact CD1-CB 4.47Å; Y708-E740 HydrophobicContact CD1-CG 4.17Å; Q709-E740 HydrophobicContact CB-CB 4.14Å; Q709-E740 PolarHBondContact N-OE2 2.98Å; Q709-E740 PolarHBondContact O-N 2.7Å; E740-G744 WeakPolarHBondContact O-CA 3.41Å; E740-G744 PolarHBondContact O-N 3.25Å
741	P	73.9	Confident	75.2	Confident	82 Å²	82	72.5 Å²	72.5	53%	0.532	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	149.5	-176.6	28.6	-34.9	0	0	0	112.1	A739	A739-P741 WeakPolarHBondContact O-CD 3.41Å
742	P	74.8	Confident	75.4	Confident	64 Å²	64	79.2 Å²	79.2	42%	0.416	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	cis	-98.7	1.6	4.9	37.7	-34.2	0	0	0	115.3	W488	W488-P742 HydrophobicContact CZ2-CB 4.49Å
743	F	79.5	Confident	75.5	Confident	7 Å²	7	83 Å²	83	3%	0.031	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-10.8	-170	-53.2	-77	0	0	0	115.8	S480 P482 W488 F490 L531 Y708	S480-F743 PolarHBondContact OG-O 2.89Å; P482-F743 HydrophobicContact CB-CD1 3.73Å; P482-F743 HydrophobicContact CB-CD2 4.4Å; P482-F743 HydrophobicContact CB-CE1 3.64Å; P482-F743 HydrophobicContact CB-CE2 4.32Å; P482-F743 HydrophobicContact CB-CG 4.11Å; P482-F743 HydrophobicContact CB-CZ 3.95Å; P482-F743 HydrophobicContact CG-CD1 4.08Å; P482-F743 HydrophobicContact CG-CD2 3.87Å; P482-F743 HydrophobicContact CG-CE1 4.13Å; P482-F743 HydrophobicContact CG-CE2 3.91Å; P482-F743 HydrophobicContact CG-CG 3.95Å; P482-F743 HydrophobicContact CG-CZ 4.04Å; W488-F743 HydrophobicContact CB-CE1 4.46Å; W488-F743 AromaticContact CD1-CD1 3.53Å; W488-F743 AromaticContact CD1-CE1 3.49Å; W488-F743 VanDerWaalsContact CD1-CE1 3.49Å; W488-F743 AromaticContact CD2-CE1 3.74Å; W488-F743 HydrophobicContact CD2-CE1 3.74Å; W488-F743 AromaticContact CE2-CE1 3.57Å; W488-F743 HydrophobicContact CG-CD1 4.15Å; W488-F743 AromaticContact CG-CE1 3.69Å; W488-F743 HydrophobicContact CG-CE1 3.69Å; W488-F743 HydrophobicContact CZ2-CE1 4.23Å; W488-F743 AromaticContact NE1-CD1 3.5Å; W488-F743 AromaticContact NE1-CE1 3.4Å; F490-F743 HydrophobicContact CD2-CE1 4.4Å; F490-F743 AromaticContact CE2-CE1 3.95Å; F490-F743 HydrophobicContact CE2-CE1 3.95Å; F490-F743 HydrophobicContact CE2-CZ 4.16Å; L531-F743 HydrophobicContact CD2-CE2 3.65Å; L531-F743 HydrophobicContact CD2-CZ 3.87Å; Y708-F743 HydrophobicContact CD1-CB 4.43Å; Y708-F743 HydrophobicContact CD1-CD2 4.17Å; Y708-F743 HydrophobicContact CD2-CB 4.06Å; Y708-F743 AromaticContact CD2-CD2 3.83Å; Y708-F743 HydrophobicContact CD2-CD2 3.83Å; Y708-F743 HydrophobicContact CD2-CG 4.39Å; Y708-F743 AromaticContact CE1-CD2 3.85Å; Y708-F743 HydrophobicContact CE1-CD2 3.85Å; Y708-F743 AromaticContact CE2-CD2 3.49Å; Y708-F743 HydrophobicContact CE2-CD2 3.49Å; Y708-F743 VanDerWaalsContact CE2-CD2 3.49Å; Y708-F743 HydrophobicContact CE2-CE2 4.07Å; Y708-F743 HydrophobicContact CE2-CG 4.43Å; Y708-F743 HydrophobicContact CG-CB 4Å; Y708-F743 HydrophobicContact CG-CD2 4.17Å; Y708-F743 AromaticContact CZ-CD2 3.49Å; Y708-F743 VanDerWaalsContact CZ-CD2 3.49Å; Y708-F743 AromaticContact CZ-CE2 3.91Å
744	G	77.5	Confident	75.7	Confident	17 Å²	17	82.2 Å²	82.2	18%	0.175	43%	0.426	C	S	.	.			trans	-63.4	140.6	174.4	0	0	0	0	0	111	S480 A739 E740	S480-G744 WeakPolarHBondContact OG-CA 3.49Å; A739-G744 WeakPolarHBondContact CB-O 2.99Å; E740-G744 WeakPolarHBondContact O-CA 3.41Å; E740-G744 PolarHBondContact O-N 3.25Å
745	R	75.2	Confident	75.9	Confident	68 Å²	68	85.9 Å²	85.9	26%	0.257	45%	0.446	S	S	.	.			trans	-114.8	154.9	-173.2	-65.3	-179.7	-72.8	149.1	8.7	113.2	E484 N710 C711	E484-R745 VanDerWaalsContact CB-NH2 3.26Å; E484-R745 PolarHBondContact O-NH1 3.09Å; E484-R745 IonicContact OE2-CZ 3.72Å; E484-R745 IonicContact OE2-NH2 2.79Å; E484-R745 PolarHBondContact OE2-NH2 3.4Å; N710-R745 WeakPolarHBondContact CA-O 3.37Å; N710-R745 PolarHBondContact OD1-N 3.46Å; N710-R745 PolarHBondContact OD1-O 2.89Å; C711-R745 PolarHBondContact N-O 3.03Å
746	C	73.4	Confident	75.5	Confident	58 Å²	58	83.6 Å²	83.6	39%	0.392	44%	0.438	S	S	.	.			trans	-116	84.7	167.4	-86	0	0	0	0	108.8	C711 M748	C711-C746 HydrophobicContact CB-CB 4.25Å; C711-C746 WeakPolarHBondContact CB-SG 3.34Å; C711-C746 WeakPolarHBondContact SG-CA 3.26Å; C711-C746 WeakPolarHBondContact SG-CB 3.36Å; C711-C746 CovalentContact SG-SG 2.03Å; C711-C746 PolarHBondContact SG-SG 2.97Å; C746-M748 HydrophobicContact CB-CE 4.11Å; C746-M748 PolarHBondContact O-N 3.33Å
747	E	68.4	Low	75.2	Confident	161 Å²	161	84.2 Å²	84.2	75%	0.752	44%	0.438	S	S	*	.			trans	-79	91.6	178.3	-170.5	157	-133.4	0	0	110.2	Y713	Y713-E747 WeakPolarHBondContact CE1-O 3.07Å; Y713-E747 PolarHBondContact OH-O 3.25Å
748	M	72.3	Confident	74.9	Confident	66 Å²	66	84 Å²	84	33%	0.325	43%	0.433	S	S	.	.			trans	-104.4	126	178.2	-60.8	-174.7	-170.5	0	0	110.7	Y713 Y733 I735 C746 K750	Y713-M748 HydrophobicContact CD1-CE 4.29Å; Y713-M748 HydrophobicContact CD1-CG 4.19Å; Y713-M748 HydrophobicContact CE1-CG 3.97Å; Y713-M748 HydrophobicContact CG-CE 4.43Å; Y733-M748 HydrophobicContact CD2-CB 4.11Å; Y733-M748 HydrophobicContact CD2-CG 4.34Å; Y733-M748 HydrophobicContact CD2-SD 3.8Å; Y733-M748 HydrophobicContact CE2-CB 4.03Å; Y733-M748 HydrophobicContact CG-CB 4.47Å; Y733-M748 HydrophobicContact CG-CG 4.28Å; Y733-M748 HydrophobicContact CG-SD 3.76Å; I735-M748 HydrophobicContact CD1-CE 3.9Å; I735-M748 HydrophobicContact CG1-CE 3.76Å; C746-M748 HydrophobicContact CB-CE 4.11Å; C746-M748 PolarHBondContact O-N 3.33Å; M748-K750 PolarHBondContact O-N 3.25Å
749	E	74.8	Confident	74.5	Confident	121 Å²	121	81.9 Å²	81.9	57%	0.565	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-63	133.9	174.6	-60.2	171.2	173.8	0	0	110.9	K715 Y733 P751	K715-E749 IonicContact NZ-OE2 3.67Å; K715-E749 PolarHBondContact NZ-OE2 3Å; Y733-E749 VanDerWaalsContact CE2-O 3.27Å; Y733-E749 WeakPolarHBondContact CE2-O 3.27Å; Y733-E749 VanDerWaalsContact CZ-O 3.32Å; Y733-E749 PolarHBondContact OH-O 2.99Å; E749-P751 WeakPolarHBondContact O-CD 3.38Å
750	K	74.9	Confident	73.7	Confident	198 Å²	198	86.9 Å²	86.9	86%	0.861	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-64.9	118.2	175.3	-173.8	178.3	-179	-179.2	0	109.7	M748	M748-K750 PolarHBondContact O-N 3.25Å
751	P	75.4	Confident	72.7	Confident	39 Å²	39	89.6 Å²	89.6	25%	0.253	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-73.7	147.8	-176	32.1	-36.2	0	0	0	111.4	V729 A731 E749	V729-P751 HydrophobicContact CB-CB 4.07Å; V729-P751 HydrophobicContact CB-CG 3.98Å; V729-P751 HydrophobicContact CG1-CG 4.18Å; V729-P751 HydrophobicContact CG2-CG 4.43Å; A731-P751 HydrophobicContact CB-CB 4.28Å; E749-P751 WeakPolarHBondContact O-CD 3.38Å
752	E	83.8	Confident	72.5	Confident	143 Å²	143	92.9 Å²	92.9	67%	0.668	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-78.4	160.2	-178.2	-55.6	176.7	135.8	0	0	111.6	V729 T730	V729-E752 CarbonylContact C-O 3.59Å; V729-E752 WeakPolarHBondContact CA-O 3.2Å; T730-E752 HydrophobicContact CG2-CB 4Å; T730-E752 PolarHBondContact N-O 2.7Å; T730-E752 PolarHBondContact OG1-N 2.86Å; T730-E752 PolarHBondContact OG1-O 3.45Å
753	E	81	Confident	72.5	Confident	130 Å²	130	92 Å²	92	61%	0.607	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	141.7	177.8	-61.2	-173.2	-167.8	0	0	112	K727 C728	K727-E753 HydrophobicContact CD-CG 4.44Å; K727-E753 WeakPolarHBondContact CD-OE1 3.36Å; K727-E753 WeakPolarHBondContact CD-OE2 3.2Å; K727-E753 IonicContact NZ-OE1 3.67Å; K727-E753 PolarHBondContact NZ-OE1 3.31Å; K727-E753 IonicContact NZ-OE2 3.63Å; K727-E753 PolarHBondContact NZ-OE2 2.94Å; C728-E753 CarbonylContact O-C 3.28Å; C728-E753 WeakPolarHBondContact O-CA 3.19Å
754	C	80.4	Confident	72.4	Confident	34 Å²	34	95.4 Å²	95.4	23%	0.23	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	174.7	179.9	64.3	0	0	0	0	112.4	C719 C728 V729 T730	C719-C754 WeakPolarHBondContact CA-SG 3.09Å; C719-C754 HydrophobicContact CB-CB 3.99Å; C719-C754 WeakPolarHBondContact CB-SG 3.04Å; C719-C754 WeakPolarHBondContact SG-CB 3.42Å; C719-C754 CovalentContact SG-SG 2.04Å; C719-C754 PolarHBondContact SG-SG 3.25Å; C728-C754 VanDerWaalsContact C-SG 3.52Å; C728-C754 WeakPolarHBondContact CB-O 3.49Å; C728-C754 PolarHBondContact O-N 3.23Å; V729-C754 PolarHBondContact N-SG 2.67Å; V729-C754 VanDerWaalsContact N-SG 3.44Å; V729-C754 PolarHBondContact O-SG 3.08Å; V729-C754 VanDerWaalsContact O-SG 3.4Å; T730-C754 HydrophobicContact CG2-CB 3.82Å
755	I	76.8	Confident	72.6	Confident	153 Å²	153	100 Å²	100	79%	0.785	50%	0.504	S	S	*	.			trans	-102.5	126.3	-178.7	-58.7	176.6	0	0	0	110.4	C719	C719-I755 PolarHBondContact SG-O 3.16Å; C719-I755 VanDerWaalsContact SG-O 3.36Å
756	C	66.3	Low	72.9	Confident	39 Å²	39	99.6 Å²	99.6	26%	0.264	50%	0.503	S	S	.	.			trans	-100.9	104.6	176.7	-83.8	0	0	0	0	112.1	C728 C758	C728-C756 HydrophobicContact CB-CB 4.02Å; C728-C756 WeakPolarHBondContact CB-SG 3.46Å; C728-C756 WeakPolarHBondContact SG-CB 3.45Å; C728-C756 CovalentContact SG-SG 2.01Å; C728-C756 PolarHBondContact SG-SG 2.79Å; C756-C758 HydrophobicContact CB-CB 4.43Å; C756-C758 VanDerWaalsContact CB-SG 3.55Å; C756-C758 PolarHBondContact O-N 3.34Å
757	E	68.1	Low	73.3	Confident	137 Å²	137	99 Å²	99	64%	0.64	50%	0.499	S	S	*	.			trans	-78.6	53	173.2	-59.3	178.6	146.2	0	0	111.8	K784 D785	E757-K784 CarbonylContact O-C 3.46Å; E757-K784 WeakPolarHBondContact O-CA 3.08Å; E757-K784 WeakPolarHBondContact O-CB 3.34Å; E757-D785 PolarHBondContact O-N 2.94Å
758	C	64.6	Low	73.6	Confident	38 Å²	38	99 Å²	99	26%	0.257	50%	0.499	S	S	.	.	B	Isolated β-bridge	trans	-107.3	130.6	-166.2	-55.7	0	0	0	0	112.6	C756 W763 C801	C756-C758 HydrophobicContact CB-CB 4.43Å; C756-C758 VanDerWaalsContact CB-SG 3.55Å; C756-C758 PolarHBondContact O-N 3.34Å; C758-W763 HydrophobicContact CB-CZ2 4.25Å; C758-C801 WeakPolarHBondContact CA-SG 3.03Å; C758-C801 HydrophobicContact CB-CB 3.73Å; C758-C801 WeakPolarHBondContact CB-SG 3.42Å; C758-C801 WeakPolarHBondContact SG-CB 3.49Å; C758-C801 CovalentContact SG-SG 2.02Å; C758-C801 PolarHBondContact SG-SG 2.64Å
759	K	64.3	Low	73.8	Confident	72 Å²	72	97.9 Å²	97.9	31%	0.313	50%	0.497	S	S	.	.			trans	-72.9	145.4	169.8	-69.1	-153.8	-177.5	-77.1	0	110.5	E761 W763 P783 D785	K759-E761 VanDerWaalsContact C-N 3.3Å; K759-W763 PolarHBondContact O-NE1 3.48Å; K759-P783 PolarHBondContact N-O 2.99Å; K759-D785 WeakPolarHBondContact CE-OD1 3.45Å; K759-D785 HydrophobicContact CG-CB 4.34Å; K759-D785 IonicContact NZ-OD1 2.87Å; K759-D785 PolarHBondContact NZ-OD1 3.15Å; K759-D785 IonicContact NZ-OD2 2.72Å; K759-D785 PolarHBondContact NZ-OD2 2.88Å
760	T	61.2	Low	73.7	Confident	134 Å²	134	95.9 Å²	95.9	82%	0.822	50%	0.496	S	S	*	.	S	Bend	trans	-79.7	-12.1	169.9	44.1	0	0	0	0	113.2
761	E	61	Low	73.3	Confident	121 Å²	121	90.7 Å²	90.7	57%	0.565	47%	0.471	S	S	*	.	S	Bend	trans	-97.2	152.5	176.6	-57.1	177.4	159.9	0	0	111.2	K759	K759-E761 VanDerWaalsContact C-N 3.3Å
762	H	68.7	Low	72.9	Confident	150 Å²	150	92.5 Å²	92.5	69%	0.694	48%	0.481	S	S	*	.	S	Bend	trans	67	27.2	176.8	-46.8	82.9	0	0	0	115.9	P783	H762-P783 HydrophobicContact CB-CG 4.12Å; H762-P783 WeakPolarHBondContact O-CD 3.43Å
763	W	75.2	Confident	72.3	Confident	47 Å²	47	86.4 Å²	86.4	18%	0.178	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-66.7	144.3	165	-74.4	90.7	0	0	0	112.2	C758 K759 R780 G782 C801 E803	C758-W763 HydrophobicContact CB-CZ2 4.25Å; K759-W763 PolarHBondContact O-NE1 3.48Å; W763-R780 HydrophobicContact CD2-CG 4.45Å; W763-R780 HydrophobicContact CE3-CB 4.38Å; W763-R780 HydrophobicContact CE3-CG 3.64Å; W763-R780 HydrophobicContact CZ3-CG 4.14Å; W763-R780 WeakPolarHBondContact CZ3-O 3.36Å; W763-G782 VanDerWaalsContact CE3-N 3.33Å; W763-G782 VanDerWaalsContact CZ3-N 3.32Å; W763-C801 HydrophobicContact CH2-CB 3.58Å; W763-C801 HydrophobicContact CZ2-CB 4.13Å; W763-C801 HydrophobicContact CZ3-CB 4.37Å; W763-E803 HydrophobicContact CE3-CB 4.2Å; W763-E803 HydrophobicContact CH2-CB 3.62Å; W763-E803 HydrophobicContact CZ2-CB 4.34Å; W763-E803 HydrophobicContact CZ3-CB 3.54Å
764	Q	77.9	Confident	71.9	Confident	77 Å²	77	83.4 Å²	83.4	36%	0.36	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-72.7	163.1	169.7	-68.4	178.8	-18.4	0	0	112.1	R780 Y781 C792	Q764-R780 WeakPolarHBondContact O-CD 3.47Å; Q764-Y781 WeakPolarHBondContact CB-O 3.16Å; Q764-Y781 WeakPolarHBondContact CG-O 3.29Å; Q764-Y781 PolarHBondContact N-O 3.37Å; Q764-C792 PolarHBondContact NE2-O 2.86Å
765	S	81.1	Confident	71.5	Confident	113 Å²	113	85.2 Å²	85.2	79%	0.79	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-54.9	146	166	-53.1	0	0	0	0	111.3
766	W	81.9	Confident	71.2	Confident	61 Å²	61	78 Å²	78	23%	0.231	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-60.7	143.9	172	-69	102.2	0	0	0	111.8	R778 R780 E803 M805	W766-R778 HydrophobicContact CE3-CB 3.9Å; W766-R778 HydrophobicContact CZ3-CB 4.46Å; W766-R780 HydrophobicContact CD2-CB 4.19Å; W766-R780 HydrophobicContact CD2-CG 3.99Å; W766-R780 HydrophobicContact CE3-CB 3.96Å; W766-R780 HydrophobicContact CE3-CG 3.79Å; W766-R780 HydrophobicContact CH2-CG 3.89Å; W766-R780 HydrophobicContact CZ2-CG 4.08Å; W766-R780 HydrophobicContact CZ3-CB 4.34Å; W766-R780 HydrophobicContact CZ3-CG 3.74Å; W766-E803 HydrophobicContact CH2-CB 4.34Å; W766-E803 HydrophobicContact CH2-CG 3.85Å; W766-E803 VanDerWaalsContact CH2-OE1 3.25Å; W766-E803 WeakPolarHBondContact CH2-OE1 3.2Å; W766-E803 VanDerWaalsContact CZ2-OE1 3.25Å; W766-E803 WeakPolarHBondContact CZ2-OE1 3.4Å; W766-M805 HydrophobicContact CD2-CE 4.22Å; W766-M805 HydrophobicContact CE3-CB 4.34Å; W766-M805 HydrophobicContact CE3-CE 4.47Å; W766-M805 HydrophobicContact CH2-CB 3.45Å; W766-M805 VanDerWaalsContact CH2-CB 3.45Å; W766-M805 HydrophobicContact CH2-SD 4.48Å; W766-M805 HydrophobicContact CZ2-CB 4.16Å; W766-M805 HydrophobicContact CZ2-CE 4.45Å; W766-M805 HydrophobicContact CZ2-SD 4.25Å; W766-M805 HydrophobicContact CZ3-CB 3.56Å
767	S	80.6	Confident	71.6	Confident	45 Å²	45	78.4 Å²	78.4	32%	0.315	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-55.5	167.6	166.7	71.7	0	0	0	0	111.9	R778 I779	S767-R778 PolarHBondContact O-NE 2.7Å; S767-R778 PolarHBondContact O-NH2 2.97Å; S767-R778 VanDerWaalsContact O-NH2 3.1Å; S767-R778 WeakPolarHBondContact OG-CA 3.38Å; S767-I779 WeakPolarHBondContact CB-O 3.28Å; S767-I779 PolarHBondContact N-O 3.45Å; S767-I779 PolarHBondContact OG-N 2.86Å; S767-I779 PolarHBondContact OG-O 3.43Å
768	Q	75.8	Confident	72.2	Confident	160 Å²	160	74.3 Å²	74.3	75%	0.748	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-60.1	151.8	157.6	-61.6	-60.6	-11.1	0	0	110
769	P	75.7	Confident	72.9	Confident	44 Å²	44	73.9 Å²	73.9	29%	0.286	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-55.2	142.8	169	-24.2	34.8	0	0	0	112.4	R771 A776 R778 L809	P769-R771 VanDerWaalsContact CB-O 3.23Å; P769-R771 WeakPolarHBondContact CB-O 3.43Å; P769-R771 PolarHBondContact O-N 3.08Å; P769-A776 HydrophobicContact CB-CB 3.79Å; P769-R778 HydrophobicContact CB-CG 4.35Å; P769-R778 HydrophobicContact CG-CG 4.37Å; P769-L809 HydrophobicContact CB-CD1 4.18Å
770	S	72.3	Confident	73.8	Confident	79 Å²	79	73.3 Å²	73.3	55%	0.552	39%	0.386	S	S	*	.	S	Bend	trans	-72	-15.9	176	68.8	0	0	0	0	114.2	V777	S770-V777 WeakPolarHBondContact CB-O 3.4Å; S770-V777 PolarHBondContact N-O 3.14Å; S770-V777 PolarHBondContact OG-N 2.77Å; S770-V777 PolarHBondContact OG-O 2.83Å
771	R	67.3	Low	74.6	Confident	88 Å²	88	68.8 Å²	68.8	33%	0.332	36%	0.355	S	S	.	.	S	Bend	trans	-137.9	162.4	176.3	-53.5	-174.9	78.3	138.5	10.8	109.2	E738 P769 T775 A776 L809	E738-R771 IonicContact OE1-CZ 2.82Å; E738-R771 IonicContact OE1-NH1 2.65Å; E738-R771 PolarHBondContact OE1-NH1 2.83Å; E738-R771 IonicContact OE1-NH2 2.8Å; E738-R771 PolarHBondContact OE1-NH2 3.06Å; E738-R771 VanDerWaalsContact OE1-NH2 3.13Å; E738-R771 IonicContact OE2-CZ 2.62Å; E738-R771 IonicContact OE2-NH1 3.57Å; E738-R771 IonicContact OE2-NH2 3.39Å; E738-R771 PolarHBondContact OE2-NH2 3.06Å; P769-R771 VanDerWaalsContact CB-O 3.23Å; P769-R771 WeakPolarHBondContact CB-O 3.43Å; P769-R771 PolarHBondContact O-N 3.08Å; R771-T775 WeakPolarHBondContact CD-O 3.39Å; R771-A776 HydrophobicContact CB-CB 4.05Å; R771-L809 WeakPolarHBondContact O-CD1 3.35Å
772	T	67.9	Low	75.4	Confident	77 Å²	77	63.1 Å²	63.1	47%	0.472	33%	0.328	S	S	.	.	S	Bend	trans	-93.1	-9.2	173.8	49.4	0	0	0	0	114.1	L809	T772-L809 VanDerWaalsContact C-CD1 3.45Å
773	C	69.8	Low	75.6	Confident	15 Å²	15	56.8 Å²	56.8	10%	0.101	30%	0.301	C	S	.	.	S	Bend	trans	-153.4	168.5	-177.2	60.2	0	0	0	0	111.2	T810 C812 Y815	C773-T810 VanDerWaalsContact CA-O 3.26Å; C773-T810 WeakPolarHBondContact CA-O 3.3Å; C773-T810 VanDerWaalsContact CB-O 3.29Å; C773-T810 WeakPolarHBondContact CB-O 3.25Å; C773-C812 HydrophobicContact CB-CB 3.89Å; C773-C812 WeakPolarHBondContact CB-SG 3.5Å; C773-C812 WeakPolarHBondContact SG-CA 3.49Å; C773-C812 WeakPolarHBondContact SG-CB 3.42Å; C773-C812 CovalentContact SG-SG 2.04Å; C773-C812 PolarHBondContact SG-SG 3.19Å; C773-Y815 HydrophobicContact CB-CD2 3.51Å; C773-Y815 HydrophobicContact CB-CE2 3.44Å; C773-Y815 VanDerWaalsContact CB-CE2 3.44Å; C773-Y815 HydrophobicContact CB-CG 4.45Å
774	D	72.9	Confident	75.4	Confident	68 Å²	68	57.6 Å²	57.6	36%	0.364	31%	0.305	S	S	.	.	S	Bend	trans	52.2	-151.7	-169.9	-68.9	-24.1	0	0	0	112.1	A776 L809 T810 P811 C812	D774-A776 PolarHBondContact O-N 3.44Å; D774-L809 WeakPolarHBondContact O-CB 3.46Å; D774-L809 PolarHBondContact O-N 3.13Å; D774-T810 PolarHBondContact N-O 2.03Å; D774-P811 WeakPolarHBondContact OD1-CA 3.44Å; D774-C812 PolarHBondContact OD1-N 2.79Å; D774-C812 VanDerWaalsContact OD2-CB 3.29Å; D774-C812 WeakPolarHBondContact OD2-CB 3.48Å; D774-C812 PolarHBondContact OD2-SG 3.15Å
775	T	71.8	Confident	74.7	Confident	72 Å²	72	58.6 Å²	58.6	44%	0.442	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	109	178	-51	0	0	0	0	110.7	R771 E806	R771-T775 WeakPolarHBondContact CD-O 3.39Å; T775-E806 HydrophobicContact CG2-CB 3.84Å; T775-E806 HydrophobicContact CG2-CG 4.11Å; T775-E806 WeakPolarHBondContact CG2-OE2 3.13Å
776	A	71.8	Confident	73.7	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	145.6	173.1	0	0	0	0	0	111.2	P769 R771 D774 E806 E807 L809	P769-A776 HydrophobicContact CB-CB 3.79Å; R771-A776 HydrophobicContact CB-CB 4.05Å; D774-A776 PolarHBondContact O-N 3.44Å; A776-E806 CarbonylContact O-C 3.55Å; A776-E806 WeakPolarHBondContact O-CA 3.46Å; A776-E807 PolarHBondContact N-O 2.86Å; A776-E807 PolarHBondContact O-N 2.95Å; A776-L809 HydrophobicContact CB-CD1 3.55Å; A776-L809 HydrophobicContact CB-CG 3.93Å
777	V	73.5	Confident	72.6	Confident	48 Å²	48	54.2 Å²	54.2	29%	0.291	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	135.7	177	-174.5	0	0	0	0	109.5	S770 I779 V804 E806	S770-V777 WeakPolarHBondContact CB-O 3.4Å; S770-V777 PolarHBondContact N-O 3.14Å; S770-V777 PolarHBondContact OG-N 2.77Å; S770-V777 PolarHBondContact OG-O 2.83Å; V777-I779 HydrophobicContact CG1-CG1 4.43Å; V777-V804 HydrophobicContact CG1-CG1 3.53Å; V777-E806 HydrophobicContact CG2-CG 4.38Å
778	R	80.8	Confident	71.4	Confident	52 Å²	52	61 Å²	61	20%	0.196	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.3	172.2	-67.1	178.5	81.5	175.2	5.9	110.7	W766 S767 P769 V804 M805 E807	W766-R778 HydrophobicContact CE3-CB 3.9Å; W766-R778 HydrophobicContact CZ3-CB 4.46Å; S767-R778 PolarHBondContact O-NE 2.7Å; S767-R778 PolarHBondContact O-NH2 2.97Å; S767-R778 VanDerWaalsContact O-NH2 3.1Å; S767-R778 WeakPolarHBondContact OG-CA 3.38Å; P769-R778 HydrophobicContact CB-CG 4.35Å; P769-R778 HydrophobicContact CG-CG 4.37Å; R778-V804 WeakPolarHBondContact O-CA 3.36Å; R778-M805 HydrophobicContact CB-CE 4.35Å; R778-M805 PolarHBondContact N-O 3.46Å; R778-M805 PolarHBondContact O-N 3.28Å; R778-E807 WeakPolarHBondContact CD-OE2 3.41Å; R778-E807 IonicContact CZ-OE2 2.67Å; R778-E807 IonicContact NE-OE2 3.17Å; R778-E807 IonicContact NH1-OE1 3.37Å; R778-E807 IonicContact NH1-OE2 3.97Å; R778-E807 PolarHBondContact NH1-OE2 2.83Å
779	I	78.6	Confident	70.5	Confident	29 Å²	29	61.4 Å²	61.4	15%	0.149	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	138.5	-172.7	-54.5	180	0	0	0	108.6	S767 V777 Y781 T802 E803	S767-I779 WeakPolarHBondContact CB-O 3.28Å; S767-I779 PolarHBondContact N-O 3.45Å; S767-I779 PolarHBondContact OG-N 2.86Å; S767-I779 PolarHBondContact OG-O 3.43Å; V777-I779 HydrophobicContact CG1-CG1 4.43Å; I779-Y781 HydrophobicContact CG2-CE1 4.03Å; I779-Y781 HydrophobicContact CG2-CE2 4.22Å; I779-T802 HydrophobicContact CG2-CG2 3.48Å; I779-T802 VanDerWaalsContact CG2-CG2 3.48Å; I779-E803 WeakPolarHBondContact CA-O 3.35Å
780	R	83.4	Confident	69.6	Low	59 Å²	59	64.5 Å²	64.5	22%	0.223	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	159.7	162.9	62.9	174.8	-175.2	-165.9	-6.7	110.9	W763 Q764 W766 E803	W763-R780 HydrophobicContact CD2-CG 4.45Å; W763-R780 HydrophobicContact CE3-CB 4.38Å; W763-R780 HydrophobicContact CE3-CG 3.64Å; W763-R780 HydrophobicContact CZ3-CG 4.14Å; W763-R780 WeakPolarHBondContact CZ3-O 3.36Å; Q764-R780 WeakPolarHBondContact O-CD 3.47Å; W766-R780 HydrophobicContact CD2-CB 4.19Å; W766-R780 HydrophobicContact CD2-CG 3.99Å; W766-R780 HydrophobicContact CE3-CB 3.96Å; W766-R780 HydrophobicContact CE3-CG 3.79Å; W766-R780 HydrophobicContact CH2-CG 3.89Å; W766-R780 HydrophobicContact CZ2-CG 4.08Å; W766-R780 HydrophobicContact CZ3-CB 4.34Å; W766-R780 HydrophobicContact CZ3-CG 3.74Å; R780-E803 HydrophobicContact CG-CB 3.92Å; R780-E803 IonicContact CZ-OE1 3.74Å; R780-E803 IonicContact CZ-OE2 2.8Å; R780-E803 PolarHBondContact N-O 2.98Å; R780-E803 VanDerWaalsContact NE-CD 3.25Å; R780-E803 IonicContact NE-OE1 2.72Å; R780-E803 PolarHBondContact NE-OE1 3.18Å; R780-E803 IonicContact NE-OE2 2.71Å; R780-E803 PolarHBondContact NE-OE2 3.3Å; R780-E803 IonicContact NH2-OE1 3.37Å; R780-E803 PolarHBondContact NH2-OE1 3.25Å; R780-E803 IonicContact NH2-OE2 2.71Å; R780-E803 PolarHBondContact NH2-OE2 3.1Å; R780-E803 PolarHBondContact O-N 3.11Å
781	Y	79.6	Confident	69.2	Low	40 Å²	40	66.2 Å²	66.2	16%	0.157	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	148.3	179.2	-51.6	-80.5	0	0	0	111.3	Q764 I779 A794 C801 T802	Q764-Y781 WeakPolarHBondContact CB-O 3.16Å; Q764-Y781 WeakPolarHBondContact CG-O 3.29Å; Q764-Y781 PolarHBondContact N-O 3.37Å; I779-Y781 HydrophobicContact CG2-CE1 4.03Å; I779-Y781 HydrophobicContact CG2-CE2 4.22Å; Y781-A794 HydrophobicContact CE2-CB 4.19Å; Y781-A794 WeakPolarHBondContact OH-CB 3.12Å; Y781-C801 WeakPolarHBondContact CA-O 3.5Å; Y781-T802 HydrophobicContact CD1-CG2 4.18Å; Y781-T802 HydrophobicContact CE1-CG2 3.87Å
782	G	77.6	Confident	69.2	Low	1 Å²	1	62.3 Å²	62.3	1%	0.01	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	163	179.6	0	0	0	0	0	110.9	W763 C792 C800 C801	W763-G782 VanDerWaalsContact CE3-N 3.33Å; W763-G782 VanDerWaalsContact CZ3-N 3.32Å; G782-C792 PolarHBondContact O-SG 2.87Å; G782-C800 CarbonylContact O-C 3.51Å; G782-C800 WeakPolarHBondContact O-CA 3.22Å; G782-C801 PolarHBondContact N-O 3.18Å; G782-C801 VanDerWaalsContact N-O 3.09Å; G782-C801 PolarHBondContact O-N 3.19Å
783	P	73.1	Confident	69.1	Low	18 Å²	18	61.3 Å²	61.3	12%	0.117	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	147.3	-178.4	30.8	-34.3	0	0	0	112.3	K759 H762 A787	K759-P783 PolarHBondContact N-O 2.99Å; H762-P783 HydrophobicContact CB-CG 4.12Å; H762-P783 WeakPolarHBondContact O-CD 3.43Å; P783-A787 HydrophobicContact CB-CB 4.41Å
784	K	68.9	Low	68.6	Low	63 Å²	63	63.9 Å²	63.9	27%	0.274	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-66.9	161.5	161.6	-72.1	-179.7	-177.2	175.2	0	110.9	E757 A787 E798 H799	E757-K784 CarbonylContact O-C 3.46Å; E757-K784 WeakPolarHBondContact O-CA 3.08Å; E757-K784 WeakPolarHBondContact O-CB 3.34Å; K784-A787 WeakPolarHBondContact O-CB 3.15Å; K784-A787 PolarHBondContact O-N 2.88Å; K784-E798 WeakPolarHBondContact CE-O 3.47Å; K784-E798 PolarHBondContact NZ-O 3.32Å; K784-H799 WeakPolarHBondContact CB-O 3.45Å; K784-H799 PolarHBondContact N-O 3.3Å
785	D	63.3	Low	67.8	Low	98 Å²	98	67 Å²	67	52%	0.524	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	153.2	171.5	-142.3	-45.7	0	0	0	111.4	E757 K759 A787	E757-D785 PolarHBondContact O-N 2.94Å; K759-D785 WeakPolarHBondContact CE-OD1 3.45Å; K759-D785 HydrophobicContact CG-CB 4.34Å; K759-D785 IonicContact NZ-OD1 2.87Å; K759-D785 PolarHBondContact NZ-OD1 3.15Å; K759-D785 IonicContact NZ-OD2 2.72Å; K759-D785 PolarHBondContact NZ-OD2 2.88Å; D785-A787 PolarHBondContact O-N 3.49Å
786	G	61.1	Low	67.2	Low	63 Å²	63	65.4 Å²	65.4	65%	0.649	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	-22.2	-169.1	0	0	0	0	0	116	K788	G786-K788 PolarHBondContact O-N 2.77Å
787	A	58.6	Low	66.7	Low	20 Å²	20	71.3 Å²	71.3	17%	0.165	40%	0.398	C	S	.	.			trans	-79.1	71.8	-171.2	0	0	0	0	0	114.3	P783 K784 D785 H799	P783-A787 HydrophobicContact CB-CB 4.41Å; K784-A787 WeakPolarHBondContact O-CB 3.15Å; K784-A787 PolarHBondContact O-N 2.88Å; D785-A787 PolarHBondContact O-N 3.49Å; A787-H799 HydrophobicContact CB-CB 4.35Å
788	K	54.7	Low	66.2	Low	186 Å²	186	76.3 Å²	76.3	81%	0.809	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	140.1	174	-67.4	-174	178	-178.5	0	112.4	G786 K790	G786-K788 PolarHBondContact O-N 2.77Å; K788-K790 VanDerWaalsContact C-N 3.28Å; K788-K790 PolarHBondContact O-N 2.84Å; K788-K790 VanDerWaalsContact O-N 3.15Å
789	N	57.5	Low	65.6	Low	169 Å²	169	77.1 Å²	77.1	90%	0.904	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	22.4	169	-60.6	7.1	0	0	0	117.1
790	K	57.1	Low	65.3	Low	109 Å²	109	76.2 Å²	76.2	47%	0.474	42%	0.42	S	S	.	.			trans	-94.4	127.8	172.5	-63	-161.4	179.5	-165.4	0	111.1	K788 C792 H799	K788-K790 VanDerWaalsContact C-N 3.28Å; K788-K790 PolarHBondContact O-N 2.84Å; K788-K790 VanDerWaalsContact O-N 3.15Å; K790-C792 PolarHBondContact O-N 3.42Å; K790-H799 HydrophobicContact CD-CB 3.98Å; K790-H799 VanDerWaalsContact CD-CD2 3.5Å; K790-H799 WeakPolarHBondContact CD-CD2 3.44Å; K790-H799 PolarHBondContact NZ-CD2 2.83Å; K790-H799 PolarHBondContact NZ-NE2 3.25Å
791	V	64.4	Low	64.7	Low	115 Å²	115	73.6 Å²	73.6	70%	0.697	41%	0.411	S	S	*	.			trans	-80.8	114.5	176	-179.3	0	0	0	0	109	T793	V791-T793 HydrophobicContact CG1-CG2 4.43Å
792	C	67.7	Low	64.5	Low	6 Å²	6	72.5 Å²	72.5	4%	0.041	41%	0.408	C	S	.	.			trans	-77.8	144	174.5	-67.4	0	0	0	0	111.9	Q764 G782 K790 C800	Q764-C792 PolarHBondContact NE2-O 2.86Å; G782-C792 PolarHBondContact O-SG 2.87Å; K790-C792 PolarHBondContact O-N 3.42Å; C792-C800 WeakPolarHBondContact CA-SG 3.27Å; C792-C800 HydrophobicContact CB-CB 3.77Å; C792-C800 WeakPolarHBondContact CB-SG 3.41Å; C792-C800 WeakPolarHBondContact SG-CB 3.04Å; C792-C800 CovalentContact SG-SG 2.04Å; C792-C800 PolarHBondContact SG-SG 2.92Å
793	T	64.3	Low	64.5	Low	56 Å²	56	73.1 Å²	73.1	34%	0.344	41%	0.411	S	S	.	.			trans	-148.3	164.9	178.9	59.5	0	0	0	0	108.9	V791 T795 S796	V791-T793 HydrophobicContact CG1-CG2 4.43Å; T793-T795 PolarHBondContact O-N 2.97Å; T793-T795 PolarHBondContact OG1-N 2.71Å; T793-T795 PolarHBondContact OG1-OG1 3.25Å; T793-S796 PolarHBondContact O-N 3.07Å; T793-S796 WeakPolarHBondContact OG1-CB 3.49Å; T793-S796 PolarHBondContact OG1-N 3.03Å
794	A	60.4	Low	64.7	Low	70 Å²	70	73 Å²	73	58%	0.579	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-6.9	173.4	0	0	0	0	0	114.9	Y781	Y781-A794 HydrophobicContact CE2-CB 4.19Å; Y781-A794 WeakPolarHBondContact OH-CB 3.12Å
795	T	56.7	Low	65.2	Low	132 Å²	132	71.2 Å²	71.2	81%	0.81	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	-2.2	178	49.3	0	0	0	0	113.8	T793	T793-T795 PolarHBondContact O-N 2.97Å; T793-T795 PolarHBondContact OG1-N 2.71Å; T793-T795 PolarHBondContact OG1-OG1 3.25Å
796	S	57.6	Low	66	Low	40 Å²	40	70.2 Å²	70.2	28%	0.28	40%	0.395	S	S	.	.			trans	-112.5	92.5	-174.7	-167.3	0	0	0	0	111	T793 C800	T793-S796 PolarHBondContact O-N 3.07Å; T793-S796 WeakPolarHBondContact OG1-CB 3.49Å; T793-S796 PolarHBondContact OG1-N 3.03Å; S796-C800 VanDerWaalsContact O-CB 3.28Å; S796-C800 WeakPolarHBondContact O-CB 2.94Å
797	N	61.2	Low	66.8	Low	124 Å²	124	70.2 Å²	70.2	66%	0.663	38%	0.378	S	S	*	.			trans	-92.2	-28.4	-170.5	-69.4	-6.7	0	0	0	114.7
798	E	64.6	Low	67.7	Low	152 Å²	152	74.4 Å²	74.4	71%	0.71	41%	0.406	S	S	*	.	S	Bend	trans	-72	-42.5	-165.8	-63.9	-177.9	163	0	0	113.6	K784	K784-E798 WeakPolarHBondContact CE-O 3.47Å; K784-E798 PolarHBondContact NZ-O 3.32Å
799	H	67	Low	68.7	Low	69 Å²	69	67.3 Å²	67.3	32%	0.319	38%	0.377	S	S	.	.	S	Bend	trans	-108.1	5.6	-173.1	-57	-59.9	0	0	0	114.3	K784 A787 K790	K784-H799 WeakPolarHBondContact CB-O 3.45Å; K784-H799 PolarHBondContact N-O 3.3Å; A787-H799 HydrophobicContact CB-CB 4.35Å; K790-H799 HydrophobicContact CD-CB 3.98Å; K790-H799 VanDerWaalsContact CD-CD2 3.5Å; K790-H799 WeakPolarHBondContact CD-CD2 3.44Å; K790-H799 PolarHBondContact NZ-CD2 2.83Å; K790-H799 PolarHBondContact NZ-NE2 3.25Å
800	C	71.9	Confident	69.5	Low	10 Å²	10	61.7 Å²	61.7	7%	0.068	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	148.4	-171.3	-63.8	0	0	0	0	111.5	G782 C792 S796	G782-C800 CarbonylContact O-C 3.51Å; G782-C800 WeakPolarHBondContact O-CA 3.22Å; C792-C800 WeakPolarHBondContact CA-SG 3.27Å; C792-C800 HydrophobicContact CB-CB 3.77Å; C792-C800 WeakPolarHBondContact CB-SG 3.41Å; C792-C800 WeakPolarHBondContact SG-CB 3.04Å; C792-C800 CovalentContact SG-SG 2.04Å; C792-C800 PolarHBondContact SG-SG 2.92Å; S796-C800 VanDerWaalsContact O-CB 3.28Å; S796-C800 WeakPolarHBondContact O-CB 2.94Å
801	C	72.3	Confident	70.4	Confident	5 Å²	5	59 Å²	59	3%	0.034	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	149.1	169.1	-69.1	0	0	0	0	110	C758 W763 Y781 G782	C758-C801 WeakPolarHBondContact CA-SG 3.03Å; C758-C801 HydrophobicContact CB-CB 3.73Å; C758-C801 WeakPolarHBondContact CB-SG 3.42Å; C758-C801 WeakPolarHBondContact SG-CB 3.49Å; C758-C801 CovalentContact SG-SG 2.02Å; C758-C801 PolarHBondContact SG-SG 2.64Å; W763-C801 HydrophobicContact CH2-CB 3.58Å; W763-C801 HydrophobicContact CZ2-CB 4.13Å; W763-C801 HydrophobicContact CZ3-CB 4.37Å; Y781-C801 WeakPolarHBondContact CA-O 3.5Å; G782-C801 PolarHBondContact N-O 3.18Å; G782-C801 VanDerWaalsContact N-O 3.09Å; G782-C801 PolarHBondContact O-N 3.19Å
802	T	74.4	Confident	70.6	Confident	16 Å²	16	54.2 Å²	54.2	10%	0.098	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.5	171.7	-53.7	0	0	0	0	107.8	F721 I779 Y781 V804	F721-T802 PolarHBondContact N-O 2.92Å; I779-T802 HydrophobicContact CG2-CG2 3.48Å; I779-T802 VanDerWaalsContact CG2-CG2 3.48Å; Y781-T802 HydrophobicContact CD1-CG2 4.18Å; Y781-T802 HydrophobicContact CE1-CG2 3.87Å; T802-V804 HydrophobicContact CG2-CG2 4.18Å
803	E	78.1	Confident	70.7	Confident	15 Å²	15	56.8 Å²	56.8	7%	0.07	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.5	171.5	-170.6	-173.5	139.7	0	0	108.5	F721 W763 W766 I779 R780	F721-E803 HydrophobicContact CB-CG 4.39Å; F721-E803 HydrophobicContact CD1-CG 3.88Å; F721-E803 HydrophobicContact CG-CG 4.48Å; W763-E803 HydrophobicContact CE3-CB 4.2Å; W763-E803 HydrophobicContact CH2-CB 3.62Å; W763-E803 HydrophobicContact CZ2-CB 4.34Å; W763-E803 HydrophobicContact CZ3-CB 3.54Å; W766-E803 HydrophobicContact CH2-CB 4.34Å; W766-E803 HydrophobicContact CH2-CG 3.85Å; W766-E803 VanDerWaalsContact CH2-OE1 3.25Å; W766-E803 WeakPolarHBondContact CH2-OE1 3.2Å; W766-E803 VanDerWaalsContact CZ2-OE1 3.25Å; W766-E803 WeakPolarHBondContact CZ2-OE1 3.4Å; I779-E803 WeakPolarHBondContact CA-O 3.35Å; R780-E803 HydrophobicContact CG-CB 3.92Å; R780-E803 IonicContact CZ-OE1 3.74Å; R780-E803 IonicContact CZ-OE2 2.8Å; R780-E803 PolarHBondContact N-O 2.98Å; R780-E803 VanDerWaalsContact NE-CD 3.25Å; R780-E803 IonicContact NE-OE1 2.72Å; R780-E803 PolarHBondContact NE-OE1 3.18Å; R780-E803 IonicContact NE-OE2 2.71Å; R780-E803 PolarHBondContact NE-OE2 3.3Å; R780-E803 IonicContact NH2-OE1 3.37Å; R780-E803 PolarHBondContact NH2-OE1 3.25Å; R780-E803 IonicContact NH2-OE2 2.71Å; R780-E803 PolarHBondContact NH2-OE2 3.1Å; R780-E803 PolarHBondContact O-N 3.11Å
804	V	76	Confident	71.3	Confident	16 Å²	16	57.7 Å²	57.7	10%	0.097	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	126	-177.4	-174.4	0	0	0	0	108.7	F721 K723 V777 R778 T802	F721-V804 PolarHBondContact O-N 3.13Å; K723-V804 VanDerWaalsContact CB-O 3.25Å; K723-V804 WeakPolarHBondContact CB-O 3.36Å; K723-V804 PolarHBondContact N-O 2.92Å; V777-V804 HydrophobicContact CG1-CG1 3.53Å; R778-V804 WeakPolarHBondContact O-CA 3.36Å; T802-V804 HydrophobicContact CG2-CG2 4.18Å
805	M	80.6	Confident	72	Confident	24 Å²	24	55.3 Å²	55.3	12%	0.118	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.7	174.4	174.1	173	77.1	0	0	108.6	K723 W766 R778 E807	K723-M805 HydrophobicContact CB-CB 4.4Å; K723-M805 HydrophobicContact CD-CB 3.9Å; K723-M805 HydrophobicContact CD-CG 3.87Å; K723-M805 HydrophobicContact CD-SD 3.92Å; K723-M805 PolarHBondContact NZ-SD 3.28Å; W766-M805 HydrophobicContact CD2-CE 4.22Å; W766-M805 HydrophobicContact CE3-CB 4.34Å; W766-M805 HydrophobicContact CE3-CE 4.47Å; W766-M805 HydrophobicContact CH2-CB 3.45Å; W766-M805 VanDerWaalsContact CH2-CB 3.45Å; W766-M805 HydrophobicContact CH2-SD 4.48Å; W766-M805 HydrophobicContact CZ2-CB 4.16Å; W766-M805 HydrophobicContact CZ2-CE 4.45Å; W766-M805 HydrophobicContact CZ2-SD 4.25Å; W766-M805 HydrophobicContact CZ3-CB 3.56Å; R778-M805 HydrophobicContact CB-CE 4.35Å; R778-M805 PolarHBondContact N-O 3.46Å; R778-M805 PolarHBondContact O-N 3.28Å; M805-E807 HydrophobicContact CE-CB 4.41Å; M805-E807 WeakPolarHBondContact CE-OE2 3.4Å
806	E	79.1	Confident	73	Confident	77 Å²	77	49.2 Å²	49.2	36%	0.36	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	132.9	157.8	-65.3	-176.6	-169.6	0	0	108.6	Q724 T775 A776 V777	Q724-E806 HydrophobicContact CG-CB 4.38Å; Q724-E806 PolarHBondContact NE2-OE2 2.03Å; Q724-E806 PolarHBondContact OE1-OE1 3.12Å; Q724-E806 PolarHBondContact OE1-OE2 2.85Å; T775-E806 HydrophobicContact CG2-CB 3.84Å; T775-E806 HydrophobicContact CG2-CG 4.11Å; T775-E806 WeakPolarHBondContact CG2-OE2 3.13Å; A776-E806 CarbonylContact O-C 3.55Å; A776-E806 WeakPolarHBondContact O-CA 3.46Å; V777-E806 HydrophobicContact CG2-CG 4.38Å
807	E	79.3	Confident	73.7	Confident	63 Å²	63	51.2 Å²	51.2	29%	0.294	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	118.1	178.2	-171.7	168.2	176	0	0	107.4	A776 R778 M805 L809	A776-E807 PolarHBondContact N-O 2.86Å; A776-E807 PolarHBondContact O-N 2.95Å; R778-E807 WeakPolarHBondContact CD-OE2 3.41Å; R778-E807 IonicContact CZ-OE2 2.67Å; R778-E807 IonicContact NE-OE2 3.17Å; R778-E807 IonicContact NH1-OE1 3.37Å; R778-E807 IonicContact NH1-OE2 3.97Å; R778-E807 PolarHBondContact NH1-OE2 2.83Å; M805-E807 HydrophobicContact CE-CB 4.41Å; M805-E807 WeakPolarHBondContact CE-OE2 3.4Å; E807-L809 HydrophobicContact CG-CD2 4.11Å; E807-L809 PolarHBondContact O-N 3.36Å
808	S	77.9	Confident	73.8	Confident	108 Å²	108	48.9 Å²	48.9	76%	0.755	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.3	105.9	173.8	-173.5	0	0	0	0	108.2
809	L	75.7	Confident	73.9	Confident	37 Å²	37	43 Å²	43	19%	0.194	26%	0.256	C	S	.	.			trans	-80.8	-177.1	172.9	-57.7	-178.3	0	0	0	110.2	P769 R771 T772 D774 A776 E807	P769-L809 HydrophobicContact CB-CD1 4.18Å; R771-L809 WeakPolarHBondContact O-CD1 3.35Å; T772-L809 VanDerWaalsContact C-CD1 3.45Å; D774-L809 WeakPolarHBondContact O-CB 3.46Å; D774-L809 PolarHBondContact O-N 3.13Å; A776-L809 HydrophobicContact CB-CD1 3.55Å; A776-L809 HydrophobicContact CB-CG 3.93Å; E807-L809 HydrophobicContact CG-CD2 4.11Å; E807-L809 PolarHBondContact O-N 3.36Å
810	T	74.2	Confident	74	Confident	51 Å²	51	45.8 Å²	45.8	31%	0.313	27%	0.272	S	S	.	.	S	Bend	trans	-51.5	133.7	164.6	23.8	0	0	0	0	110	C773 D774 E814 Y815	C773-T810 VanDerWaalsContact CA-O 3.26Å; C773-T810 WeakPolarHBondContact CA-O 3.3Å; C773-T810 VanDerWaalsContact CB-O 3.29Å; C773-T810 WeakPolarHBondContact CB-O 3.25Å; D774-T810 PolarHBondContact N-O 2.03Å; T810-E814 WeakPolarHBondContact CG2-OE2 3.41Å; T810-Y815 WeakPolarHBondContact OG1-CE2 3.4Å; T810-Y815 PolarHBondContact OG1-OH 3.17Å
811	P	74.2	Confident	74	Confident	52 Å²	52	48.7 Å²	48.7	34%	0.338	29%	0.287	S	S	.	.			trans	-55	142.8	179.7	-28	35.5	0	0	0	112.1	D774 S813 E814	D774-P811 WeakPolarHBondContact OD1-CA 3.44Å; P811-S813 WeakPolarHBondContact CB-OG 3.36Å; P811-S813 PolarHBondContact O-N 2.77Å; P811-S813 VanDerWaalsContact O-N 3.09Å; P811-E814 WeakPolarHBondContact O-CB 3.4Å; P811-E814 PolarHBondContact O-N 3.09Å
812	C	69.7	Low	74.2	Confident	16 Å²	16	51.3 Å²	51.3	11%	0.108	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-62.3	-21.4	178.1	-70	0	0	0	0	112.1	C773 D774 E814 Y815 G840	C773-C812 HydrophobicContact CB-CB 3.89Å; C773-C812 WeakPolarHBondContact CB-SG 3.5Å; C773-C812 WeakPolarHBondContact SG-CA 3.49Å; C773-C812 WeakPolarHBondContact SG-CB 3.42Å; C773-C812 CovalentContact SG-SG 2.04Å; C773-C812 PolarHBondContact SG-SG 3.19Å; D774-C812 PolarHBondContact OD1-N 2.79Å; D774-C812 VanDerWaalsContact OD2-CB 3.29Å; D774-C812 WeakPolarHBondContact OD2-CB 3.48Å; D774-C812 PolarHBondContact OD2-SG 3.15Å; C812-E814 PolarHBondContact O-N 2.82Å; C812-Y815 PolarHBondContact O-N 2.58Å; C812-G840 WeakPolarHBondContact O-CA 3.47Å
813	S	70.6	Confident	74.3	Confident	59 Å²	59	51 Å²	51	41%	0.413	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-63.2	-19.8	169.2	54.6	0	0	0	0	114.4	P811 Y815 F823 Q833	P811-S813 WeakPolarHBondContact CB-OG 3.36Å; P811-S813 PolarHBondContact O-N 2.77Å; P811-S813 VanDerWaalsContact O-N 3.09Å; S813-Y815 VanDerWaalsContact C-N 3.28Å; S813-F823 WeakPolarHBondContact O-CE2 3.41Å; S813-Q833 PolarHBondContact O-NE2 3.24Å
814	E	76.3	Confident	74.4	Confident	76 Å²	76	58.9 Å²	58.9	36%	0.355	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-80.5	-3.2	171.1	-64.7	-169.7	-160.8	0	0	113.5	T810 P811 C812 E822 F823	T810-E814 WeakPolarHBondContact CG2-OE2 3.41Å; P811-E814 WeakPolarHBondContact O-CB 3.4Å; P811-E814 PolarHBondContact O-N 3.09Å; C812-E814 PolarHBondContact O-N 2.82Å; E814-E822 CarbonylContact O-C 3.6Å; E814-E822 WeakPolarHBondContact O-CA 3.12Å; E814-F823 VanDerWaalsContact C-CD2 3.45Å; E814-F823 VanDerWaalsContact O-CD2 3.22Å; E814-F823 WeakPolarHBondContact O-CD2 3.32Å; E814-F823 PolarHBondContact O-N 3.31Å
815	Y	75.2	Confident	74.5	Confident	20 Å²	20	61.7 Å²	61.7	8%	0.078	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-108.8	142.4	175.7	-66.8	-94.4	0	0	0	111.8	C773 T810 C812 S813 H817 L821 E822 F823 G841	C773-Y815 HydrophobicContact CB-CD2 3.51Å; C773-Y815 HydrophobicContact CB-CE2 3.44Å; C773-Y815 VanDerWaalsContact CB-CE2 3.44Å; C773-Y815 HydrophobicContact CB-CG 4.45Å; T810-Y815 WeakPolarHBondContact OG1-CE2 3.4Å; T810-Y815 PolarHBondContact OG1-OH 3.17Å; C812-Y815 PolarHBondContact O-N 2.58Å; S813-Y815 VanDerWaalsContact C-N 3.28Å; Y815-H817 PolarHBondContact O-N 3.02Å; Y815-L821 WeakPolarHBondContact CA-O 3.38Å; Y815-E822 HydrophobicContact CD1-CG 3.94Å; Y815-E822 HydrophobicContact CE1-CB 4.4Å; Y815-E822 HydrophobicContact CE1-CG 3.28Å; Y815-E822 HydrophobicContact CE2-CG 4.36Å; Y815-E822 PolarHBondContact OH-OE1 2.71Å; Y815-F823 WeakPolarHBondContact O-CE2 3.47Å; Y815-G841 PolarHBondContact O-N 2.81Å
816	H	76.7	Confident	74.5	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.019	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-62.8	119	169.5	-78.2	-94.4	0	0	0	109.9	G818 T819 L821 F823 L826 R852 S853	H816-G818 PolarHBondContact O-N 2.91Å; H816-T819 HydrophobicContact CB-CG2 4.42Å; H816-T819 WeakPolarHBondContact CB-OG1 3.4Å; H816-T819 WeakPolarHBondContact O-CB 3.49Å; H816-T819 PolarHBondContact O-N 2.89Å; H816-T819 PolarHBondContact O-OG1 2.93Å; H816-L821 HydrophobicContact CB-CB 4.47Å; H816-L821 PolarHBondContact CD2-O 2.93Å; H816-L821 PolarHBondContact N-O 2.96Å; H816-F823 AromaticContact CD2-CD1 3.89Å; H816-F823 AromaticContact CD2-CE1 3.75Å; H816-F823 AromaticContact CE1-CD1 3.76Å; H816-F823 AromaticContact CE1-CE1 3.25Å; H816-F823 WeakPolarHBondContact CE1-CE1 3.22Å; H816-F823 AromaticContact CE1-CZ 3.99Å; H816-F823 AromaticContact CG-CE1 3.84Å; H816-F823 AromaticContact CG-CZ 3.86Å; H816-F823 AromaticContact ND1-CE1 3.55Å; H816-F823 AromaticContact ND1-CZ 3.82Å; H816-F823 AromaticContact NE2-CD1 3.42Å; H816-F823 WeakPolarHBondContact NE2-CD1 3.14Å; H816-F823 AromaticContact NE2-CE1 3.37Å; H816-F823 WeakPolarHBondContact NE2-CE1 3.31Å; H816-L826 PolarHBondContact NE2-O 3.25Å; H816-R852 PolarHBondContact CE1-O 3.14Å; H816-R852 WeakPolarHBondContact ND1-CG 3.35Å; H816-S853 PolarHBondContact CE1-OG 3.34Å; H816-S853 PolarHBondContact NE2-OG 3.46Å
817	H	72.2	Confident	74.8	Confident	81 Å²	81	64 Å²	64	38%	0.375	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	131.2	-176.6	159.2	-90.9	0	0	0	112.9	Y815 T819 H836 G839 G841	Y815-H817 PolarHBondContact O-N 3.02Å; H817-T819 VanDerWaalsContact C-N 3.33Å; H817-H836 HydrophobicContact CB-CB 3.98Å; H817-H836 AromaticContact CD2-CE1 3.58Å; H817-H836 AromaticContact CD2-ND1 3.13Å; H817-H836 PolarHBondContact CD2-ND1 3.32Å; H817-H836 AromaticContact CE1-CE1 3.29Å; H817-H836 PolarHBondContact CE1-CE1 3.44Å; H817-H836 AromaticContact CE1-ND1 3.68Å; H817-H836 AromaticContact CG-CE1 3.6Å; H817-H836 AromaticContact CG-CG 3.73Å; H817-H836 AromaticContact CG-ND1 3.2Å; H817-H836 AromaticContact ND1-CE1 3.43Å; H817-H836 PolarHBondContact ND1-CE1 3.12Å; H817-H836 AromaticContact ND1-ND1 3.56Å; H817-H836 AromaticContact ND1-NE2 3.95Å; H817-H836 AromaticContact NE2-CE1 3.36Å; H817-H836 PolarHBondContact NE2-CE1 3.2Å; H817-H836 AromaticContact NE2-ND1 3.43Å; H817-H836 PolarHBondContact NE2-ND1 3.2Å; H817-G839 PolarHBondContact CD2-O 3.06Å; H817-G841 WeakPolarHBondContact CB-O 3.46Å; H817-G841 PolarHBondContact N-O 3.29Å
818	G	64.3	Low	75.1	Confident	76 Å²	76	62.2 Å²	62.2	78%	0.784	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	13.9	-177	0	0	0	0	0	114.4	H816	H816-G818 PolarHBondContact O-N 2.91Å
819	T	67.2	Low	75.6	Confident	29 Å²	29	61.5 Å²	61.5	18%	0.178	35%	0.354	C	S	.	.	S	Bend	trans	-144.7	165.8	-177.9	84.6	0	0	0	0	112.3	H816 H817 L821	H816-T819 HydrophobicContact CB-CG2 4.42Å; H816-T819 WeakPolarHBondContact CB-OG1 3.4Å; H816-T819 WeakPolarHBondContact O-CB 3.49Å; H816-T819 PolarHBondContact O-N 2.89Å; H816-T819 PolarHBondContact O-OG1 2.93Å; H817-T819 VanDerWaalsContact C-N 3.33Å; T819-L821 VanDerWaalsContact C-N 3.35Å; T819-L821 WeakPolarHBondContact OG1-CB 3.26Å; T819-L821 PolarHBondContact OG1-N 3.47Å; T819-L821 VanDerWaalsContact OG1-N 3.15Å
820	N	67.9	Low	76.1	Confident	126 Å²	126	61.8 Å²	61.8	67%	0.674	36%	0.356	S	S	*	.	S	Bend	trans	-97.5	25.6	172.8	-57.1	8.5	0	0	0	111.9
821	L	72.6	Confident	76.6	Confident	71 Å²	71	59.8 Å²	59.8	37%	0.372	35%	0.346	S	S	.	.			trans	-97.2	118.3	-178.1	-64.4	169.2	0	0	0	111.1	Y815 H816 T819	Y815-L821 WeakPolarHBondContact CA-O 3.38Å; H816-L821 HydrophobicContact CB-CB 4.47Å; H816-L821 PolarHBondContact CD2-O 2.93Å; H816-L821 PolarHBondContact N-O 2.96Å; T819-L821 VanDerWaalsContact C-N 3.35Å; T819-L821 WeakPolarHBondContact OG1-CB 3.26Å; T819-L821 PolarHBondContact OG1-N 3.47Å; T819-L821 VanDerWaalsContact OG1-N 3.15Å
822	E	76.2	Confident	77.2	Confident	61 Å²	61	61.2 Å²	61.2	29%	0.285	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-71.7	140.4	173.9	-66.4	174.2	-166.3	0	0	111.3	E814 Y815 K824 S825 L826	E814-E822 CarbonylContact O-C 3.6Å; E814-E822 WeakPolarHBondContact O-CA 3.12Å; Y815-E822 HydrophobicContact CD1-CG 3.94Å; Y815-E822 HydrophobicContact CE1-CB 4.4Å; Y815-E822 HydrophobicContact CE1-CG 3.28Å; Y815-E822 HydrophobicContact CE2-CG 4.36Å; Y815-E822 PolarHBondContact OH-OE1 2.71Å; E822-K824 HydrophobicContact CB-CB 4.13Å; E822-K824 PolarHBondContact O-N 2.87Å; E822-S825 WeakPolarHBondContact O-CA 3.5Å; E822-S825 WeakPolarHBondContact O-CB 3.27Å; E822-S825 PolarHBondContact O-N 3.13Å; E822-S825 PolarHBondContact O-OG 2.68Å; E822-L826 PolarHBondContact O-N 3.22Å
823	F	76.4	Confident	78	Confident	10 Å²	10	65.1 Å²	65.1	4%	0.044	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.5	167.5	-72.7	-73.8	0	0	0	112.1	S813 E814 Y815 H816 S825 L826 P827 Q833	S813-F823 WeakPolarHBondContact O-CE2 3.41Å; E814-F823 VanDerWaalsContact C-CD2 3.45Å; E814-F823 VanDerWaalsContact O-CD2 3.22Å; E814-F823 WeakPolarHBondContact O-CD2 3.32Å; E814-F823 PolarHBondContact O-N 3.31Å; Y815-F823 WeakPolarHBondContact O-CE2 3.47Å; H816-F823 AromaticContact CD2-CD1 3.89Å; H816-F823 AromaticContact CD2-CE1 3.75Å; H816-F823 AromaticContact CE1-CD1 3.76Å; H816-F823 AromaticContact CE1-CE1 3.25Å; H816-F823 WeakPolarHBondContact CE1-CE1 3.22Å; H816-F823 AromaticContact CE1-CZ 3.99Å; H816-F823 AromaticContact CG-CE1 3.84Å; H816-F823 AromaticContact CG-CZ 3.86Å; H816-F823 AromaticContact ND1-CE1 3.55Å; H816-F823 AromaticContact ND1-CZ 3.82Å; H816-F823 AromaticContact NE2-CD1 3.42Å; H816-F823 WeakPolarHBondContact NE2-CD1 3.14Å; H816-F823 AromaticContact NE2-CE1 3.37Å; H816-F823 WeakPolarHBondContact NE2-CE1 3.31Å; F823-S825 PolarHBondContact O-N 2.88Å; F823-L826 CarbonylContact O-C 3.56Å; F823-L826 PolarHBondContact O-N 3.45Å; F823-P827 WeakPolarHBondContact O-CA 3.49Å; F823-P827 WeakPolarHBondContact O-CB 3.3Å; F823-P827 WeakPolarHBondContact O-CD 3.17Å; F823-Q833 HydrophobicContact CD1-CG 4.33Å; F823-Q833 VanDerWaalsContact CD2-CD 3.48Å; F823-Q833 HydrophobicContact CD2-CG 3.91Å; F823-Q833 VanDerWaalsContact CD2-NE2 3.25Å; F823-Q833 HydrophobicContact CE1-CG 4.27Å; F823-Q833 HydrophobicContact CE2-CG 3.89Å; F823-Q833 HydrophobicContact CG-CG 4.18Å; F823-Q833 HydrophobicContact CZ-CG 4.09Å
824	K	79.9	Confident	78.5	Confident	180 Å²	180	64.5 Å²	64.5	78%	0.783	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.7	171.3	-171.1	178.3	-179.1	-179.7	0	113.3	E822	E822-K824 HydrophobicContact CB-CB 4.13Å; E822-K824 PolarHBondContact O-N 2.87Å
825	S	78.8	Confident	78.4	Confident	75 Å²	75	65 Å²	65	52%	0.524	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-29.7	176.8	74.2	0	0	0	0	113.2	E822 F823	E822-S825 WeakPolarHBondContact O-CA 3.5Å; E822-S825 WeakPolarHBondContact O-CB 3.27Å; E822-S825 PolarHBondContact O-N 3.13Å; E822-S825 PolarHBondContact O-OG 2.68Å; F823-S825 PolarHBondContact O-N 2.88Å
826	L	80.4	Confident	78.1	Confident	74 Å²	74	65.9 Å²	65.9	39%	0.387	38%	0.382	S	S	.	.	S	Bend	trans	-143.6	71.7	-176.3	-158.5	78.2	0	0	0	111	H816 E822 F823 S853	H816-L826 PolarHBondContact NE2-O 3.25Å; E822-L826 PolarHBondContact O-N 3.22Å; F823-L826 CarbonylContact O-C 3.56Å; F823-L826 PolarHBondContact O-N 3.45Å; L826-S853 WeakPolarHBondContact CD2-OG 3.16Å; L826-S853 VanDerWaalsContact CG-OG 3.3Å; L826-S853 WeakPolarHBondContact CG-OG 3.14Å; L826-S853 PolarHBondContact O-OG 3.34Å
827	P	84.7	Confident	77	Confident	75 Å²	75	71.2 Å²	71.2	49%	0.487	42%	0.417	S	S	.	.			trans	-69.3	161.3	-172.2	27.9	-36	0	0	0	112.5	F823 V829 S853	F823-P827 WeakPolarHBondContact O-CA 3.49Å; F823-P827 WeakPolarHBondContact O-CB 3.3Å; F823-P827 WeakPolarHBondContact O-CD 3.17Å; P827-V829 WeakPolarHBondContact O-CG2 3.31Å; P827-V829 PolarHBondContact O-N 2.74Å; P827-S853 WeakPolarHBondContact O-CB 3.47Å
828	C	86.4	Confident	76.3	Confident	25 Å²	25	75.4 Å²	75.4	17%	0.169	43%	0.434	C	S	.	.			trans	-67.5	100.1	173.4	-54	0	0	0	0	110.2	G831 C843 S853	C828-G831 VanDerWaalsContact CB-O 3.26Å; C828-G831 WeakPolarHBondContact CB-O 3.4Å; C828-C843 WeakPolarHBondContact CA-SG 3.16Å; C828-C843 HydrophobicContact CB-CB 3.82Å; C828-C843 WeakPolarHBondContact CB-SG 3.26Å; C828-C843 WeakPolarHBondContact SG-CA 3.06Å; C828-C843 WeakPolarHBondContact SG-CB 3.36Å; C828-C843 CovalentContact SG-SG 2.03Å; C828-C843 PolarHBondContact SG-SG 3.2Å; C828-S853 CarbonylContact C-O 3.52Å
829	V	87.2	Confident	76	Confident	93 Å²	93	73.7 Å²	73.7	56%	0.564	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-39.2	-172.3	-172.3	0	0	0	0	111.6	P827 S853	P827-V829 WeakPolarHBondContact O-CG2 3.31Å; P827-V829 PolarHBondContact O-N 2.74Å; V829-S853 PolarHBondContact N-O 3.02Å
830	N	86.2	Confident	76.2	Confident	43 Å²	43	73 Å²	73	23%	0.23	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.1	52.8	179.1	-53.8	-83.6	0	0	0	110.7	Y846 F849 C854	N830-Y846 HydrophobicContact CB-CD2 4.44Å; N830-Y846 WeakPolarHBondContact O-CD2 3.22Å; N830-Y846 PolarHBondContact O-N 3.05Å; N830-F849 HydrophobicContact CB-CB 3.91Å; N830-F849 HydrophobicContact CB-CD1 3.49Å; N830-F849 VanDerWaalsContact CB-CD1 3.49Å; N830-F849 HydrophobicContact CB-CD2 3.6Å; N830-F849 HydrophobicContact CB-CE1 3.81Å; N830-F849 HydrophobicContact CB-CE2 3.92Å; N830-F849 HydrophobicContact CB-CG 3.36Å; N830-F849 HydrophobicContact CB-CZ 4.01Å; N830-F849 VanDerWaalsContact CG-CD1 3.46Å; N830-F849 WeakPolarHBondContact ND2-CD1 3.26Å; N830-F849 WeakPolarHBondContact ND2-CE1 3.36Å; N830-F849 WeakPolarHBondContact OD1-CZ 3.39Å; N830-C854 HydrophobicContact CB-CB 4.11Å; N830-C854 WeakPolarHBondContact CB-O 3.46Å; N830-C854 PolarHBondContact ND2-O 3.28Å; N830-C854 WeakPolarHBondContact O-CB 2.92Å
831	G	85.7	Confident	76.6	Confident	10 Å²	10	67.1 Å²	67.1	10%	0.103	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.9	178.5	-179.3	0	0	0	0	0	112.4	C828 E844	C828-G831 VanDerWaalsContact CB-O 3.26Å; C828-G831 WeakPolarHBondContact CB-O 3.4Å; G831-E844 CarbonylContact C-O 3.59Å; G831-E844 WeakPolarHBondContact CA-O 3.38Å
832	I	86.9	Confident	77.2	Confident	81 Å²	81	71 Å²	71	42%	0.415	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	148.7	176.9	58.8	172.1	0	0	0	111	V834 C843 E844 Y846	I832-V834 HydrophobicContact CD1-CG1 4.07Å; I832-V834 HydrophobicContact CG1-CG1 4.07Å; I832-C843 CarbonylContact O-C 3.53Å; I832-C843 WeakPolarHBondContact O-CA 3.09Å; I832-E844 HydrophobicContact CG1-CB 4.04Å; I832-E844 PolarHBondContact N-O 3.26Å; I832-E844 PolarHBondContact O-N 2.91Å; I832-Y846 HydrophobicContact CG2-CE1 4.06Å
833	Q	86.3	Confident	77.7	Confident	99 Å²	99	68.3 Å²	68.3	46%	0.463	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	120.8	172.4	-178.5	-175.9	-11	0	0	109	S813 F823	S813-Q833 PolarHBondContact O-NE2 3.24Å; F823-Q833 HydrophobicContact CD1-CG 4.33Å; F823-Q833 VanDerWaalsContact CD2-CD 3.48Å; F823-Q833 HydrophobicContact CD2-CG 3.91Å; F823-Q833 VanDerWaalsContact CD2-NE2 3.25Å; F823-Q833 HydrophobicContact CE1-CG 4.27Å; F823-Q833 HydrophobicContact CE2-CG 3.89Å; F823-Q833 HydrophobicContact CG-CG 4.18Å; F823-Q833 HydrophobicContact CZ-CG 4.09Å
834	V	82	Confident	78.1	Confident	46 Å²	46	73.3 Å²	73.3	28%	0.279	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	152.1	176.3	-63.7	0	0	0	0	110.6	I832 G841 R842 E844	I832-V834 HydrophobicContact CD1-CG1 4.07Å; I832-V834 HydrophobicContact CG1-CG1 4.07Å; V834-G841 CarbonylContact O-C 3.56Å; V834-G841 VanDerWaalsContact O-CA 3.32Å; V834-G841 WeakPolarHBondContact O-CA 3.41Å; V834-R842 HydrophobicContact CG2-CB 4.47Å; V834-R842 WeakPolarHBondContact CG2-O 3.41Å; V834-R842 PolarHBondContact N-O 3.07Å; V834-R842 PolarHBondContact O-N 3.09Å; V834-E844 HydrophobicContact CG1-CB 4.05Å; V834-E844 HydrophobicContact CG2-CB 3.98Å
835	A	74.2	Confident	78.5	Confident	86 Å²	86	66.5 Å²	66.5	71%	0.711	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	133.5	171.7	0	0	0	0	0	109.9
836	H	68.7	Low	78.8	Confident	39 Å²	39	69.2 Å²	69.2	18%	0.181	38%	0.379	C	S	.	.			trans	-88.9	139	177.9	-179.5	-98.6	0	0	0	110.5	H817 K838 G839 G840 R842	H817-H836 HydrophobicContact CB-CB 3.98Å; H817-H836 AromaticContact CD2-CE1 3.58Å; H817-H836 AromaticContact CD2-ND1 3.13Å; H817-H836 PolarHBondContact CD2-ND1 3.32Å; H817-H836 AromaticContact CE1-CE1 3.29Å; H817-H836 PolarHBondContact CE1-CE1 3.44Å; H817-H836 AromaticContact CE1-ND1 3.68Å; H817-H836 AromaticContact CG-CE1 3.6Å; H817-H836 AromaticContact CG-CG 3.73Å; H817-H836 AromaticContact CG-ND1 3.2Å; H817-H836 AromaticContact ND1-CE1 3.43Å; H817-H836 PolarHBondContact ND1-CE1 3.12Å; H817-H836 AromaticContact ND1-ND1 3.56Å; H817-H836 AromaticContact ND1-NE2 3.95Å; H817-H836 AromaticContact NE2-CE1 3.36Å; H817-H836 PolarHBondContact NE2-CE1 3.2Å; H817-H836 AromaticContact NE2-ND1 3.43Å; H817-H836 PolarHBondContact NE2-ND1 3.2Å; H836-K838 PolarHBondContact ND1-N 3.18Å; H836-K838 PolarHBondContact O-N 2.88Å; H836-G839 WeakPolarHBondContact CB-O 3.04Å; H836-G839 PolarHBondContact ND1-O 2.96Å; H836-G839 PolarHBondContact O-N 3.02Å; H836-G840 PolarHBondContact N-O 3.29Å; H836-R842 HydrophobicContact CB-CB 4.18Å
837	P	53.5	Low	78.7	Confident	116 Å²	116	71.5 Å²	71.5	75%	0.753	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-16.6	-172.8	-28.1	36.4	0	0	0	116.3
838	K	56.1	Low	78.2	Confident	169 Å²	169	69 Å²	69	74%	0.735	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	26.4	176.3	-58.1	-167.2	175.6	-167.2	0	113	H836	H836-K838 PolarHBondContact ND1-N 3.18Å; H836-K838 PolarHBondContact O-N 2.88Å
839	G	58.2	Low	78.1	Confident	40 Å²	40	70 Å²	70	41%	0.412	39%	0.391	S	S	.	.	S	Bend	trans	75.7	171.2	-168.4	0	0	0	0	0	112.4	H817 H836	H817-G839 PolarHBondContact CD2-O 3.06Å; H836-G839 WeakPolarHBondContact CB-O 3.04Å; H836-G839 PolarHBondContact ND1-O 2.96Å; H836-G839 PolarHBondContact O-N 3.02Å
840	G	72.4	Confident	77.8	Confident	15 Å²	15	68.6 Å²	68.6	16%	0.155	38%	0.383	C	S	.	.	S	Bend	trans	75.9	172.8	-169	0	0	0	0	0	113.3	C812 H836	C812-G840 WeakPolarHBondContact O-CA 3.47Å; H836-G840 PolarHBondContact N-O 3.29Å
841	G	75.1	Confident	77.4	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.01	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	165.9	165.9	0	0	0	0	0	112.2	Y815 H817 V834	Y815-G841 PolarHBondContact O-N 2.81Å; H817-G841 WeakPolarHBondContact CB-O 3.46Å; H817-G841 PolarHBondContact N-O 3.29Å; V834-G841 CarbonylContact O-C 3.56Å; V834-G841 VanDerWaalsContact O-CA 3.32Å; V834-G841 WeakPolarHBondContact O-CA 3.41Å
842	R	85.9	Confident	77.2	Confident	152 Å²	152	72 Å²	72	57%	0.574	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.2	149.3	173.3	170.6	175.9	173.6	-177	-0.9	109.3	V834 H836	V834-R842 HydrophobicContact CG2-CB 4.47Å; V834-R842 WeakPolarHBondContact CG2-O 3.41Å; V834-R842 PolarHBondContact N-O 3.07Å; V834-R842 PolarHBondContact O-N 3.09Å; H836-R842 HydrophobicContact CB-CB 4.18Å
843	C	85.8	Confident	77.1	Confident	5 Å²	5	68.3 Å²	68.3	3%	0.034	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	125.7	165.5	-60.8	0	0	0	0	111.7	C828 I832 R852 C854	C828-C843 WeakPolarHBondContact CA-SG 3.16Å; C828-C843 HydrophobicContact CB-CB 3.82Å; C828-C843 WeakPolarHBondContact CB-SG 3.26Å; C828-C843 WeakPolarHBondContact SG-CA 3.06Å; C828-C843 WeakPolarHBondContact SG-CB 3.36Å; C828-C843 CovalentContact SG-SG 2.03Å; C828-C843 PolarHBondContact SG-SG 3.2Å; I832-C843 CarbonylContact O-C 3.53Å; I832-C843 WeakPolarHBondContact O-CA 3.09Å; C843-R852 PolarHBondContact SG-O 3.37Å; C843-C854 WeakPolarHBondContact CB-SG 3.38Å
844	E	86.3	Confident	77.1	Confident	115 Å²	115	63.6 Å²	63.6	54%	0.537	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	107.3	163.3	179.8	163.5	-130.4	0	0	108.5	G831 I832 V834	G831-E844 CarbonylContact C-O 3.59Å; G831-E844 WeakPolarHBondContact CA-O 3.38Å; I832-E844 HydrophobicContact CG1-CB 4.04Å; I832-E844 PolarHBondContact N-O 3.26Å; I832-E844 PolarHBondContact O-N 2.91Å; V834-E844 HydrophobicContact CG1-CB 4.05Å; V834-E844 HydrophobicContact CG2-CB 3.98Å
845	C	87.6	Confident	77.3	Confident	37 Å²	37	65.9 Å²	65.9	25%	0.25	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	138.8	-171.9	-55.3	0	0	0	0	112.7	F849 C854	C845-F849 HydrophobicContact CB-CB 4.11Å; C845-C854 WeakPolarHBondContact CA-SG 3.23Å; C845-C854 HydrophobicContact CB-CB 3.72Å; C845-C854 WeakPolarHBondContact CB-SG 2.93Å; C845-C854 WeakPolarHBondContact SG-CA 3.4Å; C845-C854 WeakPolarHBondContact SG-CB 3.17Å; C845-C854 CovalentContact SG-SG 2.03Å; C845-C854 PolarHBondContact SG-SG 2.79Å
846	Y	86.2	Confident	77.5	Confident	132 Å²	132	66.2 Å²	66.2	52%	0.518	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-59.1	154.9	171.8	-59.8	-42.6	0	0	0	111.6	N830 I832 G848 F849	N830-Y846 HydrophobicContact CB-CD2 4.44Å; N830-Y846 WeakPolarHBondContact O-CD2 3.22Å; N830-Y846 PolarHBondContact O-N 3.05Å; I832-Y846 HydrophobicContact CG2-CE1 4.06Å; Y846-G848 PolarHBondContact O-N 3.19Å; Y846-F849 PolarHBondContact O-N 3Å
847	S	78.3	Confident	77.7	Confident	122 Å²	122	73.9 Å²	73.9	85%	0.853	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	127.3	172.2	-64.2	0	0	0	0	110.7
848	G	74.3	Confident	78.2	Confident	23 Å²	23	73.5 Å²	73.5	24%	0.237	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.1	1.9	-172.3	0	0	0	0	0	116	Y846 R857 K858	Y846-G848 PolarHBondContact O-N 3.19Å; G848-R857 CarbonylContact O-C 3.12Å; G848-R857 WeakPolarHBondContact O-CA 3.1Å; G848-R857 WeakPolarHBondContact O-CG 3.09Å; G848-K858 PolarHBondContact O-N 3.47Å
849	F	83.8	Confident	78	Confident	46 Å²	46	73.5 Å²	73.5	20%	0.202	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	159.5	179.5	-62.1	-87	0	0	0	114.6	N830 C845 Y846 C854 L856 R857 K858	N830-F849 HydrophobicContact CB-CB 3.91Å; N830-F849 HydrophobicContact CB-CD1 3.49Å; N830-F849 VanDerWaalsContact CB-CD1 3.49Å; N830-F849 HydrophobicContact CB-CD2 3.6Å; N830-F849 HydrophobicContact CB-CE1 3.81Å; N830-F849 HydrophobicContact CB-CE2 3.92Å; N830-F849 HydrophobicContact CB-CG 3.36Å; N830-F849 HydrophobicContact CB-CZ 4.01Å; N830-F849 VanDerWaalsContact CG-CD1 3.46Å; N830-F849 WeakPolarHBondContact ND2-CD1 3.26Å; N830-F849 WeakPolarHBondContact ND2-CE1 3.36Å; N830-F849 WeakPolarHBondContact OD1-CZ 3.39Å; C845-F849 HydrophobicContact CB-CB 4.11Å; Y846-F849 PolarHBondContact O-N 3Å; F849-C854 HydrophobicContact CB-CB 4.36Å; F849-L856 CarbonylContact C-O 3.47Å; F849-L856 WeakPolarHBondContact CA-O 3.35Å; F849-R857 HydrophobicContact CD1-CB 4.28Å; F849-R857 HydrophobicContact CD1-CG 4.32Å; F849-R857 HydrophobicContact CE1-CB 4.18Å; F849-R857 HydrophobicContact CE1-CG 4Å; F849-R857 HydrophobicContact CZ-CG 4.46Å; F849-K858 WeakPolarHBondContact O-CD 3.32Å; F849-K858 WeakPolarHBondContact O-CE 3.28Å; F849-K858 PolarHBondContact O-NZ 3.01Å
850	T	80.4	Confident	77.1	Confident	64 Å²	64	75.4 Å²	75.4	39%	0.393	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	-177.2	-177.9	-167.1	0	0	0	0	110	C854 E855 L856 K858	T850-C854 CarbonylContact O-C 3.44Å; T850-C854 VanDerWaalsContact O-C 3.27Å; T850-C854 VanDerWaalsContact O-CA 3.23Å; T850-C854 WeakPolarHBondContact O-CA 3.5Å; T850-E855 PolarHBondContact O-N 2.99Å; T850-L856 HydrophobicContact CG2-CB 3.76Å; T850-L856 HydrophobicContact CG2-CD1 4.48Å; T850-L856 PolarHBondContact N-O 3.47Å; T850-L856 WeakPolarHBondContact O-CA 3.28Å; T850-L856 WeakPolarHBondContact O-CB 3.35Å; T850-L856 PolarHBondContact O-N 3.43Å; T850-K858 HydrophobicContact CG2-CG 4.12Å
851	G	78.6	Confident	75.2	Confident	22 Å²	22	81.8 Å²	81.8	23%	0.227	41%	0.414	C	S	.	.	S	Bend	trans	91	163.6	-168.7	0	0	0	0	0	111.8	S853 C854 E855	G851-S853 VanDerWaalsContact C-N 3.27Å; G851-S853 PolarHBondContact O-N 3.37Å; G851-C854 PolarHBondContact O-N 3.35Å; G851-C854 VanDerWaalsContact O-N 3.16Å; G851-E855 VanDerWaalsContact CA-OE1 3.28Å; G851-E855 WeakPolarHBondContact CA-OE1 3.42Å
852	R	80	Confident	73.2	Confident	103 Å²	103	87.2 Å²	87.2	39%	0.389	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-31	-169.1	-176.8	174.5	-70	171.2	-7.1	112.5	E328 H816 C843 E855	E328-R852 IonicContact OE1-CZ 2.73Å; E328-R852 VanDerWaalsContact OE1-CZ 3.22Å; E328-R852 IonicContact OE1-NE 3.8Å; E328-R852 PolarHBondContact OE1-NE 3.06Å; E328-R852 IonicContact OE1-NH2 3.67Å; E328-R852 PolarHBondContact OE1-NH2 3.04Å; H816-R852 PolarHBondContact CE1-O 3.14Å; H816-R852 WeakPolarHBondContact ND1-CG 3.35Å; C843-R852 PolarHBondContact SG-O 3.37Å; R852-E855 PolarHBondContact N-OE1 3.32Å; R852-E855 PolarHBondContact N-OE2 3.23Å
853	S	85.7	Confident	70.7	Confident	2 Å²	2	90.1 Å²	90.1	1%	0.014	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	21.3	174.9	-75.5	0	0	0	0	112.3	H816 L826 P827 C828 V829 G851 E855	H816-S853 PolarHBondContact CE1-OG 3.34Å; H816-S853 PolarHBondContact NE2-OG 3.46Å; L826-S853 WeakPolarHBondContact CD2-OG 3.16Å; L826-S853 VanDerWaalsContact CG-OG 3.3Å; L826-S853 WeakPolarHBondContact CG-OG 3.14Å; L826-S853 PolarHBondContact O-OG 3.34Å; P827-S853 WeakPolarHBondContact O-CB 3.47Å; C828-S853 CarbonylContact C-O 3.52Å; V829-S853 PolarHBondContact N-O 3.02Å; G851-S853 VanDerWaalsContact C-N 3.27Å; G851-S853 PolarHBondContact O-N 3.37Å; S853-E855 VanDerWaalsContact CA-OE2 3.23Å; S853-E855 WeakPolarHBondContact CA-OE2 3.19Å; S853-E855 WeakPolarHBondContact CB-OE2 3.48Å; S853-E855 PolarHBondContact N-OE2 3.32Å; S853-E855 PolarHBondContact O-N 2.77Å
854	C	87.1	Confident	68.2	Low	0 Å²	0	97.9 Å²	97.9	0%	0	50%	0.5	C	S	.	.	S	Bend	trans	57.6	28.4	-177.5	-49.1	0	0	0	0	113.9	N830 C843 C845 F849 T850 G851	N830-C854 HydrophobicContact CB-CB 4.11Å; N830-C854 WeakPolarHBondContact CB-O 3.46Å; N830-C854 PolarHBondContact ND2-O 3.28Å; N830-C854 WeakPolarHBondContact O-CB 2.92Å; C843-C854 WeakPolarHBondContact CB-SG 3.38Å; C845-C854 WeakPolarHBondContact CA-SG 3.23Å; C845-C854 HydrophobicContact CB-CB 3.72Å; C845-C854 WeakPolarHBondContact CB-SG 2.93Å; C845-C854 WeakPolarHBondContact SG-CA 3.4Å; C845-C854 WeakPolarHBondContact SG-CB 3.17Å; C845-C854 CovalentContact SG-SG 2.03Å; C845-C854 PolarHBondContact SG-SG 2.79Å; F849-C854 HydrophobicContact CB-CB 4.36Å; T850-C854 CarbonylContact O-C 3.44Å; T850-C854 VanDerWaalsContact O-C 3.27Å; T850-C854 VanDerWaalsContact O-CA 3.23Å; T850-C854 WeakPolarHBondContact O-CA 3.5Å; G851-C854 PolarHBondContact O-N 3.35Å; G851-C854 VanDerWaalsContact O-N 3.16Å
855	E	84.7	Confident	65.7	Low	95 Å²	95	99.7 Å²	99.7	44%	0.444	51%	0.513	S	S	.	.			trans	-77.3	-19.3	-178	71.9	-70.6	168.4	0	0	113.6	T850 G851 R852 S853	T850-E855 PolarHBondContact O-N 2.99Å; G851-E855 VanDerWaalsContact CA-OE1 3.28Å; G851-E855 WeakPolarHBondContact CA-OE1 3.42Å; R852-E855 PolarHBondContact N-OE1 3.32Å; R852-E855 PolarHBondContact N-OE2 3.23Å; S853-E855 VanDerWaalsContact CA-OE2 3.23Å; S853-E855 WeakPolarHBondContact CA-OE2 3.19Å; S853-E855 WeakPolarHBondContact CB-OE2 3.48Å; S853-E855 PolarHBondContact N-OE2 3.32Å; S853-E855 PolarHBondContact O-N 2.77Å
856	L	79.4	Confident	63	Low	92 Å²	92	105.8 Å²	105.8	48%	0.482	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	131.7	-179.6	-52.8	176.6	0	0	0	110.1	F849 T850	F849-L856 CarbonylContact C-O 3.47Å; F849-L856 WeakPolarHBondContact CA-O 3.35Å; T850-L856 HydrophobicContact CG2-CB 3.76Å; T850-L856 HydrophobicContact CG2-CD1 4.48Å; T850-L856 PolarHBondContact N-O 3.47Å; T850-L856 WeakPolarHBondContact O-CA 3.28Å; T850-L856 WeakPolarHBondContact O-CB 3.35Å; T850-L856 PolarHBondContact O-N 3.43Å
857	R	72.7	Confident	60.6	Low	200 Å²	200	105.9 Å²	105.9	76%	0.755	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.6	124.7	172.8	-162.7	175.8	-177.2	173.4	0.3	109.5	G848 F849 L859	G848-R857 CarbonylContact O-C 3.12Å; G848-R857 WeakPolarHBondContact O-CA 3.1Å; G848-R857 WeakPolarHBondContact O-CG 3.09Å; F849-R857 HydrophobicContact CD1-CB 4.28Å; F849-R857 HydrophobicContact CD1-CG 4.32Å; F849-R857 HydrophobicContact CE1-CB 4.18Å; F849-R857 HydrophobicContact CE1-CG 4Å; F849-R857 HydrophobicContact CZ-CG 4.46Å; R857-L859 PolarHBondContact O-N 2.86Å
858	K	64.4	Low	58.4	Low	109 Å²	109	104 Å²	104	47%	0.474	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-59.7	126.8	164.4	-69.6	171.1	172.4	162	0	107.5	G848 F849 T850 A860	G848-K858 PolarHBondContact O-N 3.47Å; F849-K858 WeakPolarHBondContact O-CD 3.32Å; F849-K858 WeakPolarHBondContact O-CE 3.28Å; F849-K858 PolarHBondContact O-NZ 3.01Å; T850-K858 HydrophobicContact CG2-CG 4.12Å; K858-A860 PolarHBondContact O-N 2.04Å
859	L	50.4	Low	56.4	Low	169 Å²	169	109.8 Å²	109.8	89%	0.885	58%	0.58	S	S	*	*			trans	-72.1	93.9	174	-74.5	165.7	0	0	0	108.6	R857 I861	R857-L859 PolarHBondContact O-N 2.86Å; L859-I861 PolarHBondContact O-N 2.88Å; L859-I861 VanDerWaalsContact O-N 3.09Å
860	A	39.2	Very low	53.9	Low	79 Å²	79	112.3 Å²	112.3	65%	0.653	60%	0.601	S	S	*	*			trans	-70.5	103.7	-178.8	0	0	0	0	0	110.6	K858 T862	K858-A860 PolarHBondContact O-N 2.04Å; A860-T862 PolarHBondContact O-N 3.38Å
861	I	33.6	Very low	51.6	Low	149 Å²	149	116.1 Å²	116.1	76%	0.764	62%	0.624	S	S	*	*			trans	-82.2	98.6	156.7	-57.3	178.1	0	0	0	106.1	L859 K863	L859-I861 PolarHBondContact O-N 2.88Å; L859-I861 VanDerWaalsContact O-N 3.09Å; I861-K863 PolarHBondContact O-N 2.88Å
862	T	33.9	Very low	49.6	Very low	116 Å²	116	118.6 Å²	118.6	71%	0.712	64%	0.642	S	S	*	*			trans	-67.5	111	177.7	45.8	0	0	0	0	110.2	A860	A860-T862 PolarHBondContact O-N 3.38Å
863	K	31.8	Very low	47.5	Very low	213 Å²	213	118.9 Å²	118.9	93%	0.926	66%	0.656	S	S	*	*			trans	-102	85.8	156.1	-86.7	-168	170.8	-173	0	108.2	I861	I861-K863 PolarHBondContact O-N 2.88Å
864	E	35.1	Very low	45.3	Very low	168 Å²	168	121.5 Å²	121.5	79%	0.785	68%	0.683	S	S	*	*			trans	-136.2	129.4	172	-163.1	159.5	-134.2	0	0	106.2
865	D	31.8	Very low	43.3	Very low	152 Å²	152	128.3 Å²	128.3	81%	0.813	71%	0.714	S	S	*	*			trans	49.4	123	-179	-62.8	-18.3	0	0	0	121.1	T867	D865-T867 PolarHBondContact O-N 3.23Å; D865-T867 VanDerWaalsContact O-N 3.16Å
866	D	31.6	Very low	41.4	Very low	166 Å²	166	130.3 Å²	130.3	89%	0.888	73%	0.727	S	S	*	*			trans	-65.1	101.7	157.1	-76.4	-61.5	0	0	0	110.3
867	T	36.6	Very low	39.8	Very low	133 Å²	133	131.6 Å²	131.6	82%	0.816	73%	0.734	S	S	*	*			trans	-165.7	122.4	139.2	10.4	0	0	0	0	115.6	D865	D865-T867 PolarHBondContact O-N 3.23Å; D865-T867 VanDerWaalsContact O-N 3.16Å
868	A	30.7	Very low	38.6	Very low	83 Å²	83	129 Å²	129	69%	0.686	72%	0.724	S	S	*	*			trans	56.9	118.4	133.7	0	0	0	0	0	122.4
869	V	32.6	Very low	38	Very low	145 Å²	145	128.4 Å²	128.4	88%	0.879	73%	0.726	S	S	*	*			trans	86.2	140	134.2	170.6	0	0	0	0	117.5
870	P	32.4	Very low	38	Very low	99 Å²	99	122.6 Å²	122.6	64%	0.643	70%	0.703	S	S	*	*			trans	-122.6	160.4	-139.1	41.3	-29.3	0	0	0	116.6
871	V	32.1	Very low	39.1	Very low	144 Å²	144	128 Å²	128	87%	0.873	71%	0.706	S	S	*	*	S	Bend	trans	-135.2	157.8	162.7	-174.6	0	0	0	0	109
872	A	35	Very low	40.4	Very low	74 Å²	74	124.9 Å²	124.9	61%	0.612	69%	0.69	S	S	*	*			trans	76.3	24	170.7	0	0	0	0	0	119.5	G874	A872-G874 PolarHBondContact O-N 3.19Å; A872-G874 VanDerWaalsContact O-N 3.11Å
873	T	37.5	Very low	41.4	Very low	109 Å²	109	127.2 Å²	127.2	67%	0.669	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-4.6	168	44.4	0	0	0	0	115.2
874	G	39.5	Very low	42.4	Very low	56 Å²	56	122.1 Å²	122.1	58%	0.577	67%	0.669	S	S	*	*	H	α-helix	trans	-77.2	-37.5	-173.9	0	0	0	0	0	116.4	A872	A872-G874 PolarHBondContact O-N 3.19Å; A872-G874 VanDerWaalsContact O-N 3.11Å
875	Q	44	Very low	43.7	Very low	143 Å²	143	119.3 Å²	119.3	67%	0.668	66%	0.659	S	S	*	*	H	α-helix	trans	-83.9	-38.4	-165.9	-72.9	176.5	-28.3	0	0	113.9	L877 W878 L879	Q875-L877 PolarHBondContact O-N 2.93Å; Q875-W878 PolarHBondContact O-N 3.33Å; Q875-L879 PolarHBondContact O-N 3.21Å
876	L	45.6	Very low	44.5	Very low	137 Å²	137	115.6 Å²	115.6	72%	0.717	64%	0.644	S	S	*	*	H	α-helix	trans	-67.8	-34.6	178.9	-75.5	165.1	0	0	0	112.7	W878 L879 A880	L876-W878 VanDerWaalsContact C-N 3.27Å; L876-W878 PolarHBondContact O-N 2.88Å; L876-L879 PolarHBondContact O-N 3.48Å; L876-A880 WeakPolarHBondContact O-CB 3.48Å; L876-A880 PolarHBondContact O-N 3.03Å
877	L	45.9	Very low	45.5	Very low	120 Å²	120	111.8 Å²	111.8	63%	0.628	62%	0.62	S	S	*	*	H	α-helix	trans	-64.2	-30.5	174.5	-93.7	166	0	0	0	113	Q875 R881	Q875-L877 PolarHBondContact O-N 2.93Å; L877-R881 PolarHBondContact O-N 3.06Å; L877-R881 VanDerWaalsContact O-N 3.11Å
878	W	47.9	Very low	46.2	Very low	144 Å²	144	110.8 Å²	110.8	55%	0.545	61%	0.609	S	S	.	*	H	α-helix	trans	-72.9	-44.2	177.2	-161.1	79.3	0	0	0	111.7	Q875 L876 R881 L882 W917	Q875-W878 PolarHBondContact O-N 3.33Å; L876-W878 VanDerWaalsContact C-N 3.27Å; L876-W878 PolarHBondContact O-N 2.88Å; W878-R881 PolarHBondContact O-N 2.79Å; W878-L882 HydrophobicContact CD2-CD1 4.19Å; W878-L882 HydrophobicContact CE3-CD1 3.68Å; W878-L882 HydrophobicContact CH2-CD1 3.57Å; W878-L882 HydrophobicContact CZ2-CD1 4.08Å; W878-L882 HydrophobicContact CZ3-CD1 3.36Å; W878-L882 PolarHBondContact O-N 3.17Å; W878-W917 HydrophobicContact CZ3-CH2 4.31Å; W878-W917 HydrophobicContact CZ3-CZ2 4.28Å
879	L	51.3	Low	47.1	Very low	98 Å²	98	111 Å²	111	51%	0.513	60%	0.602	S	S	.	*	H	α-helix	trans	-63.3	-39.9	173.8	-66.5	175.1	0	0	0	112.1	Q875 L876 R881 L882 W883	Q875-L879 PolarHBondContact O-N 3.21Å; L876-L879 PolarHBondContact O-N 3.48Å; L879-R881 PolarHBondContact O-N 3.29Å; L879-L882 PolarHBondContact O-N 3.2Å; L879-W883 PolarHBondContact O-N 2.96Å
880	A	50.6	Low	47.9	Very low	47 Å²	47	112.3 Å²	112.3	39%	0.388	59%	0.591	S	S	.	*	H	α-helix	trans	-62.2	-41.2	174.7	0	0	0	0	0	112.5	L876 W883 L884	L876-A880 WeakPolarHBondContact O-CB 3.48Å; L876-A880 PolarHBondContact O-N 3.03Å; A880-W883 PolarHBondContact O-N 3Å; A880-L884 WeakPolarHBondContact O-CD1 3.07Å; A880-L884 PolarHBondContact O-N 3.32Å
881	R	61.1	Low	48.5	Very low	191 Å²	191	114.3 Å²	114.3	72%	0.721	59%	0.592	S	S	*	*	H	α-helix	trans	-62.8	-43.4	173.4	-89.5	-174.5	166.5	-173	-3.1	112.6	L877 W878 L879 W883 L884 L885	L877-R881 PolarHBondContact O-N 3.06Å; L877-R881 VanDerWaalsContact O-N 3.11Å; W878-R881 PolarHBondContact O-N 2.79Å; L879-R881 PolarHBondContact O-N 3.29Å; R881-W883 VanDerWaalsContact C-N 3.34Å; R881-L884 PolarHBondContact O-N 3.44Å; R881-L885 WeakPolarHBondContact O-CG 3.07Å; R881-L885 PolarHBondContact O-N 3.35Å
882	L	61.6	Low	49.3	Very low	84 Å²	84	114.1 Å²	114.1	44%	0.44	58%	0.582	S	S	.	*	H	α-helix	trans	-62.6	-40.5	176.1	-103.9	158.9	0	0	0	112.1	W878 L879 L885 C886	W878-L882 HydrophobicContact CD2-CD1 4.19Å; W878-L882 HydrophobicContact CE3-CD1 3.68Å; W878-L882 HydrophobicContact CH2-CD1 3.57Å; W878-L882 HydrophobicContact CZ2-CD1 4.08Å; W878-L882 HydrophobicContact CZ3-CD1 3.36Å; W878-L882 PolarHBondContact O-N 3.17Å; L879-L882 PolarHBondContact O-N 3.2Å; L882-L885 PolarHBondContact O-N 2.96Å; L882-C886 WeakPolarHBondContact O-CB 3.41Å; L882-C886 PolarHBondContact O-N 2.96Å
883	W	54.6	Low	49.8	Very low	166 Å²	166	117.8 Å²	117.8	63%	0.629	59%	0.586	S	S	*	*	H	α-helix	trans	-66	-42	175.7	-166.4	85.7	0	0	0	112.3	L879 A880 R881 C886 Q887	L879-W883 PolarHBondContact O-N 2.96Å; A880-W883 PolarHBondContact O-N 3Å; R881-W883 VanDerWaalsContact C-N 3.34Å; W883-C886 PolarHBondContact O-N 2.87Å; W883-Q887 HydrophobicContact CD2-CG 4.07Å; W883-Q887 HydrophobicContact CE3-CG 3.89Å; W883-Q887 HydrophobicContact CH2-CG 3.96Å; W883-Q887 HydrophobicContact CZ2-CG 4.12Å; W883-Q887 HydrophobicContact CZ3-CG 3.83Å; W883-Q887 WeakPolarHBondContact O-CG 3.42Å; W883-Q887 PolarHBondContact O-N 2.99Å
884	L	53.5	Low	50.1	Low	106 Å²	106	121.4 Å²	121.4	56%	0.555	59%	0.593	S	S	*	*	H	α-helix	trans	-61.6	-42.9	173.5	-100.2	88.9	0	0	0	112.7	A880 R881 C886 Q887 L888	A880-L884 WeakPolarHBondContact O-CD1 3.07Å; A880-L884 PolarHBondContact O-N 3.32Å; R881-L884 PolarHBondContact O-N 3.44Å; L884-C886 VanDerWaalsContact C-N 3.28Å; L884-C886 PolarHBondContact O-N 3.17Å; L884-Q887 PolarHBondContact O-N 3.2Å; L884-L888 WeakPolarHBondContact O-CB 3.41Å; L884-L888 WeakPolarHBondContact O-CG 3.37Å; L884-L888 PolarHBondContact O-N 3.1Å
885	L	61.1	Low	50.3	Low	109 Å²	109	126 Å²	126	57%	0.571	60%	0.603	S	S	*	*	H	α-helix	trans	-64.6	-33.7	177.2	-72.4	166.8	0	0	0	112.2	R881 L882 T889	R881-L885 WeakPolarHBondContact O-CG 3.07Å; R881-L885 PolarHBondContact O-N 3.35Å; L882-L885 PolarHBondContact O-N 2.96Å; L885-T889 PolarHBondContact O-N 3.42Å; L885-T889 PolarHBondContact O-OG1 2.9Å
886	C	49.9	Very low	50.3	Low	74 Å²	74	126.7 Å²	126.7	50%	0.5	60%	0.604	S	S	.	*	H	α-helix	trans	-73.4	-32.9	174.7	-161.6	0	0	0	0	112.6	L882 W883 L884 T889 R890	L882-C886 WeakPolarHBondContact O-CB 3.41Å; L882-C886 PolarHBondContact O-N 2.96Å; W883-C886 PolarHBondContact O-N 2.87Å; L884-C886 VanDerWaalsContact C-N 3.28Å; L884-C886 PolarHBondContact O-N 3.17Å; C886-T889 PolarHBondContact O-OG1 3.34Å; C886-R890 PolarHBondContact O-N 2.82Å
887	Q	52.1	Low	49.9	Very low	85 Å²	85	127.5 Å²	127.5	40%	0.397	61%	0.609	S	S	.	*	H	α-helix	trans	-70.9	-43.1	172.3	-74.5	-70.9	-3.7	0	0	112.3	W883 L884 T889 R890 Q891	W883-Q887 HydrophobicContact CD2-CG 4.07Å; W883-Q887 HydrophobicContact CE3-CG 3.89Å; W883-Q887 HydrophobicContact CH2-CG 3.96Å; W883-Q887 HydrophobicContact CZ2-CG 4.12Å; W883-Q887 HydrophobicContact CZ3-CG 3.83Å; W883-Q887 WeakPolarHBondContact O-CG 3.42Å; W883-Q887 PolarHBondContact O-N 2.99Å; L884-Q887 PolarHBondContact O-N 3.2Å; Q887-T889 PolarHBondContact O-N 3.29Å; Q887-R890 PolarHBondContact O-N 2.95Å; Q887-Q891 PolarHBondContact O-N 2.69Å
888	L	51.3	Low	49.9	Very low	112 Å²	112	128 Å²	128	59%	0.586	62%	0.617	S	S	*	*	H	α-helix	trans	-61.5	-44.3	178.8	-76.7	163.8	0	0	0	111.9	L884 R890 Q891	L884-L888 WeakPolarHBondContact O-CB 3.41Å; L884-L888 WeakPolarHBondContact O-CG 3.37Å; L884-L888 PolarHBondContact O-N 3.1Å; L888-R890 VanDerWaalsContact C-N 3.32Å; L888-R890 PolarHBondContact O-N 3.28Å; L888-Q891 PolarHBondContact O-N 2.89Å
889	T	50.6	Low	49.5	Very low	88 Å²	88	128 Å²	128	54%	0.54	63%	0.627	S	S	.	*	H	α-helix	trans	-68	-27.3	177.1	47	0	0	0	0	113.4	L885 C886 Q887	L885-T889 PolarHBondContact O-N 3.42Å; L885-T889 PolarHBondContact O-OG1 2.9Å; C886-T889 PolarHBondContact O-OG1 3.34Å; Q887-T889 PolarHBondContact O-N 3.29Å
890	R	48	Very low	48.7	Very low	172 Å²	172	132.1 Å²	132.1	65%	0.649	64%	0.644	S	S	*	*	H	α-helix	trans	-76.2	-15.1	173.2	-86.6	-174.1	166.2	-169.3	-3.9	114.9	C886 Q887 L888	C886-R890 PolarHBondContact O-N 2.82Å; Q887-R890 PolarHBondContact O-N 2.95Å; L888-R890 VanDerWaalsContact C-N 3.32Å; L888-R890 PolarHBondContact O-N 3.28Å
891	Q	45.9	Very low	47.8	Very low	141 Å²	141	136.4 Å²	136.4	66%	0.659	67%	0.667	S	S	*	*	H	α-helix	trans	-80.2	-43.7	174.2	-79.8	-76.6	-20.8	0	0	112.4	Q887 L888 Q893 K894	Q887-Q891 PolarHBondContact O-N 2.69Å; L888-Q891 PolarHBondContact O-N 2.89Å; Q891-Q893 VanDerWaalsContact C-N 3.29Å; Q891-Q893 PolarHBondContact O-N 2.04Å; Q891-K894 PolarHBondContact O-N 3.45Å; Q891-K894 VanDerWaalsContact O-N 3.15Å
892	E	48.4	Very low	46.6	Very low	141 Å²	141	130.8 Å²	130.8	66%	0.659	67%	0.669	S	S	*	*	H	α-helix	trans	-60.9	-33.4	-175.9	-70.9	-157.3	126.3	0	0	114	K894 L895	E892-K894 PolarHBondContact O-N 2.94Å; E892-L895 PolarHBondContact O-N 3.39Å; E892-L895 VanDerWaalsContact O-N 3.12Å
893	Q	44.7	Very low	45.3	Very low	150 Å²	150	138.4 Å²	138.4	70%	0.701	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-18	-179.9	-76.8	-170.2	-34.9	0	0	113.9	Q891	Q891-Q893 VanDerWaalsContact C-N 3.29Å; Q891-Q893 PolarHBondContact O-N 2.04Å
894	K	45.2	Very low	44.3	Very low	185 Å²	185	137.1 Å²	137.1	80%	0.804	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-6.3	175	-77.5	-170.9	174.1	-178.3	0	114.4	Q891 E892	Q891-K894 PolarHBondContact O-N 3.45Å; Q891-K894 VanDerWaalsContact O-N 3.15Å; E892-K894 PolarHBondContact O-N 2.94Å
895	L	44.2	Very low	43.3	Very low	153 Å²	153	140 Å²	140	80%	0.801	71%	0.708	S	S	*	*	S	Bend	trans	-100.8	-6.2	-178	-145.1	73.9	0	0	0	114.8	E892	E892-L895 PolarHBondContact O-N 3.39Å; E892-L895 VanDerWaalsContact O-N 3.12Å
896	K	42.5	Very low	41.9	Very low	158 Å²	158	139 Å²	139	69%	0.687	72%	0.716	S	S	*	*	S	Bend	trans	-98.5	-19.3	-175.7	-76.7	-179.6	175.8	169.9	0	115.8	V898	K896-V898 PolarHBondContact O-N 2.91Å
897	N	36.9	Very low	41	Very low	153 Å²	153	143 Å²	143	82%	0.818	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	24.1	-173.9	-68.6	5.6	0	0	0	115
898	V	46.6	Very low	40.2	Very low	132 Å²	132	145.8 Å²	145.8	80%	0.8	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-10.9	171.6	178.8	0	0	0	0	111.5	K896	K896-V898 PolarHBondContact O-N 2.91Å
899	L	38.9	Very low	39.3	Very low	144 Å²	144	147.1 Å²	147.1	75%	0.754	76%	0.755	S	S	*	*	S	Bend	trans	-124.6	116.3	-176.7	-72.8	166.4	0	0	0	112.5
900	Q	35.6	Very low	38.4	Very low	184 Å²	184	148.9 Å²	148.9	86%	0.86	77%	0.771	S	S	*	*			trans	65	121.2	162	-59.8	-176.9	-18.9	0	0	118.8
901	P	31.5	Very low	37.6	Very low	136 Å²	136	145.2 Å²	145.2	88%	0.883	77%	0.772	S	S	*	*			trans	-92.9	132.9	166.2	34.5	-30	0	0	0	112.2
902	G	36.8	Very low	37.4	Very low	74 Å²	74	146.5 Å²	146.5	76%	0.763	78%	0.78	S	S	*	*			trans	172.1	137.7	168.2	0	0	0	0	0	116.7
903	R	33.6	Very low	36.7	Very low	244 Å²	244	147.5 Å²	147.5	92%	0.921	79%	0.789	S	S	*	*			trans	62.7	102	166.8	-69	-175.3	173	173.3	-2	119.5
904	N	32.5	Very low	36.2	Very low	138 Å²	138	145.1 Å²	145.1	74%	0.738	79%	0.788	S	S	*	*				24.9	149.5	119.1	-68.8	32.1	0	0	0	123.1
905	E	33.5	Very low	35.7	Very low	166 Å²	166	142.4 Å²	142.4	78%	0.776	78%	0.782	S	S	*	*			trans	84.4	81.9	143	-76.4	153.6	-117.2	0	0	121.2
906	A	32.2	Very low	35.6	Very low	90 Å²	90	141 Å²	141	74%	0.744	78%	0.779	S	S	*	*				81.5	157.4	113.2	0	0	0	0	0	123.2
907	L	30.8	Very low	35.1	Very low	157 Å²	157	141 Å²	141	82%	0.822	78%	0.775	S	S	*	*			trans	89.2	127.8	152.8	-78.4	160.6	0	0	0	122.7
908	I	34.2	Very low	35.2	Very low	143 Å²	143	136.5 Å²	136.5	73%	0.733	76%	0.759	S	S	*	*			trans	92.9	100.4	148.2	-61.8	156.4	0	0	0	120.4
909	N	33.7	Very low	34.9	Very low	140 Å²	140	141.1 Å²	141.1	75%	0.749	76%	0.763	S	S	*	*			trans	18.3	129	138.7	-56.5	-11.2	0	0	0	121.8
910	S	30.7	Very low	35	Very low	125 Å²	125	142 Å²	142	87%	0.874	76%	0.763	S	S	*	*			trans	-130.3	49.4	157.4	66	0	0	0	0	112.3	M912	S910-M912 PolarHBondContact O-N 3.28Å
911	S	32.4	Very low	35	Very low	95 Å²	95	137.6 Å²	137.6	66%	0.664	75%	0.745	S	S	*	*			trans	-92.5	16.3	-169.6	62	0	0	0	0	115.7
912	M	39.9	Very low	35.1	Very low	168 Å²	168	141.8 Å²	141.8	83%	0.828	75%	0.75	S	S	*	*			trans	-113.5	-0.5	-160.4	-150.2	169.9	-173.2	0	0	115.8	S910	S910-M912 PolarHBondContact O-N 3.28Å
913	L	35.1	Very low	35	Very low	162 Å²	162	144.4 Å²	144.4	85%	0.848	75%	0.745	S	S	*	*	S	Bend	trans	-98.1	-12.9	-176.2	-83.2	163	0	0	0	115.1
914	C	32.9	Very low	35.1	Very low	101 Å²	101	140.9 Å²	140.9	68%	0.682	74%	0.736	S	S	*	*	S	Bend	trans	-84.9	-27.3	-175.7	-62	0	0	0	0	114.4	V916	C914-V916 VanDerWaalsContact C-N 3.31Å; C914-V916 PolarHBondContact O-N 2.79Å
915	D	36.2	Very low	35.2	Very low	127 Å²	127	145.1 Å²	145.1	68%	0.679	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-21	-171	-86.1	-34.2	0	0	0	114.5
916	V	41.6	Very low	35.6	Very low	123 Å²	123	141.2 Å²	141.2	75%	0.745	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-40.1	-178.6	-178.5	0	0	0	0	111.5	C914 A918	C914-V916 VanDerWaalsContact C-N 3.31Å; C914-V916 PolarHBondContact O-N 2.79Å; V916-A918 VanDerWaalsContact C-N 3.32Å; V916-A918 PolarHBondContact O-N 3.02Å
917	W	32.5	Very low	36	Very low	158 Å²	158	142.8 Å²	142.8	60%	0.598	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-78.7	-16.8	-176.3	-150.5	58.2	0	0	0	113.3	W878 R919	W878-W917 HydrophobicContact CZ3-CH2 4.31Å; W878-W917 HydrophobicContact CZ3-CZ2 4.28Å; W917-R919 PolarHBondContact O-N 3.45Å
918	A	39.1	Very low	36.4	Very low	59 Å²	59	140.5 Å²	140.5	49%	0.488	71%	0.713	S	S	.	*	G	3₁₀ helix	trans	-73.7	-1	180	0	0	0	0	0	114.8	V916	V916-A918 VanDerWaalsContact C-N 3.32Å; V916-A918 PolarHBondContact O-N 3.02Å
919	R	38.5	Very low	36.8	Very low	230 Å²	230	139.4 Å²	139.4	87%	0.868	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-89.3	-17.6	-178.2	-80.7	-170	172.3	-165.3	-1.8	115.8	W917	W917-R919 PolarHBondContact O-N 3.45Å
920	E	41.4	Very low	37	Very low	163 Å²	163	140.2 Å²	140.2	76%	0.762	70%	0.701	S	S	*	*	S	Bend	trans	-108.2	-10	-169.8	-63.6	-172.6	147.7	0	0	114.8
921	N	36.7	Very low	37.3	Very low	90 Å²	90	139.4 Å²	139.4	48%	0.481	69%	0.686	S	S	.	*	S	Bend	trans	-126.6	130.9	-176.3	-74	-79.3	0	0	0	112.8	I923	N921-I923 VanDerWaalsContact C-N 3.33Å; N921-I923 PolarHBondContact O-N 2.04Å
922	F	32.8	Very low	37.7	Very low	225 Å²	225	138.1 Å²	138.1	99%	0.987	68%	0.677	S	S	*	*			trans	-84.9	56.5	-160.6	-144.7	-88.1	0	0	0	113.9
923	I	35.2	Very low	38	Very low	128 Å²	128	136.8 Å²	136.8	66%	0.656	67%	0.669	S	S	*	*			trans	-112.1	139.1	-175.6	-60.2	-178.7	0	0	0	111.5	N921 Q927	N921-I923 VanDerWaalsContact C-N 3.33Å; N921-I923 PolarHBondContact O-N 2.04Å; I923-Q927 VanDerWaalsContact CG2-OE1 3.28Å
924	K	35.3	Very low	38.2	Very low	170 Å²	170	137.8 Å²	137.8	74%	0.739	66%	0.662	S	S	*	*			trans	-69.4	136.2	-170.3	-73.3	-178.3	178.4	176.3	0	113	S926 Q927	K924-S926 PolarHBondContact O-N 2.79Å; K924-Q927 PolarHBondContact O-N 3.31Å
925	R	35.6	Very low	38.3	Very low	227 Å²	227	137.8 Å²	137.8	86%	0.857	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.4	-14	-176.4	-150.2	175.8	-168.9	179	2.7	116
926	S	41.1	Very low	38.8	Very low	85 Å²	85	135.8 Å²	135.8	59%	0.594	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-28.9	179.3	47.1	0	0	0	0	114.3	K924	K924-S926 PolarHBondContact O-N 2.79Å
927	Q	41	Very low	38.9	Very low	123 Å²	123	141.2 Å²	141.2	58%	0.575	68%	0.676	S	S	*	*	H	α-helix	trans	-76.1	-24.4	-174.8	-71.8	179.1	-39.6	0	0	113.6	I923 K924 W930	I923-Q927 VanDerWaalsContact CG2-OE1 3.28Å; K924-Q927 PolarHBondContact O-N 3.31Å; Q927-W930 PolarHBondContact O-N 3.5Å
928	L	38.8	Very low	39.2	Very low	109 Å²	109	140.4 Å²	140.4	57%	0.571	68%	0.68	S	S	*	*	H	α-helix	trans	-70	-30.3	178.7	-81.6	161.7	0	0	0	113.7	W930 S932	L928-W930 VanDerWaalsContact C-N 3.32Å; L928-S932 PolarHBondContact O-N 3.09Å
929	L	42.9	Very low	39.2	Very low	120 Å²	120	144.6 Å²	144.6	63%	0.628	69%	0.69	S	S	*	*	H	α-helix	trans	-70	-28.4	176.9	-88.8	161.6	0	0	0	113	S932 Q933	L929-S932 PolarHBondContact O-OG 3.32Å; L929-S932 VanDerWaalsContact O-OG 3.07Å; L929-Q933 PolarHBondContact O-N 3.07Å
930	W	38	Very low	39.3	Very low	156 Å²	156	139.9 Å²	139.9	59%	0.591	68%	0.68	S	S	*	*	H	α-helix	trans	-73.2	-41.2	178.4	-140.1	82.9	0	0	0	111	Q927 L928 S932 Q933 W934	Q927-W930 PolarHBondContact O-N 3.5Å; L928-W930 VanDerWaalsContact C-N 3.32Å; W930-S932 PolarHBondContact O-N 3.23Å; W930-Q933 PolarHBondContact O-N 2.9Å; W930-W934 AromaticContact CE3-CD1 3.9Å; W930-W934 HydrophobicContact CE3-CG 4.34Å; W930-W934 AromaticContact CH2-CD1 3.81Å; W930-W934 AromaticContact CH2-NE1 3.8Å; W930-W934 AromaticContact CZ3-CD1 3.36Å; W930-W934 HydrophobicContact CZ3-CG 4.03Å; W930-W934 AromaticContact CZ3-NE1 3.6Å; W930-W934 WeakPolarHBondContact O-CB 3.38Å; W930-W934 PolarHBondContact O-N 2.88Å
931	L	37.1	Very low	39.1	Very low	109 Å²	109	138.5 Å²	138.5	57%	0.571	68%	0.676	S	S	*	*	H	α-helix	trans	-62.5	-36.4	177.6	-82.1	162.4	0	0	0	113.4	W934 C935	L931-W934 PolarHBondContact O-N 3.13Å; L931-C935 PolarHBondContact O-N 3.39Å; L931-C935 VanDerWaalsContact O-N 3.15Å; L931-C935 PolarHBondContact O-SG 3.5Å
932	S	39.8	Very low	39.3	Very low	68 Å²	68	141.6 Å²	141.6	48%	0.476	69%	0.688	S	S	.	*	H	α-helix	trans	-70	-38.9	177.1	63.5	0	0	0	0	112.4	L928 L929 W930 C935 A936	L928-S932 PolarHBondContact O-N 3.09Å; L929-S932 PolarHBondContact O-OG 3.32Å; L929-S932 VanDerWaalsContact O-OG 3.07Å; W930-S932 PolarHBondContact O-N 3.23Å; S932-C935 PolarHBondContact O-N 2.98Å; S932-A936 PolarHBondContact O-N 3.23Å
933	Q	47.2	Very low	39.7	Very low	140 Å²	140	136 Å²	136	65%	0.654	67%	0.668	S	S	*	*	H	α-helix	trans	-70.9	-31.3	174.3	-70.1	-170.9	-16.1	0	0	113	L929 W930 C935 A936	L929-Q933 PolarHBondContact O-N 3.07Å; W930-Q933 PolarHBondContact O-N 2.9Å; Q933-C935 VanDerWaalsContact C-N 3.31Å; Q933-A936 PolarHBondContact O-N 3.12Å
934	W	38	Very low	40.1	Very low	182 Å²	182	136.6 Å²	136.6	69%	0.689	67%	0.669	S	S	*	*	H	α-helix	trans	-77.9	-12.1	176.1	-134.1	81.2	0	0	0	114	W930 L931	W930-W934 AromaticContact CE3-CD1 3.9Å; W930-W934 HydrophobicContact CE3-CG 4.34Å; W930-W934 AromaticContact CH2-CD1 3.81Å; W930-W934 AromaticContact CH2-NE1 3.8Å; W930-W934 AromaticContact CZ3-CD1 3.36Å; W930-W934 HydrophobicContact CZ3-CG 4.03Å; W930-W934 AromaticContact CZ3-NE1 3.6Å; W930-W934 WeakPolarHBondContact O-CB 3.38Å; W930-W934 PolarHBondContact O-N 2.88Å; L931-W934 PolarHBondContact O-N 3.13Å
935	C	35.5	Very low	40.4	Very low	102 Å²	102	134 Å²	134	69%	0.689	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-5.3	168.2	-62.9	0	0	0	0	113.2	L931 S932 Q933	L931-C935 PolarHBondContact O-N 3.39Å; L931-C935 VanDerWaalsContact O-N 3.15Å; L931-C935 PolarHBondContact O-SG 3.5Å; S932-C935 PolarHBondContact O-N 2.98Å; Q933-C935 VanDerWaalsContact C-N 3.31Å
936	A	46.9	Very low	40.8	Very low	85 Å²	85	126.3 Å²	126.3	70%	0.702	65%	0.647	S	S	*	*			trans	-102	9.5	176.6	0	0	0	0	0	112.9	S932 Q933	S932-A936 PolarHBondContact O-N 3.23Å; Q933-A936 PolarHBondContact O-N 3.12Å
937	K	43.5	Very low	40.8	Very low	236 Å²	236	130 Å²	130	100%	1.026	65%	0.652	S	S	*	*			trans	-125.1	0	169.7	-79.8	-172.3	172.2	-177.1	0	109.8

Retrieved 937 of 937 residues in 312.8 ms (Link to these results)

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