A0A3Q0KP96_SCHMA Loading...

Putative adamts (A disintegrin and metalloprotease)

AlphaFold DB , UniProt , Accession A0A3Q0KP96, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 661 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37	Very low	43.2	Very low	235 Å²	235	142 Å²	142	100%	1.158	71%	0.706	S	S	*	*				0	-8.2	0	-77.2	-174.9	172.1	0	0	114.9
2	H	30.9	Very low	43.8	Very low	174 Å²	174	144.1 Å²	144.1	81%	0.806	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	3.4	-178.1	-101.3	-70.5	0	0	0	116.9
3	F	34.1	Very low	44.4	Very low	202 Å²	202	137.6 Å²	137.6	89%	0.886	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-7.8	-177.9	-102.3	-87	0	0	0	115.4
4	Q	39.6	Very low	44.9	Very low	173 Å²	173	134 Å²	134	81%	0.808	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-11.3	-174.3	-137.3	131.7	-20.8	0	0	114.5
5	L	36.4	Very low	45.6	Very low	127 Å²	127	129.5 Å²	129.5	67%	0.665	65%	0.646	S	S	*	*	H	α-helix	trans	-88.9	1.4	-174.5	-75.8	169.8	0	0	0	115.3
6	N	46.8	Very low	45.9	Very low	115 Å²	115	125.6 Å²	125.6	62%	0.615	63%	0.625	S	S	*	*	H	α-helix	trans	-93.3	-26.5	-176.3	-126.3	-9.1	0	0	0	114.4	I10	N6-I10 WeakPolarHBondContact O-CD1 3.32Å; N6-I10 VanDerWaalsContact O-CG1 3.23Å; N6-I10 WeakPolarHBondContact O-CG1 3.45Å; N6-I10 PolarHBondContact O-N 3.47Å
7	I	48.3	Very low	46	Very low	119 Å²	119	126.6 Å²	126.6	61%	0.61	63%	0.625	S	S	*	*	H	α-helix	trans	-78.4	-41	-175.1	-64.5	176.8	0	0	0	111.6	S9 I10 I11	I7-S9 VanDerWaalsContact C-N 3.33Å; I7-S9 PolarHBondContact O-N 3.5Å; I7-I10 PolarHBondContact O-N 3.44Å; I7-I11 HydrophobicContact CG2-CD1 3.73Å; I7-I11 HydrophobicContact CG2-CG1 4.35Å; I7-I11 WeakPolarHBondContact O-CG1 3.35Å; I7-I11 PolarHBondContact O-N 3.31Å
8	E	46.4	Very low	45.8	Very low	150 Å²	150	127.2 Å²	127.2	70%	0.701	62%	0.624	S	S	*	*	H	α-helix	trans	-63.9	-38.2	177.9	-72.2	-165.8	157.1	0	0	112.2	I11 Y12	E8-I11 PolarHBondContact O-N 3.5Å; E8-Y12 VanDerWaalsContact O-CB 3.29Å; E8-Y12 WeakPolarHBondContact O-CB 3.39Å; E8-Y12 PolarHBondContact O-N 3.21Å
9	S	48.7	Very low	45.7	Very low	77 Å²	77	127.4 Å²	127.4	54%	0.538	62%	0.621	S	S	.	*	H	α-helix	trans	-67	-38.9	177.7	-170.3	0	0	0	0	112.4	I7 Y12 S13	I7-S9 VanDerWaalsContact C-N 3.33Å; I7-S9 PolarHBondContact O-N 3.5Å; S9-Y12 PolarHBondContact O-N 3.43Å; S9-S13 VanDerWaalsContact O-CB 3.27Å; S9-S13 WeakPolarHBondContact O-CB 3.3Å; S9-S13 PolarHBondContact O-N 3.2Å
10	I	52.6	Low	45.5	Very low	92 Å²	92	129.9 Å²	129.9	47%	0.472	62%	0.623	S	S	.	*	H	α-helix	trans	-66.9	-44.4	176.2	-67.1	167.2	0	0	0	110.5	N6 I7 S13 I14	N6-I10 WeakPolarHBondContact O-CD1 3.32Å; N6-I10 VanDerWaalsContact O-CG1 3.23Å; N6-I10 WeakPolarHBondContact O-CG1 3.45Å; N6-I10 PolarHBondContact O-N 3.47Å; I7-I10 PolarHBondContact O-N 3.44Å; I10-S13 PolarHBondContact O-N 3.45Å; I10-I14 HydrophobicContact CG2-CD1 3.77Å; I10-I14 WeakPolarHBondContact O-CB 3.5Å; I10-I14 WeakPolarHBondContact O-CD1 3.41Å; I10-I14 VanDerWaalsContact O-CG1 3.22Å; I10-I14 WeakPolarHBondContact O-CG1 3.48Å; I10-I14 PolarHBondContact O-N 3.46Å
11	I	54.4	Low	45.4	Very low	98 Å²	98	127.8 Å²	127.8	50%	0.503	62%	0.618	S	S	.	*	H	α-helix	trans	-64.8	-43.7	177	-66.3	172.6	0	0	0	110.4	I7 E8 S13 I14 V15	I7-I11 HydrophobicContact CG2-CD1 3.73Å; I7-I11 HydrophobicContact CG2-CG1 4.35Å; I7-I11 WeakPolarHBondContact O-CG1 3.35Å; I7-I11 PolarHBondContact O-N 3.31Å; E8-I11 PolarHBondContact O-N 3.5Å; I11-S13 PolarHBondContact O-N 3.39Å; I11-I14 PolarHBondContact O-N 3.48Å; I11-V15 HydrophobicContact CG2-CG2 4.26Å; I11-V15 WeakPolarHBondContact O-CB 3.47Å; I11-V15 VanDerWaalsContact O-CG2 3.24Å; I11-V15 WeakPolarHBondContact O-CG2 3.23Å; I11-V15 PolarHBondContact O-N 3.4Å
12	Y	50.1	Low	45.6	Very low	167 Å²	167	121.9 Å²	121.9	66%	0.655	59%	0.591	S	S	*	*	H	α-helix	trans	-64	-39.9	177.7	-152.9	-84.5	0	0	0	111.7	E8 S9 V15 E16	E8-Y12 VanDerWaalsContact O-CB 3.29Å; E8-Y12 WeakPolarHBondContact O-CB 3.39Å; E8-Y12 PolarHBondContact O-N 3.21Å; S9-Y12 PolarHBondContact O-N 3.43Å; Y12-V15 PolarHBondContact O-N 3.39Å; Y12-E16 HydrophobicContact CD1-CG 4.25Å; Y12-E16 HydrophobicContact CE1-CG 4.07Å; Y12-E16 WeakPolarHBondContact O-CB 3.03Å; Y12-E16 PolarHBondContact O-N 3.24Å
13	S	51.8	Low	46	Very low	60 Å²	60	120 Å²	120	42%	0.42	58%	0.582	S	S	.	*	H	α-helix	trans	-65.1	-40.2	175.6	-170.5	0	0	0	0	112.6	S9 I10 I11 K17	S9-S13 VanDerWaalsContact O-CB 3.27Å; S9-S13 WeakPolarHBondContact O-CB 3.3Å; S9-S13 PolarHBondContact O-N 3.2Å; I10-S13 PolarHBondContact O-N 3.45Å; I11-S13 PolarHBondContact O-N 3.39Å; S13-K17 WeakPolarHBondContact O-CB 3.47Å; S13-K17 WeakPolarHBondContact O-CG 3.31Å; S13-K17 PolarHBondContact O-N 3.45Å
14	I	52	Low	46.3	Very low	87 Å²	87	114.9 Å²	114.9	45%	0.446	57%	0.568	S	S	.	*	H	α-helix	trans	-66.2	-44.2	174.9	-68	166.3	0	0	0	110	I10 I11 K17 F18	I10-I14 HydrophobicContact CG2-CD1 3.77Å; I10-I14 WeakPolarHBondContact O-CB 3.5Å; I10-I14 WeakPolarHBondContact O-CD1 3.41Å; I10-I14 VanDerWaalsContact O-CG1 3.22Å; I10-I14 WeakPolarHBondContact O-CG1 3.48Å; I10-I14 PolarHBondContact O-N 3.46Å; I11-I14 PolarHBondContact O-N 3.48Å; I14-K17 PolarHBondContact O-N 3.38Å; I14-F18 HydrophobicContact CG2-CD2 3.84Å; I14-F18 HydrophobicContact CG2-CE2 4.06Å; I14-F18 WeakPolarHBondContact O-CB 3.28Å; I14-F18 WeakPolarHBondContact O-CD2 3.44Å; I14-F18 PolarHBondContact O-N 3.41Å
15	V	54.3	Low	46.2	Very low	67 Å²	67	114.7 Å²	114.7	41%	0.406	56%	0.564	S	S	.	*	H	α-helix	trans	-67.3	-40.1	178.9	173.3	0	0	0	0	111.9	I11 Y12 F18 K19	I11-V15 HydrophobicContact CG2-CG2 4.26Å; I11-V15 WeakPolarHBondContact O-CB 3.47Å; I11-V15 VanDerWaalsContact O-CG2 3.24Å; I11-V15 WeakPolarHBondContact O-CG2 3.23Å; I11-V15 PolarHBondContact O-N 3.4Å; Y12-V15 PolarHBondContact O-N 3.39Å; V15-F18 PolarHBondContact O-N 3.4Å; V15-K19 WeakPolarHBondContact O-CB 3.36Å; V15-K19 WeakPolarHBondContact O-CG 3.21Å; V15-K19 PolarHBondContact O-N 2.94Å
16	E	51.2	Low	45.9	Very low	67 Å²	67	115.9 Å²	115.9	31%	0.313	56%	0.564	S	S	.	*	H	α-helix	trans	-64.1	-42.9	172.8	-103.6	-68.9	130.6	0	0	111.4	Y12 F18 K19 R20	Y12-E16 HydrophobicContact CD1-CG 4.25Å; Y12-E16 HydrophobicContact CE1-CG 4.07Å; Y12-E16 WeakPolarHBondContact O-CB 3.03Å; Y12-E16 PolarHBondContact O-N 3.24Å; E16-F18 VanDerWaalsContact C-N 3.34Å; E16-F18 PolarHBondContact O-N 3.3Å; E16-K19 PolarHBondContact O-N 2.92Å; E16-R20 WeakPolarHBondContact O-CB 3.45Å; E16-R20 WeakPolarHBondContact O-CG 3.49Å; E16-R20 PolarHBondContact O-N 2.97Å; E16-R20 IonicContact OE2-CZ 2.9Å; E16-R20 IonicContact OE2-NE 3.71Å; E16-R20 PolarHBondContact OE2-NE 3.17Å; E16-R20 IonicContact OE2-NH2 3.1Å
17	K	47.1	Very low	45.2	Very low	142 Å²	142	117.7 Å²	117.7	62%	0.617	57%	0.571	S	S	*	*	H	α-helix	trans	-61.1	-42	173.3	-83.6	179.2	176.8	175.4	0	111.5	S13 I14 T21	S13-K17 WeakPolarHBondContact O-CB 3.47Å; S13-K17 WeakPolarHBondContact O-CG 3.31Å; S13-K17 PolarHBondContact O-N 3.45Å; I14-K17 PolarHBondContact O-N 3.38Å; K17-T21 WeakPolarHBondContact O-CB 3.06Å; K17-T21 PolarHBondContact O-N 2.9Å; K17-T21 PolarHBondContact O-OG1 3.07Å
18	F	43.3	Very low	44.3	Very low	138 Å²	138	120.2 Å²	120.2	61%	0.605	58%	0.578	S	S	*	*	H	α-helix	trans	-66.1	-41.7	175.1	-96.3	-84.4	0	0	0	112.5	I14 V15 E16 T21 L22	I14-F18 HydrophobicContact CG2-CD2 3.84Å; I14-F18 HydrophobicContact CG2-CE2 4.06Å; I14-F18 WeakPolarHBondContact O-CB 3.28Å; I14-F18 WeakPolarHBondContact O-CD2 3.44Å; I14-F18 PolarHBondContact O-N 3.41Å; V15-F18 PolarHBondContact O-N 3.4Å; E16-F18 VanDerWaalsContact C-N 3.34Å; E16-F18 PolarHBondContact O-N 3.3Å; F18-T21 PolarHBondContact O-N 3.28Å; F18-L22 PolarHBondContact O-N 3.24Å
19	K	42.5	Very low	43.5	Very low	131 Å²	131	121.2 Å²	121.2	57%	0.57	58%	0.582	S	S	*	*	H	α-helix	trans	-62.5	-45.5	175.1	-81.2	-177.7	179.5	176.7	0	111.7	V15 E16 T21 L22 H23	V15-K19 WeakPolarHBondContact O-CB 3.36Å; V15-K19 WeakPolarHBondContact O-CG 3.21Å; V15-K19 PolarHBondContact O-N 2.94Å; E16-K19 PolarHBondContact O-N 2.92Å; K19-T21 VanDerWaalsContact C-N 3.32Å; K19-T21 PolarHBondContact O-N 3.23Å; K19-L22 PolarHBondContact O-N 3.37Å; K19-H23 WeakPolarHBondContact O-CB 3.14Å; K19-H23 PolarHBondContact O-N 3.41Å
20	R	43	Very low	42.4	Very low	177 Å²	177	124.7 Å²	124.7	67%	0.668	59%	0.594	S	S	*	*	H	α-helix	trans	-63.8	-36.1	176.5	-72.7	-179.5	-174.8	-145.7	-2.9	112.3	E16 T24	E16-R20 WeakPolarHBondContact O-CB 3.45Å; E16-R20 WeakPolarHBondContact O-CG 3.49Å; E16-R20 PolarHBondContact O-N 2.97Å; E16-R20 IonicContact OE2-CZ 2.9Å; E16-R20 IonicContact OE2-NE 3.71Å; E16-R20 PolarHBondContact OE2-NE 3.17Å; E16-R20 IonicContact OE2-NH2 3.1Å; R20-T24 PolarHBondContact O-N 3.4Å; R20-T24 PolarHBondContact O-OG1 3.08Å
21	T	43.6	Very low	41.3	Very low	85 Å²	85	127.8 Å²	127.8	52%	0.521	61%	0.612	S	S	.	*	H	α-helix	trans	-72.4	-37.6	177.7	-46.9	0	0	0	0	111.9	K17 F18 K19 T24 F25	K17-T21 WeakPolarHBondContact O-CB 3.06Å; K17-T21 PolarHBondContact O-N 2.9Å; K17-T21 PolarHBondContact O-OG1 3.07Å; F18-T21 PolarHBondContact O-N 3.28Å; K19-T21 VanDerWaalsContact C-N 3.32Å; K19-T21 PolarHBondContact O-N 3.23Å; T21-T24 WeakPolarHBondContact CA-OG1 3.28Å; T21-T24 PolarHBondContact O-OG1 3.48Å; T21-F25 PolarHBondContact O-N 3.16Å; T21-F25 VanDerWaalsContact O-N 3.13Å
22	L	40.7	Very low	40.2	Very low	112 Å²	112	134 Å²	134	59%	0.586	63%	0.63	S	S	*	*	H	α-helix	trans	-71.7	-34.2	173.4	-102.8	109.1	0	0	0	112.8	F18 K19 F25 K26	F18-L22 PolarHBondContact O-N 3.24Å; K19-L22 PolarHBondContact O-N 3.37Å; L22-F25 PolarHBondContact O-N 2.87Å; L22-K26 PolarHBondContact O-N 3.31Å
23	H	39.2	Very low	39.2	Very low	134 Å²	134	130.9 Å²	130.9	62%	0.62	63%	0.633	S	S	*	*	H	α-helix	trans	-71.2	-35.7	177.2	-135.5	-82.9	0	0	0	112	K19 M27	K19-H23 WeakPolarHBondContact O-CB 3.14Å; K19-H23 PolarHBondContact O-N 3.41Å; H23-M27 PolarHBondContact O-N 3.5Å
24	T	41.4	Very low	38.2	Very low	95 Å²	95	133.2 Å²	133.2	58%	0.583	65%	0.645	S	S	*	*	H	α-helix	trans	-68.9	-35	172.8	36.5	0	0	0	0	112.2	R20 T21 M27	R20-T24 PolarHBondContact O-N 3.4Å; R20-T24 PolarHBondContact O-OG1 3.08Å; T21-T24 WeakPolarHBondContact CA-OG1 3.28Å; T21-T24 PolarHBondContact O-OG1 3.48Å; T24-M27 PolarHBondContact O-N 3.26Å
25	F	35.8	Very low	37.5	Very low	168 Å²	168	138.5 Å²	138.5	74%	0.737	66%	0.664	S	S	*	*	H	α-helix	trans	-72.1	-32.8	175.6	-131.3	-95.3	0	0	0	113.2	T21 L22 M27 F28	T21-F25 PolarHBondContact O-N 3.16Å; T21-F25 VanDerWaalsContact O-N 3.13Å; L22-F25 PolarHBondContact O-N 2.87Å; F25-M27 VanDerWaalsContact C-N 3.27Å; F25-M27 PolarHBondContact O-N 2.84Å; F25-F28 PolarHBondContact O-N 3.41Å
26	K	31.6	Very low	36.8	Very low	152 Å²	152	147.2 Å²	147.2	66%	0.661	69%	0.69	S	S	*	*	H	α-helix	trans	-67.3	-23.3	175	-100.9	-178.4	175.7	178.5	0	114	L22 F28	L22-K26 PolarHBondContact O-N 3.31Å; K26-F28 VanDerWaalsContact C-N 3.35Å
27	M	32.2	Very low	36	Very low	153 Å²	153	147.3 Å²	147.3	75%	0.754	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-17.6	179.6	-73.8	-69	-78.1	0	0	113.4	H23 T24 F25	H23-M27 PolarHBondContact O-N 3.5Å; T24-M27 PolarHBondContact O-N 3.26Å; F25-M27 VanDerWaalsContact C-N 3.27Å; F25-M27 PolarHBondContact O-N 2.84Å
28	F	29.1	Very low	35.6	Very low	172 Å²	172	145.2 Å²	145.2	75%	0.754	69%	0.693	S	S	*	*	S	Bend	trans	-98.6	1.5	-166.6	-128.6	-91.1	0	0	0	116.3	F25 K26	F25-F28 PolarHBondContact O-N 3.41Å; K26-F28 VanDerWaalsContact C-N 3.35Å
29	Q	28.8	Very low	35.2	Very low	171 Å²	171	148.3 Å²	148.3	80%	0.799	70%	0.702	S	S	*	*	S	Bend	trans	-142.3	27	-177	-72.7	-63.1	-51.3	0	0	115
30	L	26.8	Very low	35.1	Very low	150 Å²	150	145.9 Å²	145.9	79%	0.785	70%	0.702	S	S	*	*			trans	-109.2	83.6	171.9	-74.8	168.4	0	0	0	110.4
31	N	27.8	Very low	34.9	Very low	158 Å²	158	144.5 Å²	144.5	85%	0.845	70%	0.698	S	S	*	*			trans	-135.6	130.7	158.4	-102.5	-24.7	0	0	0	110.1
32	Y	31.2	Very low	34.6	Very low	227 Å²	227	145.9 Å²	145.9	89%	0.89	70%	0.698	S	S	*	*	S	Bend	trans	81.5	87.5	172	-91.8	-98.1	0	0	0	120.1
33	S	30	Very low	34.7	Very low	103 Å²	103	148.8 Å²	148.8	72%	0.72	71%	0.706	S	S	*	*				66	79.2	127.6	-137.9	0	0	0	0	120.4
34	V	31.2	Very low	35	Very low	109 Å²	109	146.6 Å²	146.6	66%	0.661	70%	0.698	S	S	*	*			trans	-138.8	74.8	142.5	-172.6	0	0	0	0	108.7	R36	V34-R36 PolarHBondContact O-N 3.24Å
35	K	37.3	Very low	34.8	Very low	197 Å²	197	145.3 Å²	145.3	86%	0.857	69%	0.688	S	S	*	*			trans	-86	8	-176	-118.3	-177.8	-175.4	-178.6	0	115.1
36	R	38.5	Very low	35.1	Very low	250 Å²	250	144.3 Å²	144.3	94%	0.943	69%	0.685	S	S	*	*	S	Bend	trans	-111.3	-6.8	180	-107.1	-179.6	-176.1	178.2	1.5	116.7	V34	V34-R36 PolarHBondContact O-N 3.24Å
37	S	34.3	Very low	35.6	Very low	70 Å²	70	143.9 Å²	143.9	49%	0.49	69%	0.685	S	S	.	*	S	Bend	trans	-101.3	-1.8	-179	-44.6	0	0	0	0	114.2
38	L	38.8	Very low	36.2	Very low	97 Å²	97	140.4 Å²	140.4	51%	0.508	67%	0.669	S	S	.	*	H	α-helix	trans	-71.1	-30.2	-173.5	-95.8	138.2	0	0	0	114.5	Y41 Q42	L38-Y41 PolarHBondContact O-N 3.08Å; L38-Q42 WeakPolarHBondContact O-CG 3.19Å; L38-Q42 PolarHBondContact O-N 2.05Å; L38-Q42 VanDerWaalsContact O-N 3.13Å
39	Y	36.2	Very low	36.7	Very low	204 Å²	204	136.3 Å²	136.3	80%	0.8	66%	0.655	S	S	*	*	H	α-helix	trans	-74.8	-30.8	-175.9	-117.2	-91.9	0	0	0	113.4
40	S	38.8	Very low	37.5	Very low	80 Å²	80	130.7 Å²	130.7	56%	0.559	63%	0.634	S	S	*	*	H	α-helix	trans	-76.7	-36	173.3	135.5	0	0	0	0	111.5	Q42 K43	S40-Q42 PolarHBondContact O-N 2.99Å; S40-K43 PolarHBondContact O-N 3.28Å
41	Y	38.9	Very low	38.3	Very low	148 Å²	148	125.8 Å²	125.8	58%	0.58	62%	0.615	S	S	*	*	H	α-helix	trans	-68.5	-31.6	178.5	-116.1	-90.8	0	0	0	113.9	L38 K43 I44 N45	L38-Y41 PolarHBondContact O-N 3.08Å; Y41-K43 PolarHBondContact O-N 2.88Å; Y41-I44 PolarHBondContact O-N 3.01Å; Y41-N45 WeakPolarHBondContact O-CB 3.28Å; Y41-N45 PolarHBondContact O-N 3.45Å
42	Q	38.7	Very low	39.2	Very low	114 Å²	114	123 Å²	123	53%	0.533	60%	0.6	S	S	.	*	H	α-helix	trans	-64.5	-37.1	177.5	-81.3	-178.2	-25.7	0	0	112.8	L38 S40 H46	L38-Q42 WeakPolarHBondContact O-CG 3.19Å; L38-Q42 PolarHBondContact O-N 2.05Å; L38-Q42 VanDerWaalsContact O-N 3.13Å; S40-Q42 PolarHBondContact O-N 2.99Å; Q42-H46 PolarHBondContact O-N 2.97Å; Q42-H46 VanDerWaalsContact O-N 3.09Å
43	K	43.1	Very low	40.1	Very low	172 Å²	172	117.1 Å²	117.1	75%	0.748	58%	0.583	S	S	*	*	H	α-helix	trans	-72.5	-36.3	180	-148.5	172	-173.2	177.9	0	112	S40 Y41 Q47	S40-K43 PolarHBondContact O-N 3.28Å; Y41-K43 PolarHBondContact O-N 2.88Å; K43-Q47 PolarHBondContact O-N 3.4Å
44	I	44.3	Very low	41	Very low	88 Å²	88	119.2 Å²	119.2	45%	0.451	58%	0.579	S	S	.	*	H	α-helix	trans	-70.6	-41.1	175.3	-63	172	0	0	0	110.7	Y41 H46 Q47 I48	Y41-I44 PolarHBondContact O-N 3.01Å; I44-H46 PolarHBondContact O-N 3.23Å; I44-Q47 PolarHBondContact O-N 2.7Å; I44-I48 HydrophobicContact CG2-CD1 3.63Å; I44-I48 HydrophobicContact CG2-CG1 4.33Å; I44-I48 WeakPolarHBondContact O-CG1 3.21Å; I44-I48 PolarHBondContact O-N 3.4Å
45	N	36.9	Very low	41.8	Very low	69 Å²	69	120.7 Å²	120.7	37%	0.369	58%	0.577	S	S	.	*	H	α-helix	trans	-66.5	-31.9	176.4	-86.7	-20.9	0	0	0	113.4	Y41 I48 N49	Y41-N45 WeakPolarHBondContact O-CB 3.28Å; Y41-N45 PolarHBondContact O-N 3.45Å; N45-I48 PolarHBondContact O-N 3.39Å; N45-N49 WeakPolarHBondContact O-CB 3.49Å; N45-N49 PolarHBondContact O-N 3.16Å; N45-N49 PolarHBondContact O-ND2 3.12Å
46	H	43.9	Very low	42.8	Very low	146 Å²	146	114.9 Å²	114.9	68%	0.676	56%	0.561	S	S	*	*	H	α-helix	trans	-68.4	-37.3	175.3	-162.9	-70.3	0	0	0	112.2	Q42 I44 S50	Q42-H46 PolarHBondContact O-N 2.97Å; Q42-H46 VanDerWaalsContact O-N 3.09Å; I44-H46 PolarHBondContact O-N 3.23Å; H46-S50 WeakPolarHBondContact O-CB 3.4Å; H46-S50 PolarHBondContact O-N 2.92Å; H46-S50 VanDerWaalsContact O-N 3.09Å
47	Q	42	Very low	43.7	Very low	143 Å²	143	110 Å²	110	67%	0.668	55%	0.547	S	S	*	.	H	α-helix	trans	-68.1	-43.3	174	-72.5	-78	-5	0	0	111.5	K43 I44 A51	K43-Q47 PolarHBondContact O-N 3.4Å; I44-Q47 PolarHBondContact O-N 2.7Å; Q47-A51 PolarHBondContact O-N 3.12Å; Q47-A51 VanDerWaalsContact O-N 3.14Å
48	I	44.6	Very low	45.2	Very low	81 Å²	81	111.6 Å²	111.6	42%	0.415	55%	0.549	S	S	.	.	H	α-helix	trans	-67.8	-41.4	178.2	-68.6	173.2	0	0	0	111.7	I44 N45 A51 L52	I44-I48 HydrophobicContact CG2-CD1 3.63Å; I44-I48 HydrophobicContact CG2-CG1 4.33Å; I44-I48 WeakPolarHBondContact O-CG1 3.21Å; I44-I48 PolarHBondContact O-N 3.4Å; N45-I48 PolarHBondContact O-N 3.39Å; I48-A51 PolarHBondContact O-N 3.21Å; I48-L52 HydrophobicContact CG2-CD1 3.64Å; I48-L52 WeakPolarHBondContact O-CB 3.22Å; I48-L52 PolarHBondContact O-N 3.39Å
49	N	39.9	Very low	46.5	Very low	86 Å²	86	111.8 Å²	111.8	46%	0.46	55%	0.549	S	S	.	.	H	α-helix	trans	-69	-37.5	178.1	-74.7	-25.2	0	0	0	112.3	N45 A51 L52 I53	N45-N49 WeakPolarHBondContact O-CB 3.49Å; N45-N49 PolarHBondContact O-N 3.16Å; N45-N49 PolarHBondContact O-ND2 3.12Å; N49-A51 VanDerWaalsContact C-N 3.34Å; N49-A51 PolarHBondContact O-N 3.42Å; N49-L52 PolarHBondContact O-N 3.17Å; N49-I53 WeakPolarHBondContact O-CB 2.91Å; N49-I53 WeakPolarHBondContact O-CD1 3.45Å; N49-I53 WeakPolarHBondContact O-CG1 3.36Å; N49-I53 PolarHBondContact O-N 3.37Å
50	S	44.4	Very low	47.8	Very low	52 Å²	52	105.3 Å²	105.3	36%	0.364	53%	0.534	S	S	.	.	H	α-helix	trans	-59	-44.8	171.3	165	0	0	0	0	111.7	H46 K54	H46-S50 WeakPolarHBondContact O-CB 3.4Å; H46-S50 PolarHBondContact O-N 2.92Å; H46-S50 VanDerWaalsContact O-N 3.09Å; S50-K54 WeakPolarHBondContact O-CG 3.2Å; S50-K54 PolarHBondContact O-N 2.79Å; S50-K54 VanDerWaalsContact O-N 3.1Å
51	A	44.3	Very low	49	Very low	47 Å²	47	107.1 Å²	107.1	39%	0.388	54%	0.535	S	S	.	.	H	α-helix	trans	-69.3	-36.3	177.7	0	0	0	0	0	113	Q47 I48 N49 K55	Q47-A51 PolarHBondContact O-N 3.12Å; Q47-A51 VanDerWaalsContact O-N 3.14Å; I48-A51 PolarHBondContact O-N 3.21Å; N49-A51 VanDerWaalsContact C-N 3.34Å; N49-A51 PolarHBondContact O-N 3.42Å; A51-K55 WeakPolarHBondContact O-CB 3.01Å; A51-K55 WeakPolarHBondContact O-CG 3.49Å; A51-K55 PolarHBondContact O-N 3.29Å
52	L	45.8	Very low	50.3	Low	100 Å²	100	104.3 Å²	104.3	52%	0.524	53%	0.53	S	S	.	.	H	α-helix	trans	-71.3	-37.6	176.2	-90.5	156.2	0	0	0	112.5	I48 N49 K55 S56	I48-L52 HydrophobicContact CG2-CD1 3.64Å; I48-L52 WeakPolarHBondContact O-CB 3.22Å; I48-L52 PolarHBondContact O-N 3.39Å; N49-L52 PolarHBondContact O-N 3.17Å; L52-K55 PolarHBondContact O-N 3.14Å; L52-S56 WeakPolarHBondContact O-CB 3.2Å; L52-S56 PolarHBondContact O-N 3.29Å
53	I	51.3	Low	51.6	Low	104 Å²	104	102.2 Å²	102.2	53%	0.533	52%	0.524	S	S	.	.	H	α-helix	trans	-66.8	-43	175.3	-66.9	162.6	0	0	0	109.8	N49 S56 F57	N49-I53 WeakPolarHBondContact O-CB 2.91Å; N49-I53 WeakPolarHBondContact O-CD1 3.45Å; N49-I53 WeakPolarHBondContact O-CG1 3.36Å; N49-I53 PolarHBondContact O-N 3.37Å; I53-S56 PolarHBondContact O-N 3.27Å; I53-F57 HydrophobicContact CG2-CD2 4.2Å; I53-F57 HydrophobicContact CG2-CE2 4.39Å; I53-F57 WeakPolarHBondContact O-CD2 3.35Å; I53-F57 PolarHBondContact O-N 3.14Å
54	K	48.4	Very low	52.4	Low	147 Å²	147	96.7 Å²	96.7	64%	0.639	51%	0.507	S	S	*	.	H	α-helix	trans	-63.9	-43.1	174.6	-74.2	-177.9	178.5	-176.2	0	112.6	S50 F57 I58	S50-K54 WeakPolarHBondContact O-CG 3.2Å; S50-K54 PolarHBondContact O-N 2.79Å; S50-K54 VanDerWaalsContact O-N 3.1Å; K54-F57 PolarHBondContact O-N 2.81Å; K54-I58 WeakPolarHBondContact O-CG1 2.8Å; K54-I58 PolarHBondContact O-N 2.53Å
55	K	48.5	Very low	52.9	Low	139 Å²	139	96.7 Å²	96.7	60%	0.604	51%	0.508	S	S	*	.	H	α-helix	trans	-68.7	-35.9	176.5	-76.9	-177.8	178.3	-176	0	112.7	A51 L52 F57 I58 I59	A51-K55 WeakPolarHBondContact O-CB 3.01Å; A51-K55 WeakPolarHBondContact O-CG 3.49Å; A51-K55 PolarHBondContact O-N 3.29Å; L52-K55 PolarHBondContact O-N 3.14Å; K55-F57 VanDerWaalsContact C-N 3.34Å; K55-I58 PolarHBondContact O-N 3.46Å; K55-I59 WeakPolarHBondContact O-CB 3.14Å; K55-I59 WeakPolarHBondContact O-CD1 3.33Å; K55-I59 VanDerWaalsContact O-CG1 3.22Å; K55-I59 WeakPolarHBondContact O-CG1 3.34Å; K55-I59 PolarHBondContact O-N 2.78Å
56	S	57.8	Low	53.5	Low	76 Å²	76	97.6 Å²	97.6	53%	0.531	51%	0.512	S	S	.	.	H	α-helix	trans	-67.8	-34.2	176.1	-167.1	0	0	0	0	111.9	L52 I53 S60	L52-S56 WeakPolarHBondContact O-CB 3.2Å; L52-S56 PolarHBondContact O-N 3.29Å; I53-S56 PolarHBondContact O-N 3.27Å; S56-S60 WeakPolarHBondContact O-CB 3.48Å; S56-S60 PolarHBondContact O-N 3.47Å
57	F	56.6	Low	53.7	Low	148 Å²	148	95.8 Å²	95.8	65%	0.649	51%	0.506	S	S	*	.	H	α-helix	trans	-66	-41.8	171.3	-99.6	-85.5	0	0	0	112.1	I53 K54 K55 S60 M61	I53-F57 HydrophobicContact CG2-CD2 4.2Å; I53-F57 HydrophobicContact CG2-CE2 4.39Å; I53-F57 WeakPolarHBondContact O-CD2 3.35Å; I53-F57 PolarHBondContact O-N 3.14Å; K54-F57 PolarHBondContact O-N 2.81Å; K55-F57 VanDerWaalsContact C-N 3.34Å; F57-S60 PolarHBondContact O-N 3.14Å; F57-M61 WeakPolarHBondContact O-CB 3.07Å; F57-M61 VanDerWaalsContact O-CG 3.28Å; F57-M61 WeakPolarHBondContact O-CG 3.04Å; F57-M61 PolarHBondContact O-N 3.29Å
58	I	66.9	Low	53.9	Low	102 Å²	102	95.3 Å²	95.3	52%	0.523	51%	0.506	S	S	.	.	H	α-helix	trans	-67.4	-43.2	177.7	-63.5	164.4	0	0	0	110.9	K54 K55 M61 L62	K54-I58 WeakPolarHBondContact O-CG1 2.8Å; K54-I58 PolarHBondContact O-N 2.53Å; K55-I58 PolarHBondContact O-N 3.46Å; I58-M61 PolarHBondContact O-N 2.9Å; I58-L62 HydrophobicContact CG2-CD1 3.82Å; I58-L62 HydrophobicContact CG2-CG 4.39Å; I58-L62 WeakPolarHBondContact O-CB 3.23Å; I58-L62 VanDerWaalsContact O-CG 3.24Å; I58-L62 WeakPolarHBondContact O-CG 3.07Å; I58-L62 PolarHBondContact O-N 3.17Å
59	I	65.5	Low	53.9	Low	102 Å²	102	98.3 Å²	98.3	52%	0.523	52%	0.518	S	S	.	.	H	α-helix	trans	-67.9	-39.2	177.4	-64.9	163.3	0	0	0	110.7	K55 L62 V63	K55-I59 WeakPolarHBondContact O-CB 3.14Å; K55-I59 WeakPolarHBondContact O-CD1 3.33Å; K55-I59 VanDerWaalsContact O-CG1 3.22Å; K55-I59 WeakPolarHBondContact O-CG1 3.34Å; K55-I59 PolarHBondContact O-N 2.78Å; I59-L62 PolarHBondContact O-N 3.42Å; I59-V63 HydrophobicContact CG2-CG2 4.12Å; I59-V63 VanDerWaalsContact O-CB 3.3Å; I59-V63 WeakPolarHBondContact O-CB 3.36Å; I59-V63 WeakPolarHBondContact O-CG2 3.16Å; I59-V63 PolarHBondContact O-N 3.11Å
60	S	63.7	Low	54.1	Low	68 Å²	68	100 Å²	100	48%	0.476	53%	0.526	S	S	.	.	H	α-helix	trans	-63.6	-43.1	174	-173.8	0	0	0	0	111.4	S56 F57 V63 S64	S56-S60 WeakPolarHBondContact O-CB 3.48Å; S56-S60 PolarHBondContact O-N 3.47Å; F57-S60 PolarHBondContact O-N 3.14Å; S60-V63 PolarHBondContact O-N 2.01Å; S60-S64 VanDerWaalsContact O-CB 3.25Å; S60-S64 WeakPolarHBondContact O-CB 3.43Å; S60-S64 PolarHBondContact O-N 3.25Å; S60-S64 PolarHBondContact O-OG 2.96Å
61	M	63.4	Low	54	Low	117 Å²	117	101.8 Å²	101.8	58%	0.576	54%	0.538	S	S	*	.	H	α-helix	trans	-64.1	-43.7	175.7	-77.7	-75.2	-70.4	0	0	111.3	F57 I58 S64 L65	F57-M61 WeakPolarHBondContact O-CB 3.07Å; F57-M61 VanDerWaalsContact O-CG 3.28Å; F57-M61 WeakPolarHBondContact O-CG 3.04Å; F57-M61 PolarHBondContact O-N 3.29Å; I58-M61 PolarHBondContact O-N 2.9Å; M61-S64 PolarHBondContact O-N 3.32Å; M61-L65 VanDerWaalsContact O-CB 3.31Å; M61-L65 WeakPolarHBondContact O-CB 3.03Å; M61-L65 WeakPolarHBondContact O-CD1 3.35Å; M61-L65 VanDerWaalsContact O-CG 3.26Å; M61-L65 WeakPolarHBondContact O-CG 3.1Å; M61-L65 PolarHBondContact O-N 2.99Å
62	L	67	Low	54	Low	90 Å²	90	103.4 Å²	103.4	47%	0.471	55%	0.552	S	S	.	*	H	α-helix	trans	-65.9	-42.2	177.3	-73.8	168.1	0	0	0	112	I58 I59 S64 L65 I66	I58-L62 HydrophobicContact CG2-CD1 3.82Å; I58-L62 HydrophobicContact CG2-CG 4.39Å; I58-L62 WeakPolarHBondContact O-CB 3.23Å; I58-L62 VanDerWaalsContact O-CG 3.24Å; I58-L62 WeakPolarHBondContact O-CG 3.07Å; I58-L62 PolarHBondContact O-N 3.17Å; I59-L62 PolarHBondContact O-N 3.42Å; L62-S64 VanDerWaalsContact C-N 3.33Å; L62-L65 PolarHBondContact O-N 3.36Å; L62-I66 VanDerWaalsContact O-CB 3.26Å; L62-I66 WeakPolarHBondContact O-CB 3.3Å; L62-I66 WeakPolarHBondContact O-CD1 3.45Å; L62-I66 WeakPolarHBondContact O-CG1 3.38Å; L62-I66 PolarHBondContact O-N 2.01Å
63	V	65.2	Low	54.5	Low	70 Å²	70	101.3 Å²	101.3	42%	0.424	54%	0.543	S	S	.	.	H	α-helix	trans	-68.7	-34.5	176.1	172.1	0	0	0	0	110.9	I59 S60 L67	I59-V63 HydrophobicContact CG2-CG2 4.12Å; I59-V63 VanDerWaalsContact O-CB 3.3Å; I59-V63 WeakPolarHBondContact O-CB 3.36Å; I59-V63 WeakPolarHBondContact O-CG2 3.16Å; I59-V63 PolarHBondContact O-N 3.11Å; S60-V63 PolarHBondContact O-N 2.01Å; V63-L67 HydrophobicContact CG1-CD1 3.7Å; V63-L67 HydrophobicContact CG1-CG 4.33Å; V63-L67 WeakPolarHBondContact O-CB 3.08Å; V63-L67 WeakPolarHBondContact O-CD1 3.36Å; V63-L67 VanDerWaalsContact O-CG 3.22Å; V63-L67 WeakPolarHBondContact O-CG 3.24Å; V63-L67 PolarHBondContact O-N 3.45Å
64	S	60	Low	55.1	Low	55 Å²	55	100 Å²	100	39%	0.385	54%	0.54	S	S	.	.	H	α-helix	trans	-69	-40.9	173.5	-53.3	0	0	0	0	111.6	S60 M61 L62 L67 M68	S60-S64 VanDerWaalsContact O-CB 3.25Å; S60-S64 WeakPolarHBondContact O-CB 3.43Å; S60-S64 PolarHBondContact O-N 3.25Å; S60-S64 PolarHBondContact O-OG 2.96Å; M61-S64 PolarHBondContact O-N 3.32Å; L62-S64 VanDerWaalsContact C-N 3.33Å; S64-L67 PolarHBondContact O-N 3.25Å; S64-M68 VanDerWaalsContact O-CB 3.28Å; S64-M68 WeakPolarHBondContact O-CB 3.41Å; S64-M68 VanDerWaalsContact O-CG 3.26Å; S64-M68 WeakPolarHBondContact O-CG 3.39Å; S64-M68 PolarHBondContact O-N 3.11Å
65	L	54.1	Low	56.3	Low	89 Å²	89	95.4 Å²	95.4	47%	0.466	52%	0.524	S	S	.	.	H	α-helix	trans	-65.2	-44.2	173.9	-77.7	162.6	0	0	0	111.2	M61 L62 M68 E69	M61-L65 VanDerWaalsContact O-CB 3.31Å; M61-L65 WeakPolarHBondContact O-CB 3.03Å; M61-L65 WeakPolarHBondContact O-CD1 3.35Å; M61-L65 VanDerWaalsContact O-CG 3.26Å; M61-L65 WeakPolarHBondContact O-CG 3.1Å; M61-L65 PolarHBondContact O-N 2.99Å; L62-L65 PolarHBondContact O-N 3.36Å; L65-M68 PolarHBondContact O-N 3.45Å; L65-E69 WeakPolarHBondContact O-CB 3.41Å; L65-E69 WeakPolarHBondContact O-CG 3.32Å; L65-E69 PolarHBondContact O-N 3.35Å
66	I	49.7	Very low	57.8	Low	88 Å²	88	93.5 Å²	93.5	45%	0.451	53%	0.526	S	S	.	.	H	α-helix	trans	-67.6	-38.7	176.8	-67.4	162.9	0	0	0	110.8	L62 E69 I70	L62-I66 VanDerWaalsContact O-CB 3.26Å; L62-I66 WeakPolarHBondContact O-CB 3.3Å; L62-I66 WeakPolarHBondContact O-CD1 3.45Å; L62-I66 WeakPolarHBondContact O-CG1 3.38Å; L62-I66 PolarHBondContact O-N 2.01Å; I66-E69 PolarHBondContact O-N 2.75Å; I66-I70 HydrophobicContact CG2-CD1 3.6Å; I66-I70 HydrophobicContact CG2-CG1 4.34Å; I66-I70 WeakPolarHBondContact O-CB 3.3Å; I66-I70 WeakPolarHBondContact O-CD1 3.12Å; I66-I70 WeakPolarHBondContact O-CG1 3.28Å; I66-I70 PolarHBondContact O-N 2.92Å
67	L	48.9	Very low	59	Low	107 Å²	107	91.4 Å²	91.4	56%	0.56	51%	0.511	S	S	*	.	H	α-helix	trans	-69.8	-33.5	173.8	-78	164.6	0	0	0	112.2	V63 S64 S71	V63-L67 HydrophobicContact CG1-CD1 3.7Å; V63-L67 HydrophobicContact CG1-CG 4.33Å; V63-L67 WeakPolarHBondContact O-CB 3.08Å; V63-L67 WeakPolarHBondContact O-CD1 3.36Å; V63-L67 VanDerWaalsContact O-CG 3.22Å; V63-L67 WeakPolarHBondContact O-CG 3.24Å; V63-L67 PolarHBondContact O-N 3.45Å; S64-L67 PolarHBondContact O-N 3.25Å; L67-S71 WeakPolarHBondContact O-CB 3.38Å; L67-S71 PolarHBondContact O-N 3.22Å; L67-S71 PolarHBondContact O-OG 2.78Å
68	M	46.6	Very low	60.4	Low	133 Å²	133	87.9 Å²	87.9	66%	0.655	50%	0.495	S	S	*	.	H	α-helix	trans	-68	-40.5	170.8	-79.5	-176.4	168.9	0	0	111.3	S64 L65 S71 A72	S64-M68 VanDerWaalsContact O-CB 3.28Å; S64-M68 WeakPolarHBondContact O-CB 3.41Å; S64-M68 VanDerWaalsContact O-CG 3.26Å; S64-M68 WeakPolarHBondContact O-CG 3.39Å; S64-M68 PolarHBondContact O-N 3.11Å; L65-M68 PolarHBondContact O-N 3.45Å; M68-S71 PolarHBondContact O-N 2.05Å; M68-S71 PolarHBondContact O-OG 3.48Å; M68-A72 WeakPolarHBondContact O-CB 3.32Å; M68-A72 PolarHBondContact O-N 3.33Å
69	E	43	Very low	61.2	Low	144 Å²	144	84.5 Å²	84.5	67%	0.673	48%	0.476	S	S	*	.	H	α-helix	trans	-68.7	-36.2	175.9	-76.3	-169.5	-173.6	0	0	112.9	L65 I66 V73	L65-E69 WeakPolarHBondContact O-CB 3.41Å; L65-E69 WeakPolarHBondContact O-CG 3.32Å; L65-E69 PolarHBondContact O-N 3.35Å; I66-E69 PolarHBondContact O-N 2.75Å; E69-V73 WeakPolarHBondContact O-CG2 3.41Å
70	I	44.6	Very low	62	Low	122 Å²	122	82.2 Å²	82.2	63%	0.626	46%	0.463	S	S	*	.	H	α-helix	trans	-75.4	-27.5	178.1	-65.6	166.5	0	0	0	111.7	I66	I66-I70 HydrophobicContact CG2-CD1 3.6Å; I66-I70 HydrophobicContact CG2-CG1 4.34Å; I66-I70 WeakPolarHBondContact O-CB 3.3Å; I66-I70 WeakPolarHBondContact O-CD1 3.12Å; I66-I70 WeakPolarHBondContact O-CG1 3.28Å; I66-I70 PolarHBondContact O-N 2.92Å
71	S	43.1	Very low	62.8	Low	90 Å²	90	81.6 Å²	81.6	63%	0.629	46%	0.458	S	S	*	.	H	α-helix	trans	-88.6	-12.8	176.1	55.4	0	0	0	0	114.4	L67 M68 V73	L67-S71 WeakPolarHBondContact O-CB 3.38Å; L67-S71 PolarHBondContact O-N 3.22Å; L67-S71 PolarHBondContact O-OG 2.78Å; M68-S71 PolarHBondContact O-N 2.05Å; M68-S71 PolarHBondContact O-OG 3.48Å; S71-V73 PolarHBondContact O-N 3.35Å; S71-V73 VanDerWaalsContact O-N 3.13Å
72	A	44.8	Very low	63.3	Low	81 Å²	81	76.4 Å²	76.4	67%	0.669	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	14.4	-177.5	0	0	0	0	0	115.5	M68	M68-A72 WeakPolarHBondContact O-CB 3.32Å; M68-A72 PolarHBondContact O-N 3.33Å
73	V	56.2	Low	63.6	Low	56 Å²	56	76.7 Å²	76.7	34%	0.339	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-17.4	-161.9	-170.6	0	0	0	0	114.2	E69 S71 H108	E69-V73 WeakPolarHBondContact O-CG2 3.41Å; S71-V73 PolarHBondContact O-N 3.35Å; S71-V73 VanDerWaalsContact O-N 3.13Å; V73-H108 HydrophobicContact CG1-CB 3.67Å; V73-H108 VanDerWaalsContact CG1-CE1 3.44Å; V73-H108 WeakPolarHBondContact CG1-CE1 3.29Å; V73-H108 WeakPolarHBondContact CG1-ND1 3.47Å; V73-H108 WeakPolarHBondContact O-CA 3.4Å
74	V	63.1	Low	64.1	Low	77 Å²	77	74 Å²	74	47%	0.467	42%	0.416	S	S	.	.	S	Bend	trans	-113.4	126.7	173.6	-172.9	0	0	0	0	107.2	Q105 N106	V74-Q105 HydrophobicContact CG1-CG 3.94Å; V74-N106 WeakPolarHBondContact CG1-O 3.38Å
75	T	74.4	Confident	65.1	Low	50 Å²	50	73.5 Å²	73.5	31%	0.307	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-65.1	148.5	177.7	67.6	0	0	0	0	109.2	Q105 N106	T75-Q105 VanDerWaalsContact O-CG 3.25Å; T75-Q105 WeakPolarHBondContact O-CG 3.34Å; T75-Q105 PolarHBondContact O-NE2 2.88Å; T75-N106 HydrophobicContact CG2-CB 4.07Å; T75-N106 PolarHBondContact N-O 3.2Å; T75-N106 VanDerWaalsContact N-O 3.13Å; T75-N106 WeakPolarHBondContact OG1-CB 3.24Å; T75-N106 PolarHBondContact OG1-N 2.83Å; T75-N106 VanDerWaalsContact OG1-N 3.14Å; T75-N106 PolarHBondContact OG1-O 3.44Å
76	P	79.6	Confident	66.3	Low	99 Å²	99	71.2 Å²	71.2	64%	0.643	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-59.7	154.3	168.6	25.1	-32.5	0	0	0	110.6
77	P	83.6	Confident	67.6	Low	32 Å²	32	68.9 Å²	68.9	21%	0.208	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-54.2	146.8	170.9	-24.1	34	0	0	0	111.4	V104 L115 L123	P77-V104 CarbonylContact C-O 3.57Å; P77-V104 WeakPolarHBondContact CA-O 3.39Å; P77-L115 HydrophobicContact CB-CD1 3.93Å; P77-L115 HydrophobicContact CG-CD1 3.86Å; P77-L123 HydrophobicContact CB-CD1 4.42Å; P77-L123 WeakPolarHBondContact O-CD1 3.47Å
78	F	85	Confident	69.2	Low	73 Å²	73	64.9 Å²	64.9	32%	0.32	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	161.4	174.4	68.1	-85.4	0	0	0	111.8	M80 V104	F78-M80 HydrophobicContact CE2-CB 4.36Å; F78-M80 HydrophobicContact CE2-CE 4.02Å; F78-M80 HydrophobicContact CZ-CE 4.05Å; F78-V104 HydrophobicContact CD1-CG2 4.42Å; F78-V104 HydrophobicContact CD2-CG2 4.18Å; F78-V104 HydrophobicContact CE1-CG2 4.03Å; F78-V104 HydrophobicContact CE2-CG2 3.75Å; F78-V104 HydrophobicContact CG-CG2 4.49Å; F78-V104 HydrophobicContact CZ-CG2 3.67Å; F78-V104 PolarHBondContact N-O 2.89Å; F78-V104 PolarHBondContact O-N 3.32Å
79	W	82.9	Confident	70.9	Confident	31 Å²	31	62 Å²	62	12%	0.117	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.2	178.6	-67.9	107.6	0	0	0	111.5	F101 C103 E117 C120 P126	W79-F101 HydrophobicContact CB-CB 4.42Å; W79-F101 HydrophobicContact CB-CD1 4.33Å; W79-F101 HydrophobicContact CE3-CB 3.82Å; W79-F101 HydrophobicContact CZ3-CB 4.47Å; W79-C103 HydrophobicContact CE3-CB 4.41Å; W79-C103 HydrophobicContact CZ3-CB 4.23Å; W79-E117 HydrophobicContact CH2-CG 3.58Å; W79-E117 HydrophobicContact CZ3-CG 4.14Å; W79-C120 HydrophobicContact CD2-CB 4.06Å; W79-C120 VanDerWaalsContact CE2-CB 3.49Å; W79-C120 HydrophobicContact CH2-CB 4.09Å; W79-C120 HydrophobicContact CZ2-CB 3.51Å; W79-C120 PolarHBondContact NE1-O 3.01Å; W79-P126 HydrophobicContact CB-CG 3.56Å; W79-P126 VanDerWaalsContact CD1-CD 3.44Å; W79-P126 VanDerWaalsContact CG-CD 3.41Å; W79-P126 HydrophobicContact CG-CG 3.94Å
80	M	82.5	Confident	72.7	Confident	54 Å²	54	60.1 Å²	60.1	27%	0.266	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.9	175.7	-176.7	179.2	-76.1	0	0	110.5	F78 F101 L102 V104 T112	F78-M80 HydrophobicContact CE2-CB 4.36Å; F78-M80 HydrophobicContact CE2-CE 4.02Å; F78-M80 HydrophobicContact CZ-CE 4.05Å; M80-F101 CarbonylContact O-C 3.57Å; M80-F101 VanDerWaalsContact O-CA 3.31Å; M80-F101 WeakPolarHBondContact O-CA 3.02Å; M80-L102 PolarHBondContact N-O 2.96Å; M80-L102 PolarHBondContact O-N 2.7Å; M80-V104 HydrophobicContact CB-CG1 4.48Å; M80-V104 HydrophobicContact CB-CG2 3.72Å; M80-V104 HydrophobicContact CE-CG2 3.91Å; M80-V104 HydrophobicContact SD-CG2 4.41Å; M80-T112 HydrophobicContact CE-CG2 4.24Å
81	P	80.2	Confident	74.1	Confident	55 Å²	55	61.2 Å²	61.2	36%	0.357	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	136.3	177	26.4	-32.8	0	0	0	111.1	R99 F101	P81-R99 VanDerWaalsContact CB-NE 3.28Å; P81-F101 HydrophobicContact CB-CD1 4.06Å; P81-F101 HydrophobicContact CB-CE1 3.67Å; P81-F101 HydrophobicContact CB-CZ 4.22Å; P81-F101 HydrophobicContact CG-CE1 4.4Å
82	S	75.6	Confident	75.7	Confident	8 Å²	8	58.7 Å²	58.7	6%	0.056	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	148.6	168.9	87.3	0	0	0	0	110.4	S84 R100	S82-S84 VanDerWaalsContact C-N 3.27Å; S82-S84 PolarHBondContact O-N 2.99Å; S82-S84 PolarHBondContact OG-O 3.4Å; S82-S84 VanDerWaalsContact OG-O 3.04Å; S82-S84 PolarHBondContact OG-OG 3.42Å; S82-R100 WeakPolarHBondContact CB-O 3.01Å; S82-R100 PolarHBondContact N-O 2.77Å; S82-R100 VanDerWaalsContact OG-CG 3.22Å; S82-R100 WeakPolarHBondContact OG-CG 3.4Å; S82-R100 PolarHBondContact OG-O 2.91Å
83	E	73.2	Confident	77.4	Confident	97 Å²	97	55.8 Å²	55.8	45%	0.453	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	-26.4	179.4	-62.5	-174.2	167.2	0	0	113.6	S204 R207	E83-S204 WeakPolarHBondContact OE2-CB 3.31Å; E83-S204 PolarHBondContact OE2-OG 3.02Å; E83-R207 VanDerWaalsContact CD-NE 3.33Å; E83-R207 WeakPolarHBondContact OE1-CB 3.34Å; E83-R207 WeakPolarHBondContact OE1-CD 3.41Å; E83-R207 VanDerWaalsContact OE1-CG 3.28Å; E83-R207 WeakPolarHBondContact OE1-CG 3.49Å; E83-R207 IonicContact OE1-NE 3.5Å; E83-R207 PolarHBondContact OE1-NE 2.8Å; E83-R207 WeakPolarHBondContact OE2-CD 2.96Å; E83-R207 WeakPolarHBondContact OE2-CG 3.43Å; E83-R207 IonicContact OE2-CZ 3.28Å; E83-R207 IonicContact OE2-NE 2.78Å; E83-R207 PolarHBondContact OE2-NE 3.48Å; E83-R207 IonicContact OE2-NH2 3.11Å
84	S	74.1	Confident	78.7	Confident	13 Å²	13	58.7 Å²	58.7	9%	0.091	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	143.5	-172.8	58	0	0	0	0	113.1	S82 M167	S82-S84 VanDerWaalsContact C-N 3.27Å; S82-S84 PolarHBondContact O-N 2.99Å; S82-S84 PolarHBondContact OG-O 3.4Å; S82-S84 VanDerWaalsContact OG-O 3.04Å; S82-S84 PolarHBondContact OG-OG 3.42Å; S84-M167 WeakPolarHBondContact OG-CE 3.32Å
85	W	81.2	Confident	79.8	Confident	44 Å²	44	55.4 Å²	55.4	17%	0.167	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	152.5	174	-63.3	84.7	0	0	0	111.4	E97 R99 N134 R136 W154	W85-E97 HydrophobicContact CB-CB 4.18Å; W85-E97 HydrophobicContact CE3-CB 4.24Å; W85-E97 VanDerWaalsContact CE3-O 3.27Å; W85-E97 VanDerWaalsContact CZ3-O 3.29Å; W85-E97 WeakPolarHBondContact CZ3-O 3.46Å; W85-R99 HydrophobicContact CD2-CB 4.01Å; W85-R99 HydrophobicContact CE3-CB 3.85Å; W85-R99 HydrophobicContact CE3-CG 4.39Å; W85-R99 HydrophobicContact CH2-CB 4.47Å; W85-R99 HydrophobicContact CH2-CG 4.18Å; W85-R99 HydrophobicContact CZ2-CG 4.48Å; W85-R99 HydrophobicContact CZ3-CB 4.09Å; W85-R99 HydrophobicContact CZ3-CG 4.12Å; W85-N134 VanDerWaalsContact CZ3-O 3.31Å; W85-N134 WeakPolarHBondContact CZ3-O 3.39Å; W85-R136 HydrophobicContact CD2-CG 3.83Å; W85-R136 HydrophobicContact CE3-CB 4.38Å; W85-R136 HydrophobicContact CE3-CG 3.69Å; W85-R136 HydrophobicContact CG-CG 4.45Å; W85-R136 VanDerWaalsContact CG-NE 3.31Å; W85-R136 HydrophobicContact CH2-CB 4.05Å; W85-R136 HydrophobicContact CH2-CG 4.21Å; W85-R136 HydrophobicContact CZ2-CB 4.36Å; W85-R136 HydrophobicContact CZ2-CG 4.35Å; W85-R136 HydrophobicContact CZ3-CB 4.07Å; W85-R136 HydrophobicContact CZ3-CG 3.89Å; W85-W154 PolarHBondContact O-NE1 2.84Å
86	S	80.5	Confident	80.3	Confident	42 Å²	42	55.5 Å²	55.5	29%	0.294	31%	0.312	S	S	.	.			trans	-64.9	174.8	174.3	68.9	0	0	0	0	111.8	V98	S86-V98 WeakPolarHBondContact CB-O 3.35Å; S86-V98 PolarHBondContact N-O 3.47Å; S86-V98 PolarHBondContact OG-N 2.87Å; S86-V98 PolarHBondContact OG-O 3.37Å
87	S	76.4	Confident	80.5	Confident	39 Å²	39	52.4 Å²	52.4	27%	0.273	29%	0.289	S	S	.	.			trans	-57	152	158.8	-48	0	0	0	0	109.9
88	C	81.8	Confident	80.5	Confident	22 Å²	22	53.5 Å²	53.5	15%	0.149	30%	0.295	C	S	.	.			trans	-58.4	139.5	170.6	-167.6	0	0	0	0	109	E90 C138 L140	C88-E90 PolarHBondContact O-N 2.03Å; C88-C138 VanDerWaalsContact CA-SG 3.52Å; C88-C138 HydrophobicContact CB-CB 3.9Å; C88-C138 WeakPolarHBondContact CB-SG 3.3Å; C88-C138 WeakPolarHBondContact SG-CB 3.49Å; C88-C138 CovalentContact SG-SG 2.03Å; C88-C138 PolarHBondContact SG-SG 2.93Å; C88-L140 HydrophobicContact CB-CD1 3.79Å; C88-L140 HydrophobicContact CB-CD2 4.41Å; C88-L140 HydrophobicContact CB-CG 4.08Å
89	S	83.4	Confident	80.3	Confident	74 Å²	74	52 Å²	52	52%	0.517	29%	0.287	S	S	.	.	S	Bend	trans	-59.9	-31.2	179.7	61.2	0	0	0	0	113.1	V96	S89-V96 WeakPolarHBondContact CB-O 3.37Å; S89-V96 PolarHBondContact N-O 3.02Å; S89-V96 PolarHBondContact OG-N 2.82Å; S89-V96 PolarHBondContact OG-O 2.97Å
90	E	81	Confident	80.2	Confident	103 Å²	103	56.4 Å²	56.4	48%	0.481	30%	0.304	S	S	.	.	S	Bend	trans	-107.6	146.2	179.1	-57.2	-56.1	145.1	0	0	110.3	C88 C92 L140	C88-E90 PolarHBondContact O-N 2.03Å; E90-C92 VanDerWaalsContact C-N 3.32Å; E90-C92 VanDerWaalsContact CB-O 3.27Å; E90-C92 WeakPolarHBondContact CB-O 3.26Å; E90-L140 WeakPolarHBondContact O-CD1 3.31Å
91	E	74	Confident	80.2	Confident	145 Å²	145	55.1 Å²	55.1	68%	0.678	30%	0.297	S	S	*	.	S	Bend	trans	-81	-14.1	176.4	-64.9	-173	163.4	0	0	113.1
92	C	77.3	Confident	80.3	Confident	37 Å²	37	53.7 Å²	53.7	25%	0.25	29%	0.286	C	S	.	.	S	Bend	trans	-153.9	163.1	177.1	61.8	0	0	0	0	108.9	E90 C143	E90-C92 VanDerWaalsContact C-N 3.32Å; E90-C92 VanDerWaalsContact CB-O 3.27Å; E90-C92 WeakPolarHBondContact CB-O 3.26Å; C92-C143 HydrophobicContact CB-CB 3.93Å; C92-C143 WeakPolarHBondContact CB-SG 3.09Å; C92-C143 PolarHBondContact O-SG 3.3Å; C92-C143 WeakPolarHBondContact SG-CA 3.48Å; C92-C143 WeakPolarHBondContact SG-CB 3.16Å; C92-C143 CovalentContact SG-SG 2.04Å; C92-C143 PolarHBondContact SG-SG 2.98Å
93	G	79.5	Confident	80.7	Confident	20 Å²	20	53.5 Å²	53.5	21%	0.206	29%	0.285	C	S	.	.	S	Bend	trans	82.5	-155	177.2	0	0	0	0	0	113.5	K139 L140 G141	G93-K139 WeakPolarHBondContact O-CA 3.37Å; G93-L140 PolarHBondContact O-N 2.91Å; G93-G141 WeakPolarHBondContact CA-O 3.47Å; G93-G141 PolarHBondContact N-O 3.07Å
94	D	84	Confident	81.2	Confident	117 Å²	117	48.9 Å²	48.9	63%	0.626	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	128.9	169.9	-63.2	-55	0	0	0	108.7	C138 K139	D94-C138 WeakPolarHBondContact CA-O 3.11Å; D94-K139 VanDerWaalsContact OD1-CD 3.31Å; D94-K139 WeakPolarHBondContact OD1-CD 3.15Å; D94-K139 WeakPolarHBondContact OD1-CE 3.37Å; D94-K139 VanDerWaalsContact OD1-CG 3.3Å; D94-K139 WeakPolarHBondContact OD1-CG 3.34Å; D94-K139 IonicContact OD1-NZ 2.72Å
95	G	85	Confident	81.5	Confident	8 Å²	8	50.8 Å²	50.8	8%	0.082	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	-172.6	176	0	0	0	0	0	111.8	A137 C138	G95-A137 WeakPolarHBondContact O-CA 3.33Å; G95-C138 PolarHBondContact N-O 2.78Å; G95-C138 PolarHBondContact O-N 2.81Å; G95-C138 PolarHBondContact O-SG 2.81Å
96	V	86.6	Confident	81.1	Confident	53 Å²	53	50.1 Å²	50.1	32%	0.321	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	136	178.5	-176.1	0	0	0	0	110.4	S89 Q135 R136 C138	S89-V96 WeakPolarHBondContact CB-O 3.37Å; S89-V96 PolarHBondContact N-O 3.02Å; S89-V96 PolarHBondContact OG-N 2.82Å; S89-V96 PolarHBondContact OG-O 2.97Å; V96-Q135 HydrophobicContact CG1-CB 3.68Å; V96-Q135 HydrophobicContact CG1-CG 3.75Å; V96-R136 WeakPolarHBondContact CA-O 3.31Å; V96-C138 PolarHBondContact N-SG 3.47Å
97	E	82.2	Confident	80.4	Confident	33 Å²	33	49.6 Å²	49.6	15%	0.154	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	137.5	171.4	-32.2	177.6	-141	0	0	108.5	W85 Q135 R136 C138	W85-E97 HydrophobicContact CB-CB 4.18Å; W85-E97 HydrophobicContact CE3-CB 4.24Å; W85-E97 VanDerWaalsContact CE3-O 3.27Å; W85-E97 VanDerWaalsContact CZ3-O 3.29Å; W85-E97 WeakPolarHBondContact CZ3-O 3.46Å; E97-Q135 WeakPolarHBondContact O-CA 3.48Å; E97-R136 HydrophobicContact CB-CG 3.76Å; E97-R136 HydrophobicContact CG-CG 3.95Å; E97-R136 PolarHBondContact N-O 3.36Å; E97-R136 PolarHBondContact O-N 3.26Å; E97-R136 IonicContact OE1-CZ 2.77Å; E97-R136 IonicContact OE1-NE 2.82Å; E97-R136 PolarHBondContact OE1-NE 2.97Å; E97-R136 VanDerWaalsContact OE1-NE 3.12Å; E97-R136 IonicContact OE1-NH2 3.57Å; E97-R136 IonicContact OE2-CZ 2.69Å; E97-R136 IonicContact OE2-NE 2.62Å; E97-R136 PolarHBondContact OE2-NE 2.78Å; E97-R136 IonicContact OE2-NH2 2.79Å; E97-R136 PolarHBondContact OE2-NH2 3.35Å; E97-C138 HydrophobicContact CG-CB 3.51Å; E97-C138 WeakPolarHBondContact CG-SG 3.49Å; E97-C138 WeakPolarHBondContact OE1-CB 3.06Å
98	V	83.4	Confident	79.9	Confident	55 Å²	55	52.9 Å²	52.9	33%	0.333	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	139.8	-176.4	-162.5	0	0	0	0	109.2	S86 N134 Q135	S86-V98 WeakPolarHBondContact CB-O 3.35Å; S86-V98 PolarHBondContact N-O 3.47Å; S86-V98 PolarHBondContact OG-N 2.87Å; S86-V98 PolarHBondContact OG-O 3.37Å; V98-N134 WeakPolarHBondContact CA-O 3.41Å; V98-N134 VanDerWaalsContact CG1-O 3.24Å; V98-N134 WeakPolarHBondContact CG1-O 3.35Å; V98-Q135 HydrophobicContact CG1-CG 4.3Å; V98-Q135 HydrophobicContact CG2-CG 4.23Å
99	R	81.4	Confident	78.9	Confident	41 Å²	41	54 Å²	54	16%	0.155	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	143.5	172.3	69.1	176.4	-170.3	-159.4	-13.6	111.1	P81 W85 F101 N133 N134	P81-R99 VanDerWaalsContact CB-NE 3.28Å; W85-R99 HydrophobicContact CD2-CB 4.01Å; W85-R99 HydrophobicContact CE3-CB 3.85Å; W85-R99 HydrophobicContact CE3-CG 4.39Å; W85-R99 HydrophobicContact CH2-CB 4.47Å; W85-R99 HydrophobicContact CH2-CG 4.18Å; W85-R99 HydrophobicContact CZ2-CG 4.48Å; W85-R99 HydrophobicContact CZ3-CB 4.09Å; W85-R99 HydrophobicContact CZ3-CG 4.12Å; R99-F101 HydrophobicContact CG-CE2 4.42Å; R99-N133 WeakPolarHBondContact CD-O 3.31Å; R99-N133 PolarHBondContact NE-O 2.9Å; R99-N133 VanDerWaalsContact NH2-CB 3.28Å; R99-N133 VanDerWaalsContact NH2-CG 3.26Å; R99-N133 PolarHBondContact NH2-O 2.77Å; R99-N133 PolarHBondContact NH2-OD1 3.34Å; R99-N134 PolarHBondContact N-O 2.94Å; R99-N134 VanDerWaalsContact N-O 3.17Å
100	R	81.4	Confident	78	Confident	124 Å²	124	55.9 Å²	55.9	47%	0.468	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	157	175.2	65.7	178.2	-176.8	142.8	3.3	111.1	S82	S82-R100 WeakPolarHBondContact CB-O 3.01Å; S82-R100 PolarHBondContact N-O 2.77Å; S82-R100 VanDerWaalsContact OG-CG 3.22Å; S82-R100 WeakPolarHBondContact OG-CG 3.4Å; S82-R100 PolarHBondContact OG-O 2.91Å
101	F	82.6	Confident	77.2	Confident	27 Å²	27	51.1 Å²	51.1	12%	0.118	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	145.1	171.3	-71.6	-100.7	0	0	0	109.5	W79 M80 P81 R99 P126 N134	W79-F101 HydrophobicContact CB-CB 4.42Å; W79-F101 HydrophobicContact CB-CD1 4.33Å; W79-F101 HydrophobicContact CE3-CB 3.82Å; W79-F101 HydrophobicContact CZ3-CB 4.47Å; M80-F101 CarbonylContact O-C 3.57Å; M80-F101 VanDerWaalsContact O-CA 3.31Å; M80-F101 WeakPolarHBondContact O-CA 3.02Å; P81-F101 HydrophobicContact CB-CD1 4.06Å; P81-F101 HydrophobicContact CB-CE1 3.67Å; P81-F101 HydrophobicContact CB-CZ 4.22Å; P81-F101 HydrophobicContact CG-CE1 4.4Å; R99-F101 HydrophobicContact CG-CE2 4.42Å; F101-P126 HydrophobicContact CD1-CB 3.8Å; F101-P126 HydrophobicContact CD1-CG 3.86Å; F101-P126 HydrophobicContact CD2-CB 4.13Å; F101-P126 HydrophobicContact CE1-CB 3.52Å; F101-P126 HydrophobicContact CE1-CG 3.98Å; F101-P126 HydrophobicContact CE2-CB 3.9Å; F101-P126 HydrophobicContact CG-CB 4.1Å; F101-P126 HydrophobicContact CG-CG 4.28Å; F101-P126 HydrophobicContact CZ-CB 3.58Å; F101-N134 HydrophobicContact CE2-CB 3.94Å; F101-N134 HydrophobicContact CZ-CB 4.34Å
102	L	82.1	Confident	77	Confident	25 Å²	25	45.2 Å²	45.2	13%	0.131	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	132.4	-179.9	-59.8	174.7	0	0	0	109	M80 V104 L114 F208	M80-L102 PolarHBondContact N-O 2.96Å; M80-L102 PolarHBondContact O-N 2.7Å; L102-V104 HydrophobicContact CB-CG1 4.3Å; L102-V104 PolarHBondContact O-N 2.74Å; L102-L114 HydrophobicContact CB-CD1 4.04Å; L102-L114 HydrophobicContact CD1-CD1 4.17Å; L102-L114 HydrophobicContact CD2-CD1 4.3Å; L102-L114 HydrophobicContact CG-CD1 4.4Å; L102-F208 HydrophobicContact CD1-CE1 4.27Å
103	C	83.9	Confident	76.6	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.034	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	119	172	-178.5	0	0	0	0	109.2	W79 L115 C120	W79-C103 HydrophobicContact CE3-CB 4.41Å; W79-C103 HydrophobicContact CZ3-CB 4.23Å; C103-L115 HydrophobicContact CB-CB 4.5Å; C103-L115 PolarHBondContact O-N 3.01Å; C103-C120 VanDerWaalsContact CA-SG 3.52Å; C103-C120 HydrophobicContact CB-CB 3.69Å; C103-C120 WeakPolarHBondContact CB-SG 3.42Å; C103-C120 WeakPolarHBondContact SG-CB 3.33Å; C103-C120 PolarHBondContact SG-N 2.9Å; C103-C120 CovalentContact SG-SG 2.03Å; C103-C120 PolarHBondContact SG-SG 3.04Å
104	V	82.7	Confident	76.1	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	157.7	-176.8	-61.8	0	0	0	0	112	P77 F78 M80 L102 T112 T113 L114	P77-V104 CarbonylContact C-O 3.57Å; P77-V104 WeakPolarHBondContact CA-O 3.39Å; F78-V104 HydrophobicContact CD1-CG2 4.42Å; F78-V104 HydrophobicContact CD2-CG2 4.18Å; F78-V104 HydrophobicContact CE1-CG2 4.03Å; F78-V104 HydrophobicContact CE2-CG2 3.75Å; F78-V104 HydrophobicContact CG-CG2 4.49Å; F78-V104 HydrophobicContact CZ-CG2 3.67Å; F78-V104 PolarHBondContact N-O 2.89Å; F78-V104 PolarHBondContact O-N 3.32Å; M80-V104 HydrophobicContact CB-CG1 4.48Å; M80-V104 HydrophobicContact CB-CG2 3.72Å; M80-V104 HydrophobicContact CE-CG2 3.91Å; M80-V104 HydrophobicContact SD-CG2 4.41Å; L102-V104 HydrophobicContact CB-CG1 4.3Å; L102-V104 PolarHBondContact O-N 2.74Å; V104-T112 HydrophobicContact CB-CG2 3.58Å; V104-T112 HydrophobicContact CG1-CG2 3.97Å; V104-T112 HydrophobicContact CG2-CG2 3.94Å; V104-T113 VanDerWaalsContact CA-O 3.31Å; V104-T113 WeakPolarHBondContact CA-O 3.45Å; V104-L114 HydrophobicContact CG1-CD1 4.38Å
105	Q	81	Confident	75.7	Confident	52 Å²	52	46 Å²	46	24%	0.243	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	138.3	175.8	-179.9	171.3	33.9	0	0	110.5	V74 T75 T112 T113 L115	V74-Q105 HydrophobicContact CG1-CG 3.94Å; T75-Q105 VanDerWaalsContact O-CG 3.25Å; T75-Q105 WeakPolarHBondContact O-CG 3.34Å; T75-Q105 PolarHBondContact O-NE2 2.88Å; Q105-T112 CarbonylContact O-C 3.57Å; Q105-T112 WeakPolarHBondContact O-CA 2.98Å; Q105-T113 PolarHBondContact N-O 3.34Å; Q105-T113 PolarHBondContact O-N 3.02Å; Q105-L115 HydrophobicContact CB-CD1 3.52Å; Q105-L115 HydrophobicContact CB-CG 4.03Å; Q105-L115 HydrophobicContact CG-CD1 4.48Å
106	N	73	Confident	75.3	Confident	31 Å²	31	50.8 Å²	50.8	17%	0.166	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	130.9	172.6	-62.2	-31.2	0	0	0	110	V74 T75 A111 T112	V74-N106 WeakPolarHBondContact CG1-O 3.38Å; T75-N106 HydrophobicContact CG2-CB 4.07Å; T75-N106 PolarHBondContact N-O 3.2Å; T75-N106 VanDerWaalsContact N-O 3.13Å; T75-N106 WeakPolarHBondContact OG1-CB 3.24Å; T75-N106 PolarHBondContact OG1-N 2.83Å; T75-N106 VanDerWaalsContact OG1-N 3.14Å; T75-N106 PolarHBondContact OG1-O 3.44Å; N106-A111 WeakPolarHBondContact CA-O 3.35Å; N106-T112 WeakPolarHBondContact OD1-CA 3.37Å; N106-T112 WeakPolarHBondContact OD1-CB 3.33Å; N106-T112 PolarHBondContact OD1-OG1 3.37Å
107	D	65	Low	74.9	Confident	31 Å²	31	54.2 Å²	54.2	17%	0.166	27%	0.268	C	S	.	.			trans	-78.6	-177	172.4	77.6	-2.4	0	0	0	112.6	Y109 N110 A111	D107-Y109 PolarHBondContact O-N 3.32Å; D107-Y109 WeakPolarHBondContact OD1-CA 3.43Å; D107-Y109 PolarHBondContact OD1-N 3.41Å; D107-N110 PolarHBondContact O-N 2.87Å; D107-N110 VanDerWaalsContact O-N 3.12Å; D107-N110 PolarHBondContact OD1-N 3.2Å; D107-A111 PolarHBondContact N-O 3.01Å; D107-A111 WeakPolarHBondContact OD1-CA 3.47Å; D107-A111 WeakPolarHBondContact OD1-CB 3Å; D107-A111 PolarHBondContact OD1-N 2.99Å
108	H	65.8	Low	74.8	Confident	108 Å²	108	55 Å²	55	50%	0.5	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-27.1	176	-176	29	0	0	0	114.2	V73	V73-H108 HydrophobicContact CG1-CB 3.67Å; V73-H108 VanDerWaalsContact CG1-CE1 3.44Å; V73-H108 WeakPolarHBondContact CG1-CE1 3.29Å; V73-H108 WeakPolarHBondContact CG1-ND1 3.47Å; V73-H108 WeakPolarHBondContact O-CA 3.4Å
109	Y	61	Low	74.7	Confident	44 Å²	44	57.7 Å²	57.7	17%	0.173	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	13.9	-172.6	-56	-73.1	0	0	0	112.7	D107 A111 R249 P252 A255 M258	D107-Y109 PolarHBondContact O-N 3.32Å; D107-Y109 WeakPolarHBondContact OD1-CA 3.43Å; D107-Y109 PolarHBondContact OD1-N 3.41Å; Y109-A111 PolarHBondContact O-N 2.84Å; Y109-R249 PolarHBondContact O-NH1 3.05Å; Y109-P252 HydrophobicContact CE1-CG 3.9Å; Y109-A255 HydrophobicContact CD2-CB 3.81Å; Y109-A255 HydrophobicContact CE2-CB 3.64Å; Y109-M258 HydrophobicContact CE2-CE 3.89Å
110	N	65.5	Low	74.8	Confident	114 Å²	114	55.8 Å²	55.8	61%	0.61	28%	0.279	S	S	*	.	S	Bend	trans	59.7	26.8	-172.1	-65.2	-24.3	0	0	0	113.5	D107	D107-N110 PolarHBondContact O-N 2.87Å; D107-N110 VanDerWaalsContact O-N 3.12Å; D107-N110 PolarHBondContact OD1-N 3.2Å
111	A	64.3	Low	74.9	Confident	4 Å²	4	56.8 Å²	56.8	3%	0.033	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-84	120.2	169.5	0	0	0	0	0	109.4	N106 D107 Y109	N106-A111 WeakPolarHBondContact CA-O 3.35Å; D107-A111 PolarHBondContact N-O 3.01Å; D107-A111 WeakPolarHBondContact OD1-CA 3.47Å; D107-A111 WeakPolarHBondContact OD1-CB 3Å; D107-A111 PolarHBondContact OD1-N 2.99Å; Y109-A111 PolarHBondContact O-N 2.84Å
112	T	69.3	Low	74.8	Confident	20 Å²	20	64 Å²	64	12%	0.123	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	118.4	-179.4	-49.9	0	0	0	0	110.3	M80 V104 Q105 N106 F208	M80-T112 HydrophobicContact CE-CG2 4.24Å; V104-T112 HydrophobicContact CB-CG2 3.58Å; V104-T112 HydrophobicContact CG1-CG2 3.97Å; V104-T112 HydrophobicContact CG2-CG2 3.94Å; Q105-T112 CarbonylContact O-C 3.57Å; Q105-T112 WeakPolarHBondContact O-CA 2.98Å; N106-T112 WeakPolarHBondContact OD1-CA 3.37Å; N106-T112 WeakPolarHBondContact OD1-CB 3.33Å; N106-T112 PolarHBondContact OD1-OG1 3.37Å; T112-F208 HydrophobicContact CG2-CB 4.36Å
113	T	69.1	Low	74.9	Confident	61 Å²	61	65.8 Å²	65.8	37%	0.374	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	133.2	176	-57.5	0	0	0	0	109.9	V104 Q105 L115	V104-T113 VanDerWaalsContact CA-O 3.31Å; V104-T113 WeakPolarHBondContact CA-O 3.45Å; Q105-T113 PolarHBondContact N-O 3.34Å; Q105-T113 PolarHBondContact O-N 3.02Å; T113-L115 PolarHBondContact O-N 2.03Å
114	L	68.8	Low	74.7	Confident	87 Å²	87	70.7 Å²	70.7	46%	0.455	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	119	170.1	-166.2	90.8	0	0	0	108.8	L102 V104 F208	L102-L114 HydrophobicContact CB-CD1 4.04Å; L102-L114 HydrophobicContact CD1-CD1 4.17Å; L102-L114 HydrophobicContact CD2-CD1 4.3Å; L102-L114 HydrophobicContact CG-CD1 4.4Å; V104-L114 HydrophobicContact CG1-CD1 4.38Å; L114-F208 HydrophobicContact CB-CE2 4.3Å; L114-F208 HydrophobicContact CB-CZ 4.17Å; L114-F208 HydrophobicContact CD1-CE1 4Å; L114-F208 HydrophobicContact CD1-CZ 3.96Å
115	L	75.1	Confident	74.4	Confident	42 Å²	42	73.4 Å²	73.4	22%	0.22	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-97.5	162.3	177	-66.8	-178.3	0	0	0	110.9	P77 C103 Q105 T113 Q119	P77-L115 HydrophobicContact CB-CD1 3.93Å; P77-L115 HydrophobicContact CG-CD1 3.86Å; C103-L115 HydrophobicContact CB-CB 4.5Å; C103-L115 PolarHBondContact O-N 3.01Å; Q105-L115 HydrophobicContact CB-CD1 3.52Å; Q105-L115 HydrophobicContact CB-CG 4.03Å; Q105-L115 HydrophobicContact CG-CD1 4.48Å; T113-L115 PolarHBondContact O-N 2.03Å; L115-Q119 HydrophobicContact CB-CB 4.28Å; L115-Q119 HydrophobicContact CB-CG 4.43Å; L115-Q119 HydrophobicContact CD1-CB 4.12Å
116	D	76.2	Confident	74	Confident	109 Å²	109	72.4 Å²	72.4	58%	0.583	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-64.7	143.3	167.2	-172.4	73.7	0	0	0	110.4	S118 Q119	D116-S118 PolarHBondContact O-N 3.16Å; D116-S118 VanDerWaalsContact O-N 3.15Å; D116-S118 VanDerWaalsContact OD2-CB 3.24Å; D116-S118 WeakPolarHBondContact OD2-CB 3.23Å; D116-S118 PolarHBondContact OD2-N 2.84Å; D116-S118 PolarHBondContact OD2-OG 3.27Å; D116-Q119 WeakPolarHBondContact O-CB 3.46Å; D116-Q119 PolarHBondContact O-N 2.95Å
117	E	80	Confident	73.8	Confident	125 Å²	125	73.6 Å²	73.6	58%	0.584	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-60.5	-29.2	-173.2	-161	167.9	-178.6	0	0	112.7	W79 Q119 C120 E121	W79-E117 HydrophobicContact CH2-CG 3.58Å; W79-E117 HydrophobicContact CZ3-CG 4.14Å; E117-Q119 PolarHBondContact O-N 3.43Å; E117-Q119 VanDerWaalsContact O-N 3.13Å; E117-C120 PolarHBondContact O-N 3.27Å; E117-C120 VanDerWaalsContact O-N 3.09Å; E117-E121 PolarHBondContact O-N 3.35Å
118	S	78.7	Confident	73.8	Confident	49 Å²	49	76 Å²	76	34%	0.343	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-56.2	-28.5	174.3	62.5	0	0	0	0	113.5	D116 C120 E121	D116-S118 PolarHBondContact O-N 3.16Å; D116-S118 VanDerWaalsContact O-N 3.15Å; D116-S118 VanDerWaalsContact OD2-CB 3.24Å; D116-S118 WeakPolarHBondContact OD2-CB 3.23Å; D116-S118 PolarHBondContact OD2-N 2.84Å; D116-S118 PolarHBondContact OD2-OG 3.27Å; S118-C120 VanDerWaalsContact C-N 3.28Å; S118-C120 PolarHBondContact O-N 3.42Å; S118-E121 WeakPolarHBondContact O-CB 3.36Å; S118-E121 PolarHBondContact O-N 3.13Å
119	Q	81.1	Confident	73.9	Confident	113 Å²	113	76.7 Å²	76.7	53%	0.528	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-75.3	-17	-177.8	-57.5	-60.9	-73.6	0	0	113	L115 D116 E117	L115-Q119 HydrophobicContact CB-CB 4.28Å; L115-Q119 HydrophobicContact CB-CG 4.43Å; L115-Q119 HydrophobicContact CD1-CB 4.12Å; D116-Q119 WeakPolarHBondContact O-CB 3.46Å; D116-Q119 PolarHBondContact O-N 2.95Å; E117-Q119 PolarHBondContact O-N 3.43Å; E117-Q119 VanDerWaalsContact O-N 3.13Å
120	C	84.7	Confident	74	Confident	0 Å²	0	80.8 Å²	80.8	0%	0	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-109	3.6	175.1	-67.8	0	0	0	0	113.2	W79 C103 E117 S118 H122 L123	W79-C120 HydrophobicContact CD2-CB 4.06Å; W79-C120 VanDerWaalsContact CE2-CB 3.49Å; W79-C120 HydrophobicContact CH2-CB 4.09Å; W79-C120 HydrophobicContact CZ2-CB 3.51Å; W79-C120 PolarHBondContact NE1-O 3.01Å; C103-C120 VanDerWaalsContact CA-SG 3.52Å; C103-C120 HydrophobicContact CB-CB 3.69Å; C103-C120 WeakPolarHBondContact CB-SG 3.42Å; C103-C120 WeakPolarHBondContact SG-CB 3.33Å; C103-C120 PolarHBondContact SG-N 2.9Å; C103-C120 CovalentContact SG-SG 2.03Å; C103-C120 PolarHBondContact SG-SG 3.04Å; E117-C120 PolarHBondContact O-N 3.27Å; E117-C120 VanDerWaalsContact O-N 3.09Å; S118-C120 VanDerWaalsContact C-N 3.28Å; S118-C120 PolarHBondContact O-N 3.42Å; C120-H122 PolarHBondContact O-N 3.37Å; C120-H122 VanDerWaalsContact O-N 3.17Å; C120-L123 HydrophobicContact CB-CD1 4.16Å; C120-L123 WeakPolarHBondContact O-CB 3.23Å; C120-L123 PolarHBondContact O-N 2.87Å
121	E	82.5	Confident	74.2	Confident	146 Å²	146	78.4 Å²	78.4	68%	0.682	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-30.4	-175.6	-169.8	175.8	-175.4	0	0	112.9	E117 S118 L123	E117-E121 PolarHBondContact O-N 3.35Å; S118-E121 WeakPolarHBondContact O-CB 3.36Å; S118-E121 PolarHBondContact O-N 3.13Å; E121-L123 VanDerWaalsContact C-N 3.29Å; E121-L123 PolarHBondContact O-N 3.26Å
122	H	82	Confident	74.4	Confident	177 Å²	177	87.2 Å²	87.2	82%	0.819	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-10.8	177.6	-55.5	-40.5	0	0	0	114.2	C120	C120-H122 PolarHBondContact O-N 3.37Å; C120-H122 VanDerWaalsContact O-N 3.17Å
123	L	83.3	Confident	74.4	Confident	64 Å²	64	91.2 Å²	91.2	34%	0.335	49%	0.49	S	S	.	.	S	Bend	trans	-92.2	146.9	179.9	-62.3	167.8	0	0	0	109.8	P77 C120 E121 N125	P77-L123 HydrophobicContact CB-CD1 4.42Å; P77-L123 WeakPolarHBondContact O-CD1 3.47Å; C120-L123 HydrophobicContact CB-CD1 4.16Å; C120-L123 WeakPolarHBondContact O-CB 3.23Å; C120-L123 PolarHBondContact O-N 2.87Å; E121-L123 VanDerWaalsContact C-N 3.29Å; E121-L123 PolarHBondContact O-N 3.26Å; L123-N125 PolarHBondContact O-N 3.24Å
124	P	80.1	Confident	74.8	Confident	107 Å²	107	88.3 Å²	88.3	70%	0.695	47%	0.472	S	S	*	.			trans	-57.1	114.2	176.6	22.8	-31.8	0	0	0	109.6	P126	P124-P126 WeakPolarHBondContact O-CD 3.39Å
125	N	75.4	Confident	75.4	Confident	58 Å²	58	87 Å²	87	31%	0.31	46%	0.464	S	S	.	.			trans	-70.3	115.2	-178	-171.1	-9.5	0	0	0	109.5	L123 S127 A128	L123-N125 PolarHBondContact O-N 3.24Å; N125-S127 PolarHBondContact ND2-OG 2.77Å; N125-S127 PolarHBondContact O-N 2.93Å; N125-S127 VanDerWaalsContact O-N 3.14Å; N125-S127 WeakPolarHBondContact OD1-CB 3.39Å; N125-S127 PolarHBondContact OD1-N 3.43Å; N125-S127 VanDerWaalsContact OD1-N 3.08Å; N125-S127 PolarHBondContact OD1-OG 2.91Å; N125-A128 WeakPolarHBondContact O-CB 3.38Å; N125-A128 PolarHBondContact O-N 2.84Å; N125-A128 VanDerWaalsContact O-N 3.09Å
126	P	72.4	Confident	75.9	Confident	31 Å²	31	89.1 Å²	89.1	20%	0.201	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-63.7	-19.2	179.9	-20.8	33.5	0	0	0	113	W79 F101 P124 A128 Q129	W79-P126 HydrophobicContact CB-CG 3.56Å; W79-P126 VanDerWaalsContact CD1-CD 3.44Å; W79-P126 VanDerWaalsContact CG-CD 3.41Å; W79-P126 HydrophobicContact CG-CG 3.94Å; F101-P126 HydrophobicContact CD1-CB 3.8Å; F101-P126 HydrophobicContact CD1-CG 3.86Å; F101-P126 HydrophobicContact CD2-CB 4.13Å; F101-P126 HydrophobicContact CE1-CB 3.52Å; F101-P126 HydrophobicContact CE1-CG 3.98Å; F101-P126 HydrophobicContact CE2-CB 3.9Å; F101-P126 HydrophobicContact CG-CB 4.1Å; F101-P126 HydrophobicContact CG-CG 4.28Å; F101-P126 HydrophobicContact CZ-CB 3.58Å; P124-P126 WeakPolarHBondContact O-CD 3.39Å; P126-A128 PolarHBondContact O-N 3.34Å; P126-Q129 PolarHBondContact O-N 3.35Å
127	S	68.9	Low	76.1	Confident	55 Å²	55	88.1 Å²	88.1	39%	0.385	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-62.9	-25.7	175.3	73.8	0	0	0	0	112.6	N125 N134	N125-S127 PolarHBondContact ND2-OG 2.77Å; N125-S127 PolarHBondContact O-N 2.93Å; N125-S127 VanDerWaalsContact O-N 3.14Å; N125-S127 WeakPolarHBondContact OD1-CB 3.39Å; N125-S127 PolarHBondContact OD1-N 3.43Å; N125-S127 VanDerWaalsContact OD1-N 3.08Å; N125-S127 PolarHBondContact OD1-OG 2.91Å; S127-N134 PolarHBondContact O-ND2 3.27Å; S127-N134 VanDerWaalsContact O-ND2 3.15Å
128	A	66.8	Low	76.3	Confident	81 Å²	81	82.5 Å²	82.5	67%	0.669	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-80.7	-17.7	-178.8	0	0	0	0	0	113.9	N125 P126	N125-A128 WeakPolarHBondContact O-CB 3.38Å; N125-A128 PolarHBondContact O-N 2.84Å; N125-A128 VanDerWaalsContact O-N 3.09Å; P126-A128 PolarHBondContact O-N 3.34Å
129	Q	66	Low	76.2	Confident	123 Å²	123	87.8 Å²	87.8	58%	0.575	47%	0.467	S	S	*	.	S	Bend	trans	-94.1	100.6	-179.1	-68.5	-173.5	-17.1	0	0	110.5	P126 T131 N134	P126-Q129 PolarHBondContact O-N 3.35Å; Q129-T131 VanDerWaalsContact C-N 3.33Å; Q129-T131 HydrophobicContact CB-CG2 4.13Å; Q129-T131 PolarHBondContact O-N 3.49Å; Q129-T131 PolarHBondContact O-OG1 3.38Å; Q129-N134 PolarHBondContact O-ND2 2.03Å; Q129-N134 PolarHBondContact O-OD1 2.81Å; Q129-N134 VanDerWaalsContact O-OD1 3.1Å
130	N	63.3	Low	75.8	Confident	131 Å²	131	84.5 Å²	84.5	70%	0.701	45%	0.452	S	S	*	.			trans	-56	89.6	172.4	-75	-13	0	0	0	111	Q135	N130-Q135 PolarHBondContact OD1-NE2 3.38Å
131	T	69.7	Low	75.1	Confident	63 Å²	63	85.3 Å²	85.3	39%	0.387	46%	0.461	S	S	.	.			trans	-130.2	155.4	-175.9	50.9	0	0	0	0	109	Q129 N133 N134 Q135	Q129-T131 VanDerWaalsContact C-N 3.33Å; Q129-T131 HydrophobicContact CB-CG2 4.13Å; Q129-T131 PolarHBondContact O-N 3.49Å; Q129-T131 PolarHBondContact O-OG1 3.38Å; T131-N133 PolarHBondContact O-N 2.83Å; T131-N134 PolarHBondContact N-OD1 3.17Å; T131-N134 PolarHBondContact O-N 2.98Å; T131-N134 PolarHBondContact O-OD1 3.2Å; T131-Q135 PolarHBondContact O-N 3.42Å
132	E	68.2	Low	74.6	Confident	190 Å²	190	83 Å²	83	89%	0.888	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-18.3	174.3	-65.7	-176.1	170.2	0	0	113
133	N	70.8	Confident	74.2	Confident	103 Å²	103	78.7 Å²	78.7	55%	0.551	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-38.2	173.2	-99.1	-31.5	0	0	0	112.8	R99 T131	R99-N133 WeakPolarHBondContact CD-O 3.31Å; R99-N133 PolarHBondContact NE-O 2.9Å; R99-N133 VanDerWaalsContact NH2-CB 3.28Å; R99-N133 VanDerWaalsContact NH2-CG 3.26Å; R99-N133 PolarHBondContact NH2-O 2.77Å; R99-N133 PolarHBondContact NH2-OD1 3.34Å; T131-N133 PolarHBondContact O-N 2.83Å
134	N	76.7	Confident	73.6	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-16.8	-176.9	75.6	-22.2	0	0	0	114	W85 V98 R99 F101 S127 Q129 T131	W85-N134 VanDerWaalsContact CZ3-O 3.31Å; W85-N134 WeakPolarHBondContact CZ3-O 3.39Å; V98-N134 WeakPolarHBondContact CA-O 3.41Å; V98-N134 VanDerWaalsContact CG1-O 3.24Å; V98-N134 WeakPolarHBondContact CG1-O 3.35Å; R99-N134 PolarHBondContact N-O 2.94Å; R99-N134 VanDerWaalsContact N-O 3.17Å; F101-N134 HydrophobicContact CE2-CB 3.94Å; F101-N134 HydrophobicContact CZ-CB 4.34Å; S127-N134 PolarHBondContact O-ND2 3.27Å; S127-N134 VanDerWaalsContact O-ND2 3.15Å; Q129-N134 PolarHBondContact O-ND2 2.03Å; Q129-N134 PolarHBondContact O-OD1 2.81Å; Q129-N134 VanDerWaalsContact O-OD1 3.1Å; T131-N134 PolarHBondContact N-OD1 3.17Å; T131-N134 PolarHBondContact O-N 2.98Å; T131-N134 PolarHBondContact O-OD1 3.2Å
135	Q	82.4	Confident	73.1	Confident	61 Å²	61	80 Å²	80	29%	0.285	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	137.6	-174.5	-74.5	175.9	17.9	0	0	112.8	V96 E97 V98 N130 T131	V96-Q135 HydrophobicContact CG1-CB 3.68Å; V96-Q135 HydrophobicContact CG1-CG 3.75Å; E97-Q135 WeakPolarHBondContact O-CA 3.48Å; V98-Q135 HydrophobicContact CG1-CG 4.3Å; V98-Q135 HydrophobicContact CG2-CG 4.23Å; N130-Q135 PolarHBondContact OD1-NE2 3.38Å; T131-Q135 PolarHBondContact O-N 3.42Å
136	R	84.2	Confident	73.3	Confident	86 Å²	86	78.2 Å²	78.2	33%	0.325	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	143.3	169.3	70.1	178.2	-175.6	-174.5	3.8	110.7	W85 V96 E97	W85-R136 HydrophobicContact CD2-CG 3.83Å; W85-R136 HydrophobicContact CE3-CB 4.38Å; W85-R136 HydrophobicContact CE3-CG 3.69Å; W85-R136 HydrophobicContact CG-CG 4.45Å; W85-R136 VanDerWaalsContact CG-NE 3.31Å; W85-R136 HydrophobicContact CH2-CB 4.05Å; W85-R136 HydrophobicContact CH2-CG 4.21Å; W85-R136 HydrophobicContact CZ2-CB 4.36Å; W85-R136 HydrophobicContact CZ2-CG 4.35Å; W85-R136 HydrophobicContact CZ3-CB 4.07Å; W85-R136 HydrophobicContact CZ3-CG 3.89Å; V96-R136 WeakPolarHBondContact CA-O 3.31Å; E97-R136 HydrophobicContact CB-CG 3.76Å; E97-R136 HydrophobicContact CG-CG 3.95Å; E97-R136 PolarHBondContact N-O 3.36Å; E97-R136 PolarHBondContact O-N 3.26Å; E97-R136 IonicContact OE1-CZ 2.77Å; E97-R136 IonicContact OE1-NE 2.82Å; E97-R136 PolarHBondContact OE1-NE 2.97Å; E97-R136 VanDerWaalsContact OE1-NE 3.12Å; E97-R136 IonicContact OE1-NH2 3.57Å; E97-R136 IonicContact OE2-CZ 2.69Å; E97-R136 IonicContact OE2-NE 2.62Å; E97-R136 PolarHBondContact OE2-NE 2.78Å; E97-R136 IonicContact OE2-NH2 2.79Å; E97-R136 PolarHBondContact OE2-NH2 3.35Å
137	A	81.9	Confident	73.8	Confident	87 Å²	87	81.1 Å²	81.1	72%	0.719	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	133.2	175.6	0	0	0	0	0	111.1	G95	G95-A137 WeakPolarHBondContact O-CA 3.33Å
138	C	82.5	Confident	74.5	Confident	7 Å²	7	81.2 Å²	81.2	5%	0.047	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	148.2	169.6	39.3	0	0	0	0	110.6	C88 D94 G95 V96 E97	C88-C138 VanDerWaalsContact CA-SG 3.52Å; C88-C138 HydrophobicContact CB-CB 3.9Å; C88-C138 WeakPolarHBondContact CB-SG 3.3Å; C88-C138 WeakPolarHBondContact SG-CB 3.49Å; C88-C138 CovalentContact SG-SG 2.03Å; C88-C138 PolarHBondContact SG-SG 2.93Å; D94-C138 WeakPolarHBondContact CA-O 3.11Å; G95-C138 PolarHBondContact N-O 2.78Å; G95-C138 PolarHBondContact O-N 2.81Å; G95-C138 PolarHBondContact O-SG 2.81Å; V96-C138 PolarHBondContact N-SG 3.47Å; E97-C138 HydrophobicContact CG-CB 3.51Å; E97-C138 WeakPolarHBondContact CG-SG 3.49Å; E97-C138 WeakPolarHBondContact OE1-CB 3.06Å
139	K	77.6	Confident	75.4	Confident	161 Å²	161	78.4 Å²	78.4	70%	0.7	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.9	109.9	171.9	-56.1	-162.8	174.1	-167.2	0	109.3	G93 D94	G93-K139 WeakPolarHBondContact O-CA 3.37Å; D94-K139 VanDerWaalsContact OD1-CD 3.31Å; D94-K139 WeakPolarHBondContact OD1-CD 3.15Å; D94-K139 WeakPolarHBondContact OD1-CE 3.37Å; D94-K139 VanDerWaalsContact OD1-CG 3.3Å; D94-K139 WeakPolarHBondContact OD1-CG 3.34Å; D94-K139 IonicContact OD1-NZ 2.72Å
140	L	73.1	Confident	76.3	Confident	43 Å²	43	77.3 Å²	77.3	23%	0.225	41%	0.413	C	S	.	.			trans	-97.4	5.9	-176.6	-67.8	-167.7	0	0	0	114.3	C88 E90 G93	C88-L140 HydrophobicContact CB-CD1 3.79Å; C88-L140 HydrophobicContact CB-CD2 4.41Å; C88-L140 HydrophobicContact CB-CG 4.08Å; E90-L140 WeakPolarHBondContact O-CD1 3.31Å; G93-L140 PolarHBondContact O-N 2.91Å
141	G	69.6	Low	77.3	Confident	17 Å²	17	73.3 Å²	73.3	18%	0.175	39%	0.393	C	S	.	.			trans	94.9	176.8	-177.4	0	0	0	0	0	113.3	G93	G93-G141 WeakPolarHBondContact CA-O 3.47Å; G93-G141 PolarHBondContact N-O 3.07Å
142	P	72.5	Confident	78.2	Confident	99 Å²	99	71.9 Å²	71.9	64%	0.643	39%	0.386	S	S	*	.			trans	-66.4	141	-175.2	28.6	-30.1	0	0	0	112.5	G144 Y196	P142-G144 PolarHBondContact O-N 3.21Å; P142-Y196 VanDerWaalsContact CD-CZ 3.47Å; P142-Y196 WeakPolarHBondContact CD-OH 3.36Å; P142-Y196 WeakPolarHBondContact CG-OH 3.38Å
143	C	71.9	Confident	79	Confident	86 Å²	86	68.9 Å²	68.9	58%	0.581	38%	0.376	S	S	*	.	S	Bend	trans	-74.9	106	172.9	-71.5	0	0	0	0	111.2	C92	C92-C143 HydrophobicContact CB-CB 3.93Å; C92-C143 WeakPolarHBondContact CB-SG 3.09Å; C92-C143 PolarHBondContact O-SG 3.3Å; C92-C143 WeakPolarHBondContact SG-CA 3.48Å; C92-C143 WeakPolarHBondContact SG-CB 3.16Å; C92-C143 CovalentContact SG-SG 2.04Å; C92-C143 PolarHBondContact SG-SG 2.98Å
144	G	71.9	Confident	79.6	Confident	56 Å²	56	66.2 Å²	66.2	58%	0.577	36%	0.358	S	S	*	.	S	Bend	trans	178.8	-179.7	178.8	0	0	0	0	0	113.3	P142 G146	P142-G144 PolarHBondContact O-N 3.21Å; G144-G146 PolarHBondContact O-N 2.74Å
145	K	68.3	Low	80.1	Confident	141 Å²	141	68.1 Å²	68.1	61%	0.613	38%	0.378	S	S	*	.	S	Bend	trans	-64.4	130.4	170.8	-67.5	178.6	-178	169.3	0	109.3
146	G	80.3	Confident	80.5	Confident	21 Å²	21	74.2 Å²	74.2	22%	0.216	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.9	-172.1	-176.7	0	0	0	0	0	113.2	G144 S176	G144-G146 PolarHBondContact O-N 2.74Å; G146-S176 PolarHBondContact O-N 3.13Å
147	Y	84.1	Confident	80.6	Confident	93 Å²	93	71.7 Å²	71.7	37%	0.365	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	125.9	179.1	-57.7	-67.8	0	0	0	110.9	V174 Y175 I184 Y192	Y147-V174 WeakPolarHBondContact CA-O 3.33Å; Y147-Y175 AromaticContact CD1-CD2 3.67Å; Y147-Y175 HydrophobicContact CD1-CD2 3.67Å; Y147-Y175 HydrophobicContact CD1-CG 4.24Å; Y147-Y175 AromaticContact CE1-CD2 3.56Å; Y147-Y175 HydrophobicContact CE1-CD2 3.56Å; Y147-Y175 HydrophobicContact CE1-CE2 4.48Å; Y147-Y175 HydrophobicContact CE1-CG 4.06Å; Y147-Y175 HydrophobicContact CE2-CD2 4.4Å; Y147-Y175 HydrophobicContact CG-CD2 4.2Å; Y147-Y175 AromaticContact CZ-CD2 3.94Å; Y147-I184 HydrophobicContact CD1-CD1 3.23Å; Y147-I184 HydrophobicContact CE1-CD1 3.41Å; Y147-I184 VanDerWaalsContact CE1-CD1 3.41Å; Y147-I184 HydrophobicContact CG-CD1 4.45Å; Y147-Y192 WeakPolarHBondContact CB-O 3.35Å; Y147-Y192 HydrophobicContact CD1-CD1 4.11Å; Y147-Y192 HydrophobicContact CD1-CG 4.12Å; Y147-Y192 HydrophobicContact CD2-CD1 4.11Å; Y147-Y192 AromaticContact CE1-CD1 3.51Å; Y147-Y192 HydrophobicContact CE1-CD1 3.51Å; Y147-Y192 HydrophobicContact CE1-CE1 4.18Å; Y147-Y192 AromaticContact CE1-CG 3.82Å; Y147-Y192 HydrophobicContact CE1-CG 3.82Å; Y147-Y192 AromaticContact CE2-CD1 3.55Å; Y147-Y192 HydrophobicContact CE2-CD1 3.55Å; Y147-Y192 HydrophobicContact CE2-CE1 4.23Å; Y147-Y192 HydrophobicContact CE2-CG 4.43Å; Y147-Y192 HydrophobicContact CG-CD1 4.37Å; Y147-Y192 AromaticContact CZ-CD1 3.19Å; Y147-Y192 AromaticContact CZ-CE1 3.66Å; Y147-Y192 AromaticContact CZ-CG 3.99Å; Y147-Y192 WeakPolarHBondContact OH-CD1 3.42Å; Y147-Y192 VanDerWaalsContact OH-CE1 3.29Å; Y147-Y192 WeakPolarHBondContact OH-CE1 3.31Å
148	R	82.6	Confident	81.1	Confident	57 Å²	57	71.4 Å²	71.4	22%	0.215	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	164	176.4	72.1	170.6	-171.7	-108.3	-12.7	112.2	V174 S176 D181 C193	R148-V174 HydrophobicContact CG-CG2 3.83Å; R148-V174 PolarHBondContact N-O 3.07Å; R148-V174 PolarHBondContact O-N 3.11Å; R148-S176 PolarHBondContact NH1-OG 2.77Å; R148-S176 PolarHBondContact NH2-OG 2.91Å; R148-D181 IonicContact CZ-OD1 3.12Å; R148-D181 IonicContact CZ-OD2 3.67Å; R148-D181 IonicContact NH2-OD1 3.78Å; R148-D181 PolarHBondContact NH2-OD1 3.49Å; R148-D181 IonicContact NH2-OD2 2.78Å; R148-D181 PolarHBondContact NH2-OD2 2.79Å; R148-C193 PolarHBondContact O-SG 3.18Å; R148-C193 VanDerWaalsContact O-SG 3.34Å
149	W	84.8	Confident	81.4	Confident	22 Å²	22	74.9 Å²	74.9	8%	0.083	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	123.2	172	-66.3	107.2	0	0	0	111.1	V171 C173 A189 C193 Y196 Q198 P199	W149-V171 HydrophobicContact CE3-CG1 3.84Å; W149-V171 HydrophobicContact CZ3-CG1 4.41Å; W149-C173 HydrophobicContact CE3-CB 4Å; W149-C173 HydrophobicContact CH2-CB 4.1Å; W149-C173 HydrophobicContact CZ3-CB 3.67Å; W149-A189 HydrophobicContact CH2-CB 3.83Å; W149-A189 HydrophobicContact CZ3-CB 4.25Å; W149-C193 HydrophobicContact CD2-CB 3.97Å; W149-C193 VanDerWaalsContact CE2-CB 3.42Å; W149-C193 HydrophobicContact CG-CB 4.46Å; W149-C193 HydrophobicContact CH2-CB 4.13Å; W149-C193 HydrophobicContact CZ2-CB 3.52Å; W149-C193 PolarHBondContact NE1-O 2.78Å; W149-C193 VanDerWaalsContact NE1-O 3.11Å; W149-Y196 PolarHBondContact NE1-O 3.22Å; W149-Q198 HydrophobicContact CD2-CG 4.2Å; W149-Q198 HydrophobicContact CE3-CG 4.24Å; W149-Q198 HydrophobicContact CH2-CB 4.41Å; W149-Q198 HydrophobicContact CH2-CG 3.83Å; W149-Q198 HydrophobicContact CZ2-CB 3.87Å; W149-Q198 HydrophobicContact CZ2-CG 3.77Å; W149-Q198 HydrophobicContact CZ3-CG 4.06Å; W149-Q198 VanDerWaalsContact CZ3-NE2 3.28Å; W149-P199 HydrophobicContact CB-CG 3.88Å; W149-P199 VanDerWaalsContact CG-CD 3.48Å; W149-P199 HydrophobicContact CG-CG 4.28Å
150	R	85.1	Confident	81.7	Confident	100 Å²	100	72.6 Å²	72.6	38%	0.377	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	129.4	169.4	-175.1	175.3	71.2	179.7	3.1	109.6	V171 Q172 V174	R150-V171 WeakPolarHBondContact O-CA 3.44Å; R150-Q172 PolarHBondContact N-O 2.65Å; R150-Q172 PolarHBondContact O-N 2.93Å; R150-V174 HydrophobicContact CB-CG1 3.91Å; R150-V174 HydrophobicContact CB-CG2 3.89Å
151	V	85.6	Confident	82.2	Confident	46 Å²	46	71.8 Å²	71.8	28%	0.279	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.9	-178.9	-64.2	0	0	0	0	111.4	D170 V171 P199	V151-D170 WeakPolarHBondContact CA-O 3.35Å; V151-V171 HydrophobicContact CG1-CG1 4.24Å; V151-V171 HydrophobicContact CG1-CG2 4.16Å; V151-P199 HydrophobicContact CG1-CB 3.5Å; V151-P199 VanDerWaalsContact CG1-CB 3.5Å; V151-P199 HydrophobicContact CG1-CG 3.53Å
152	S	87.5	Confident	82.6	Confident	33 Å²	33	71.1 Å²	71.1	23%	0.231	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-80.4	173	169.4	77.1	0	0	0	0	111.6	R169 D170	S152-R169 WeakPolarHBondContact OG-CB 3.15Å; S152-D170 PolarHBondContact N-O 2.84Å; S152-D170 PolarHBondContact OG-N 3.12Å
153	N	85.5	Confident	83	Confident	128 Å²	128	66.8 Å²	66.8	68%	0.684	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-62.1	155.8	161.1	60.1	-30.6	0	0	0	111	R169	N153-R169 WeakPolarHBondContact O-CB 3.48Å
154	W	84.4	Confident	83.6	Confident	46 Å²	46	68.4 Å²	68.4	17%	0.174	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-66.3	133.3	170	-70.5	113.6	0	0	0	110.7	W85 M167 R169 E200 A203	W85-W154 PolarHBondContact O-NE1 2.84Å; W154-M167 HydrophobicContact CB-SD 3.86Å; W154-M167 HydrophobicContact CD2-CG 4.13Å; W154-M167 HydrophobicContact CD2-SD 4.15Å; W154-M167 HydrophobicContact CE3-CB 4.42Å; W154-M167 HydrophobicContact CE3-CG 3.73Å; W154-M167 HydrophobicContact CE3-SD 4.34Å; W154-M167 HydrophobicContact CG-CG 4.5Å; W154-M167 HydrophobicContact CG-SD 3.97Å; W154-M167 HydrophobicContact CZ3-CG 4.29Å; W154-M167 WeakPolarHBondContact CZ3-O 3.38Å; W154-R169 HydrophobicContact CD2-CB 4.17Å; W154-R169 HydrophobicContact CD2-CG 4.18Å; W154-R169 HydrophobicContact CE3-CB 3.67Å; W154-R169 HydrophobicContact CE3-CG 3.71Å; W154-R169 HydrophobicContact CH2-CG 3.88Å; W154-R169 HydrophobicContact CZ2-CG 4.34Å; W154-R169 VanDerWaalsContact CZ2-CZ 3.43Å; W154-R169 HydrophobicContact CZ3-CB 3.98Å; W154-R169 HydrophobicContact CZ3-CG 3.55Å; W154-E200 HydrophobicContact CH2-CB 4.49Å; W154-E200 WeakPolarHBondContact CH2-O 3.17Å; W154-A203 HydrophobicContact CH2-CB 3.4Å; W154-A203 VanDerWaalsContact CH2-CB 3.4Å; W154-A203 HydrophobicContact CZ2-CB 3.66Å; W154-A203 HydrophobicContact CZ3-CB 3.86Å
155	G	87.4	Confident	84.3	Confident	40 Å²	40	65.8 Å²	65.8	41%	0.412	35%	0.349	S	S	.	.			trans	-74.2	-178.1	171	0	0	0	0	0	113.1	S168	G155-S168 PolarHBondContact N-O 3.04Å
156	H	89.5	Confident	85.3	Confident	189 Å²	189	63.1 Å²	63.1	88%	0.875	34%	0.34	S	S	*	.			trans	-63.5	146.5	175.5	-65.5	-63.4	0	0	0	112
157	C	87.7	Confident	85.7	Confident	34 Å²	34	62.6 Å²	62.6	23%	0.23	33%	0.332	C	S	.	.			trans	-68.8	136	175.1	-168.7	0	0	0	0	110.7	Q159 C205 N206	C157-Q159 VanDerWaalsContact C-N 3.25Å; C157-Q159 PolarHBondContact O-N 2.88Å; C157-Q159 PolarHBondContact SG-O 3.1Å; C157-C205 VanDerWaalsContact CA-SG 3.53Å; C157-C205 HydrophobicContact CB-CB 3.84Å; C157-C205 WeakPolarHBondContact CB-SG 3.48Å; C157-C205 WeakPolarHBondContact SG-CB 3.48Å; C157-C205 CovalentContact SG-SG 2.01Å; C157-C205 PolarHBondContact SG-SG 3.41Å; C157-N206 WeakPolarHBondContact CB-ND2 3.03Å; C157-N206 PolarHBondContact SG-ND2 2.93Å; C157-N206 VanDerWaalsContact SG-ND2 3.36Å
158	S	90.8	Very high	86.1	Confident	81 Å²	81	61.1 Å²	61.1	57%	0.566	34%	0.335	S	S	*	.	S	Bend	trans	-64	-25.1	179	49	0	0	0	0	114.5	I166	S158-I166 VanDerWaalsContact CB-O 3.3Å; S158-I166 WeakPolarHBondContact CB-O 3.29Å; S158-I166 PolarHBondContact N-O 3.33Å; S158-I166 PolarHBondContact OG-N 3.42Å; S158-I166 PolarHBondContact OG-O 3.1Å
159	Q	89.1	Confident	86.4	Confident	79 Å²	79	59.7 Å²	59.7	37%	0.369	33%	0.33	S	S	.	.			trans	-134.2	146.4	177.2	-60.2	-173.1	7.3	0	0	110.7	C157 C161 N206	C157-Q159 VanDerWaalsContact C-N 3.25Å; C157-Q159 PolarHBondContact O-N 2.88Å; C157-Q159 PolarHBondContact SG-O 3.1Å; Q159-C161 PolarHBondContact OE1-O 3.31Å; Q159-N206 WeakPolarHBondContact O-CB 3.33Å; Q159-N206 PolarHBondContact O-ND2 2.87Å
160	T	84.8	Confident	86.5	Confident	114 Å²	114	64.2 Å²	64.2	70%	0.699	36%	0.356	S	S	*	.	S	Bend	trans	-86.5	-14.1	179.6	51.2	0	0	0	0	113.6	F208	T160-F208 WeakPolarHBondContact O-CE2 3.41Å; T160-F208 WeakPolarHBondContact O-CZ 3.09Å
161	C	84	Confident	86.8	Confident	25 Å²	25	59.8 Å²	59.8	17%	0.169	34%	0.34	C	S	.	.	S	Bend	trans	-166.2	175.3	178.6	60.9	0	0	0	0	110.9	Q159 F208 C210	Q159-C161 PolarHBondContact OE1-O 3.31Å; C161-F208 HydrophobicContact CB-CD2 4.11Å; C161-F208 HydrophobicContact CB-CE2 3.9Å; C161-C210 HydrophobicContact CB-CB 3.9Å; C161-C210 WeakPolarHBondContact CB-SG 3.27Å; C161-C210 WeakPolarHBondContact SG-CA 3.06Å; C161-C210 WeakPolarHBondContact SG-CB 2.96Å; C161-C210 CovalentContact SG-SG 2.03Å; C161-C210 PolarHBondContact SG-SG 2.8Å
162	G	76.6	Confident	87	Confident	3 Å²	3	60.8 Å²	60.8	3%	0.031	34%	0.342	C	S	.	.	S	Bend	trans	100.2	-3.7	167.6	0	0	0	0	0	116.3	F208 C210 Q243	G162-F208 PolarHBondContact N-O 2.83Å; G162-C210 PolarHBondContact N-SG 2.75Å; G162-C210 VanDerWaalsContact N-SG 3.42Å; G162-Q243 VanDerWaalsContact O-O 3.08Å
163	G	80.7	Confident	87.1	Confident	9 Å²	9	59.2 Å²	59.2	9%	0.093	33%	0.331	C	S	.	.	S	Bend	trans	90.9	-12.1	171	0	0	0	0	0	116.9	V244	G163-V244 WeakPolarHBondContact CA-O 3.21Å
164	L	84.1	Confident	87.3	Confident	120 Å²	120	53.1 Å²	53.1	63%	0.628	30%	0.298	S	S	*	.			trans	-98.7	10.6	177.7	-62.5	175.3	0	0	0	113.5	I166	L164-I166 PolarHBondContact O-N 2.98Å
165	G	87.6	Confident	87.4	Confident	1 Å²	1	55 Å²	55	1%	0.01	31%	0.306	C	S	.	.			trans	-65.4	125.5	178.4	0	0	0	0	0	111.5	S204 C205	G165-S204 CarbonylContact O-C 3.6Å; G165-S204 WeakPolarHBondContact O-CA 3.31Å; G165-C205 CarbonylContact C-O 3.52Å; G165-C205 WeakPolarHBondContact CA-O 3.32Å; G165-C205 PolarHBondContact O-N 2.95Å
166	I	89.8	Confident	87.1	Confident	85 Å²	85	53.5 Å²	53.5	44%	0.436	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	135.2	172.2	-58.9	168	0	0	0	108.8	S158 L164 H202 A203	S158-I166 VanDerWaalsContact CB-O 3.3Å; S158-I166 WeakPolarHBondContact CB-O 3.29Å; S158-I166 PolarHBondContact N-O 3.33Å; S158-I166 PolarHBondContact OG-N 3.42Å; S158-I166 PolarHBondContact OG-O 3.1Å; L164-I166 PolarHBondContact O-N 2.98Å; I166-H202 HydrophobicContact CG2-CB 3.94Å; I166-A203 WeakPolarHBondContact CA-O 3.45Å
167	M	87.7	Confident	86.7	Confident	9 Å²	9	45.9 Å²	45.9	4%	0.044	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	151	166.5	59.8	-173.4	155.4	0	0	109.5	S84 W154 H202 A203 C205	S84-M167 WeakPolarHBondContact OG-CE 3.32Å; W154-M167 HydrophobicContact CB-SD 3.86Å; W154-M167 HydrophobicContact CD2-CG 4.13Å; W154-M167 HydrophobicContact CD2-SD 4.15Å; W154-M167 HydrophobicContact CE3-CB 4.42Å; W154-M167 HydrophobicContact CE3-CG 3.73Å; W154-M167 HydrophobicContact CE3-SD 4.34Å; W154-M167 HydrophobicContact CG-CG 4.5Å; W154-M167 HydrophobicContact CG-SD 3.97Å; W154-M167 HydrophobicContact CZ3-CG 4.29Å; W154-M167 WeakPolarHBondContact CZ3-O 3.38Å; M167-H202 WeakPolarHBondContact O-CA 3.3Å; M167-A203 HydrophobicContact CE-CB 4.07Å; M167-A203 HydrophobicContact CG-CB 4.34Å; M167-A203 PolarHBondContact N-O 3.27Å; M167-A203 PolarHBondContact O-N 2.03Å; M167-C205 HydrophobicContact CB-CB 4.5Å; M167-C205 HydrophobicContact CE-CB 3.85Å; M167-C205 HydrophobicContact CG-CB 4.17Å; M167-C205 PolarHBondContact N-SG 3.3Å; M167-C205 HydrophobicContact SD-CB 4.05Å
168	S	92.1	Very high	86.3	Confident	62 Å²	62	52.8 Å²	52.8	43%	0.434	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	148.1	-172.4	-45.5	0	0	0	0	109.6	G155 R201 H202	G155-S168 PolarHBondContact N-O 3.04Å; S168-R201 WeakPolarHBondContact CA-O 3.38Å; S168-H202 PolarHBondContact OG-CD2 3.39Å
169	R	88.8	Confident	85.9	Confident	28 Å²	28	57.2 Å²	57.2	11%	0.106	31%	0.305	C	S	.	.			trans	-138.3	154	171.1	69.3	179.4	173.9	-175.1	-7.7	109.8	S152 N153 W154 V171 E200 R201	S152-R169 WeakPolarHBondContact OG-CB 3.15Å; N153-R169 WeakPolarHBondContact O-CB 3.48Å; W154-R169 HydrophobicContact CD2-CB 4.17Å; W154-R169 HydrophobicContact CD2-CG 4.18Å; W154-R169 HydrophobicContact CE3-CB 3.67Å; W154-R169 HydrophobicContact CE3-CG 3.71Å; W154-R169 HydrophobicContact CH2-CG 3.88Å; W154-R169 HydrophobicContact CZ2-CG 4.34Å; W154-R169 VanDerWaalsContact CZ2-CZ 3.43Å; W154-R169 HydrophobicContact CZ3-CB 3.98Å; W154-R169 HydrophobicContact CZ3-CG 3.55Å; R169-V171 HydrophobicContact CG-CG2 4.05Å; R169-E200 VanDerWaalsContact CZ-O 3.3Å; R169-E200 PolarHBondContact NE-O 2.98Å; R169-E200 PolarHBondContact NH2-O 2.95Å; R169-R201 PolarHBondContact N-O 2.6Å
170	D	88.8	Confident	85.4	Confident	117 Å²	117	55.3 Å²	55.3	63%	0.626	31%	0.306	S	S	*	.			trans	-80.4	131.5	175.6	-66.9	-34.8	0	0	0	109.8	V151 S152	V151-D170 WeakPolarHBondContact CA-O 3.35Å; S152-D170 PolarHBondContact N-O 2.84Å; S152-D170 PolarHBondContact OG-N 3.12Å
171	V	89.9	Confident	85.5	Confident	7 Å²	7	52.5 Å²	52.5	4%	0.042	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	113.4	178.2	-177.4	0	0	0	0	107.7	W149 R150 V151 R169 Q198 P199 R201	W149-V171 HydrophobicContact CE3-CG1 3.84Å; W149-V171 HydrophobicContact CZ3-CG1 4.41Å; R150-V171 WeakPolarHBondContact O-CA 3.44Å; V151-V171 HydrophobicContact CG1-CG1 4.24Å; V151-V171 HydrophobicContact CG1-CG2 4.16Å; R169-V171 HydrophobicContact CG-CG2 4.05Å; V171-Q198 HydrophobicContact CG1-CG 4.37Å; V171-P199 HydrophobicContact CG1-CB 4.06Å; V171-P199 HydrophobicContact CG1-CG 4.2Å; V171-P199 HydrophobicContact CG2-CB 4.3Å; V171-R201 HydrophobicContact CB-CG 3.82Å; V171-R201 HydrophobicContact CG2-CG 3.75Å
172	Q	90.2	Very high	85.6	Confident	67 Å²	67	57 Å²	57	31%	0.313	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	137.6	-174.4	-68.3	177	-27.5	0	0	110.3	R150 V174 V183	R150-Q172 PolarHBondContact N-O 2.65Å; R150-Q172 PolarHBondContact O-N 2.93Å; Q172-V174 HydrophobicContact CB-CG1 4.48Å; Q172-V183 HydrophobicContact CB-CG1 4.45Å
173	C	89.2	Confident	86.2	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	126.1	169.9	177.3	0	0	0	0	108.1	W149 I184 A189 C193	W149-C173 HydrophobicContact CE3-CB 4Å; W149-C173 HydrophobicContact CH2-CB 4.1Å; W149-C173 HydrophobicContact CZ3-CB 3.67Å; C173-I184 HydrophobicContact CB-CB 4.22Å; C173-I184 WeakPolarHBondContact O-CB 2.94Å; C173-I184 PolarHBondContact O-N 2.88Å; C173-A189 HydrophobicContact CB-CB 3.62Å; C173-C193 VanDerWaalsContact CA-SG 3.58Å; C173-C193 HydrophobicContact CB-CB 3.88Å; C173-C193 WeakPolarHBondContact CB-SG 3.42Å; C173-C193 WeakPolarHBondContact SG-CB 3.43Å; C173-C193 CovalentContact SG-SG 2.04Å; C173-C193 PolarHBondContact SG-SG 2.81Å
174	V	89.2	Confident	86.5	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145	-179.6	-59	0	0	0	0	110.6	Y147 R148 R150 Q172 D181 L182 V183	Y147-V174 WeakPolarHBondContact CA-O 3.33Å; R148-V174 HydrophobicContact CG-CG2 3.83Å; R148-V174 PolarHBondContact N-O 3.07Å; R148-V174 PolarHBondContact O-N 3.11Å; R150-V174 HydrophobicContact CB-CG1 3.91Å; R150-V174 HydrophobicContact CB-CG2 3.89Å; Q172-V174 HydrophobicContact CB-CG1 4.48Å; V174-D181 HydrophobicContact CB-CB 4.11Å; V174-D181 HydrophobicContact CG1-CB 4.43Å; V174-D181 HydrophobicContact CG2-CB 4.33Å; V174-L182 CarbonylContact C-O 3.54Å; V174-L182 VanDerWaalsContact CA-O 3.25Å; V174-L182 WeakPolarHBondContact CA-O 3.43Å; V174-V183 HydrophobicContact CG1-CG2 4.29Å
175	Y	86.6	Confident	86.7	Confident	85 Å²	85	58.5 Å²	58.5	33%	0.333	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	121.7	165.3	178.7	-98.5	0	0	0	109.6	Y147 G177 D181 L182	Y147-Y175 AromaticContact CD1-CD2 3.67Å; Y147-Y175 HydrophobicContact CD1-CD2 3.67Å; Y147-Y175 HydrophobicContact CD1-CG 4.24Å; Y147-Y175 AromaticContact CE1-CD2 3.56Å; Y147-Y175 HydrophobicContact CE1-CD2 3.56Å; Y147-Y175 HydrophobicContact CE1-CE2 4.48Å; Y147-Y175 HydrophobicContact CE1-CG 4.06Å; Y147-Y175 HydrophobicContact CE2-CD2 4.4Å; Y147-Y175 HydrophobicContact CG-CD2 4.2Å; Y147-Y175 AromaticContact CZ-CD2 3.94Å; Y175-G177 PolarHBondContact O-N 2.81Å; Y175-D181 WeakPolarHBondContact O-CA 3.32Å; Y175-L182 PolarHBondContact N-O 2.8Å; Y175-L182 PolarHBondContact O-N 2.8Å
176	S	82.8	Confident	86.7	Confident	9 Å²	9	64.3 Å²	64.3	6%	0.063	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	99.2	-175.3	-58.9	0	0	0	0	110.9	G146 R148 D181	G146-S176 PolarHBondContact O-N 3.13Å; R148-S176 PolarHBondContact NH1-OG 2.77Å; R148-S176 PolarHBondContact NH2-OG 2.91Å; S176-D181 WeakPolarHBondContact CA-OD1 3.39Å; S176-D181 VanDerWaalsContact CB-OD1 3.26Å; S176-D181 WeakPolarHBondContact CB-OD1 3.32Å; S176-D181 PolarHBondContact OG-OD1 3.45Å
177	G	81.2	Confident	86.6	Confident	29 Å²	29	69 Å²	69	30%	0.299	37%	0.37	S	S	.	.			trans	-96.3	-166.2	-177.8	0	0	0	0	0	113.7	Y175 G180	Y175-G177 PolarHBondContact O-N 2.81Å; G177-G180 PolarHBondContact N-O 3.04Å
178	K	79.1	Confident	86.7	Confident	178 Å²	178	71.6 Å²	71.6	77%	0.774	38%	0.384	S	S	*	.	S	Bend	trans	-76.8	-32.8	173	-70.3	-175.3	178.5	-179.5	0	112.3	G180	K178-G180 VanDerWaalsContact C-N 3.29Å; K178-G180 PolarHBondContact O-N 3.02Å
179	D	81.1	Confident	86.5	Confident	174 Å²	174	68.8 Å²	68.8	93%	0.93	37%	0.365	S	S	*	.	S	Bend	trans	-92	12.4	-176.2	-52.3	-48.3	0	0	0	112.8
180	G	80	Confident	86.3	Confident	39 Å²	39	71.8 Å²	71.8	40%	0.402	39%	0.39	S	S	.	.			trans	109.2	-167.9	-176.4	0	0	0	0	0	113.7	G177 K178	G177-G180 PolarHBondContact N-O 3.04Å; K178-G180 VanDerWaalsContact C-N 3.29Å; K178-G180 PolarHBondContact O-N 3.02Å
181	D	85.3	Confident	86.3	Confident	55 Å²	55	75 Å²	75	29%	0.294	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	123.6	-179.6	-76.3	-8.2	0	0	0	111.1	R148 V174 Y175 S176	R148-D181 IonicContact CZ-OD1 3.12Å; R148-D181 IonicContact CZ-OD2 3.67Å; R148-D181 IonicContact NH2-OD1 3.78Å; R148-D181 PolarHBondContact NH2-OD1 3.49Å; R148-D181 IonicContact NH2-OD2 2.78Å; R148-D181 PolarHBondContact NH2-OD2 2.79Å; V174-D181 HydrophobicContact CB-CB 4.11Å; V174-D181 HydrophobicContact CG1-CB 4.43Å; V174-D181 HydrophobicContact CG2-CB 4.33Å; Y175-D181 WeakPolarHBondContact O-CA 3.32Å; S176-D181 WeakPolarHBondContact CA-OD1 3.39Å; S176-D181 VanDerWaalsContact CB-OD1 3.26Å; S176-D181 WeakPolarHBondContact CB-OD1 3.32Å; S176-D181 PolarHBondContact OG-OD1 3.45Å
182	L	86.4	Confident	86	Confident	120 Å²	120	78.4 Å²	78.4	63%	0.628	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	124	170.6	-64.8	172.8	0	0	0	109.7	V174 Y175	V174-L182 CarbonylContact C-O 3.54Å; V174-L182 VanDerWaalsContact CA-O 3.25Å; V174-L182 WeakPolarHBondContact CA-O 3.43Å; Y175-L182 PolarHBondContact N-O 2.8Å; Y175-L182 PolarHBondContact O-N 2.8Å
183	V	88.6	Confident	85.8	Confident	83 Å²	83	75.2 Å²	75.2	50%	0.503	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	125.2	179	-176.9	0	0	0	0	109.9	Q172 V174	Q172-V183 HydrophobicContact CB-CG1 4.45Å; V174-V183 HydrophobicContact CG1-CG2 4.29Å
184	I	88.5	Confident	85.4	Confident	24 Å²	24	77.3 Å²	77.3	12%	0.123	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-92	142.1	177.8	-63.8	171.5	0	0	0	108.5	Y147 C173 D188 Y192	Y147-I184 HydrophobicContact CD1-CD1 3.23Å; Y147-I184 HydrophobicContact CE1-CD1 3.41Å; Y147-I184 VanDerWaalsContact CE1-CD1 3.41Å; Y147-I184 HydrophobicContact CG-CD1 4.45Å; C173-I184 HydrophobicContact CB-CB 4.22Å; C173-I184 WeakPolarHBondContact O-CB 2.94Å; C173-I184 PolarHBondContact O-N 2.88Å; I184-D188 HydrophobicContact CG2-CB 3.92Å; I184-Y192 HydrophobicContact CD1-CD2 4.33Å; I184-Y192 HydrophobicContact CD1-CG 4.2Å; I184-Y192 HydrophobicContact CG2-CD2 3.68Å; I184-Y192 HydrophobicContact CG2-CE2 4.38Å; I184-Y192 HydrophobicContact CG2-CG 4.46Å
185	S	88.1	Confident	85	Confident	56 Å²	56	84 Å²	84	39%	0.392	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-59.5	146.4	178.7	91.3	0	0	0	0	110.9	F187 D188 A189	S185-F187 PolarHBondContact O-N 3.17Å; S185-F187 VanDerWaalsContact O-N 3.15Å; S185-F187 PolarHBondContact OG-N 2.85Å; S185-D188 PolarHBondContact O-N 3.3Å; S185-D188 VanDerWaalsContact O-N 3.08Å; S185-D188 PolarHBondContact OG-N 2.87Å; S185-D188 PolarHBondContact OG-OD2 3.25Å; S185-A189 WeakPolarHBondContact O-CB 3Å; S185-A189 PolarHBondContact O-N 2.96Å
186	D	86.2	Confident	84.5	Confident	124 Å²	124	83.2 Å²	83.2	66%	0.663	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-25.8	176.7	-76.4	-29.6	0	0	0	112.7
187	F	87.8	Confident	84.2	Confident	182 Å²	182	92.2 Å²	92.2	80%	0.798	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-41.1	176.1	-176.5	-97.4	0	0	0	111.8	S185	S185-F187 PolarHBondContact O-N 3.17Å; S185-F187 VanDerWaalsContact O-N 3.15Å; S185-F187 PolarHBondContact OG-N 2.85Å
188	D	91	Very high	84.3	Confident	64 Å²	64	94.6 Å²	94.6	34%	0.342	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-9.5	-178.7	-51.1	-59.3	0	0	0	113.1	I184 S185 S190 Y191 Y192	I184-D188 HydrophobicContact CG2-CB 3.92Å; S185-D188 PolarHBondContact O-N 3.3Å; S185-D188 VanDerWaalsContact O-N 3.08Å; S185-D188 PolarHBondContact OG-N 2.87Å; S185-D188 PolarHBondContact OG-OD2 3.25Å; D188-S190 VanDerWaalsContact C-N 3.28Å; D188-S190 PolarHBondContact O-N 2.83Å; D188-Y191 WeakPolarHBondContact O-CB 3.26Å; D188-Y191 PolarHBondContact O-N 2.74Å; D188-Y192 HydrophobicContact CB-CD2 3.59Å; D188-Y192 HydrophobicContact CB-CE2 3.56Å; D188-Y192 VanDerWaalsContact O-CD2 3.26Å; D188-Y192 WeakPolarHBondContact O-CD2 3.43Å; D188-Y192 PolarHBondContact O-N 3.04Å; D188-Y192 VanDerWaalsContact O-N 3.08Å
189	A	87.3	Confident	84.5	Confident	3 Å²	3	87.2 Å²	87.2	3%	0.025	45%	0.453	C	S	.	.	H	α-helix	trans	-58.9	-35.6	-173.6	0	0	0	0	0	113.3	W149 C173 S185 Y191 C193	W149-A189 HydrophobicContact CH2-CB 3.83Å; W149-A189 HydrophobicContact CZ3-CB 4.25Å; C173-A189 HydrophobicContact CB-CB 3.62Å; S185-A189 WeakPolarHBondContact O-CB 3Å; S185-A189 PolarHBondContact O-N 2.96Å; A189-Y191 VanDerWaalsContact C-N 3.32Å; A189-C193 WeakPolarHBondContact O-CA 3.38Å; A189-C193 WeakPolarHBondContact O-CB 3.35Å; A189-C193 PolarHBondContact O-N 2.67Å
190	S	85.8	Confident	84.8	Confident	91 Å²	91	83.1 Å²	83.1	64%	0.636	43%	0.428	S	S	*	.	H	α-helix	trans	-68.3	-32	176.4	60.9	0	0	0	0	112.6	D188 G194	D188-S190 VanDerWaalsContact C-N 3.28Å; D188-S190 PolarHBondContact O-N 2.83Å; S190-G194 WeakPolarHBondContact O-CA 3.27Å; S190-G194 PolarHBondContact O-N 2.65Å; S190-G194 VanDerWaalsContact O-N 3.15Å
191	Y	87.3	Confident	85.3	Confident	184 Å²	184	86.5 Å²	86.5	72%	0.722	43%	0.429	S	S	*	.	H	α-helix	trans	-73.8	-45.6	178	-179.4	-103.6	0	0	0	111	D188 A189	D188-Y191 WeakPolarHBondContact O-CB 3.26Å; D188-Y191 PolarHBondContact O-N 2.74Å; A189-Y191 VanDerWaalsContact C-N 3.32Å
192	Y	85.3	Confident	85.6	Confident	80 Å²	80	89.4 Å²	89.4	31%	0.314	44%	0.44	S	S	.	.	H	α-helix	trans	-83.7	-41.1	-174.3	-68.7	-63.8	0	0	0	113.9	Y147 I184 D188	Y147-Y192 WeakPolarHBondContact CB-O 3.35Å; Y147-Y192 HydrophobicContact CD1-CD1 4.11Å; Y147-Y192 HydrophobicContact CD1-CG 4.12Å; Y147-Y192 HydrophobicContact CD2-CD1 4.11Å; Y147-Y192 AromaticContact CE1-CD1 3.51Å; Y147-Y192 HydrophobicContact CE1-CD1 3.51Å; Y147-Y192 HydrophobicContact CE1-CE1 4.18Å; Y147-Y192 AromaticContact CE1-CG 3.82Å; Y147-Y192 HydrophobicContact CE1-CG 3.82Å; Y147-Y192 AromaticContact CE2-CD1 3.55Å; Y147-Y192 HydrophobicContact CE2-CD1 3.55Å; Y147-Y192 HydrophobicContact CE2-CE1 4.23Å; Y147-Y192 HydrophobicContact CE2-CG 4.43Å; Y147-Y192 HydrophobicContact CG-CD1 4.37Å; Y147-Y192 AromaticContact CZ-CD1 3.19Å; Y147-Y192 AromaticContact CZ-CE1 3.66Å; Y147-Y192 AromaticContact CZ-CG 3.99Å; Y147-Y192 WeakPolarHBondContact OH-CD1 3.42Å; Y147-Y192 VanDerWaalsContact OH-CE1 3.29Å; Y147-Y192 WeakPolarHBondContact OH-CE1 3.31Å; I184-Y192 HydrophobicContact CD1-CD2 4.33Å; I184-Y192 HydrophobicContact CD1-CG 4.2Å; I184-Y192 HydrophobicContact CG2-CD2 3.68Å; I184-Y192 HydrophobicContact CG2-CE2 4.38Å; I184-Y192 HydrophobicContact CG2-CG 4.46Å; D188-Y192 HydrophobicContact CB-CD2 3.59Å; D188-Y192 HydrophobicContact CB-CE2 3.56Å; D188-Y192 VanDerWaalsContact O-CD2 3.26Å; D188-Y192 WeakPolarHBondContact O-CD2 3.43Å; D188-Y192 PolarHBondContact O-N 3.04Å; D188-Y192 VanDerWaalsContact O-N 3.08Å
193	C	85.5	Confident	85.6	Confident	0 Å²	0	84.3 Å²	84.3	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-107.3	-0.4	-178	-66.6	0	0	0	0	114.2	R148 W149 C173 A189 N195 Y196	R148-C193 PolarHBondContact O-SG 3.18Å; R148-C193 VanDerWaalsContact O-SG 3.34Å; W149-C193 HydrophobicContact CD2-CB 3.97Å; W149-C193 VanDerWaalsContact CE2-CB 3.42Å; W149-C193 HydrophobicContact CG-CB 4.46Å; W149-C193 HydrophobicContact CH2-CB 4.13Å; W149-C193 HydrophobicContact CZ2-CB 3.52Å; W149-C193 PolarHBondContact NE1-O 2.78Å; W149-C193 VanDerWaalsContact NE1-O 3.11Å; C173-C193 VanDerWaalsContact CA-SG 3.58Å; C173-C193 HydrophobicContact CB-CB 3.88Å; C173-C193 WeakPolarHBondContact CB-SG 3.42Å; C173-C193 WeakPolarHBondContact SG-CB 3.43Å; C173-C193 CovalentContact SG-SG 2.04Å; C173-C193 PolarHBondContact SG-SG 2.81Å; A189-C193 WeakPolarHBondContact O-CA 3.38Å; A189-C193 WeakPolarHBondContact O-CB 3.35Å; A189-C193 PolarHBondContact O-N 2.67Å; C193-N195 PolarHBondContact O-N 3.35Å; C193-N195 VanDerWaalsContact O-N 3.14Å; C193-Y196 PolarHBondContact O-N 2.91Å; C193-Y196 VanDerWaalsContact O-N 3.15Å
194	G	80.2	Confident	85.5	Confident	44 Å²	44	81.9 Å²	81.9	45%	0.454	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-13.7	-173.1	0	0	0	0	0	116	S190 Y196	S190-G194 WeakPolarHBondContact O-CA 3.27Å; S190-G194 PolarHBondContact O-N 2.65Å; S190-G194 VanDerWaalsContact O-N 3.15Å; G194-Y196 PolarHBondContact O-N 3.15Å
195	N	80.4	Confident	85.3	Confident	140 Å²	140	81 Å²	81	75%	0.749	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-20.7	173.4	-67.1	-27.5	0	0	0	112.7	C193	C193-N195 PolarHBondContact O-N 3.35Å; C193-N195 VanDerWaalsContact O-N 3.14Å
196	Y	75.7	Confident	85	Confident	68 Å²	68	79.6 Å²	79.6	27%	0.267	39%	0.386	S	S	.	.	S	Bend	trans	-111	142.1	177	-50.9	-63.4	0	0	0	110.3	P142 W149 C193 G194 Q198	P142-Y196 VanDerWaalsContact CD-CZ 3.47Å; P142-Y196 WeakPolarHBondContact CD-OH 3.36Å; P142-Y196 WeakPolarHBondContact CG-OH 3.38Å; W149-Y196 PolarHBondContact NE1-O 3.22Å; C193-Y196 PolarHBondContact O-N 2.91Å; C193-Y196 VanDerWaalsContact O-N 3.15Å; G194-Y196 PolarHBondContact O-N 3.15Å; Y196-Q198 PolarHBondContact O-N 2.81Å
197	R	77.5	Confident	84.7	Confident	199 Å²	199	79.2 Å²	79.2	75%	0.751	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-55.5	118.4	176.3	-179.5	-179.9	174.2	-178.3	-2.8	109.2	P199 E200	R197-P199 WeakPolarHBondContact O-CD 3.49Å; R197-E200 IonicContact NH2-OE1 2.63Å
198	Q	82.4	Confident	84.3	Confident	78 Å²	78	71.2 Å²	71.2	36%	0.364	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-61.4	126	176.5	-174.5	170	31	0	0	109.9	W149 V171 Y196	W149-Q198 HydrophobicContact CD2-CG 4.2Å; W149-Q198 HydrophobicContact CE3-CG 4.24Å; W149-Q198 HydrophobicContact CH2-CB 4.41Å; W149-Q198 HydrophobicContact CH2-CG 3.83Å; W149-Q198 HydrophobicContact CZ2-CB 3.87Å; W149-Q198 HydrophobicContact CZ2-CG 3.77Å; W149-Q198 HydrophobicContact CZ3-CG 4.06Å; W149-Q198 VanDerWaalsContact CZ3-NE2 3.28Å; V171-Q198 HydrophobicContact CG1-CG 4.37Å; Y196-Q198 PolarHBondContact O-N 2.81Å
199	P	84	Confident	83.8	Confident	23 Å²	23	68.5 Å²	68.5	15%	0.149	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-61.6	144.8	173.6	-24.4	35.2	0	0	0	111.7	W149 V151 V171 R197 R201	W149-P199 HydrophobicContact CB-CG 3.88Å; W149-P199 VanDerWaalsContact CG-CD 3.48Å; W149-P199 HydrophobicContact CG-CG 4.28Å; V151-P199 HydrophobicContact CG1-CB 3.5Å; V151-P199 VanDerWaalsContact CG1-CB 3.5Å; V151-P199 HydrophobicContact CG1-CG 3.53Å; V171-P199 HydrophobicContact CG1-CB 4.06Å; V171-P199 HydrophobicContact CG1-CG 4.2Å; V171-P199 HydrophobicContact CG2-CB 4.3Å; R197-P199 WeakPolarHBondContact O-CD 3.49Å; P199-R201 PolarHBondContact O-N 3.41Å
200	E	86.5	Confident	83.6	Confident	88 Å²	88	69.1 Å²	69.1	41%	0.411	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-64.9	128.2	179.8	-67.8	166	-167.9	0	0	111	W154 R169 R197 H202	W154-E200 HydrophobicContact CH2-CB 4.49Å; W154-E200 WeakPolarHBondContact CH2-O 3.17Å; R169-E200 VanDerWaalsContact CZ-O 3.3Å; R169-E200 PolarHBondContact NE-O 2.98Å; R169-E200 PolarHBondContact NH2-O 2.95Å; R197-E200 IonicContact NH2-OE1 2.63Å; E200-H202 VanDerWaalsContact C-N 3.33Å
201	R	91.1	Very high	83.5	Confident	111 Å²	111	70.5 Å²	70.5	42%	0.419	33%	0.325	S	S	.	.	S	Bend	trans	-74.5	-24.1	172.3	-78.1	-176.1	-75.7	-77.6	-0.4	113.3	S168 R169 V171 P199	S168-R201 WeakPolarHBondContact CA-O 3.38Å; R169-R201 PolarHBondContact N-O 2.6Å; V171-R201 HydrophobicContact CB-CG 3.82Å; V171-R201 HydrophobicContact CG2-CG 3.75Å; P199-R201 PolarHBondContact O-N 3.41Å
202	H	92.2	Very high	83.4	Confident	115 Å²	115	62 Å²	62	53%	0.532	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	139.7	-174.3	-53.3	99.9	0	0	0	109.6	I166 M167 S168 E200	I166-H202 HydrophobicContact CG2-CB 3.94Å; M167-H202 WeakPolarHBondContact O-CA 3.3Å; S168-H202 PolarHBondContact OG-CD2 3.39Å; E200-H202 VanDerWaalsContact C-N 3.33Å
203	A	87.2	Confident	83.4	Confident	13 Å²	13	63 Å²	63	11%	0.107	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	151.5	173.6	0	0	0	0	0	110.7	W154 I166 M167	W154-A203 HydrophobicContact CH2-CB 3.4Å; W154-A203 VanDerWaalsContact CH2-CB 3.4Å; W154-A203 HydrophobicContact CZ2-CB 3.66Å; W154-A203 HydrophobicContact CZ3-CB 3.86Å; I166-A203 WeakPolarHBondContact CA-O 3.45Å; M167-A203 HydrophobicContact CE-CB 4.07Å; M167-A203 HydrophobicContact CG-CB 4.34Å; M167-A203 PolarHBondContact N-O 3.27Å; M167-A203 PolarHBondContact O-N 2.03Å
204	S	85.8	Confident	83.4	Confident	33 Å²	33	63.7 Å²	63.7	23%	0.231	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	144.3	172.5	49.2	0	0	0	0	111.7	E83 G165 R207	E83-S204 WeakPolarHBondContact OE2-CB 3.31Å; E83-S204 PolarHBondContact OE2-OG 3.02Å; G165-S204 CarbonylContact O-C 3.6Å; G165-S204 WeakPolarHBondContact O-CA 3.31Å; S204-R207 PolarHBondContact OG-NE 3.02Å; S204-R207 PolarHBondContact OG-NH2 3.18Å
205	C	84.5	Confident	83.8	Confident	5 Å²	5	64.2 Å²	64.2	3%	0.034	30%	0.297	C	S	.	.			trans	-144.7	157.2	179.7	52.1	0	0	0	0	110.8	C157 G165 M167 R207	C157-C205 VanDerWaalsContact CA-SG 3.53Å; C157-C205 HydrophobicContact CB-CB 3.84Å; C157-C205 WeakPolarHBondContact CB-SG 3.48Å; C157-C205 WeakPolarHBondContact SG-CB 3.48Å; C157-C205 CovalentContact SG-SG 2.01Å; C157-C205 PolarHBondContact SG-SG 3.41Å; G165-C205 CarbonylContact C-O 3.52Å; G165-C205 WeakPolarHBondContact CA-O 3.32Å; G165-C205 PolarHBondContact O-N 2.95Å; M167-C205 HydrophobicContact CB-CB 4.5Å; M167-C205 HydrophobicContact CE-CB 3.85Å; M167-C205 HydrophobicContact CG-CB 4.17Å; M167-C205 PolarHBondContact N-SG 3.3Å; M167-C205 HydrophobicContact SD-CB 4.05Å; C205-R207 PolarHBondContact O-N 2.99Å
206	N	81.2	Confident	84	Confident	27 Å²	27	59.9 Å²	59.9	14%	0.144	28%	0.277	C	S	.	.			trans	53.2	45.2	175.5	-59.2	-18.1	0	0	0	115.3	C157 Q159 F208	C157-N206 WeakPolarHBondContact CB-ND2 3.03Å; C157-N206 PolarHBondContact SG-ND2 2.93Å; C157-N206 VanDerWaalsContact SG-ND2 3.36Å; Q159-N206 WeakPolarHBondContact O-CB 3.33Å; Q159-N206 PolarHBondContact O-ND2 2.87Å; N206-F208 VanDerWaalsContact C-N 3.27Å; N206-F208 HydrophobicContact CB-CE1 3.81Å; N206-F208 HydrophobicContact CB-CZ 3.88Å; N206-F208 PolarHBondContact O-N 3.32Å
207	R	81	Confident	84.6	Confident	115 Å²	115	60.7 Å²	60.7	43%	0.434	28%	0.283	S	S	.	.			trans	-80.5	63.9	176.3	-65.2	-140.8	-148.7	-165.6	-0.9	113.6	E83 S204 C205 V244	E83-R207 VanDerWaalsContact CD-NE 3.33Å; E83-R207 WeakPolarHBondContact OE1-CB 3.34Å; E83-R207 WeakPolarHBondContact OE1-CD 3.41Å; E83-R207 VanDerWaalsContact OE1-CG 3.28Å; E83-R207 WeakPolarHBondContact OE1-CG 3.49Å; E83-R207 IonicContact OE1-NE 3.5Å; E83-R207 PolarHBondContact OE1-NE 2.8Å; E83-R207 WeakPolarHBondContact OE2-CD 2.96Å; E83-R207 WeakPolarHBondContact OE2-CG 3.43Å; E83-R207 IonicContact OE2-CZ 3.28Å; E83-R207 IonicContact OE2-NE 2.78Å; E83-R207 PolarHBondContact OE2-NE 3.48Å; E83-R207 IonicContact OE2-NH2 3.11Å; S204-R207 PolarHBondContact OG-NE 3.02Å; S204-R207 PolarHBondContact OG-NH2 3.18Å; C205-R207 PolarHBondContact O-N 2.99Å; R207-V244 HydrophobicContact CB-CG1 3.96Å
208	F	78.1	Confident	85.1	Confident	15 Å²	15	60.7 Å²	60.7	7%	0.066	29%	0.289	C	S	.	.	S	Bend	trans	-134.7	160.2	172.2	46	-97	0	0	0	110.8	L102 T112 L114 T160 C161 G162 N206	L102-F208 HydrophobicContact CD1-CE1 4.27Å; T112-F208 HydrophobicContact CG2-CB 4.36Å; L114-F208 HydrophobicContact CB-CE2 4.3Å; L114-F208 HydrophobicContact CB-CZ 4.17Å; L114-F208 HydrophobicContact CD1-CE1 4Å; L114-F208 HydrophobicContact CD1-CZ 3.96Å; T160-F208 WeakPolarHBondContact O-CE2 3.41Å; T160-F208 WeakPolarHBondContact O-CZ 3.09Å; C161-F208 HydrophobicContact CB-CD2 4.11Å; C161-F208 HydrophobicContact CB-CE2 3.9Å; G162-F208 PolarHBondContact N-O 2.83Å; N206-F208 VanDerWaalsContact C-N 3.27Å; N206-F208 HydrophobicContact CB-CE1 3.81Å; N206-F208 HydrophobicContact CB-CZ 3.88Å; N206-F208 PolarHBondContact O-N 3.32Å
209	A	80.3	Confident	85.2	Confident	6 Å²	6	59.8 Å²	59.8	5%	0.05	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-62.7	139.9	-178.8	0	0	0	0	0	111.1	V242	A209-V242 CarbonylContact C-O 3.51Å; A209-V242 WeakPolarHBondContact CA-O 3.43Å
210	C	84.6	Confident	85.2	Confident	17 Å²	17	60.3 Å²	60.3	12%	0.115	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-71.4	149.4	175.7	-72.5	0	0	0	0	111.4	C161 G162 S241 V242	C161-C210 HydrophobicContact CB-CB 3.9Å; C161-C210 WeakPolarHBondContact CB-SG 3.27Å; C161-C210 WeakPolarHBondContact SG-CA 3.06Å; C161-C210 WeakPolarHBondContact SG-CB 2.96Å; C161-C210 CovalentContact SG-SG 2.03Å; C161-C210 PolarHBondContact SG-SG 2.8Å; G162-C210 PolarHBondContact N-SG 2.75Å; G162-C210 VanDerWaalsContact N-SG 3.42Å; C210-S241 WeakPolarHBondContact O-CB 3.47Å; C210-S241 PolarHBondContact O-OG 2.03Å; C210-V242 HydrophobicContact CB-CB 3.97Å; C210-V242 HydrophobicContact CB-CG2 4.39Å; C210-V242 PolarHBondContact N-O 3.38Å
211	K	82.9	Confident	85.2	Confident	120 Å²	120	65.2 Å²	65.2	52%	0.522	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-54.1	146	170.1	61.4	-179.2	167	-176.2	0	111.3	E213	K211-E213 PolarHBondContact O-N 3.43Å
212	P	85.4	Confident	84.9	Confident	6 Å²	6	61.2 Å²	61.2	4%	0.039	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-56.5	137.9	176.6	-23.8	33.2	0	0	0	112.1	I240 L251 A255 C256 T259	P212-I240 WeakPolarHBondContact CA-O 3.29Å; P212-L251 HydrophobicContact CB-CD1 4.01Å; P212-L251 HydrophobicContact CG-CD1 3.77Å; P212-A255 HydrophobicContact CB-CB 4.15Å; P212-A255 HydrophobicContact CG-CB 4.04Å; P212-C256 VanDerWaalsContact CB-SG 3.59Å; P212-T259 HydrophobicContact CB-CG2 4.43Å
213	E	85.4	Confident	84.2	Confident	100 Å²	100	61.2 Å²	61.2	47%	0.467	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	141.1	178.7	-175.9	154	175.4	0	0	112.2	K211 V215 I240 C256 K261	K211-E213 PolarHBondContact O-N 3.43Å; E213-V215 PolarHBondContact O-N 2.02Å; E213-I240 PolarHBondContact N-O 2.83Å; E213-I240 PolarHBondContact O-N 2.82Å; E213-C256 PolarHBondContact N-SG 2.87Å; E213-C256 VanDerWaalsContact N-SG 3.36Å; E213-C256 PolarHBondContact O-SG 2.87Å; E213-K261 IonicContact OE1-NZ 3.73Å; E213-K261 IonicContact OE2-NZ 3.72Å; E213-K261 PolarHBondContact OE2-NZ 3.25Å
214	F	85.8	Confident	83.4	Confident	14 Å²	14	62.8 Å²	62.8	6%	0.061	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	113.9	173	-72.1	-67.3	0	0	0	110.2	L237 S238 M253 C256 Y257 I263	F214-L237 HydrophobicContact CB-CD1 4.43Å; F214-L237 HydrophobicContact CD1-CB 4.11Å; F214-L237 HydrophobicContact CD1-CD1 4.26Å; F214-L237 HydrophobicContact CG-CD1 4.44Å; F214-S238 CarbonylContact C-O 3.53Å; F214-S238 WeakPolarHBondContact CA-O 3.44Å; F214-M253 HydrophobicContact CE1-CE 4.17Å; F214-C256 HydrophobicContact CD1-CB 3.77Å; F214-C256 HydrophobicContact CD2-CB 3.75Å; F214-C256 HydrophobicContact CE1-CB 3.47Å; F214-C256 VanDerWaalsContact CE1-CB 3.47Å; F214-C256 HydrophobicContact CE2-CB 3.44Å; F214-C256 VanDerWaalsContact CE2-CB 3.44Å; F214-C256 HydrophobicContact CG-CB 3.91Å; F214-C256 HydrophobicContact CZ-CB 3.3Å; F214-Y257 HydrophobicContact CE2-CD1 4.35Å; F214-Y257 AromaticContact CZ-CD1 3.82Å; F214-Y257 HydrophobicContact CZ-CD1 3.82Å; F214-Y257 HydrophobicContact CZ-CD2 4.15Å; F214-Y257 AromaticContact CZ-CE1 3.87Å; F214-Y257 HydrophobicContact CZ-CE1 3.87Å; F214-Y257 HydrophobicContact CZ-CE2 4.19Å; F214-Y257 AromaticContact CZ-CG 3.95Å; F214-Y257 HydrophobicContact CZ-CG 3.95Å; F214-I263 HydrophobicContact CD2-CG1 4.21Å; F214-I263 HydrophobicContact CE2-CG1 3.9Å
215	V	87.9	Confident	82.8	Confident	55 Å²	55	67.1 Å²	67.1	33%	0.333	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.3	172.1	173.9	0	0	0	0	109.6	E213 L237 S238 I240	E213-V215 PolarHBondContact O-N 2.02Å; V215-L237 WeakPolarHBondContact O-CA 3.25Å; V215-S238 PolarHBondContact N-O 2.9Å; V215-S238 PolarHBondContact O-N 3.14Å; V215-S238 PolarHBondContact O-OG 2.71Å; V215-I240 HydrophobicContact CB-CD1 4.12Å; V215-I240 HydrophobicContact CB-CG1 4.29Å; V215-I240 HydrophobicContact CG2-CD1 3.45Å; V215-I240 VanDerWaalsContact CG2-CD1 3.45Å; V215-I240 HydrophobicContact CG2-CG1 3.59Å
216	P	84.9	Confident	81.9	Confident	49 Å²	49	68 Å²	68	32%	0.318	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	133.8	177.3	28.8	-32.1	0	0	0	112.2	L237	P216-L237 HydrophobicContact CB-CD2 3.79Å
217	E	87.8	Confident	81.2	Confident	86 Å²	86	69.4 Å²	69.4	40%	0.402	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-74	173.6	170.9	-66.5	-179.8	-160.8	0	0	112.1	R235 Q236	E217-R235 WeakPolarHBondContact O-CD 2.98Å; E217-Q236 WeakPolarHBondContact CB-O 3.34Å; E217-Q236 PolarHBondContact N-O 2.95Å
218	K	87.7	Confident	80.6	Confident	198 Å²	198	65.7 Å²	65.7	86%	0.861	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-58.2	142.2	172.2	-66.3	-175.5	-177.8	178.5	0	109.8	G220	K218-G220 PolarHBondContact O-N 2.62Å
219	W	85.1	Confident	80	Confident	60 Å²	60	70.1 Å²	70.1	23%	0.227	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-62.6	133.8	172.5	-70.3	104.6	0	0	0	110.4	Q233 R235 R268	W219-Q233 HydrophobicContact CB-CB 4.46Å; W219-Q233 HydrophobicContact CD2-CB 4.44Å; W219-Q233 HydrophobicContact CE3-CB 3.86Å; W219-Q233 WeakPolarHBondContact CZ3-O 3.38Å; W219-R235 HydrophobicContact CD2-CB 4.13Å; W219-R235 HydrophobicContact CD2-CG 4.16Å; W219-R235 HydrophobicContact CE3-CB 3.66Å; W219-R235 HydrophobicContact CE3-CG 3.72Å; W219-R235 HydrophobicContact CH2-CG 3.8Å; W219-R235 HydrophobicContact CZ2-CG 4.22Å; W219-R235 HydrophobicContact CZ3-CB 3.94Å; W219-R235 HydrophobicContact CZ3-CG 3.52Å; W219-R268 HydrophobicContact CD2-CG 4.13Å; W219-R268 HydrophobicContact CE3-CG 4.02Å; W219-R268 HydrophobicContact CH2-CB 3.93Å; W219-R268 HydrophobicContact CH2-CG 3.82Å; W219-R268 HydrophobicContact CZ2-CB 4.24Å; W219-R268 HydrophobicContact CZ2-CG 3.93Å; W219-R268 HydrophobicContact CZ3-CB 4.3Å; W219-R268 HydrophobicContact CZ3-CG 3.87Å
220	G	84.5	Confident	79.5	Confident	34 Å²	34	72.5 Å²	72.5	35%	0.351	38%	0.376	S	S	.	.			trans	-63.2	174.1	168.9	0	0	0	0	0	112.5	K218 Q233 V234	K218-G220 PolarHBondContact O-N 2.62Å; G220-Q233 WeakPolarHBondContact O-CG 3.32Å; G220-Q233 PolarHBondContact O-NE2 3.36Å; G220-V234 PolarHBondContact N-O 2.97Å
221	K	86.8	Confident	79	Confident	191 Å²	191	71.8 Å²	71.8	83%	0.83	37%	0.371	S	S	*	.			trans	-58.8	153.2	173.7	-63.5	-173.9	-180	-177.3	0	110.9	I223	K221-I223 PolarHBondContact O-N 2.85Å
222	C	83.1	Confident	78.8	Confident	27 Å²	27	73.5 Å²	73.5	18%	0.182	37%	0.374	C	S	.	.			trans	-68	112.2	175.6	-172.8	0	0	0	0	109.6	Q224 Q233 C270	C222-Q224 PolarHBondContact O-N 2.91Å; C222-Q233 HydrophobicContact CB-CG 4.3Å; C222-C270 WeakPolarHBondContact CA-SG 3.19Å; C222-C270 HydrophobicContact CB-CB 3.83Å; C222-C270 WeakPolarHBondContact CB-SG 3.5Å; C222-C270 WeakPolarHBondContact SG-CB 3.45Å; C222-C270 CovalentContact SG-SG 2.02Å; C222-C270 PolarHBondContact SG-SG 3.25Å
223	I	78	Confident	78.6	Confident	114 Å²	114	74.7 Å²	74.7	59%	0.585	38%	0.379	S	S	*	.	B	Isolated β-bridge	trans	-88.6	101	175.6	-54.8	169.2	0	0	0	107.2	K221 G231 R232	K221-I223 PolarHBondContact O-N 2.85Å; I223-G231 CarbonylContact O-C 3.59Å; I223-G231 VanDerWaalsContact O-CA 3.26Å; I223-G231 WeakPolarHBondContact O-CA 2.96Å; I223-R232 WeakPolarHBondContact CB-O 3.27Å; I223-R232 PolarHBondContact N-O 2.91Å; I223-R232 PolarHBondContact O-N 2.97Å
224	Q	69.8	Low	78.1	Confident	47 Å²	47	73.7 Å²	73.7	22%	0.22	38%	0.38	C	S	.	.			trans	-115.7	96.7	176.7	-168.8	-177.9	37.4	0	0	109.1	C222 D226 P227 R229 E272	C222-Q224 PolarHBondContact O-N 2.91Å; Q224-D226 VanDerWaalsContact C-N 3.33Å; Q224-D226 WeakPolarHBondContact CG-O 3.26Å; Q224-P227 PolarHBondContact NE2-O 2.95Å; Q224-R229 PolarHBondContact NE2-O 3.03Å; Q224-E272 VanDerWaalsContact OE1-CB 3.28Å
225	S	73.9	Confident	77.6	Confident	124 Å²	124	74.7 Å²	74.7	87%	0.867	38%	0.383	S	S	*	.	S	Bend	trans	-75.1	-26.1	174.9	52.6	0	0	0	0	112.7
226	D	65.6	Low	77.2	Confident	24 Å²	24	78.6 Å²	78.6	13%	0.128	40%	0.398	C	S	.	.	S	Bend	trans	-123.1	113.4	176.9	-175.8	5.3	0	0	0	109.3	Q224 C228 R229 K281 Y325	Q224-D226 VanDerWaalsContact C-N 3.33Å; Q224-D226 WeakPolarHBondContact CG-O 3.26Å; D226-C228 PolarHBondContact O-N 2.84Å; D226-C228 PolarHBondContact OD1-N 2.88Å; D226-R229 HydrophobicContact CB-CB 4.27Å; D226-R229 HydrophobicContact CB-CG 4.27Å; D226-R229 PolarHBondContact O-N 3.2Å; D226-R229 IonicContact OD2-NE 3.51Å; D226-K281 IonicContact OD1-NZ 3.75Å; D226-K281 PolarHBondContact OD1-NZ 2.8Å; D226-K281 VanDerWaalsContact OD1-NZ 3.16Å; D226-Y325 PolarHBondContact OD1-OH 3.44Å; D226-Y325 PolarHBondContact OD2-OH 3.13Å
227	P	66.9	Low	77	Confident	56 Å²	56	76.8 Å²	76.8	36%	0.364	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-16.2	-178	22.5	-32.5	0	0	0	113.4	Q224	Q224-P227 PolarHBondContact NE2-O 2.95Å
228	C	68.8	Low	76.8	Confident	37 Å²	37	73.9 Å²	73.9	25%	0.25	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-3.8	178.9	-54.2	0	0	0	0	114.3	D226 C278 Y325	D226-C228 PolarHBondContact O-N 2.84Å; D226-C228 PolarHBondContact OD1-N 2.88Å; C228-C278 WeakPolarHBondContact CA-SG 3.15Å; C228-C278 HydrophobicContact CB-CB 3.75Å; C228-C278 WeakPolarHBondContact CB-SG 3.31Å; C228-C278 VanDerWaalsContact SG-CA 3.54Å; C228-C278 WeakPolarHBondContact SG-CB 3.48Å; C228-C278 CovalentContact SG-SG 2.03Å; C228-C278 PolarHBondContact SG-SG 3.1Å; C228-Y325 HydrophobicContact CB-CE1 3.7Å; C228-Y325 WeakPolarHBondContact CB-OH 3.27Å
229	R	64.1	Low	76.6	Confident	107 Å²	107	64.7 Å²	64.7	40%	0.404	34%	0.335	S	S	.	.	S	Bend	trans	-115.4	149.5	180	-71.8	179.7	164.5	-122.3	-28.8	110.6	Q224 D226 G231 Q324	Q224-R229 PolarHBondContact NE2-O 3.03Å; D226-R229 HydrophobicContact CB-CB 4.27Å; D226-R229 HydrophobicContact CB-CG 4.27Å; D226-R229 PolarHBondContact O-N 3.2Å; D226-R229 IonicContact OD2-NE 3.51Å; R229-G231 PolarHBondContact O-N 2.94Å; R229-G231 VanDerWaalsContact O-N 3.13Å; R229-Q324 VanDerWaalsContact NH2-OE1 3.12Å
230	P	70	Confident	76.8	Confident	56 Å²	56	62.9 Å²	62.9	36%	0.364	33%	0.33	S	S	.	.			trans	-54.4	125	165.7	-15	25.2	0	0	0	108.7	R269 C270 F271	P230-R269 HydrophobicContact CB-CB 4.15Å; P230-R269 HydrophobicContact CB-CG 4.35Å; P230-C270 CarbonylContact C-O 3.58Å; P230-C270 VanDerWaalsContact CA-O 3.28Å; P230-C270 WeakPolarHBondContact CA-O 3.49Å; P230-F271 HydrophobicContact CB-CD1 4.1Å; P230-F271 HydrophobicContact CB-CE1 3.69Å; P230-F271 HydrophobicContact CB-CZ 3.96Å; P230-F271 HydrophobicContact CG-CD1 4.32Å; P230-F271 HydrophobicContact CG-CE1 3.57Å; P230-F271 HydrophobicContact CG-CZ 3.98Å
231	G	75	Confident	76.9	Confident	2 Å²	2	61.3 Å²	61.3	2%	0.021	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	174.2	170.9	0	0	0	0	0	111.2	I223 R229 R269 C270	I223-G231 CarbonylContact O-C 3.59Å; I223-G231 VanDerWaalsContact O-CA 3.26Å; I223-G231 WeakPolarHBondContact O-CA 2.96Å; R229-G231 PolarHBondContact O-N 2.94Å; R229-G231 VanDerWaalsContact O-N 3.13Å; G231-R269 WeakPolarHBondContact O-CA 3.47Å; G231-C270 VanDerWaalsContact CA-SG 3.57Å; G231-C270 PolarHBondContact N-O 2.83Å; G231-C270 PolarHBondContact O-N 3.43Å; G231-C270 PolarHBondContact O-SG 3.28Å; G231-C270 VanDerWaalsContact O-SG 3.41Å
232	R	79.3	Confident	76.9	Confident	156 Å²	156	54.5 Å²	54.5	59%	0.589	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118	130.5	177.1	-63.6	-177.9	-178.9	-140.4	2.7	109.9	I223 C270	I223-R232 WeakPolarHBondContact CB-O 3.27Å; I223-R232 PolarHBondContact N-O 2.91Å; I223-R232 PolarHBondContact O-N 2.97Å; R232-C270 PolarHBondContact N-SG 2.99Å; R232-C270 VanDerWaalsContact N-SG 3.43Å
233	Q	80.6	Confident	77	Confident	31 Å²	31	55 Å²	55	15%	0.145	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	132	164.5	-75.4	-179.2	-52.6	0	0	108.6	W219 G220 C222 W267 R268 C270	W219-Q233 HydrophobicContact CB-CB 4.46Å; W219-Q233 HydrophobicContact CD2-CB 4.44Å; W219-Q233 HydrophobicContact CE3-CB 3.86Å; W219-Q233 WeakPolarHBondContact CZ3-O 3.38Å; G220-Q233 WeakPolarHBondContact O-CG 3.32Å; G220-Q233 PolarHBondContact O-NE2 3.36Å; C222-Q233 HydrophobicContact CB-CG 4.3Å; Q233-W267 CarbonylContact O-C 3.56Å; Q233-W267 VanDerWaalsContact O-CA 3.25Å; Q233-W267 WeakPolarHBondContact O-CA 3.21Å; Q233-R268 HydrophobicContact CB-CG 4Å; Q233-R268 PolarHBondContact N-O 2.77Å; Q233-R268 PolarHBondContact O-N 2.79Å; Q233-R268 VanDerWaalsContact OE1-CZ 3.31Å; Q233-C270 HydrophobicContact CG-CB 3.84Å
234	V	75.7	Confident	77.1	Confident	80 Å²	80	52.7 Å²	52.7	49%	0.485	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	143.9	174.7	-177.1	0	0	0	0	107.7	G220 T266	G220-V234 PolarHBondContact N-O 2.97Å; V234-T266 CarbonylContact C-O 3.58Å; V234-T266 WeakPolarHBondContact CA-O 3.19Å
235	R	74.5	Confident	77.7	Confident	34 Å²	34	56.5 Å²	56.5	13%	0.128	30%	0.301	C	S	.	.			trans	-133.2	149.8	170	68.9	-179.1	173.2	179.6	2.8	109.4	E217 W219 P265 T266	E217-R235 WeakPolarHBondContact O-CD 2.98Å; W219-R235 HydrophobicContact CD2-CB 4.13Å; W219-R235 HydrophobicContact CD2-CG 4.16Å; W219-R235 HydrophobicContact CE3-CB 3.66Å; W219-R235 HydrophobicContact CE3-CG 3.72Å; W219-R235 HydrophobicContact CH2-CG 3.8Å; W219-R235 HydrophobicContact CZ2-CG 4.22Å; W219-R235 HydrophobicContact CZ3-CB 3.94Å; W219-R235 HydrophobicContact CZ3-CG 3.52Å; R235-P265 PolarHBondContact NE-O 2.88Å; R235-P265 PolarHBondContact NH2-O 2.88Å; R235-T266 PolarHBondContact N-O 3.33Å
236	Q	78.6	Confident	77.9	Confident	137 Å²	137	52.3 Å²	52.3	64%	0.64	28%	0.277	S	S	*	.			trans	-85.7	164.9	170.6	-63.5	-177.5	-37.4	0	0	109.8	E217	E217-Q236 WeakPolarHBondContact CB-O 3.34Å; E217-Q236 PolarHBondContact N-O 2.95Å
237	L	80.9	Confident	78.8	Confident	12 Å²	12	53.7 Å²	53.7	6%	0.063	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	131	172.5	-58.6	175.2	0	0	0	106.9	F214 V215 P216 M253 I263 Q264 T266	F214-L237 HydrophobicContact CB-CD1 4.43Å; F214-L237 HydrophobicContact CD1-CB 4.11Å; F214-L237 HydrophobicContact CD1-CD1 4.26Å; F214-L237 HydrophobicContact CG-CD1 4.44Å; V215-L237 WeakPolarHBondContact O-CA 3.25Å; P216-L237 HydrophobicContact CB-CD2 3.79Å; L237-M253 HydrophobicContact CB-CE 4.03Å; L237-M253 WeakPolarHBondContact O-CE 3.37Å; L237-I263 HydrophobicContact CD1-CG2 3.26Å; L237-Q264 HydrophobicContact CD2-CB 4.16Å; L237-T266 HydrophobicContact CD1-CG2 3.83Å; L237-T266 HydrophobicContact CG-CG2 3.91Å
238	S	83.8	Confident	79.8	Confident	25 Å²	25	56.5 Å²	56.5	18%	0.175	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	145	167.6	55.8	0	0	0	0	109.1	F214 V215	F214-S238 CarbonylContact C-O 3.53Å; F214-S238 WeakPolarHBondContact CA-O 3.44Å; V215-S238 PolarHBondContact N-O 2.9Å; V215-S238 PolarHBondContact O-N 3.14Å; V215-S238 PolarHBondContact O-OG 2.71Å
239	C	83.9	Confident	80.5	Confident	4 Å²	4	59.4 Å²	59.4	3%	0.027	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	117.2	171.3	179.2	0	0	0	0	107.5	L251 C256	C239-L251 PolarHBondContact O-N 3.07Å; C239-C256 WeakPolarHBondContact CA-SG 3.38Å; C239-C256 HydrophobicContact CB-CB 3.86Å; C239-C256 WeakPolarHBondContact CB-SG 3.35Å; C239-C256 WeakPolarHBondContact SG-CB 3.32Å; C239-C256 PolarHBondContact SG-N 3.11Å; C239-C256 CovalentContact SG-SG 2.03Å; C239-C256 PolarHBondContact SG-SG 3.32Å
240	I	89	Confident	81.6	Confident	22 Å²	22	61.9 Å²	61.9	11%	0.113	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	155.7	-177	71.2	171.8	0	0	0	111.9	P212 E213 V215 L248 R249 E250	P212-I240 WeakPolarHBondContact CA-O 3.29Å; E213-I240 PolarHBondContact N-O 2.83Å; E213-I240 PolarHBondContact O-N 2.82Å; V215-I240 HydrophobicContact CB-CD1 4.12Å; V215-I240 HydrophobicContact CB-CG1 4.29Å; V215-I240 HydrophobicContact CG2-CD1 3.45Å; V215-I240 VanDerWaalsContact CG2-CD1 3.45Å; V215-I240 HydrophobicContact CG2-CG1 3.59Å; I240-L248 HydrophobicContact CD1-CB 4.46Å; I240-L248 HydrophobicContact CD1-CD1 4.1Å; I240-L248 HydrophobicContact CD1-CD2 4.01Å; I240-L248 HydrophobicContact CD1-CG 4.42Å; I240-R249 CarbonylContact C-O 3.57Å; I240-R249 VanDerWaalsContact CA-O 3.26Å; I240-R249 WeakPolarHBondContact CA-O 3.45Å; I240-E250 HydrophobicContact CG2-CG 4.05Å
241	S	86.8	Confident	82.1	Confident	1 Å²	1	60 Å²	60	1%	0.007	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	126.4	172.7	166.4	0	0	0	0	109.5	C210 Q243 R249	C210-S241 WeakPolarHBondContact O-CB 3.47Å; C210-S241 PolarHBondContact O-OG 2.03Å; S241-Q243 PolarHBondContact O-N 2.81Å; S241-Q243 PolarHBondContact O-NE2 3.37Å; S241-Q243 VanDerWaalsContact O-NE2 3.14Å; S241-Q243 PolarHBondContact OG-NE2 2.67Å; S241-Q243 VanDerWaalsContact OG-NE2 3.15Å; S241-R249 PolarHBondContact N-O 3.44Å; S241-R249 PolarHBondContact O-N 2.76Å
242	V	86.9	Confident	82.2	Confident	49 Å²	49	63.2 Å²	63.2	30%	0.297	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	118.3	173.8	-173.2	0	0	0	0	108.5	A209 C210 L248	A209-V242 CarbonylContact C-O 3.51Å; A209-V242 WeakPolarHBondContact CA-O 3.43Å; C210-V242 HydrophobicContact CB-CB 3.97Å; C210-V242 HydrophobicContact CB-CG2 4.39Å; C210-V242 PolarHBondContact N-O 3.38Å; V242-L248 HydrophobicContact CB-CD2 4.5Å; V242-L248 HydrophobicContact CG2-CD2 3.82Å
243	Q	84.4	Confident	82	Confident	36 Å²	36	59.5 Å²	59.5	17%	0.168	32%	0.319	C	S	.	.			trans	-82.2	167.2	179.1	-58	-56.3	-60.6	0	0	111.2	G162 S241 N245 G246 S247 R249	G162-Q243 VanDerWaalsContact O-O 3.08Å; S241-Q243 PolarHBondContact O-N 2.81Å; S241-Q243 PolarHBondContact O-NE2 3.37Å; S241-Q243 VanDerWaalsContact O-NE2 3.14Å; S241-Q243 PolarHBondContact OG-NE2 2.67Å; S241-Q243 VanDerWaalsContact OG-NE2 3.15Å; Q243-N245 VanDerWaalsContact CB-OD1 3.27Å; Q243-N245 WeakPolarHBondContact CB-OD1 3.32Å; Q243-N245 PolarHBondContact O-N 2.03Å; Q243-G246 PolarHBondContact O-N 2.95Å; Q243-S247 WeakPolarHBondContact CB-O 3.47Å; Q243-S247 PolarHBondContact N-O 2.95Å; Q243-R249 HydrophobicContact CG-CB 3.73Å
244	V	80.4	Confident	81.7	Confident	66 Å²	66	60.4 Å²	60.4	40%	0.4	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-28.7	-179.1	-175.4	0	0	0	0	113.1	G163 R207 G246	G163-V244 WeakPolarHBondContact CA-O 3.21Å; R207-V244 HydrophobicContact CB-CG1 3.96Å; V244-G246 PolarHBondContact O-N 3.16Å
245	N	81.7	Confident	81.5	Confident	127 Å²	127	56.7 Å²	56.7	68%	0.679	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	5.2	175.8	67	-7.8	0	0	0	113.4	Q243 S247	Q243-N245 VanDerWaalsContact CB-OD1 3.27Å; Q243-N245 WeakPolarHBondContact CB-OD1 3.32Å; Q243-N245 PolarHBondContact O-N 2.03Å; N245-S247 VanDerWaalsContact CG-OG 3.26Å; N245-S247 PolarHBondContact ND2-OG 3.14Å; N245-S247 VanDerWaalsContact ND2-OG 3.14Å; N245-S247 PolarHBondContact O-N 3.18Å; N245-S247 VanDerWaalsContact OD1-CB 3.23Å; N245-S247 WeakPolarHBondContact OD1-CB 3.21Å; N245-S247 PolarHBondContact OD1-N 2.83Å; N245-S247 PolarHBondContact OD1-OG 3.07Å
246	G	79.2	Confident	81.7	Confident	36 Å²	36	55 Å²	55	37%	0.371	30%	0.304	S	S	.	.	S	Bend	trans	77.2	-3.6	-174.3	0	0	0	0	0	114.9	Q243 V244	Q243-G246 PolarHBondContact O-N 2.95Å; V244-G246 PolarHBondContact O-N 3.16Å
247	S	85.1	Confident	81.7	Confident	53 Å²	53	54.8 Å²	54.8	37%	0.371	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-72.7	148.7	176.1	71.1	0	0	0	0	111.6	Q243 N245	Q243-S247 WeakPolarHBondContact CB-O 3.47Å; Q243-S247 PolarHBondContact N-O 2.95Å; N245-S247 VanDerWaalsContact CG-OG 3.26Å; N245-S247 PolarHBondContact ND2-OG 3.14Å; N245-S247 VanDerWaalsContact ND2-OG 3.14Å; N245-S247 PolarHBondContact O-N 3.18Å; N245-S247 VanDerWaalsContact OD1-CB 3.23Å; N245-S247 WeakPolarHBondContact OD1-CB 3.21Å; N245-S247 PolarHBondContact OD1-N 2.83Å; N245-S247 PolarHBondContact OD1-OG 3.07Å
248	L	86.2	Confident	81.1	Confident	115 Å²	115	60.5 Å²	60.5	60%	0.602	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	121.9	173.8	-58	177.7	0	0	0	108.8	I240 V242	I240-L248 HydrophobicContact CD1-CB 4.46Å; I240-L248 HydrophobicContact CD1-CD1 4.1Å; I240-L248 HydrophobicContact CD1-CD2 4.01Å; I240-L248 HydrophobicContact CD1-CG 4.42Å; V242-L248 HydrophobicContact CB-CD2 4.5Å; V242-L248 HydrophobicContact CG2-CD2 3.82Å
249	R	84.7	Confident	80.5	Confident	99 Å²	99	61.6 Å²	61.6	37%	0.374	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.1	172.9	-175.9	178.3	176.2	-161	-4.9	109.6	Y109 I240 S241 Q243 L251	Y109-R249 PolarHBondContact O-NH1 3.05Å; I240-R249 CarbonylContact C-O 3.57Å; I240-R249 VanDerWaalsContact CA-O 3.26Å; I240-R249 WeakPolarHBondContact CA-O 3.45Å; S241-R249 PolarHBondContact N-O 3.44Å; S241-R249 PolarHBondContact O-N 2.76Å; Q243-R249 HydrophobicContact CG-CB 3.73Å; R249-L251 HydrophobicContact CG-CD2 4.18Å
250	E	86.7	Confident	79.8	Confident	158 Å²	158	64.9 Å²	64.9	74%	0.738	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	133.3	169.6	-68.3	-174.4	175.9	0	0	110.4	I240	I240-E250 HydrophobicContact CG2-CG 4.05Å
251	L	80	Confident	79.1	Confident	18 Å²	18	67 Å²	67	9%	0.094	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	158.7	-178.4	-64.1	176.7	0	0	0	109.9	P212 C239 R249 A255	P212-L251 HydrophobicContact CB-CD1 4.01Å; P212-L251 HydrophobicContact CG-CD1 3.77Å; C239-L251 PolarHBondContact O-N 3.07Å; R249-L251 HydrophobicContact CG-CD2 4.18Å; L251-A255 HydrophobicContact CB-CB 4.18Å; L251-A255 HydrophobicContact CD1-CB 4.26Å
252	P	77.6	Confident	78.3	Confident	68 Å²	68	71.5 Å²	71.5	44%	0.442	41%	0.412	S	S	.	.			trans	-59.8	144.8	170.1	-21.1	33	0	0	0	111.4	Y109 A254 A255	Y109-P252 HydrophobicContact CE1-CG 3.9Å; P252-A254 PolarHBondContact O-N 2.85Å; P252-A255 WeakPolarHBondContact O-CB 3.24Å; P252-A255 PolarHBondContact O-N 3Å
253	M	75.6	Confident	77.8	Confident	78 Å²	78	73.2 Å²	73.2	38%	0.384	42%	0.418	S	S	.	.	H	α-helix	trans	-55.8	-29.5	-177.7	-58.7	-166.8	96.5	0	0	113.5	F214 L237 A255 C256 Y257	F214-M253 HydrophobicContact CE1-CE 4.17Å; L237-M253 HydrophobicContact CB-CE 4.03Å; L237-M253 WeakPolarHBondContact O-CE 3.37Å; M253-A255 PolarHBondContact O-N 3.1Å; M253-C256 PolarHBondContact O-N 3.16Å; M253-C256 VanDerWaalsContact O-N 3.1Å; M253-Y257 HydrophobicContact CB-CD2 4.1Å; M253-Y257 HydrophobicContact CB-CE2 3.72Å; M253-Y257 WeakPolarHBondContact O-CD2 3.02Å; M253-Y257 PolarHBondContact O-N 2.9Å; M253-Y257 VanDerWaalsContact O-N 3.1Å
254	A	74	Confident	77.5	Confident	50 Å²	50	76.2 Å²	76.2	41%	0.413	43%	0.432	S	S	.	.	H	α-helix	trans	-52.5	-38.1	176	0	0	0	0	0	112.9	P252 C256 Y257 M258	P252-A254 PolarHBondContact O-N 2.85Å; A254-C256 VanDerWaalsContact C-N 3.33Å; A254-C256 PolarHBondContact O-N 2.84Å; A254-Y257 PolarHBondContact O-N 2.71Å; A254-M258 WeakPolarHBondContact O-CG 3.3Å; A254-M258 PolarHBondContact O-N 2.8Å; A254-M258 VanDerWaalsContact O-N 3.13Å
255	A	70.9	Confident	77.2	Confident	2 Å²	2	76.6 Å²	76.6	2%	0.017	44%	0.436	C	S	.	.	H	α-helix	trans	-60	-42.5	178.4	0	0	0	0	0	112.1	Y109 P212 L251 P252 M253	Y109-A255 HydrophobicContact CD2-CB 3.81Å; Y109-A255 HydrophobicContact CE2-CB 3.64Å; P212-A255 HydrophobicContact CB-CB 4.15Å; P212-A255 HydrophobicContact CG-CB 4.04Å; L251-A255 HydrophobicContact CB-CB 4.18Å; L251-A255 HydrophobicContact CD1-CB 4.26Å; P252-A255 WeakPolarHBondContact O-CB 3.24Å; P252-A255 PolarHBondContact O-N 3Å; M253-A255 PolarHBondContact O-N 3.1Å
256	C	79.2	Confident	77	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-75.7	-34.1	178.5	-71.1	0	0	0	0	112.6	P212 E213 F214 C239 M253 A254 M258 T259	P212-C256 VanDerWaalsContact CB-SG 3.59Å; E213-C256 PolarHBondContact N-SG 2.87Å; E213-C256 VanDerWaalsContact N-SG 3.36Å; E213-C256 PolarHBondContact O-SG 2.87Å; F214-C256 HydrophobicContact CD1-CB 3.77Å; F214-C256 HydrophobicContact CD2-CB 3.75Å; F214-C256 HydrophobicContact CE1-CB 3.47Å; F214-C256 VanDerWaalsContact CE1-CB 3.47Å; F214-C256 HydrophobicContact CE2-CB 3.44Å; F214-C256 VanDerWaalsContact CE2-CB 3.44Å; F214-C256 HydrophobicContact CG-CB 3.91Å; F214-C256 HydrophobicContact CZ-CB 3.3Å; C239-C256 WeakPolarHBondContact CA-SG 3.38Å; C239-C256 HydrophobicContact CB-CB 3.86Å; C239-C256 WeakPolarHBondContact CB-SG 3.35Å; C239-C256 WeakPolarHBondContact SG-CB 3.32Å; C239-C256 PolarHBondContact SG-N 3.11Å; C239-C256 CovalentContact SG-SG 2.03Å; C239-C256 PolarHBondContact SG-SG 3.32Å; M253-C256 PolarHBondContact O-N 3.16Å; M253-C256 VanDerWaalsContact O-N 3.1Å; A254-C256 VanDerWaalsContact C-N 3.33Å; A254-C256 PolarHBondContact O-N 2.84Å; C256-M258 VanDerWaalsContact C-N 3.28Å; C256-M258 PolarHBondContact O-N 2.85Å; C256-T259 WeakPolarHBondContact O-CB 3.23Å; C256-T259 PolarHBondContact O-N 2.81Å; C256-T259 VanDerWaalsContact O-N 3.15Å; C256-T259 PolarHBondContact O-OG1 2.77Å
257	Y	78.8	Confident	77.2	Confident	132 Å²	132	78 Å²	78	52%	0.518	43%	0.428	S	S	.	.	H	α-helix	trans	-61.4	-37.1	174.7	-75.1	-64	0	0	0	112.5	F214 M253 A254 T259 G260 I263	F214-Y257 HydrophobicContact CE2-CD1 4.35Å; F214-Y257 AromaticContact CZ-CD1 3.82Å; F214-Y257 HydrophobicContact CZ-CD1 3.82Å; F214-Y257 HydrophobicContact CZ-CD2 4.15Å; F214-Y257 AromaticContact CZ-CE1 3.87Å; F214-Y257 HydrophobicContact CZ-CE1 3.87Å; F214-Y257 HydrophobicContact CZ-CE2 4.19Å; F214-Y257 AromaticContact CZ-CG 3.95Å; F214-Y257 HydrophobicContact CZ-CG 3.95Å; M253-Y257 HydrophobicContact CB-CD2 4.1Å; M253-Y257 HydrophobicContact CB-CE2 3.72Å; M253-Y257 WeakPolarHBondContact O-CD2 3.02Å; M253-Y257 PolarHBondContact O-N 2.9Å; M253-Y257 VanDerWaalsContact O-N 3.1Å; A254-Y257 PolarHBondContact O-N 2.71Å; Y257-T259 PolarHBondContact O-N 2.71Å; Y257-G260 PolarHBondContact O-N 2.95Å; Y257-I263 HydrophobicContact CD1-CD1 4.12Å; Y257-I263 HydrophobicContact CE1-CD1 3.56Å
258	M	68.6	Low	76.7	Confident	131 Å²	131	80.9 Å²	80.9	65%	0.645	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.4	177	-70.5	-171.2	-66.1	0	0	113.6	Y109 A254 C256 G260	Y109-M258 HydrophobicContact CE2-CE 3.89Å; A254-M258 WeakPolarHBondContact O-CG 3.3Å; A254-M258 PolarHBondContact O-N 2.8Å; A254-M258 VanDerWaalsContact O-N 3.13Å; C256-M258 VanDerWaalsContact C-N 3.28Å; C256-M258 PolarHBondContact O-N 2.85Å; M258-G260 VanDerWaalsContact C-N 3.28Å; M258-G260 PolarHBondContact O-N 3.3Å
259	T	70.1	Confident	76.3	Confident	49 Å²	49	83.7 Å²	83.7	30%	0.301	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-15.7	179.5	71	0	0	0	0	114.1	P212 C256 Y257 K261	P212-T259 HydrophobicContact CB-CG2 4.43Å; C256-T259 WeakPolarHBondContact O-CB 3.23Å; C256-T259 PolarHBondContact O-N 2.81Å; C256-T259 VanDerWaalsContact O-N 3.15Å; C256-T259 PolarHBondContact O-OG1 2.77Å; Y257-T259 PolarHBondContact O-N 2.71Å; T259-K261 PolarHBondContact O-N 3.28Å; T259-K261 VanDerWaalsContact O-N 3.09Å; T259-K261 PolarHBondContact OG1-N 2.71Å
260	G	71	Confident	76.1	Confident	72 Å²	72	79.5 Å²	79.5	74%	0.742	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	7.4	-176.6	0	0	0	0	0	115.2	Y257 M258	Y257-G260 PolarHBondContact O-N 2.95Å; M258-G260 VanDerWaalsContact C-N 3.28Å; M258-G260 PolarHBondContact O-N 3.3Å
261	K	73	Confident	75.7	Confident	66 Å²	66	79.4 Å²	79.4	29%	0.287	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-66.7	148.5	176.8	-76.1	-175.6	170	-173.6	0	111.4	E213 T259 I263	E213-K261 IonicContact OE1-NZ 3.73Å; E213-K261 IonicContact OE2-NZ 3.72Å; E213-K261 PolarHBondContact OE2-NZ 3.25Å; T259-K261 PolarHBondContact O-N 3.28Å; T259-K261 VanDerWaalsContact O-N 3.09Å; T259-K261 PolarHBondContact OG1-N 2.71Å; K261-I263 PolarHBondContact O-N 2.05Å
262	A	70.3	Confident	75.3	Confident	97 Å²	97	83.3 Å²	83.3	80%	0.802	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-61.5	129.4	175.4	0	0	0	0	0	111.3
263	I	75.8	Confident	74.5	Confident	84 Å²	84	89.9 Å²	89.9	43%	0.431	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-80.2	130.9	-178.5	-55.9	167.8	0	0	0	109	F214 L237 Y257 K261	F214-I263 HydrophobicContact CD2-CG1 4.21Å; F214-I263 HydrophobicContact CE2-CG1 3.9Å; L237-I263 HydrophobicContact CD1-CG2 3.26Å; Y257-I263 HydrophobicContact CD1-CD1 4.12Å; Y257-I263 HydrophobicContact CE1-CD1 3.56Å; K261-I263 PolarHBondContact O-N 2.05Å
264	Q	78	Confident	73.5	Confident	100 Å²	100	90.1 Å²	90.1	47%	0.467	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-63.2	147.8	174	-71.8	-69.6	-38.2	0	0	111.1	L237 T266	L237-Q264 HydrophobicContact CD2-CB 4.16Å; Q264-T266 PolarHBondContact O-N 2.82Å
265	P	75.5	Confident	72.4	Confident	74 Å²	74	91 Å²	91	48%	0.481	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-62.8	129.6	-177.6	23.1	-31.7	0	0	0	111.1	R235	R235-P265 PolarHBondContact NE-O 2.88Å; R235-P265 PolarHBondContact NH2-O 2.88Å
266	T	76.2	Confident	71.4	Confident	63 Å²	63	102.6 Å²	102.6	39%	0.387	52%	0.515	S	S	.	.	S	Bend	trans	-88.2	-7.8	177.8	51.1	0	0	0	0	113.1	V234 R235 L237 Q264	V234-T266 CarbonylContact C-O 3.58Å; V234-T266 WeakPolarHBondContact CA-O 3.19Å; R235-T266 PolarHBondContact N-O 3.33Å; L237-T266 HydrophobicContact CD1-CG2 3.83Å; L237-T266 HydrophobicContact CG-CG2 3.91Å; Q264-T266 PolarHBondContact O-N 2.82Å
267	W	83.3	Confident	69.8	Low	129 Å²	129	111.7 Å²	111.7	49%	0.489	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-140.4	149.9	178.2	80.7	-83	0	0	0	111.8	Q233 R269	Q233-W267 CarbonylContact O-C 3.56Å; Q233-W267 VanDerWaalsContact O-CA 3.25Å; Q233-W267 WeakPolarHBondContact O-CA 3.21Å; W267-R269 HydrophobicContact CZ3-CG 4.14Å
268	R	75.4	Confident	68.9	Low	113 Å²	113	106.7 Å²	106.7	43%	0.426	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	165.2	170.1	70.2	176.1	-173.7	-176.5	2.1	111.6	W219 Q233	W219-R268 HydrophobicContact CD2-CG 4.13Å; W219-R268 HydrophobicContact CE3-CG 4.02Å; W219-R268 HydrophobicContact CH2-CB 3.93Å; W219-R268 HydrophobicContact CH2-CG 3.82Å; W219-R268 HydrophobicContact CZ2-CB 4.24Å; W219-R268 HydrophobicContact CZ2-CG 3.93Å; W219-R268 HydrophobicContact CZ3-CB 4.3Å; W219-R268 HydrophobicContact CZ3-CG 3.87Å; Q233-R268 HydrophobicContact CB-CG 4Å; Q233-R268 PolarHBondContact N-O 2.77Å; Q233-R268 PolarHBondContact O-N 2.79Å; Q233-R268 VanDerWaalsContact OE1-CZ 3.31Å
269	R	78.3	Confident	68.2	Low	174 Å²	174	108.7 Å²	108.7	66%	0.657	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78	145.9	170	-64	-178.6	-172	156.7	3.1	110.2	P230 G231 W267	P230-R269 HydrophobicContact CB-CB 4.15Å; P230-R269 HydrophobicContact CB-CG 4.35Å; G231-R269 WeakPolarHBondContact O-CA 3.47Å; W267-R269 HydrophobicContact CZ3-CG 4.14Å
270	C	80.6	Confident	67.6	Low	11 Å²	11	111.6 Å²	111.6	7%	0.074	57%	0.573	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.4	159.5	170.2	54.5	0	0	0	0	109.5	C222 P230 G231 R232 Q233	C222-C270 WeakPolarHBondContact CA-SG 3.19Å; C222-C270 HydrophobicContact CB-CB 3.83Å; C222-C270 WeakPolarHBondContact CB-SG 3.5Å; C222-C270 WeakPolarHBondContact SG-CB 3.45Å; C222-C270 CovalentContact SG-SG 2.02Å; C222-C270 PolarHBondContact SG-SG 3.25Å; P230-C270 CarbonylContact C-O 3.58Å; P230-C270 VanDerWaalsContact CA-O 3.28Å; P230-C270 WeakPolarHBondContact CA-O 3.49Å; G231-C270 VanDerWaalsContact CA-SG 3.57Å; G231-C270 PolarHBondContact N-O 2.83Å; G231-C270 PolarHBondContact O-N 3.43Å; G231-C270 PolarHBondContact O-SG 3.28Å; G231-C270 VanDerWaalsContact O-SG 3.41Å; R232-C270 PolarHBondContact N-SG 2.99Å; R232-C270 VanDerWaalsContact N-SG 3.43Å; Q233-C270 HydrophobicContact CG-CB 3.84Å
271	F	77.6	Confident	67.1	Low	157 Å²	157	112.3 Å²	112.3	69%	0.689	56%	0.556	S	S	*	*			trans	-129.5	124.8	178.9	-60.6	-92	0	0	0	107.4	P230	P230-F271 HydrophobicContact CB-CD1 4.1Å; P230-F271 HydrophobicContact CB-CE1 3.69Å; P230-F271 HydrophobicContact CB-CZ 3.96Å; P230-F271 HydrophobicContact CG-CD1 4.32Å; P230-F271 HydrophobicContact CG-CE1 3.57Å; P230-F271 HydrophobicContact CG-CZ 3.98Å
272	E	70.6	Confident	67	Low	100 Å²	100	113.8 Å²	113.8	47%	0.467	57%	0.573	S	S	.	*			trans	-96.8	145.3	174.4	-157.8	75.5	-140.3	0	0	108.8	Q224 S274 S275	Q224-E272 VanDerWaalsContact OE1-CB 3.28Å; E272-S274 PolarHBondContact O-N 2.98Å; E272-S275 PolarHBondContact O-OG 3.17Å
273	E	62.3	Low	67.3	Low	205 Å²	205	110.2 Å²	110.2	96%	0.958	54%	0.541	S	S	*	.	S	Bend	trans	-76.5	11.8	-161.9	-149.2	154	-157.7	0	0	115.5
274	S	54.3	Low	67.6	Low	84 Å²	84	110 Å²	110	59%	0.587	54%	0.539	S	S	*	.			trans	-109.8	48	-176.1	59.6	0	0	0	0	114.5	E272 R276	E272-S274 PolarHBondContact O-N 2.98Å; S274-R276 PolarHBondContact O-N 3.1Å
275	S	50.8	Low	68	Low	67 Å²	67	105.8 Å²	105.8	47%	0.469	52%	0.52	S	S	.	.			trans	-91.6	22.3	-173.1	-60.6	0	0	0	0	116.3	E272	E272-S275 PolarHBondContact O-OG 3.17Å
276	R	49.1	Very low	68.5	Low	247 Å²	247	104.8 Å²	104.8	93%	0.932	51%	0.51	S	S	*	.			trans	-94.3	12.4	-173.5	-66.8	-166.8	-169.8	-173.3	4.4	117.4	S274	S274-R276 PolarHBondContact O-N 3.1Å
277	K	46.9	Very low	69	Low	191 Å²	191	105.2 Å²	105.2	83%	0.83	51%	0.513	S	S	*	.			trans	-128.9	47.5	-179.6	-77.5	-172.8	176	-179.7	0	114.1
278	C	59.4	Low	68.9	Low	26 Å²	26	102 Å²	102	18%	0.176	51%	0.505	C	S	.	.			trans	-112.8	-5.3	-169.6	-69.9	0	0	0	0	117.3	C228 S280	C228-C278 WeakPolarHBondContact CA-SG 3.15Å; C228-C278 HydrophobicContact CB-CB 3.75Å; C228-C278 WeakPolarHBondContact CB-SG 3.31Å; C228-C278 VanDerWaalsContact SG-CA 3.54Å; C228-C278 WeakPolarHBondContact SG-CB 3.48Å; C228-C278 CovalentContact SG-SG 2.03Å; C228-C278 PolarHBondContact SG-SG 3.1Å; C278-S280 PolarHBondContact O-N 2.78Å
279	D	54.1	Low	69.1	Low	174 Å²	174	102.1 Å²	102.1	93%	0.93	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	9.8	-176.3	-67.7	-29.1	0	0	0	115.1
280	S	56.6	Low	69.2	Low	109 Å²	109	95.6 Å²	95.6	76%	0.762	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	9.1	-176.6	57.6	0	0	0	0	116.1	C278	C278-S280 PolarHBondContact O-N 2.78Å
281	K	60.3	Low	69.3	Low	88 Å²	88	96.6 Å²	96.6	38%	0.383	50%	0.502	S	S	.	.	S	Bend	trans	-83.6	142.2	174.5	-72.2	-175.7	-173.9	173.3	0	111.2	D226 Y325	D226-K281 IonicContact OD1-NZ 3.75Å; D226-K281 PolarHBondContact OD1-NZ 2.8Å; D226-K281 VanDerWaalsContact OD1-NZ 3.16Å; K281-Y325 HydrophobicContact CB-CD1 4.22Å; K281-Y325 HydrophobicContact CB-CD2 4.08Å; K281-Y325 HydrophobicContact CB-CE1 4.33Å; K281-Y325 HydrophobicContact CB-CE2 4.23Å; K281-Y325 HydrophobicContact CB-CG 4.08Å; K281-Y325 HydrophobicContact CD-CE1 4.23Å; K281-Y325 HydrophobicContact CD-CE2 4.08Å
282	P	71.9	Confident	69.7	Low	97 Å²	97	90 Å²	90	63%	0.63	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-59	151.3	173.9	25.2	-33.3	0	0	0	111
283	P	75.8	Confident	70.3	Confident	21 Å²	21	85.3 Å²	85.3	14%	0.136	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-56.4	144.3	178.9	25.6	-34.8	0	0	0	109.8	Q324 F326 A376 M379	P283-Q324 WeakPolarHBondContact CA-O 3.22Å; P283-F326 HydrophobicContact CB-CB 3.99Å; P283-F326 HydrophobicContact CB-CD2 3.97Å; P283-F326 HydrophobicContact CB-CG 4.27Å; P283-F326 HydrophobicContact CG-CD2 4.5Å; P283-A376 WeakPolarHBondContact CG-O 3.4Å; P283-M379 HydrophobicContact CG-CB 4.41Å; P283-M379 HydrophobicContact CG-CG 4.39Å; P283-M379 WeakPolarHBondContact O-CG 3.23Å
284	M	81.8	Confident	71.3	Confident	80 Å²	80	75.8 Å²	75.8	39%	0.394	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	129.5	177.8	-171.1	173.1	70.5	0	0	111.1	V323 Q324	M284-V323 CarbonylContact O-C 3.59Å; M284-V323 WeakPolarHBondContact O-CA 3.19Å; M284-Q324 HydrophobicContact CB-CB 4.31Å; M284-Q324 HydrophobicContact CB-CG 4.47Å; M284-Q324 HydrophobicContact CE-CG 4.26Å; M284-Q324 PolarHBondContact N-O 2.73Å; M284-Q324 WeakPolarHBondContact O-CG 3.08Å; M284-Q324 PolarHBondContact O-N 2.68Å
285	I	86.7	Confident	72	Confident	12 Å²	12	73.2 Å²	73.2	6%	0.062	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	121.9	-178.7	-48.5	-176	0	0	0	110.3	T287 V305 V323 A376 M379 A381	I285-T287 PolarHBondContact O-N 3.05Å; I285-V305 HydrophobicContact CG2-CG2 3.67Å; I285-V323 HydrophobicContact CD1-CG1 4.34Å; I285-V323 HydrophobicContact CG1-CG1 3.9Å; I285-V323 HydrophobicContact CG2-CG1 4.35Å; I285-A376 HydrophobicContact CD1-CB 4.07Å; I285-A376 HydrophobicContact CG1-CB 4.39Å; I285-M379 HydrophobicContact CD1-CB 4.11Å; I285-M379 HydrophobicContact CG1-CB 4.14Å; I285-A381 HydrophobicContact CB-CB 4.12Å; I285-A381 HydrophobicContact CD1-CB 3.98Å; I285-A381 HydrophobicContact CG2-CB 3.61Å
286	N	86.1	Confident	73.2	Confident	52 Å²	52	75.9 Å²	75.9	28%	0.278	39%	0.387	S	S	.	.			trans	-83.5	113.5	176.3	-70.6	3	0	0	0	110.6	K304 P322 Q324	N286-K304 WeakPolarHBondContact O-CE 3.42Å; N286-P322 HydrophobicContact CB-CG 4.12Å; N286-P322 PolarHBondContact N-O 2.97Å; N286-P322 VanDerWaalsContact N-O 3.07Å; N286-P322 VanDerWaalsContact O-CG 3.27Å; N286-P322 WeakPolarHBondContact O-CG 3.25Å; N286-Q324 VanDerWaalsContact CG-NE2 3.33Å; N286-Q324 PolarHBondContact ND2-NE2 2.86Å; N286-Q324 VanDerWaalsContact ND2-NE2 3.1Å; N286-Q324 PolarHBondContact OD1-NE2 2.03Å
287	T	86.9	Confident	74.6	Confident	73 Å²	73	72.2 Å²	72.2	45%	0.448	38%	0.378	S	S	.	.			trans	-101	149.7	179.4	54.5	0	0	0	0	112.6	I285 V305 A381	I285-T287 PolarHBondContact O-N 3.05Å; T287-V305 CarbonylContact C-O 3.59Å; T287-V305 VanDerWaalsContact CA-O 3.26Å; T287-V305 WeakPolarHBondContact CA-O 3.31Å; T287-V305 HydrophobicContact CG2-CG2 4.26Å; T287-A381 HydrophobicContact CG2-CB 3.69Å
288	D	81.9	Confident	76.2	Confident	61 Å²	61	64.7 Å²	64.7	33%	0.326	35%	0.347	S	S	.	.			trans	-119.6	123.8	170.1	-73.8	-12.9	0	0	0	110.7	L290 K304 V305 G306 Q307	D288-L290 VanDerWaalsContact C-N 3.31Å; D288-L290 PolarHBondContact O-N 2.78Å; D288-K304 HydrophobicContact CB-CD 4.42Å; D288-K304 VanDerWaalsContact CG-CE 3.46Å; D288-K304 IonicContact OD1-NZ 2.67Å; D288-K304 PolarHBondContact OD1-NZ 2.81Å; D288-K304 VanDerWaalsContact OD2-CD 3.23Å; D288-K304 WeakPolarHBondContact OD2-CD 3.34Å; D288-K304 VanDerWaalsContact OD2-CE 3.31Å; D288-K304 WeakPolarHBondContact OD2-CE 3.5Å; D288-K304 IonicContact OD2-NZ 3.16Å; D288-K304 PolarHBondContact OD2-NZ 3.07Å; D288-V305 PolarHBondContact N-O 3.4Å; D288-G306 CarbonylContact O-C 3.5Å; D288-G306 WeakPolarHBondContact O-CA 3.39Å; D288-Q307 HydrophobicContact CB-CG 4.1Å; D288-Q307 WeakPolarHBondContact O-CA 3.36Å; D288-Q307 WeakPolarHBondContact O-CG 3.27Å; D288-Q307 PolarHBondContact O-N 3.04Å
289	T	79.9	Confident	77.4	Confident	115 Å²	115	72.7 Å²	72.7	71%	0.706	38%	0.379	S	S	*	.			trans	-86.7	59.9	-177.5	58.9	0	0	0	0	112.4
290	L	78.9	Confident	79.1	Confident	38 Å²	38	67.5 Å²	67.5	20%	0.199	35%	0.354	C	S	.	.			trans	-109.6	137.1	-179.2	-67.2	172.1	0	0	0	111.7	D288 Q307 Q308 I459 L460	D288-L290 VanDerWaalsContact C-N 3.31Å; D288-L290 PolarHBondContact O-N 2.78Å; L290-Q307 HydrophobicContact CB-CG 4.13Å; L290-Q307 CarbonylContact O-C 3.52Å; L290-Q307 VanDerWaalsContact O-CA 3.25Å; L290-Q307 WeakPolarHBondContact O-CA 3.12Å; L290-Q307 WeakPolarHBondContact O-CB 3.06Å; L290-Q308 PolarHBondContact O-N 3.49Å; L290-I459 WeakPolarHBondContact CD2-O 3.32Å; L290-L460 HydrophobicContact CD2-CD2 3.76Å
291	T	83.9	Confident	80.7	Confident	31 Å²	31	63.2 Å²	63.2	19%	0.19	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	118.2	170.8	-49.1	0	0	0	0	109.9	Q308 F310 Q458 I459	T291-Q308 CarbonylContact C-O 3.59Å; T291-Q308 VanDerWaalsContact CA-O 3.27Å; T291-Q308 WeakPolarHBondContact CA-O 3.4Å; T291-Q308 HydrophobicContact CG2-CB 4.3Å; T291-Q308 HydrophobicContact CG2-CG 4.38Å; T291-F310 HydrophobicContact CG2-CD2 4.15Å; T291-F310 HydrophobicContact CG2-CE2 3.77Å; T291-Q458 CarbonylContact O-C 3.59Å; T291-Q458 WeakPolarHBondContact O-CA 3.14Å; T291-I459 HydrophobicContact CG2-CD1 4.29Å; T291-I459 PolarHBondContact O-N 2.9Å
292	I	85.3	Confident	82.2	Confident	19 Å²	19	62.8 Å²	62.8	10%	0.097	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.5	-178.5	-61.5	172.3	0	0	0	109.1	L303 Q308 A309 F310 F456 Q458	I292-L303 HydrophobicContact CD1-CD2 3.67Å; I292-Q308 PolarHBondContact N-O 3.37Å; I292-A309 CarbonylContact O-C 3.59Å; I292-A309 VanDerWaalsContact O-CA 3.32Å; I292-A309 WeakPolarHBondContact O-CA 3.47Å; I292-F310 PolarHBondContact O-N 3.15Å; I292-F456 HydrophobicContact CG2-CB 4.47Å; I292-Q458 HydrophobicContact CG1-CG 4.3Å
293	V	83.7	Confident	83.3	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	117.2	175.5	178.6	0	0	0	0	110.4	M295 F310 F456 Y457	V293-M295 PolarHBondContact O-N 3.42Å; V293-F310 HydrophobicContact CG1-CB 4.32Å; V293-F310 HydrophobicContact CG2-CB 4.26Å; V293-F310 HydrophobicContact CG2-CD2 3.67Å; V293-F310 HydrophobicContact CG2-CE2 4.38Å; V293-F310 HydrophobicContact CG2-CG 4.23Å; V293-F456 WeakPolarHBondContact O-CA 3.27Å; V293-F456 VanDerWaalsContact O-CB 3.25Å; V293-F456 WeakPolarHBondContact O-CB 3.33Å; V293-Y457 HydrophobicContact CB-CD1 3.81Å; V293-Y457 HydrophobicContact CB-CD2 3.99Å; V293-Y457 HydrophobicContact CB-CE1 3.49Å; V293-Y457 VanDerWaalsContact CB-CE1 3.49Å; V293-Y457 HydrophobicContact CB-CE2 3.64Å; V293-Y457 HydrophobicContact CB-CG 4.07Å; V293-Y457 VanDerWaalsContact CB-CZ 3.41Å; V293-Y457 HydrophobicContact CG1-CD1 3.98Å; V293-Y457 HydrophobicContact CG1-CE1 3.35Å; V293-Y457 HydrophobicContact CG1-CE2 4.32Å; V293-Y457 HydrophobicContact CG2-CD2 4.07Å; V293-Y457 HydrophobicContact CG2-CE1 4.02Å; V293-Y457 HydrophobicContact CG2-CE2 3.37Å; V293-Y457 PolarHBondContact N-O 2.79Å; V293-Y457 PolarHBondContact O-N 3.48Å; V293-Y457 VanDerWaalsContact O-N 3.16Å
294	Q	82.3	Confident	84.1	Confident	5 Å²	5	59.7 Å²	59.7	2%	0.023	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	119.8	173.5	-173.9	-176.5	1.4	0	0	110.6	R296 I301 F310 I312 T315	Q294-R296 WeakPolarHBondContact CG-O 3.29Å; Q294-R296 PolarHBondContact NE2-O 3.34Å; Q294-I301 HydrophobicContact CB-CD1 4.06Å; Q294-I301 HydrophobicContact CG-CD1 4.05Å; Q294-F310 VanDerWaalsContact CB-O 3.32Å; Q294-F310 WeakPolarHBondContact CB-O 3.17Å; Q294-F310 PolarHBondContact N-O 3.32Å; Q294-F310 VanDerWaalsContact N-O 3.07Å; Q294-I312 HydrophobicContact CB-CG1 4.35Å; Q294-I312 HydrophobicContact CG-CD1 3.81Å; Q294-I312 HydrophobicContact CG-CG1 3.98Å; Q294-T315 PolarHBondContact NE2-OG1 3.21Å; Q294-T315 PolarHBondContact OE1-OG1 2.91Å
295	M	70.7	Confident	84.7	Confident	31 Å²	31	55.9 Å²	55.9	15%	0.153	28%	0.28	C	S	.	.			trans	-94	-30.6	178.4	-61.2	-169.8	-71.4	0	0	113	V293 W397 D453 R455 Y457	V293-M295 PolarHBondContact O-N 3.42Å; M295-W397 HydrophobicContact SD-CB 4.38Å; M295-W397 VanDerWaalsContact SD-CD1 3.57Å; M295-W397 HydrophobicContact SD-CG 4.01Å; M295-D453 WeakPolarHBondContact CE-O 3.26Å; M295-R455 PolarHBondContact N-O 3.41Å; M295-R455 VanDerWaalsContact N-O 3.11Å; M295-Y457 HydrophobicContact CG-CD1 3.97Å; M295-Y457 HydrophobicContact SD-CD1 3.88Å
296	R	74.7	Confident	84.9	Confident	122 Å²	122	56.7 Å²	56.7	46%	0.46	29%	0.291	S	S	.	.	S	Bend	trans	-136.6	162.3	-178.9	63.9	-175.5	-178.3	178.7	-2.5	111.9	Q294 V298 S454 R455	Q294-R296 WeakPolarHBondContact CG-O 3.29Å; Q294-R296 PolarHBondContact NE2-O 3.34Å; R296-V298 PolarHBondContact O-N 2.78Å; R296-S454 VanDerWaalsContact CD-O 3.32Å; R296-S454 WeakPolarHBondContact CD-O 3.48Å; R296-S454 PolarHBondContact NE-O 3.36Å; R296-S454 VanDerWaalsContact NH2-CB 3.27Å; R296-S454 PolarHBondContact NH2-OG 2.87Å; R296-R455 VanDerWaalsContact NE-CG 3.3Å
297	K	78.4	Confident	85.2	Confident	171 Å²	171	55 Å²	55	74%	0.743	28%	0.282	S	S	*	.			trans	-62.2	122.3	177.3	-167.3	172.2	-177	175.7	0	110
298	V	81.3	Confident	85.4	Confident	32 Å²	32	55 Å²	55	19%	0.194	28%	0.276	C	S	.	.			trans	-119.3	157.6	174.7	-64.5	0	0	0	0	110.1	R296 I301 T315 R455	R296-V298 PolarHBondContact O-N 2.78Å; V298-I301 HydrophobicContact CG2-CD1 3.99Å; V298-I301 HydrophobicContact CG2-CG1 3.46Å; V298-I301 VanDerWaalsContact CG2-CG1 3.46Å; V298-T315 HydrophobicContact CG2-CG2 4.2Å; V298-R455 HydrophobicContact CG1-CB 4.15Å; V298-R455 HydrophobicContact CG1-CG 4.13Å
299	K	83.6	Confident	85.9	Confident	194 Å²	194	52.1 Å²	52.1	84%	0.843	26%	0.261	S	S	*	.	S	Bend	trans	-65.9	-45.1	-176.6	-71	-176.5	178.3	179.1	0	112.5	R316	K299-R316 WeakPolarHBondContact O-CB 3.45Å
300	V	89.7	Confident	86.5	Confident	65 Å²	65	49.1 Å²	49.1	39%	0.394	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	142	-178.8	-175.7	0	0	0	0	108.6	R316	V300-R316 CarbonylContact C-O 3.56Å; V300-R316 VanDerWaalsContact CA-O 3.32Å; V300-R316 WeakPolarHBondContact CA-O 3.49Å; V300-R316 HydrophobicContact CB-CB 4.38Å; V300-R316 HydrophobicContact CG1-CB 4.37Å; V300-R316 HydrophobicContact CG2-CB 4.02Å
301	I	90.7	Very high	87.1	Confident	19 Å²	19	47.3 Å²	47.3	10%	0.097	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122	167.9	-63.7	-179.1	0	0	0	108	Q294 V298 L303 V311 T315 R316 V317 T318	Q294-I301 HydrophobicContact CB-CD1 4.06Å; Q294-I301 HydrophobicContact CG-CD1 4.05Å; V298-I301 HydrophobicContact CG2-CD1 3.99Å; V298-I301 HydrophobicContact CG2-CG1 3.46Å; V298-I301 VanDerWaalsContact CG2-CG1 3.46Å; I301-L303 HydrophobicContact CG2-CD1 4.38Å; I301-L303 HydrophobicContact CG2-CD2 3.6Å; I301-L303 HydrophobicContact CG2-CG 3.81Å; I301-V311 HydrophobicContact CD1-CG1 4.24Å; I301-V311 HydrophobicContact CD1-CG2 4.43Å; I301-T315 HydrophobicContact CD1-CG2 3.78Å; I301-T315 HydrophobicContact CG1-CG2 3.8Å; I301-R316 PolarHBondContact N-O 2.82Å; I301-V317 CarbonylContact O-C 3.5Å; I301-V317 WeakPolarHBondContact O-CA 3.28Å; I301-T318 PolarHBondContact O-N 3.31Å
302	D	92	Very high	87.3	Confident	80 Å²	80	46.4 Å²	46.4	43%	0.428	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	125	172	-77.2	-71	0	0	0	109.8	T318 R320	D302-T318 CarbonylContact C-O 3.59Å; D302-T318 WeakPolarHBondContact CA-O 3.38Å; D302-R320 IonicContact OD1-CZ 2.78Å; D302-R320 IonicContact OD1-NE 3.81Å; D302-R320 IonicContact OD1-NH2 3.75Å; D302-R320 PolarHBondContact OD1-NH2 3.32Å; D302-R320 IonicContact OD2-NH2 2.83Å; D302-R320 PolarHBondContact OD2-NH2 3.3Å
303	L	94.7	Very high	87.6	Confident	5 Å²	5	47.1 Å²	47.1	3%	0.026	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	163.5	-179.2	-58.1	176.2	0	0	0	110.9	I292 I301 A309 V317 T318 V319 R320 V383 L385	I292-L303 HydrophobicContact CD1-CD2 3.67Å; I301-L303 HydrophobicContact CG2-CD1 4.38Å; I301-L303 HydrophobicContact CG2-CD2 3.6Å; I301-L303 HydrophobicContact CG2-CG 3.81Å; L303-A309 HydrophobicContact CD1-CB 3.54Å; L303-A309 HydrophobicContact CD2-CB 3.74Å; L303-A309 HydrophobicContact CG-CB 4.31Å; L303-V317 HydrophobicContact CD1-CG1 3.66Å; L303-V317 HydrophobicContact CG-CG1 4.3Å; L303-T318 PolarHBondContact N-O 2.87Å; L303-V319 HydrophobicContact CB-CG1 4.28Å; L303-V319 HydrophobicContact CB-CG2 4.26Å; L303-V319 HydrophobicContact CD1-CG2 4.43Å; L303-V319 CarbonylContact O-C 3.56Å; L303-V319 WeakPolarHBondContact O-CA 3.24Å; L303-R320 PolarHBondContact O-N 3.47Å; L303-V383 HydrophobicContact CD1-CG2 4.25Å; L303-L385 HydrophobicContact CD1-CD2 3.35Å
304	K	93.1	Very high	87.9	Confident	47 Å²	47	54 Å²	54	20%	0.204	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.8	172.8	-178.7	171.7	148.2	-163.4	0	110.1	N286 D288 Q307 R320 P322	N286-K304 WeakPolarHBondContact O-CE 3.42Å; D288-K304 HydrophobicContact CB-CD 4.42Å; D288-K304 VanDerWaalsContact CG-CE 3.46Å; D288-K304 IonicContact OD1-NZ 2.67Å; D288-K304 PolarHBondContact OD1-NZ 2.81Å; D288-K304 VanDerWaalsContact OD2-CD 3.23Å; D288-K304 WeakPolarHBondContact OD2-CD 3.34Å; D288-K304 VanDerWaalsContact OD2-CE 3.31Å; D288-K304 WeakPolarHBondContact OD2-CE 3.5Å; D288-K304 IonicContact OD2-NZ 3.16Å; D288-K304 PolarHBondContact OD2-NZ 3.07Å; K304-Q307 HydrophobicContact CB-CG 4.44Å; K304-Q307 WeakPolarHBondContact O-CB 3.4Å; K304-Q307 WeakPolarHBondContact O-CG 2.99Å; K304-Q307 PolarHBondContact O-N 2.8Å; K304-Q307 VanDerWaalsContact O-N 3.16Å; K304-R320 WeakPolarHBondContact CA-O 3.29Å; K304-P322 HydrophobicContact CD-CG 3.85Å; K304-P322 HydrophobicContact CG-CG 4.05Å
305	V	93.9	Very high	88.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	143.4	172.5	-64.9	0	0	0	0	111.7	I285 T287 D288 Q307 R320 C321 W333 C374 A381	I285-V305 HydrophobicContact CG2-CG2 3.67Å; T287-V305 CarbonylContact C-O 3.59Å; T287-V305 VanDerWaalsContact CA-O 3.26Å; T287-V305 WeakPolarHBondContact CA-O 3.31Å; T287-V305 HydrophobicContact CG2-CG2 4.26Å; D288-V305 PolarHBondContact N-O 3.4Å; V305-Q307 VanDerWaalsContact C-N 3.33Å; V305-R320 PolarHBondContact N-O 2.9Å; V305-R320 VanDerWaalsContact N-O 3.1Å; V305-C321 HydrophobicContact CG1-CB 3.88Å; V305-W333 HydrophobicContact CG1-CH2 3.63Å; V305-W333 HydrophobicContact CG1-CZ3 4.12Å; V305-C374 HydrophobicContact CG1-CB 3.84Å; V305-A381 HydrophobicContact CB-CB 3.92Å; V305-A381 HydrophobicContact CG1-CB 4.5Å; V305-A381 HydrophobicContact CG2-CB 4.07Å
306	G	91	Very high	89.5	Confident	29 Å²	29	58.5 Å²	58.5	30%	0.299	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	-18.2	-168.7	0	0	0	0	0	114.4	D288 T382	D288-G306 CarbonylContact O-C 3.5Å; D288-G306 WeakPolarHBondContact O-CA 3.39Å; G306-T382 WeakPolarHBondContact CA-O 3.41Å; G306-T382 PolarHBondContact N-O 3.04Å
307	Q	92.5	Very high	90.5	Very high	17 Å²	17	52.8 Å²	52.8	8%	0.079	25%	0.253	C	S	.	.			trans	-82.4	158.5	-178.6	-62.6	-177	-28.2	0	0	111.5	D288 L290 K304 V305 V383 T384	D288-Q307 HydrophobicContact CB-CG 4.1Å; D288-Q307 WeakPolarHBondContact O-CA 3.36Å; D288-Q307 WeakPolarHBondContact O-CG 3.27Å; D288-Q307 PolarHBondContact O-N 3.04Å; L290-Q307 HydrophobicContact CB-CG 4.13Å; L290-Q307 CarbonylContact O-C 3.52Å; L290-Q307 VanDerWaalsContact O-CA 3.25Å; L290-Q307 WeakPolarHBondContact O-CA 3.12Å; L290-Q307 WeakPolarHBondContact O-CB 3.06Å; K304-Q307 HydrophobicContact CB-CG 4.44Å; K304-Q307 WeakPolarHBondContact O-CB 3.4Å; K304-Q307 WeakPolarHBondContact O-CG 2.99Å; K304-Q307 PolarHBondContact O-N 2.8Å; K304-Q307 VanDerWaalsContact O-N 3.16Å; V305-Q307 VanDerWaalsContact C-N 3.33Å; Q307-V383 WeakPolarHBondContact O-CA 3.42Å; Q307-V383 WeakPolarHBondContact O-CG2 3.29Å; Q307-T384 PolarHBondContact O-N 2.78Å; Q307-T384 VanDerWaalsContact O-N 3.14Å
308	Q	92	Very high	91.3	Very high	72 Å²	72	45.2 Å²	45.2	34%	0.336	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.3	167.9	-179.4	173.6	13.6	0	0	109	L290 T291 I292 F310 T384	L290-Q308 PolarHBondContact O-N 3.49Å; T291-Q308 CarbonylContact C-O 3.59Å; T291-Q308 VanDerWaalsContact CA-O 3.27Å; T291-Q308 WeakPolarHBondContact CA-O 3.4Å; T291-Q308 HydrophobicContact CG2-CB 4.3Å; T291-Q308 HydrophobicContact CG2-CG 4.38Å; I292-Q308 PolarHBondContact N-O 3.37Å; Q308-F310 HydrophobicContact CG-CE2 4.42Å; Q308-T384 CarbonylContact C-O 3.51Å; Q308-T384 WeakPolarHBondContact CA-O 3.35Å; Q308-T384 HydrophobicContact CG-CG2 4.25Å
309	A	92.7	Very high	92	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.008	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	128.5	-176.6	0	0	0	0	0	112.6	I292 L303 V311 T384 L385 T386	I292-A309 CarbonylContact O-C 3.59Å; I292-A309 VanDerWaalsContact O-CA 3.32Å; I292-A309 WeakPolarHBondContact O-CA 3.47Å; L303-A309 HydrophobicContact CD1-CB 3.54Å; L303-A309 HydrophobicContact CD2-CB 3.74Å; L303-A309 HydrophobicContact CG-CB 4.31Å; A309-V311 HydrophobicContact CB-CG2 3.92Å; A309-T384 PolarHBondContact N-O 2.94Å; A309-L385 HydrophobicContact CB-CD2 4.01Å; A309-T386 PolarHBondContact O-N 2.82Å
310	F	90.9	Very high	92.6	Very high	52 Å²	52	39.8 Å²	39.8	23%	0.228	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	107.3	169.2	-66.3	-96.2	0	0	0	109	T291 I292 V293 Q294 Q308 T386 R388	T291-F310 HydrophobicContact CG2-CD2 4.15Å; T291-F310 HydrophobicContact CG2-CE2 3.77Å; I292-F310 PolarHBondContact O-N 3.15Å; V293-F310 HydrophobicContact CG1-CB 4.32Å; V293-F310 HydrophobicContact CG2-CB 4.26Å; V293-F310 HydrophobicContact CG2-CD2 3.67Å; V293-F310 HydrophobicContact CG2-CE2 4.38Å; V293-F310 HydrophobicContact CG2-CG 4.23Å; Q294-F310 VanDerWaalsContact CB-O 3.32Å; Q294-F310 WeakPolarHBondContact CB-O 3.17Å; Q294-F310 PolarHBondContact N-O 3.32Å; Q294-F310 VanDerWaalsContact N-O 3.07Å; Q308-F310 HydrophobicContact CG-CE2 4.42Å; F310-T386 CarbonylContact C-O 3.58Å; F310-T386 WeakPolarHBondContact CA-O 3.39Å; F310-T386 HydrophobicContact CD1-CG2 3.85Å; F310-T386 HydrophobicContact CE1-CG2 3.78Å; F310-R388 HydrophobicContact CB-CB 4.11Å
311	V	91.7	Very high	92.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134	-167.9	-177.5	0	0	0	0	110.5	I301 A309 T315 V317 F364 T386 R388	I301-V311 HydrophobicContact CD1-CG1 4.24Å; I301-V311 HydrophobicContact CD1-CG2 4.43Å; A309-V311 HydrophobicContact CB-CG2 3.92Å; V311-T315 HydrophobicContact CG1-CG2 4.41Å; V311-V317 HydrophobicContact CG1-CG2 3.79Å; V311-V317 HydrophobicContact CG2-CG2 4.32Å; V311-F364 HydrophobicContact CB-CD1 3.85Å; V311-F364 HydrophobicContact CB-CE1 3.89Å; V311-F364 HydrophobicContact CB-CG 4.34Å; V311-F364 HydrophobicContact CB-CZ 4.4Å; V311-F364 HydrophobicContact CG1-CB 4.12Å; V311-F364 HydrophobicContact CG1-CD1 3.63Å; V311-F364 HydrophobicContact CG1-CE1 4.2Å; V311-F364 HydrophobicContact CG1-CG 3.86Å; V311-T386 PolarHBondContact N-O 2.92Å; V311-R388 PolarHBondContact O-N 3.1Å
312	I	88.6	Confident	92.8	Very high	13 Å²	13	38.7 Å²	38.7	7%	0.067	19%	0.187	C	C	.	.			trans	-72.6	131.4	171.9	-61.8	173.7	0	0	0	108.4	Q294 T315 R388 P390	Q294-I312 HydrophobicContact CB-CG1 4.35Å; Q294-I312 HydrophobicContact CG-CD1 3.81Å; Q294-I312 HydrophobicContact CG-CG1 3.98Å; I312-T315 WeakPolarHBondContact O-CB 3.28Å; I312-T315 PolarHBondContact O-N 3.39Å; I312-T315 PolarHBondContact O-OG1 3.24Å; I312-R388 WeakPolarHBondContact CA-O 3.42Å; I312-P390 HydrophobicContact CD1-CB 4.48Å; I312-P390 HydrophobicContact CD1-CG 4.19Å; I312-P390 HydrophobicContact CG1-CG 4.48Å; I312-P390 HydrophobicContact CG2-CG 3.97Å
313	P	90.7	Very high	92.6	Very high	34 Å²	34	36.2 Å²	36.2	22%	0.221	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	148.6	175.5	-29.7	35.4	0	0	0	113.6	T315 F364 R388	P313-T315 PolarHBondContact O-N 3.11Å; P313-F364 CarbonylContact C-O 3.51Å; P313-R388 VanDerWaalsContact CD-O 3.29Å; P313-R388 WeakPolarHBondContact CD-O 3.09Å
314	F	91	Very high	92.1	Very high	144 Å²	144	36.7 Å²	36.7	63%	0.632	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.1	9.5	-177	-42.7	-75	0	0	0	115.6	F364	F314-F364 WeakPolarHBondContact CA-O 3.04Å; F314-F364 PolarHBondContact N-O 3.17Å
315	T	91.8	Very high	91.5	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.012	18%	0.18	C	C	.	.			trans	-76.5	145	171.9	-57	0	0	0	0	110.6	Q294 V298 I301 V311 I312 P313 F364	Q294-T315 PolarHBondContact NE2-OG1 3.21Å; Q294-T315 PolarHBondContact OE1-OG1 2.91Å; V298-T315 HydrophobicContact CG2-CG2 4.2Å; I301-T315 HydrophobicContact CD1-CG2 3.78Å; I301-T315 HydrophobicContact CG1-CG2 3.8Å; V311-T315 HydrophobicContact CG1-CG2 4.41Å; I312-T315 WeakPolarHBondContact O-CB 3.28Å; I312-T315 PolarHBondContact O-N 3.39Å; I312-T315 PolarHBondContact O-OG1 3.24Å; P313-T315 PolarHBondContact O-N 3.11Å; T315-F364 WeakPolarHBondContact O-CB 3.45Å; T315-F364 PolarHBondContact O-N 2.96Å
316	R	94.8	Very high	91	Very high	130 Å²	130	39.9 Å²	39.9	49%	0.491	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	125.4	170.5	-72.3	171.6	-176.8	-176.5	5.2	109.3	K299 V300 I301 I361 R362	K299-R316 WeakPolarHBondContact O-CB 3.45Å; V300-R316 CarbonylContact C-O 3.56Å; V300-R316 VanDerWaalsContact CA-O 3.32Å; V300-R316 WeakPolarHBondContact CA-O 3.49Å; V300-R316 HydrophobicContact CB-CB 4.38Å; V300-R316 HydrophobicContact CG1-CB 4.37Å; V300-R316 HydrophobicContact CG2-CB 4.02Å; I301-R316 PolarHBondContact N-O 2.82Å; R316-I361 CarbonylContact C-O 3.57Å; R316-I361 WeakPolarHBondContact CA-O 3.45Å; R316-R362 WeakPolarHBondContact CG-O 3.33Å
317	V	95.7	Very high	90.7	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131.4	178	-177	0	0	0	0	109.1	I301 L303 V311 V319 I361 F364 L385	I301-V317 CarbonylContact O-C 3.5Å; I301-V317 WeakPolarHBondContact O-CA 3.28Å; L303-V317 HydrophobicContact CD1-CG1 3.66Å; L303-V317 HydrophobicContact CG-CG1 4.3Å; V311-V317 HydrophobicContact CG1-CG2 3.79Å; V311-V317 HydrophobicContact CG2-CG2 4.32Å; V317-V319 HydrophobicContact CG1-CG2 4.02Å; V317-I361 HydrophobicContact CB-CB 4.22Å; V317-I361 PolarHBondContact N-O 2.9Å; V317-I361 PolarHBondContact O-N 3.41Å; V317-F364 HydrophobicContact CG2-CB 4.09Å; V317-F364 HydrophobicContact CG2-CD2 4.41Å; V317-F364 HydrophobicContact CG2-CG 4.41Å; V317-L385 HydrophobicContact CG1-CD1 4.35Å
318	T	95.5	Very high	90.2	Very high	12 Å²	12	42.8 Å²	42.8	7%	0.074	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125	172.7	-56.9	0	0	0	0	108.2	I301 D302 L303 R358 L359	I301-T318 PolarHBondContact O-N 3.31Å; D302-T318 CarbonylContact C-O 3.59Å; D302-T318 WeakPolarHBondContact CA-O 3.38Å; L303-T318 PolarHBondContact N-O 2.87Å; T318-R358 HydrophobicContact CG2-CB 4.49Å; T318-L359 CarbonylContact C-O 3.54Å; T318-L359 VanDerWaalsContact CA-O 3.31Å; T318-L359 WeakPolarHBondContact CA-O 3.33Å
319	V	96.3	Very high	89.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132	178.9	-166.8	0	0	0	0	110	L303 V317 W333 R358 L359 V383	L303-V319 HydrophobicContact CB-CG1 4.28Å; L303-V319 HydrophobicContact CB-CG2 4.26Å; L303-V319 HydrophobicContact CD1-CG2 4.43Å; L303-V319 CarbonylContact O-C 3.56Å; L303-V319 WeakPolarHBondContact O-CA 3.24Å; V317-V319 HydrophobicContact CG1-CG2 4.02Å; V319-W333 HydrophobicContact CB-CH2 3.95Å; V319-W333 HydrophobicContact CB-CZ2 4.47Å; V319-W333 HydrophobicContact CB-CZ3 4.49Å; V319-W333 HydrophobicContact CG1-CH2 3.54Å; V319-W333 HydrophobicContact CG1-CZ2 4.41Å; V319-W333 HydrophobicContact CG1-CZ3 4.11Å; V319-R358 WeakPolarHBondContact O-CA 3.43Å; V319-L359 HydrophobicContact CB-CB 4.2Å; V319-L359 HydrophobicContact CB-CD2 4.45Å; V319-L359 HydrophobicContact CG2-CD2 4.12Å; V319-L359 PolarHBondContact N-O 3.45Å; V319-L359 PolarHBondContact O-N 2.82Å; V319-V383 HydrophobicContact CB-CG1 4.47Å; V319-V383 HydrophobicContact CG1-CB 4.24Å; V319-V383 HydrophobicContact CG1-CG1 3.51Å; V319-V383 HydrophobicContact CG1-CG2 4.39Å; V319-V383 HydrophobicContact CG2-CG1 4.33Å
320	R	95.1	Very high	89.5	Confident	113 Å²	113	50.8 Å²	50.8	43%	0.426	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.8	177.5	-56.7	179.5	-165.9	156.2	4.9	110.1	D302 L303 K304 V305 P322 R358	D302-R320 IonicContact OD1-CZ 2.78Å; D302-R320 IonicContact OD1-NE 3.81Å; D302-R320 IonicContact OD1-NH2 3.75Å; D302-R320 PolarHBondContact OD1-NH2 3.32Å; D302-R320 IonicContact OD2-NH2 2.83Å; D302-R320 PolarHBondContact OD2-NH2 3.3Å; L303-R320 PolarHBondContact O-N 3.47Å; K304-R320 WeakPolarHBondContact CA-O 3.29Å; V305-R320 PolarHBondContact N-O 2.9Å; V305-R320 VanDerWaalsContact N-O 3.1Å; R320-P322 WeakPolarHBondContact O-CD 3.18Å; R320-R358 HydrophobicContact CG-CG 4.16Å
321	C	94.2	Very high	89.6	Confident	12 Å²	12	48.3 Å²	48.3	8%	0.081	23%	0.233	C	C	.	.			trans	-113.5	94.7	171.5	-174	0	0	0	0	108.9	V305 V323 L331 W333 C374	V305-C321 HydrophobicContact CG1-CB 3.88Å; C321-V323 PolarHBondContact O-N 3.49Å; C321-V323 VanDerWaalsContact SG-CG1 3.53Å; C321-L331 HydrophobicContact CB-CD1 4.42Å; C321-W333 HydrophobicContact CB-CH2 4.01Å; C321-W333 HydrophobicContact CB-CZ2 3.66Å; C321-C374 HydrophobicContact CB-CB 3.66Å; C321-C374 WeakPolarHBondContact CB-SG 3.33Å; C321-C374 WeakPolarHBondContact SG-CB 2.94Å; C321-C374 CovalentContact SG-SG 2.02Å; C321-C374 PolarHBondContact SG-SG 3.46Å
322	P	91.2	Very high	89.6	Confident	48 Å²	48	52.3 Å²	52.3	31%	0.312	25%	0.252	S	S	.	.			trans	-81.4	89.8	-177.6	30.2	-26.6	0	0	0	109.5	N286 K304 R320	N286-P322 HydrophobicContact CB-CG 4.12Å; N286-P322 PolarHBondContact N-O 2.97Å; N286-P322 VanDerWaalsContact N-O 3.07Å; N286-P322 VanDerWaalsContact O-CG 3.27Å; N286-P322 WeakPolarHBondContact O-CG 3.25Å; K304-P322 HydrophobicContact CD-CG 3.85Å; K304-P322 HydrophobicContact CG-CG 4.05Å; R320-P322 WeakPolarHBondContact O-CD 3.18Å
323	V	87.7	Confident	89.9	Confident	28 Å²	28	51.7 Å²	51.7	17%	0.17	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	147.6	176.7	-57.6	0	0	0	0	111.6	M284 I285 C321 F326 L331 A376	M284-V323 CarbonylContact O-C 3.59Å; M284-V323 WeakPolarHBondContact O-CA 3.19Å; I285-V323 HydrophobicContact CD1-CG1 4.34Å; I285-V323 HydrophobicContact CG1-CG1 3.9Å; I285-V323 HydrophobicContact CG2-CG1 4.35Å; C321-V323 PolarHBondContact O-N 3.49Å; C321-V323 VanDerWaalsContact SG-CG1 3.53Å; V323-F326 HydrophobicContact CB-CB 4.23Å; V323-F326 HydrophobicContact CG2-CB 4.01Å; V323-F326 HydrophobicContact CG2-CD1 4.33Å; V323-L331 HydrophobicContact CB-CD2 4.46Å; V323-L331 HydrophobicContact CG1-CD1 4.27Å; V323-L331 HydrophobicContact CG1-CD2 3.67Å; V323-L331 HydrophobicContact CG2-CD1 4.01Å; V323-L331 HydrophobicContact CG2-CD2 4.11Å; V323-L331 HydrophobicContact CG2-CG 4.4Å; V323-A376 HydrophobicContact CG1-CB 3.99Å
324	Q	83.2	Confident	90.1	Very high	15 Å²	15	51 Å²	51	7%	0.07	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	150.7	171.4	-39.4	-169.2	20.5	0	0	108.6	R229 P283 M284 N286 F326	R229-Q324 VanDerWaalsContact NH2-OE1 3.12Å; P283-Q324 WeakPolarHBondContact CA-O 3.22Å; M284-Q324 HydrophobicContact CB-CB 4.31Å; M284-Q324 HydrophobicContact CB-CG 4.47Å; M284-Q324 HydrophobicContact CE-CG 4.26Å; M284-Q324 PolarHBondContact N-O 2.73Å; M284-Q324 WeakPolarHBondContact O-CG 3.08Å; M284-Q324 PolarHBondContact O-N 2.68Å; N286-Q324 VanDerWaalsContact CG-NE2 3.33Å; N286-Q324 PolarHBondContact ND2-NE2 2.86Å; N286-Q324 VanDerWaalsContact ND2-NE2 3.1Å; N286-Q324 PolarHBondContact OD1-NE2 2.03Å; Q324-F326 PolarHBondContact O-N 2.95Å
325	Y	80.9	Confident	90.3	Very high	67 Å²	67	44.3 Å²	44.3	26%	0.263	22%	0.217	S	C	.	.	S	Bend	trans	55	32.2	178.3	-45.1	-71.5	0	0	0	113.4	D226 C228 K281	D226-Y325 PolarHBondContact OD1-OH 3.44Å; D226-Y325 PolarHBondContact OD2-OH 3.13Å; C228-Y325 HydrophobicContact CB-CE1 3.7Å; C228-Y325 WeakPolarHBondContact CB-OH 3.27Å; K281-Y325 HydrophobicContact CB-CD1 4.22Å; K281-Y325 HydrophobicContact CB-CD2 4.08Å; K281-Y325 HydrophobicContact CB-CE1 4.33Å; K281-Y325 HydrophobicContact CB-CE2 4.23Å; K281-Y325 HydrophobicContact CB-CG 4.08Å; K281-Y325 HydrophobicContact CD-CE1 4.23Å; K281-Y325 HydrophobicContact CD-CE2 4.08Å
326	F	82.8	Confident	90.2	Very high	48 Å²	48	49.5 Å²	49.5	21%	0.211	25%	0.25	C	S	.	.	S	Bend	trans	-150.7	141	-179	-163.2	-100.2	0	0	0	110.7	P283 V323 Q324 A328 E330 L331 A376	P283-F326 HydrophobicContact CB-CB 3.99Å; P283-F326 HydrophobicContact CB-CD2 3.97Å; P283-F326 HydrophobicContact CB-CG 4.27Å; P283-F326 HydrophobicContact CG-CD2 4.5Å; V323-F326 HydrophobicContact CB-CB 4.23Å; V323-F326 HydrophobicContact CG2-CB 4.01Å; V323-F326 HydrophobicContact CG2-CD1 4.33Å; Q324-F326 PolarHBondContact O-N 2.95Å; F326-A328 PolarHBondContact O-N 2.79Å; F326-E330 HydrophobicContact CE1-CB 3.73Å; F326-E330 HydrophobicContact CZ-CB 3.8Å; F326-L331 HydrophobicContact CD1-CD2 3.68Å; F326-L331 HydrophobicContact CD1-CG 4.2Å; F326-L331 HydrophobicContact CE1-CD2 3.77Å; F326-L331 HydrophobicContact CE1-CG 4.22Å; F326-A376 HydrophobicContact CD1-CB 3.7Å; F326-A376 HydrophobicContact CD2-CB 4.28Å; F326-A376 HydrophobicContact CE1-CB 3.92Å; F326-A376 HydrophobicContact CE2-CB 4.48Å; F326-A376 HydrophobicContact CG-CB 3.89Å; F326-A376 HydrophobicContact CZ-CB 4.32Å
327	T	85	Confident	90.1	Very high	68 Å²	68	47.6 Å²	47.6	42%	0.417	25%	0.25	S	C	.	.			trans	-74	119.6	179.9	-54.2	0	0	0	0	110	Q329 E330	T327-Q329 HydrophobicContact CG2-CB 4.18Å; T327-Q329 PolarHBondContact O-N 3.05Å; T327-E330 HydrophobicContact CG2-CG 4.43Å; T327-E330 PolarHBondContact O-N 2.76Å
328	A	82	Confident	89.8	Confident	38 Å²	38	50.1 Å²	50.1	31%	0.314	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-60.9	-21.1	-176.8	0	0	0	0	0	114.5	F326 L331 G357	F326-A328 PolarHBondContact O-N 2.79Å; A328-L331 HydrophobicContact CB-CD1 4.38Å; A328-G357 VanDerWaalsContact O-CA 3.32Å; A328-G357 WeakPolarHBondContact O-CA 3.49Å; A328-G357 PolarHBondContact O-N 3.45Å
329	Q	83.8	Confident	89.6	Confident	124 Å²	124	51.4 Å²	51.4	58%	0.579	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-75.4	-25.6	177.3	-66	172.4	-5.6	0	0	112.9	T327 L331	T327-Q329 HydrophobicContact CG2-CB 4.18Å; T327-Q329 PolarHBondContact O-N 3.05Å; Q329-L331 VanDerWaalsContact C-N 3.26Å; Q329-L331 PolarHBondContact O-N 2.81Å
330	E	87.2	Confident	89.4	Confident	117 Å²	117	56.8 Å²	56.8	55%	0.547	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-85.9	0.5	179.7	-66.4	168.7	-160	0	0	112.3	F326 T327 Q332	F326-E330 HydrophobicContact CE1-CB 3.73Å; F326-E330 HydrophobicContact CZ-CB 3.8Å; T327-E330 HydrophobicContact CG2-CG 4.43Å; T327-E330 PolarHBondContact O-N 2.76Å; E330-Q332 PolarHBondContact O-N 2.82Å
331	L	92	Very high	89.2	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	30%	0.295	C	S	.	.			trans	-66.6	132.2	179.6	-72.4	175.1	0	0	0	111.6	C321 V323 F326 A328 Q329 A376	C321-L331 HydrophobicContact CB-CD1 4.42Å; V323-L331 HydrophobicContact CB-CD2 4.46Å; V323-L331 HydrophobicContact CG1-CD1 4.27Å; V323-L331 HydrophobicContact CG1-CD2 3.67Å; V323-L331 HydrophobicContact CG2-CD1 4.01Å; V323-L331 HydrophobicContact CG2-CD2 4.11Å; V323-L331 HydrophobicContact CG2-CG 4.4Å; F326-L331 HydrophobicContact CD1-CD2 3.68Å; F326-L331 HydrophobicContact CD1-CG 4.2Å; F326-L331 HydrophobicContact CE1-CD2 3.77Å; F326-L331 HydrophobicContact CE1-CG 4.22Å; A328-L331 HydrophobicContact CB-CD1 4.38Å; Q329-L331 VanDerWaalsContact C-N 3.26Å; Q329-L331 PolarHBondContact O-N 2.81Å; L331-A376 HydrophobicContact CD2-CB 3.64Å
332	Q	92.9	Very high	89	Confident	83 Å²	83	55.1 Å²	55.1	39%	0.388	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	141.4	175.6	-64	-179.2	-18.1	0	0	109.7	E330 I340 L341 A342 C374 I375	E330-Q332 PolarHBondContact O-N 2.82Å; Q332-I340 HydrophobicContact CB-CG2 3.98Å; Q332-I340 HydrophobicContact CG-CG2 4.37Å; Q332-L341 CarbonylContact C-O 3.36Å; Q332-L341 WeakPolarHBondContact CA-O 3.4Å; Q332-A342 HydrophobicContact CG-CB 4.4Å; Q332-C374 CarbonylContact O-C 3.58Å; Q332-I375 HydrophobicContact CB-CB 4.26Å; Q332-I375 PolarHBondContact N-O 3.33Å; Q332-I375 VanDerWaalsContact N-O 3.13Å; Q332-I375 PolarHBondContact O-N 3.25Å
333	W	94.9	Very high	88.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	120.9	175	-75.5	90.6	0	0	0	109.2	V305 V319 C321 I340 L341 V353 G357 L359 W372 T373 C374 V383	V305-W333 HydrophobicContact CG1-CH2 3.63Å; V305-W333 HydrophobicContact CG1-CZ3 4.12Å; V319-W333 HydrophobicContact CB-CH2 3.95Å; V319-W333 HydrophobicContact CB-CZ2 4.47Å; V319-W333 HydrophobicContact CB-CZ3 4.49Å; V319-W333 HydrophobicContact CG1-CH2 3.54Å; V319-W333 HydrophobicContact CG1-CZ2 4.41Å; V319-W333 HydrophobicContact CG1-CZ3 4.11Å; C321-W333 HydrophobicContact CB-CH2 4.01Å; C321-W333 HydrophobicContact CB-CZ2 3.66Å; W333-I340 CarbonylContact O-C 3.51Å; W333-I340 WeakPolarHBondContact O-CA 3.06Å; W333-L341 HydrophobicContact CB-CB 4.36Å; W333-L341 PolarHBondContact N-O 3.47Å; W333-L341 PolarHBondContact O-N 3.1Å; W333-V353 HydrophobicContact CB-CG2 4.42Å; W333-V353 HydrophobicContact CG-CG2 4.26Å; W333-G357 PolarHBondContact NE1-O 2.02Å; W333-L359 HydrophobicContact CD2-CB 3.81Å; W333-L359 HydrophobicContact CD2-CD2 4.28Å; W333-L359 HydrophobicContact CD2-CG 4.49Å; W333-L359 HydrophobicContact CE3-CB 4.28Å; W333-L359 HydrophobicContact CE3-CD2 4.04Å; W333-L359 HydrophobicContact CG-CB 4.15Å; W333-L359 HydrophobicContact CG-CD1 4.41Å; W333-L359 HydrophobicContact CH2-CB 4.44Å; W333-L359 HydrophobicContact CZ2-CB 4Å; W333-L359 HydrophobicContact CZ3-CD2 4.39Å; W333-W372 HydrophobicContact CE3-CB 4.35Å; W333-W372 HydrophobicContact CZ3-CB 4.38Å; W333-T373 CarbonylContact C-O 3.43Å; W333-T373 VanDerWaalsContact CA-O 3.31Å; W333-T373 WeakPolarHBondContact CA-O 3.34Å; W333-C374 HydrophobicContact CD2-CB 4.35Å; W333-C374 HydrophobicContact CE3-CB 4.09Å; W333-C374 HydrophobicContact CH2-CB 3.81Å; W333-C374 HydrophobicContact CZ2-CB 4.08Å; W333-C374 HydrophobicContact CZ3-CB 3.81Å; W333-V383 HydrophobicContact CZ3-CG1 4.12Å
334	A	94.5	Very high	88.7	Confident	20 Å²	20	61.9 Å²	61.9	17%	0.165	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.9	175.4	0	0	0	0	0	110.6	G339 I340 T373 I375	A334-G339 WeakPolarHBondContact CA-O 3.32Å; A334-I340 HydrophobicContact CB-CG1 4.24Å; A334-T373 PolarHBondContact N-O 3.36Å; A334-T373 PolarHBondContact O-N 2.98Å; A334-I375 HydrophobicContact CB-CD1 3.77Å
335	N	94.3	Very high	88.4	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.021	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	138.2	168	173.6	-83.5	0	0	0	108.6	N337 H338 G339 D371 W372	N335-N337 PolarHBondContact O-N 2.69Å; N335-N337 VanDerWaalsContact O-N 3.1Å; N335-N337 WeakPolarHBondContact OD1-CB 3.49Å; N335-N337 PolarHBondContact OD1-N 2.77Å; N335-H338 HydrophobicContact CB-CB 4.32Å; N335-H338 PolarHBondContact O-N 2.82Å; N335-H338 VanDerWaalsContact O-N 3.1Å; N335-H338 PolarHBondContact OD1-N 3.16Å; N335-G339 PolarHBondContact N-O 2.81Å; N335-G339 PolarHBondContact O-N 3.18Å; N335-D371 PolarHBondContact ND2-O 2.9Å; N335-W372 HydrophobicContact CB-CD2 3.75Å; N335-W372 HydrophobicContact CB-CE3 3.67Å; N335-W372 HydrophobicContact CB-CG 4.38Å; N335-W372 HydrophobicContact CB-CH2 4.03Å; N335-W372 HydrophobicContact CB-CZ2 4.11Å; N335-W372 HydrophobicContact CB-CZ3 3.82Å; N335-W372 PolarHBondContact ND2-NE1 2.72Å
336	P	90.5	Very high	88.2	Confident	110 Å²	110	63.5 Å²	63.5	71%	0.714	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-34.4	-177.9	-28.4	35.4	0	0	0	114.5
337	N	91.9	Very high	87.6	Confident	90 Å²	90	68 Å²	68	48%	0.481	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-17.6	-176.5	-57.6	-25	0	0	0	113.4	N335 I367 E369	N335-N337 PolarHBondContact O-N 2.69Å; N335-N337 VanDerWaalsContact O-N 3.1Å; N335-N337 WeakPolarHBondContact OD1-CB 3.49Å; N335-N337 PolarHBondContact OD1-N 2.77Å; N337-I367 HydrophobicContact CB-CG1 4.22Å; N337-I367 WeakPolarHBondContact CB-O 3.44Å; N337-I367 PolarHBondContact ND2-O 3.45Å; N337-E369 PolarHBondContact ND2-O 2.79Å
338	H	90.6	Very high	87	Confident	55 Å²	55	67.7 Å²	67.7	26%	0.255	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-3.9	-174.4	-67.7	-60.6	0	0	0	114.6	N335 R350 D368 W372	N335-H338 HydrophobicContact CB-CB 4.32Å; N335-H338 PolarHBondContact O-N 2.82Å; N335-H338 VanDerWaalsContact O-N 3.1Å; N335-H338 PolarHBondContact OD1-N 3.16Å; H338-R350 PolarHBondContact CE1-NH2 3.44Å; H338-D368 IonicContact CE1-OD1 3.78Å; H338-D368 IonicContact NE2-OD1 3.75Å; H338-D368 PolarHBondContact NE2-OD1 2.62Å; H338-W372 HydrophobicContact CB-CH2 4.13Å; H338-W372 AromaticContact CD2-CH2 3.51Å; H338-W372 AromaticContact CD2-CZ2 3.48Å; H338-W372 VanDerWaalsContact CD2-CZ2 3.48Å; H338-W372 WeakPolarHBondContact CD2-CZ2 3.03Å
339	G	90.7	Very high	86.6	Confident	38 Å²	38	72.3 Å²	72.3	39%	0.392	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	69	-148.1	-175.3	0	0	0	0	0	112	A334 N335	A334-G339 WeakPolarHBondContact CA-O 3.32Å; N335-G339 PolarHBondContact N-O 2.81Å; N335-G339 PolarHBondContact O-N 3.18Å
340	I	91.6	Very high	87	Confident	114 Å²	114	68.3 Å²	68.3	59%	0.585	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	129.1	-177.5	-56.8	172.7	0	0	0	109.7	Q332 W333 A334	Q332-I340 HydrophobicContact CB-CG2 3.98Å; Q332-I340 HydrophobicContact CG-CG2 4.37Å; W333-I340 CarbonylContact O-C 3.51Å; W333-I340 WeakPolarHBondContact O-CA 3.06Å; A334-I340 HydrophobicContact CB-CG1 4.24Å
341	L	91	Very high	87.3	Confident	45 Å²	45	63.3 Å²	63.3	24%	0.236	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.3	-179.7	-63.3	167.4	0	0	0	109.5	Q332 W333 I351 V353 L359 W372	Q332-L341 CarbonylContact C-O 3.36Å; Q332-L341 WeakPolarHBondContact CA-O 3.4Å; W333-L341 HydrophobicContact CB-CB 4.36Å; W333-L341 PolarHBondContact N-O 3.47Å; W333-L341 PolarHBondContact O-N 3.1Å; L341-I351 HydrophobicContact CD1-CG2 3.67Å; L341-V353 HydrophobicContact CB-CG2 4.05Å; L341-L359 HydrophobicContact CD1-CD1 4.46Å; L341-W372 HydrophobicContact CD1-CH2 4.24Å; L341-W372 HydrophobicContact CD1-CZ3 3.84Å
342	A	89.6	Confident	87.3	Confident	44 Å²	44	68.4 Å²	68.4	36%	0.364	39%	0.393	S	S	.	.			trans	-126.9	170.7	174	0	0	0	0	0	110	Q332 T344	Q332-A342 HydrophobicContact CG-CB 4.4Å; A342-T344 PolarHBondContact O-N 3.48Å
343	Y	88.8	Confident	87.3	Confident	106 Å²	106	65 Å²	65	42%	0.416	38%	0.378	S	S	.	.			trans	-69.5	112.3	172.6	174.7	-113.6	0	0	0	110.3	V353 K355	Y343-V353 WeakPolarHBondContact CD2-O 3.46Å; Y343-K355 HydrophobicContact CE1-CB 4.44Å; Y343-K355 HydrophobicContact CE2-CB 4.16Å
344	T	83.9	Confident	87.1	Confident	113 Å²	113	65.5 Å²	65.5	69%	0.693	38%	0.381	S	S	*	.			trans	-106.7	-2.8	178.8	55.9	0	0	0	0	113.5	A342 A346	A342-T344 PolarHBondContact O-N 3.48Å; T344-A346 PolarHBondContact O-N 3.32Å
345	G	78.3	Confident	86.7	Confident	47 Å²	47	71.2 Å²	71.2	49%	0.485	40%	0.402	S	S	.	.	S	Bend	trans	71	-21.8	-169.9	0	0	0	0	0	114.7
346	A	75.5	Confident	86.5	Confident	68 Å²	68	79 Å²	79	56%	0.562	43%	0.431	S	S	*	.			trans	-70.1	137.7	177.1	0	0	0	0	0	111.9	T344 S348	T344-A346 PolarHBondContact O-N 3.32Å; A346-S348 PolarHBondContact O-N 3.11Å; A346-S348 VanDerWaalsContact O-N 3.15Å
347	I	71	Confident	86.6	Confident	144 Å²	144	73.8 Å²	73.8	74%	0.738	40%	0.398	S	S	*	.			trans	-84.5	89.2	175.3	-55.2	173.2	0	0	0	107.5
348	S	72.7	Confident	86.7	Confident	60 Å²	60	72.9 Å²	72.9	42%	0.42	39%	0.387	S	S	.	.			trans	-63.7	140.8	164.2	164.5	0	0	0	0	109.9	A346 R350 I351	A346-S348 PolarHBondContact O-N 3.11Å; A346-S348 VanDerWaalsContact O-N 3.15Å; S348-R350 PolarHBondContact O-N 3.43Å; S348-I351 WeakPolarHBondContact CB-O 3.46Å; S348-I351 PolarHBondContact OG-O 3.44Å
349	D	73.5	Confident	86.9	Confident	136 Å²	136	70.2 Å²	70.2	73%	0.727	38%	0.375	S	S	*	.	S	Bend	trans	-64.1	-27.2	-172.9	-76.2	-30.4	0	0	0	113.8	R362	D349-R362 WeakPolarHBondContact O-CD 3.03Å
350	R	91.3	Very high	87.1	Confident	39 Å²	39	69.8 Å²	69.8	15%	0.147	36%	0.363	C	S	.	.	S	Bend	trans	-129.9	-55.3	-169.2	-165.3	175.7	75.9	88.8	0.1	116.1	H338 S348 R362 S363 D368	H338-R350 PolarHBondContact CE1-NH2 3.44Å; S348-R350 PolarHBondContact O-N 3.43Å; R350-R362 VanDerWaalsContact O-CB 3.3Å; R350-R362 WeakPolarHBondContact O-CB 3.43Å; R350-R362 PolarHBondContact O-N 2.86Å; R350-S363 PolarHBondContact NH1-O 3.21Å; R350-D368 IonicContact CZ-OD1 3.68Å; R350-D368 IonicContact CZ-OD2 2.85Å; R350-D368 IonicContact NH1-OD1 2.7Å; R350-D368 PolarHBondContact NH1-OD1 2.75Å; R350-D368 IonicContact NH1-OD2 2.74Å; R350-D368 PolarHBondContact NH1-OD2 2.03Å; R350-D368 IonicContact NH2-OD1 2.96Å; R350-D368 PolarHBondContact NH2-OD1 2.85Å; R350-D368 IonicContact NH2-OD2 3.98Å
351	I	93.5	Very high	87.2	Confident	13 Å²	13	64.4 Å²	64.4	7%	0.067	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.1	-178.5	-57.6	168.7	0	0	0	108.1	L341 S348 L359 H360 I361 W372	L341-I351 HydrophobicContact CD1-CG2 3.67Å; S348-I351 WeakPolarHBondContact CB-O 3.46Å; S348-I351 PolarHBondContact OG-O 3.44Å; I351-L359 HydrophobicContact CG2-CD1 3.77Å; I351-H360 WeakPolarHBondContact CA-O 3.26Å; I351-I361 HydrophobicContact CG1-CG1 4.38Å; I351-I361 HydrophobicContact CG1-CG2 4.28Å; I351-I361 HydrophobicContact CG2-CG1 4.44Å; I351-W372 HydrophobicContact CD1-CH2 4.05Å; I351-W372 HydrophobicContact CD1-CZ2 4.39Å; I351-W372 HydrophobicContact CG2-CH2 3.98Å; I351-W372 HydrophobicContact CG2-CZ3 4.36Å
352	R	92.2	Very high	87.3	Confident	108 Å²	108	69.4 Å²	69.4	41%	0.408	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	154.7	-179.7	67.3	-178.7	-172	120.5	3.6	111.9	H360	R352-H360 HydrophobicContact CG-CB 3.86Å; R352-H360 PolarHBondContact N-O 3.43Å; R352-H360 PolarHBondContact O-N 2.91Å
353	V	92.4	Very high	87.4	Confident	11 Å²	11	68.6 Å²	68.6	7%	0.067	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.1	166.7	-175.8	0	0	0	0	107.8	W333 L341 Y343 R358 L359	W333-V353 HydrophobicContact CB-CG2 4.42Å; W333-V353 HydrophobicContact CG-CG2 4.26Å; L341-V353 HydrophobicContact CB-CG2 4.05Å; Y343-V353 WeakPolarHBondContact CD2-O 3.46Å; V353-R358 CarbonylContact C-O 3.51Å; V353-R358 VanDerWaalsContact CA-O 3.31Å; V353-R358 WeakPolarHBondContact CA-O 3.36Å; V353-L359 HydrophobicContact CG2-CD1 4.48Å
354	D	90.6	Very high	87.7	Confident	11 Å²	11	63.6 Å²	63.6	6%	0.059	32%	0.323	C	S	.	.			trans	-89.5	174.2	177.4	74.7	12.9	0	0	0	113.2	R356 G357 R358 H360	D354-R356 PolarHBondContact O-N 2.85Å; D354-R356 WeakPolarHBondContact OD1-CA 3.21Å; D354-R356 WeakPolarHBondContact OD1-CB 3.36Å; D354-R356 PolarHBondContact OD1-N 2.86Å; D354-G357 PolarHBondContact O-N 3.47Å; D354-G357 PolarHBondContact OD1-N 3.22Å; D354-R358 PolarHBondContact N-O 3.17Å; D354-R358 WeakPolarHBondContact OD1-CB 3.37Å; D354-R358 PolarHBondContact OD1-N 3.39Å; D354-R358 IonicContact OD1-NE 3.21Å; D354-R358 IonicContact OD2-CZ 3.99Å; D354-R358 IonicContact OD2-NE 3.04Å; D354-R358 PolarHBondContact OD2-NE 3.42Å; D354-R358 IonicContact OD2-NH2 2.65Å; D354-R358 PolarHBondContact OD2-NH2 2.83Å; D354-H360 IonicContact OD2-CD2 3.67Å; D354-H360 IonicContact OD2-CE1 3.7Å; D354-H360 IonicContact OD2-NE2 2.78Å; D354-H360 PolarHBondContact OD2-NE2 3.43Å
355	K	87.9	Confident	88.1	Confident	139 Å²	139	63.9 Å²	63.9	60%	0.604	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-11.1	179.1	71.2	-179.1	-177.4	179	0	115.3	Y343	Y343-K355 HydrophobicContact CE1-CB 4.44Å; Y343-K355 HydrophobicContact CE2-CB 4.16Å
356	R	90.2	Very high	88.7	Confident	168 Å²	168	67.6 Å²	67.6	63%	0.634	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	10.7	175.8	-63.6	-176.4	173.7	179.3	-0.8	111.4	D354 R358	D354-R356 PolarHBondContact O-N 2.85Å; D354-R356 WeakPolarHBondContact OD1-CA 3.21Å; D354-R356 WeakPolarHBondContact OD1-CB 3.36Å; D354-R356 PolarHBondContact OD1-N 2.86Å; R356-R358 VanDerWaalsContact C-N 3.26Å; R356-R358 HydrophobicContact CB-CG 4.39Å; R356-R358 PolarHBondContact O-N 2.85Å
357	G	90.9	Very high	89.5	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.01	32%	0.315	C	S	.	.	S	Bend	trans	70.5	16	-178.3	0	0	0	0	0	114.3	A328 W333 D354	A328-G357 VanDerWaalsContact O-CA 3.32Å; A328-G357 WeakPolarHBondContact O-CA 3.49Å; A328-G357 PolarHBondContact O-N 3.45Å; W333-G357 PolarHBondContact NE1-O 2.02Å; D354-G357 PolarHBondContact O-N 3.47Å; D354-G357 PolarHBondContact OD1-N 3.22Å
358	R	94.1	Very high	90.6	Very high	70 Å²	70	61.9 Å²	61.9	26%	0.264	28%	0.28	S	S	.	.			trans	-81.9	134.7	177.5	-58.7	-178.8	-67.1	174.2	3.8	110	T318 V319 R320 V353 D354 R356 H360	T318-R358 HydrophobicContact CG2-CB 4.49Å; V319-R358 WeakPolarHBondContact O-CA 3.43Å; R320-R358 HydrophobicContact CG-CG 4.16Å; V353-R358 CarbonylContact C-O 3.51Å; V353-R358 VanDerWaalsContact CA-O 3.31Å; V353-R358 WeakPolarHBondContact CA-O 3.36Å; D354-R358 PolarHBondContact N-O 3.17Å; D354-R358 WeakPolarHBondContact OD1-CB 3.37Å; D354-R358 PolarHBondContact OD1-N 3.39Å; D354-R358 IonicContact OD1-NE 3.21Å; D354-R358 IonicContact OD2-CZ 3.99Å; D354-R358 IonicContact OD2-NE 3.04Å; D354-R358 PolarHBondContact OD2-NE 3.42Å; D354-R358 IonicContact OD2-NH2 2.65Å; D354-R358 PolarHBondContact OD2-NH2 2.83Å; R356-R358 VanDerWaalsContact C-N 3.26Å; R356-R358 HydrophobicContact CB-CG 4.39Å; R356-R358 PolarHBondContact O-N 2.85Å; R358-H360 PolarHBondContact O-CD2 2.87Å
359	L	94.9	Very high	91.6	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	129	171.8	175.8	71.5	0	0	0	109.6	T318 V319 W333 L341 I351 V353 I361 W372	T318-L359 CarbonylContact C-O 3.54Å; T318-L359 VanDerWaalsContact CA-O 3.31Å; T318-L359 WeakPolarHBondContact CA-O 3.33Å; V319-L359 HydrophobicContact CB-CB 4.2Å; V319-L359 HydrophobicContact CB-CD2 4.45Å; V319-L359 HydrophobicContact CG2-CD2 4.12Å; V319-L359 PolarHBondContact N-O 3.45Å; V319-L359 PolarHBondContact O-N 2.82Å; W333-L359 HydrophobicContact CD2-CB 3.81Å; W333-L359 HydrophobicContact CD2-CD2 4.28Å; W333-L359 HydrophobicContact CD2-CG 4.49Å; W333-L359 HydrophobicContact CE3-CB 4.28Å; W333-L359 HydrophobicContact CE3-CD2 4.04Å; W333-L359 HydrophobicContact CG-CB 4.15Å; W333-L359 HydrophobicContact CG-CD1 4.41Å; W333-L359 HydrophobicContact CH2-CB 4.44Å; W333-L359 HydrophobicContact CZ2-CB 4Å; W333-L359 HydrophobicContact CZ3-CD2 4.39Å; L341-L359 HydrophobicContact CD1-CD1 4.46Å; I351-L359 HydrophobicContact CG2-CD1 3.77Å; V353-L359 HydrophobicContact CG2-CD1 4.48Å; L359-I361 HydrophobicContact CD2-CD1 4.36Å; L359-I361 HydrophobicContact CD2-CG1 4.46Å; L359-I361 HydrophobicContact CG-CG1 4.36Å; L359-W372 HydrophobicContact CD1-CE3 4.03Å; L359-W372 HydrophobicContact CD1-CH2 4.41Å; L359-W372 HydrophobicContact CD1-CZ3 3.69Å; L359-W372 HydrophobicContact CD2-CB 4.26Å; L359-W372 HydrophobicContact CD2-CD2 3.56Å; L359-W372 HydrophobicContact CD2-CE3 3.21Å; L359-W372 HydrophobicContact CD2-CG 4.05Å; L359-W372 HydrophobicContact CD2-CH2 4.48Å; L359-W372 HydrophobicContact CD2-CZ3 3.73Å; L359-W372 HydrophobicContact CG-CE3 4.25Å; L359-W372 HydrophobicContact CG-CZ3 4.34Å
360	H	94.4	Very high	92.5	Very high	29 Å²	29	56.8 Å²	56.8	13%	0.134	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.5	175.9	-65.2	-101.4	0	0	0	109.4	I351 R352 D354 R358	I351-H360 WeakPolarHBondContact CA-O 3.26Å; R352-H360 HydrophobicContact CG-CB 3.86Å; R352-H360 PolarHBondContact N-O 3.43Å; R352-H360 PolarHBondContact O-N 2.91Å; D354-H360 IonicContact OD2-CD2 3.67Å; D354-H360 IonicContact OD2-CE1 3.7Å; D354-H360 IonicContact OD2-NE2 2.78Å; D354-H360 PolarHBondContact OD2-NE2 3.43Å; R358-H360 PolarHBondContact O-CD2 2.87Å
361	I	95.1	Very high	92.7	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	102.9	170.1	-54.2	171.9	0	0	0	106.8	R316 V317 I351 L359 S363 F364 D368 W372 L385	R316-I361 CarbonylContact C-O 3.57Å; R316-I361 WeakPolarHBondContact CA-O 3.45Å; V317-I361 HydrophobicContact CB-CB 4.22Å; V317-I361 PolarHBondContact N-O 2.9Å; V317-I361 PolarHBondContact O-N 3.41Å; I351-I361 HydrophobicContact CG1-CG1 4.38Å; I351-I361 HydrophobicContact CG1-CG2 4.28Å; I351-I361 HydrophobicContact CG2-CG1 4.44Å; L359-I361 HydrophobicContact CD2-CD1 4.36Å; L359-I361 HydrophobicContact CD2-CG1 4.46Å; L359-I361 HydrophobicContact CG-CG1 4.36Å; I361-S363 PolarHBondContact O-N 2.94Å; I361-F364 HydrophobicContact CD1-CD2 4.43Å; I361-F364 HydrophobicContact CG2-CB 4.32Å; I361-D368 WeakPolarHBondContact CG2-OD2 3.5Å; I361-W372 HydrophobicContact CD1-CZ2 3.91Å; I361-L385 HydrophobicContact CD1-CD1 3.79Å
362	R	92.6	Very high	92.9	Very high	150 Å²	150	57.9 Å²	57.9	57%	0.566	26%	0.261	S	S	*	.	S	Bend	trans	-65.4	-28.5	-176.3	-170.4	-179.4	-177.1	171.8	0.9	112.9	R316 D349 R350	R316-R362 WeakPolarHBondContact CG-O 3.33Å; D349-R362 WeakPolarHBondContact O-CD 3.03Å; R350-R362 VanDerWaalsContact O-CB 3.3Å; R350-R362 WeakPolarHBondContact O-CB 3.43Å; R350-R362 PolarHBondContact O-N 2.86Å
363	S	92.3	Very high	93.1	Very high	27 Å²	27	54 Å²	54	19%	0.189	25%	0.249	C	C	.	.	S	Bend	trans	-150.8	102.6	178	-174.7	0	0	0	0	108.4	R350 I361	R350-S363 PolarHBondContact NH1-O 3.21Å; I361-S363 PolarHBondContact O-N 2.94Å
364	F	93.9	Very high	93.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.246	C	C	.	.			trans	-66.8	129.9	-179.8	-178.5	-101.9	0	0	0	111	V311 P313 F314 T315 V317 I361 D368 E369 L385 A387	V311-F364 HydrophobicContact CB-CD1 3.85Å; V311-F364 HydrophobicContact CB-CE1 3.89Å; V311-F364 HydrophobicContact CB-CG 4.34Å; V311-F364 HydrophobicContact CB-CZ 4.4Å; V311-F364 HydrophobicContact CG1-CB 4.12Å; V311-F364 HydrophobicContact CG1-CD1 3.63Å; V311-F364 HydrophobicContact CG1-CE1 4.2Å; V311-F364 HydrophobicContact CG1-CG 3.86Å; P313-F364 CarbonylContact C-O 3.51Å; F314-F364 WeakPolarHBondContact CA-O 3.04Å; F314-F364 PolarHBondContact N-O 3.17Å; T315-F364 WeakPolarHBondContact O-CB 3.45Å; T315-F364 PolarHBondContact O-N 2.96Å; V317-F364 HydrophobicContact CG2-CB 4.09Å; V317-F364 HydrophobicContact CG2-CD2 4.41Å; V317-F364 HydrophobicContact CG2-CG 4.41Å; I361-F364 HydrophobicContact CD1-CD2 4.43Å; I361-F364 HydrophobicContact CG2-CB 4.32Å; F364-D368 VanDerWaalsContact CA-OD2 3.29Å; F364-D368 WeakPolarHBondContact CA-OD2 3.39Å; F364-D368 HydrophobicContact CD2-CB 3.76Å; F364-D368 HydrophobicContact CE2-CB 3.71Å; F364-E369 HydrophobicContact CZ-CB 4.49Å; F364-L385 HydrophobicContact CD2-CD1 4.29Å; F364-L385 HydrophobicContact CE2-CB 3.78Å; F364-L385 HydrophobicContact CE2-CD1 3.9Å; F364-L385 HydrophobicContact CE2-CG 4.49Å; F364-L385 HydrophobicContact CZ-CB 4.09Å; F364-A387 HydrophobicContact CE1-CB 3.99Å
365	R	92.9	Very high	93.4	Very high	120 Å²	120	55 Å²	55	45%	0.453	25%	0.253	S	S	.	.			trans	-126.9	164.8	-178.3	-61.9	175.6	-170.1	179.1	-0.5	109.3	I367 D368	R365-I367 HydrophobicContact CB-CG2 4.05Å; R365-I367 PolarHBondContact O-N 3.08Å; R365-D368 PolarHBondContact N-OD2 3.38Å; R365-D368 WeakPolarHBondContact O-CB 3.02Å; R365-D368 PolarHBondContact O-N 3.08Å
366	L	91.4	Very high	93.6	Very high	124 Å²	124	48.4 Å²	48.4	65%	0.649	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-55.9	-32	174.8	-71.2	161.4	0	0	0	112.6	D368 E369 A387	L366-D368 PolarHBondContact O-N 3.12Å; L366-E369 WeakPolarHBondContact O-CB 3.44Å; L366-E369 PolarHBondContact O-N 2.86Å; L366-A387 HydrophobicContact CD2-CB 3.54Å
367	I	92.4	Very high	93.3	Very high	93 Å²	93	43 Å²	43	48%	0.477	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-70	-19.3	176	-165.5	158.9	0	0	0	113.7	N337 R365 E369	N337-I367 HydrophobicContact CB-CG1 4.22Å; N337-I367 WeakPolarHBondContact CB-O 3.44Å; N337-I367 PolarHBondContact ND2-O 3.45Å; R365-I367 HydrophobicContact CB-CG2 4.05Å; R365-I367 PolarHBondContact O-N 3.08Å; I367-E369 VanDerWaalsContact C-N 3.29Å
368	D	93.8	Very high	93.1	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-87	-4.5	177.7	-45.6	-29.4	0	0	0	112.1	H338 R350 I361 F364 R365 L366 W372	H338-D368 IonicContact CE1-OD1 3.78Å; H338-D368 IonicContact NE2-OD1 3.75Å; H338-D368 PolarHBondContact NE2-OD1 2.62Å; R350-D368 IonicContact CZ-OD1 3.68Å; R350-D368 IonicContact CZ-OD2 2.85Å; R350-D368 IonicContact NH1-OD1 2.7Å; R350-D368 PolarHBondContact NH1-OD1 2.75Å; R350-D368 IonicContact NH1-OD2 2.74Å; R350-D368 PolarHBondContact NH1-OD2 2.03Å; R350-D368 IonicContact NH2-OD1 2.96Å; R350-D368 PolarHBondContact NH2-OD1 2.85Å; R350-D368 IonicContact NH2-OD2 3.98Å; I361-D368 WeakPolarHBondContact CG2-OD2 3.5Å; F364-D368 VanDerWaalsContact CA-OD2 3.29Å; F364-D368 WeakPolarHBondContact CA-OD2 3.39Å; F364-D368 HydrophobicContact CD2-CB 3.76Å; F364-D368 HydrophobicContact CE2-CB 3.71Å; R365-D368 PolarHBondContact N-OD2 3.38Å; R365-D368 WeakPolarHBondContact O-CB 3.02Å; R365-D368 PolarHBondContact O-N 3.08Å; L366-D368 PolarHBondContact O-N 3.12Å; D368-W372 HydrophobicContact CB-CZ2 4.29Å; D368-W372 PolarHBondContact O-NE1 3.04Å
369	E	93.1	Very high	92.8	Very high	65 Å²	65	48 Å²	48	30%	0.304	26%	0.26	S	S	.	.			trans	-64.9	141.2	176.3	177	157.1	-149	0	0	110.8	N337 F364 L366 I367 L385 T386 A387	N337-E369 PolarHBondContact ND2-O 2.79Å; F364-E369 HydrophobicContact CZ-CB 4.49Å; L366-E369 WeakPolarHBondContact O-CB 3.44Å; L366-E369 PolarHBondContact O-N 2.86Å; I367-E369 VanDerWaalsContact C-N 3.29Å; E369-L385 WeakPolarHBondContact CA-O 3.47Å; E369-L385 WeakPolarHBondContact CG-O 3.47Å; E369-T386 WeakPolarHBondContact OE1-CA 3.38Å; E369-T386 WeakPolarHBondContact OE1-CG2 3.47Å; E369-A387 VanDerWaalsContact CD-N 3.3Å; E369-A387 PolarHBondContact OE1-N 2.94Å; E369-A387 VanDerWaalsContact OE2-CB 3.31Å; E369-A387 WeakPolarHBondContact OE2-CB 3.27Å
370	G	93.9	Very high	92.7	Very high	24 Å²	24	53.2 Å²	53.2	25%	0.247	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	124	-165.3	-178.6	0	0	0	0	0	112.9	L385	G370-L385 PolarHBondContact N-O 3.03Å; G370-L385 PolarHBondContact O-N 2.81Å
371	D	95.1	Very high	92.8	Very high	75 Å²	75	52.3 Å²	52.3	40%	0.401	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	122.4	-174.4	-64.4	-31.7	0	0	0	111.2	N335 T384	N335-D371 PolarHBondContact ND2-O 2.9Å; D371-T384 VanDerWaalsContact OD1-CB 3.26Å; D371-T384 WeakPolarHBondContact OD1-CB 3.3Å; D371-T384 VanDerWaalsContact OD1-CG2 3.27Å; D371-T384 WeakPolarHBondContact OD1-CG2 3.36Å; D371-T384 PolarHBondContact OD1-OG1 2.9Å
372	W	96.6	Very high	92.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	110.2	173.2	-73.6	82.7	0	0	0	108.8	W333 N335 H338 L341 I351 L359 I361 D368 T382 V383 L385	W333-W372 HydrophobicContact CE3-CB 4.35Å; W333-W372 HydrophobicContact CZ3-CB 4.38Å; N335-W372 HydrophobicContact CB-CD2 3.75Å; N335-W372 HydrophobicContact CB-CE3 3.67Å; N335-W372 HydrophobicContact CB-CG 4.38Å; N335-W372 HydrophobicContact CB-CH2 4.03Å; N335-W372 HydrophobicContact CB-CZ2 4.11Å; N335-W372 HydrophobicContact CB-CZ3 3.82Å; N335-W372 PolarHBondContact ND2-NE1 2.72Å; H338-W372 HydrophobicContact CB-CH2 4.13Å; H338-W372 AromaticContact CD2-CH2 3.51Å; H338-W372 AromaticContact CD2-CZ2 3.48Å; H338-W372 VanDerWaalsContact CD2-CZ2 3.48Å; H338-W372 WeakPolarHBondContact CD2-CZ2 3.03Å; L341-W372 HydrophobicContact CD1-CH2 4.24Å; L341-W372 HydrophobicContact CD1-CZ3 3.84Å; I351-W372 HydrophobicContact CD1-CH2 4.05Å; I351-W372 HydrophobicContact CD1-CZ2 4.39Å; I351-W372 HydrophobicContact CG2-CH2 3.98Å; I351-W372 HydrophobicContact CG2-CZ3 4.36Å; L359-W372 HydrophobicContact CD1-CE3 4.03Å; L359-W372 HydrophobicContact CD1-CH2 4.41Å; L359-W372 HydrophobicContact CD1-CZ3 3.69Å; L359-W372 HydrophobicContact CD2-CB 4.26Å; L359-W372 HydrophobicContact CD2-CD2 3.56Å; L359-W372 HydrophobicContact CD2-CE3 3.21Å; L359-W372 HydrophobicContact CD2-CG 4.05Å; L359-W372 HydrophobicContact CD2-CH2 4.48Å; L359-W372 HydrophobicContact CD2-CZ3 3.73Å; L359-W372 HydrophobicContact CG-CE3 4.25Å; L359-W372 HydrophobicContact CG-CZ3 4.34Å; I361-W372 HydrophobicContact CD1-CZ2 3.91Å; D368-W372 HydrophobicContact CB-CZ2 4.29Å; D368-W372 PolarHBondContact O-NE1 3.04Å; W372-T382 CarbonylContact O-C 3.57Å; W372-T382 WeakPolarHBondContact O-CA 3.25Å; W372-V383 HydrophobicContact CB-CG1 3.79Å; W372-V383 PolarHBondContact N-O 2.85Å; W372-V383 WeakPolarHBondContact O-CG1 3.26Å; W372-V383 PolarHBondContact O-N 2.82Å; W372-L385 HydrophobicContact CG-CD1 4.38Å
373	T	96.2	Very high	92.9	Very high	26 Å²	26	48.1 Å²	48.1	16%	0.16	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	117.5	-174.6	-50.9	0	0	0	0	109.9	W333 A334 I375 N380 T382	W333-T373 CarbonylContact C-O 3.43Å; W333-T373 VanDerWaalsContact CA-O 3.31Å; W333-T373 WeakPolarHBondContact CA-O 3.34Å; A334-T373 PolarHBondContact N-O 3.36Å; A334-T373 PolarHBondContact O-N 2.98Å; T373-I375 HydrophobicContact CG2-CG1 4.03Å; T373-N380 HydrophobicContact CG2-CB 3.79Å; T373-T382 HydrophobicContact CG2-CG2 3.92Å; T373-T382 WeakPolarHBondContact OG1-CG2 3.49Å
374	C	96.1	Very high	93	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	128.4	165.3	175.2	0	0	0	0	109.3	V305 C321 Q332 W333 N380 A381	V305-C374 HydrophobicContact CG1-CB 3.84Å; C321-C374 HydrophobicContact CB-CB 3.66Å; C321-C374 WeakPolarHBondContact CB-SG 3.33Å; C321-C374 WeakPolarHBondContact SG-CB 2.94Å; C321-C374 CovalentContact SG-SG 2.02Å; C321-C374 PolarHBondContact SG-SG 3.46Å; Q332-C374 CarbonylContact O-C 3.58Å; W333-C374 HydrophobicContact CD2-CB 4.35Å; W333-C374 HydrophobicContact CE3-CB 4.09Å; W333-C374 HydrophobicContact CH2-CB 3.81Å; W333-C374 HydrophobicContact CZ2-CB 4.08Å; W333-C374 HydrophobicContact CZ3-CB 3.81Å; C374-N380 CarbonylContact O-C 3.59Å; C374-N380 WeakPolarHBondContact O-CA 3.41Å; C374-A381 PolarHBondContact N-O 2.85Å; C374-A381 PolarHBondContact O-N 3.05Å
375	I	94.1	Very high	93.1	Very high	43 Å²	43	48.7 Å²	48.7	22%	0.221	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125	-179.1	-55.7	170	0	0	0	108.2	Q332 A334 T373 N380	Q332-I375 HydrophobicContact CB-CB 4.26Å; Q332-I375 PolarHBondContact N-O 3.33Å; Q332-I375 VanDerWaalsContact N-O 3.13Å; Q332-I375 PolarHBondContact O-N 3.25Å; A334-I375 HydrophobicContact CB-CD1 3.77Å; T373-I375 HydrophobicContact CG2-CG1 4.03Å; I375-N380 HydrophobicContact CG1-CB 4.39Å
376	A	91	Very high	93.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	85.2	179.5	0	0	0	0	0	109	P283 I285 V323 F326 L331 S378 M379	P283-A376 WeakPolarHBondContact CG-O 3.4Å; I285-A376 HydrophobicContact CD1-CB 4.07Å; I285-A376 HydrophobicContact CG1-CB 4.39Å; V323-A376 HydrophobicContact CG1-CB 3.99Å; F326-A376 HydrophobicContact CD1-CB 3.7Å; F326-A376 HydrophobicContact CD2-CB 4.28Å; F326-A376 HydrophobicContact CE1-CB 3.92Å; F326-A376 HydrophobicContact CE2-CB 4.48Å; F326-A376 HydrophobicContact CG-CB 3.89Å; F326-A376 HydrophobicContact CZ-CB 4.32Å; L331-A376 HydrophobicContact CD2-CB 3.64Å; A376-S378 PolarHBondContact O-N 3.04Å; A376-S378 VanDerWaalsContact O-N 3.11Å; A376-M379 PolarHBondContact N-O 2.81Å; A376-M379 PolarHBondContact O-N 3.32Å
377	G	85.7	Confident	93	Very high	55 Å²	55	39.7 Å²	39.7	57%	0.567	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	-112.7	-174.6	0	0	0	0	0	111.4
378	S	85.1	Confident	92.5	Very high	107 Å²	107	36.8 Å²	36.8	75%	0.748	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-8.2	179	60.7	0	0	0	0	114.8	A376	A376-S378 PolarHBondContact O-N 3.04Å; A376-S378 VanDerWaalsContact O-N 3.11Å
379	M	88.8	Confident	91.5	Very high	69 Å²	69	41 Å²	41	34%	0.34	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	144.3	179.7	-78.8	-149.8	66.1	0	0	112	P283 I285 A376	P283-M379 HydrophobicContact CG-CB 4.41Å; P283-M379 HydrophobicContact CG-CG 4.39Å; P283-M379 WeakPolarHBondContact O-CG 3.23Å; I285-M379 HydrophobicContact CD1-CB 4.11Å; I285-M379 HydrophobicContact CG1-CB 4.14Å; A376-M379 PolarHBondContact N-O 2.81Å; A376-M379 PolarHBondContact O-N 3.32Å
380	N	93.6	Very high	90	Very high	110 Å²	110	41.4 Å²	41.4	59%	0.588	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.3	154.2	174.6	60	10.4	0	0	0	111.9	T373 C374 I375	T373-N380 HydrophobicContact CG2-CB 3.79Å; C374-N380 CarbonylContact O-C 3.59Å; C374-N380 WeakPolarHBondContact O-CA 3.41Å; I375-N380 HydrophobicContact CG1-CB 4.39Å
381	A	94.4	Very high	88	Confident	9 Å²	9	43.8 Å²	43.8	7%	0.074	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	138.5	175.4	0	0	0	0	0	110.6	I285 T287 V305 C374	I285-A381 HydrophobicContact CB-CB 4.12Å; I285-A381 HydrophobicContact CD1-CB 3.98Å; I285-A381 HydrophobicContact CG2-CB 3.61Å; T287-A381 HydrophobicContact CG2-CB 3.69Å; V305-A381 HydrophobicContact CB-CB 3.92Å; V305-A381 HydrophobicContact CG1-CB 4.5Å; V305-A381 HydrophobicContact CG2-CB 4.07Å; C374-A381 PolarHBondContact N-O 2.85Å; C374-A381 PolarHBondContact O-N 3.05Å
382	T	95.3	Very high	86.3	Confident	63 Å²	63	42.2 Å²	42.2	39%	0.387	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	148.3	-171.3	54.6	0	0	0	0	112.5	G306 W372 T373	G306-T382 WeakPolarHBondContact CA-O 3.41Å; G306-T382 PolarHBondContact N-O 3.04Å; W372-T382 CarbonylContact O-C 3.57Å; W372-T382 WeakPolarHBondContact O-CA 3.25Å; T373-T382 HydrophobicContact CG2-CG2 3.92Å; T373-T382 WeakPolarHBondContact OG1-CG2 3.49Å
383	V	95.8	Very high	84.4	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.9	163.6	47	0	0	0	0	107.7	L303 Q307 V319 W333 W372 L385	L303-V383 HydrophobicContact CD1-CG2 4.25Å; Q307-V383 WeakPolarHBondContact O-CA 3.42Å; Q307-V383 WeakPolarHBondContact O-CG2 3.29Å; V319-V383 HydrophobicContact CB-CG1 4.47Å; V319-V383 HydrophobicContact CG1-CB 4.24Å; V319-V383 HydrophobicContact CG1-CG1 3.51Å; V319-V383 HydrophobicContact CG1-CG2 4.39Å; V319-V383 HydrophobicContact CG2-CG1 4.33Å; W333-V383 HydrophobicContact CZ3-CG1 4.12Å; W372-V383 HydrophobicContact CB-CG1 3.79Å; W372-V383 PolarHBondContact N-O 2.85Å; W372-V383 WeakPolarHBondContact O-CG1 3.26Å; W372-V383 PolarHBondContact O-N 2.82Å; V383-L385 HydrophobicContact CG2-CD2 3.88Å
384	T	95.1	Very high	82.5	Confident	40 Å²	40	47.5 Å²	47.5	25%	0.245	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	119.3	-178.1	-56.6	0	0	0	0	109.3	Q307 Q308 A309 D371	Q307-T384 PolarHBondContact O-N 2.78Å; Q307-T384 VanDerWaalsContact O-N 3.14Å; Q308-T384 CarbonylContact C-O 3.51Å; Q308-T384 WeakPolarHBondContact CA-O 3.35Å; Q308-T384 HydrophobicContact CG-CG2 4.25Å; A309-T384 PolarHBondContact N-O 2.94Å; D371-T384 VanDerWaalsContact OD1-CB 3.26Å; D371-T384 WeakPolarHBondContact OD1-CB 3.3Å; D371-T384 VanDerWaalsContact OD1-CG2 3.27Å; D371-T384 WeakPolarHBondContact OD1-CG2 3.36Å; D371-T384 PolarHBondContact OD1-OG1 2.9Å
385	L	95.1	Very high	80.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.9	176	-55.1	-174.6	0	0	0	109.4	L303 A309 V317 I361 F364 E369 G370 W372 V383	L303-L385 HydrophobicContact CD1-CD2 3.35Å; A309-L385 HydrophobicContact CB-CD2 4.01Å; V317-L385 HydrophobicContact CG1-CD1 4.35Å; I361-L385 HydrophobicContact CD1-CD1 3.79Å; F364-L385 HydrophobicContact CD2-CD1 4.29Å; F364-L385 HydrophobicContact CE2-CB 3.78Å; F364-L385 HydrophobicContact CE2-CD1 3.9Å; F364-L385 HydrophobicContact CE2-CG 4.49Å; F364-L385 HydrophobicContact CZ-CB 4.09Å; E369-L385 WeakPolarHBondContact CA-O 3.47Å; E369-L385 WeakPolarHBondContact CG-O 3.47Å; G370-L385 PolarHBondContact N-O 3.03Å; G370-L385 PolarHBondContact O-N 2.81Å; W372-L385 HydrophobicContact CG-CD1 4.38Å; V383-L385 HydrophobicContact CG2-CD2 3.88Å
386	T	92.9	Very high	78.9	Confident	31 Å²	31	53 Å²	53	19%	0.19	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	133.7	179.5	-52.8	0	0	0	0	109.2	A309 F310 V311 E369	A309-T386 PolarHBondContact O-N 2.82Å; F310-T386 CarbonylContact C-O 3.58Å; F310-T386 WeakPolarHBondContact CA-O 3.39Å; F310-T386 HydrophobicContact CD1-CG2 3.85Å; F310-T386 HydrophobicContact CE1-CG2 3.78Å; V311-T386 PolarHBondContact N-O 2.92Å; E369-T386 WeakPolarHBondContact OE1-CA 3.38Å; E369-T386 WeakPolarHBondContact OE1-CG2 3.47Å
387	A	90	Very high	77.4	Confident	23 Å²	23	55 Å²	55	19%	0.19	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	133.8	177.7	0	0	0	0	0	110.4	F364 L366 E369	F364-A387 HydrophobicContact CE1-CB 3.99Å; L366-A387 HydrophobicContact CD2-CB 3.54Å; E369-A387 VanDerWaalsContact CD-N 3.3Å; E369-A387 PolarHBondContact OE1-N 2.94Å; E369-A387 VanDerWaalsContact OE2-CB 3.31Å; E369-A387 WeakPolarHBondContact OE2-CB 3.27Å
388	R	81.8	Confident	76.2	Confident	33 Å²	33	55.2 Å²	55.2	13%	0.125	32%	0.321	C	S	.	.			trans	-132	138.6	177.6	-168.4	173.9	-178.1	159.8	-0.9	111.2	F310 V311 I312 P313 A392 D396 Y457	F310-R388 HydrophobicContact CB-CB 4.11Å; V311-R388 PolarHBondContact O-N 3.1Å; I312-R388 WeakPolarHBondContact CA-O 3.42Å; P313-R388 VanDerWaalsContact CD-O 3.29Å; P313-R388 WeakPolarHBondContact CD-O 3.09Å; R388-A392 HydrophobicContact CG-CB 4.12Å; R388-A392 PolarHBondContact NH2-O 3.43Å; R388-D396 IonicContact CZ-OD2 3.61Å; R388-D396 IonicContact NH1-OD2 3.16Å; R388-D396 VanDerWaalsContact NH2-CG 3.31Å; R388-D396 IonicContact NH2-OD2 3.86Å; R388-D396 PolarHBondContact NH2-OD2 3.02Å; R388-Y457 PolarHBondContact NH1-OH 2.83Å
389	T	71.7	Confident	74.9	Confident	87 Å²	87	54.3 Å²	54.3	53%	0.534	31%	0.305	S	S	.	.			trans	-81.1	145.9	171.9	61.6	0	0	0	0	110.6	A391 A392 G393	T389-A391 PolarHBondContact O-N 3.24Å; T389-A392 PolarHBondContact O-N 3.39Å; T389-A392 VanDerWaalsContact O-N 3.1Å; T389-G393 PolarHBondContact O-N 2.84Å
390	P	61.2	Low	73.5	Confident	74 Å²	74	55.6 Å²	55.6	48%	0.481	31%	0.306	S	S	.	.	H	α-helix	trans	-54.3	-37.9	177.1	-25.4	32.6	0	0	0	113.4	I312 A392 G393 F394	I312-P390 HydrophobicContact CD1-CB 4.48Å; I312-P390 HydrophobicContact CD1-CG 4.19Å; I312-P390 HydrophobicContact CG1-CG 4.48Å; I312-P390 HydrophobicContact CG2-CG 3.97Å; P390-A392 VanDerWaalsContact C-N 3.32Å; P390-A392 PolarHBondContact O-N 3.3Å; P390-G393 PolarHBondContact O-N 2.81Å; P390-G393 VanDerWaalsContact O-N 3.15Å; P390-F394 PolarHBondContact O-N 3.02Å
391	A	52.7	Low	71.6	Confident	75 Å²	75	52 Å²	52	62%	0.62	29%	0.288	S	S	*	.	H	α-helix	trans	-60.4	-39.5	178.5	0	0	0	0	0	112.5	T389 G393 H395	T389-A391 PolarHBondContact O-N 3.24Å; A391-G393 VanDerWaalsContact C-N 3.34Å; A391-G393 PolarHBondContact O-N 3.04Å; A391-H395 VanDerWaalsContact O-CB 3.27Å; A391-H395 WeakPolarHBondContact O-CB 3.41Å; A391-H395 PolarHBondContact O-N 3.04Å; A391-H395 VanDerWaalsContact O-N 3.11Å
392	A	59.3	Low	69.4	Low	42 Å²	42	60.9 Å²	60.9	35%	0.347	32%	0.319	S	S	.	.	H	α-helix	trans	-68.2	-33.4	177.2	0	0	0	0	0	112.2	R388 T389 P390 D396	R388-A392 HydrophobicContact CG-CB 4.12Å; R388-A392 PolarHBondContact NH2-O 3.43Å; T389-A392 PolarHBondContact O-N 3.39Å; T389-A392 VanDerWaalsContact O-N 3.1Å; P390-A392 VanDerWaalsContact C-N 3.32Å; P390-A392 PolarHBondContact O-N 3.3Å; A392-D396 WeakPolarHBondContact O-CB 3.48Å; A392-D396 PolarHBondContact O-N 3.22Å
393	G	57.3	Low	66.9	Low	1 Å²	1	66.2 Å²	66.2	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-65.1	-53.9	177.7	0	0	0	0	0	113	T389 P390 A391 W397	T389-G393 PolarHBondContact O-N 2.84Å; P390-G393 PolarHBondContact O-N 2.81Å; P390-G393 VanDerWaalsContact O-N 3.15Å; A391-G393 VanDerWaalsContact C-N 3.34Å; A391-G393 PolarHBondContact O-N 3.04Å; G393-W397 WeakPolarHBondContact O-CB 3.38Å; G393-W397 PolarHBondContact O-N 3.31Å; G393-W397 VanDerWaalsContact O-N 3.1Å
394	F	54.9	Low	64.5	Low	136 Å²	136	71.9 Å²	71.9	60%	0.596	37%	0.366	S	S	*	.	H	α-helix	trans	-68.3	-43.6	-178.3	-177.1	-105.7	0	0	0	112.4	P390 D396 W397 V398	P390-F394 PolarHBondContact O-N 3.02Å; F394-D396 PolarHBondContact O-N 3.08Å; F394-W397 HydrophobicContact CD2-CE3 4.41Å; F394-W397 HydrophobicContact CE2-CE3 4.29Å; F394-W397 HydrophobicContact CE2-CZ3 4.31Å; F394-W397 PolarHBondContact O-N 3.43Å; F394-V398 HydrophobicContact CD1-CG2 3.93Å; F394-V398 HydrophobicContact CD2-CG2 4.17Å; F394-V398 HydrophobicContact CE1-CG2 3.53Å; F394-V398 HydrophobicContact CE2-CG2 3.79Å; F394-V398 HydrophobicContact CG-CG2 4.24Å; F394-V398 HydrophobicContact CZ-CG2 3.45Å; F394-V398 VanDerWaalsContact CZ-CG2 3.45Å; F394-V398 WeakPolarHBondContact O-CG2 3.09Å; F394-V398 PolarHBondContact O-N 3.31Å
395	H	58	Low	61.6	Low	118 Å²	118	75.8 Å²	75.8	55%	0.546	39%	0.39	S	S	.	.	H	α-helix	trans	-61.8	-44.3	-179.6	-168.2	66.3	0	0	0	112.1	A391 W397 V398 Q399	A391-H395 VanDerWaalsContact O-CB 3.27Å; A391-H395 WeakPolarHBondContact O-CB 3.41Å; A391-H395 PolarHBondContact O-N 3.04Å; A391-H395 VanDerWaalsContact O-N 3.11Å; H395-W397 VanDerWaalsContact C-N 3.34Å; H395-W397 PolarHBondContact O-N 2.95Å; H395-V398 PolarHBondContact O-N 3.32Å; H395-Q399 WeakPolarHBondContact O-CB 3.32Å; H395-Q399 VanDerWaalsContact O-CG 3.27Å; H395-Q399 WeakPolarHBondContact O-CG 3.26Å; H395-Q399 PolarHBondContact O-N 3.27Å
396	D	57.8	Low	59	Low	39 Å²	39	84.7 Å²	84.7	21%	0.209	43%	0.428	C	S	.	.	H	α-helix	trans	-60	-42.4	174.1	-179.5	44.2	0	0	0	112.2	R388 A392 F394 R400 Y457	R388-D396 IonicContact CZ-OD2 3.61Å; R388-D396 IonicContact NH1-OD2 3.16Å; R388-D396 VanDerWaalsContact NH2-CG 3.31Å; R388-D396 IonicContact NH2-OD2 3.86Å; R388-D396 PolarHBondContact NH2-OD2 3.02Å; A392-D396 WeakPolarHBondContact O-CB 3.48Å; A392-D396 PolarHBondContact O-N 3.22Å; F394-D396 PolarHBondContact O-N 3.08Å; D396-R400 WeakPolarHBondContact O-CG 3.05Å; D396-R400 PolarHBondContact O-N 2.89Å; D396-R400 IonicContact OD1-CZ 3.11Å; D396-R400 IonicContact OD1-NE 3.89Å; D396-R400 PolarHBondContact OD1-NE 2.84Å; D396-R400 IonicContact OD1-NH2 2.71Å; D396-R400 PolarHBondContact OD1-NH2 3.22Å; D396-R400 IonicContact OD2-CZ 2.71Å; D396-R400 VanDerWaalsContact OD2-CZ 3.28Å; D396-R400 IonicContact OD2-NE 2.8Å; D396-R400 IonicContact OD2-NH2 3.74Å; D396-R400 PolarHBondContact OD2-NH2 2.97Å; D396-Y457 PolarHBondContact OD2-OH 3.3Å
397	W	59.2	Low	56.3	Low	44 Å²	44	86.3 Å²	86.3	17%	0.167	45%	0.451	C	S	.	.	H	α-helix	trans	-67.9	-43.7	177.8	179.7	90.5	0	0	0	113.1	M295 G393 F394 H395 R400 N401 W404	M295-W397 HydrophobicContact SD-CB 4.38Å; M295-W397 VanDerWaalsContact SD-CD1 3.57Å; M295-W397 HydrophobicContact SD-CG 4.01Å; G393-W397 WeakPolarHBondContact O-CB 3.38Å; G393-W397 PolarHBondContact O-N 3.31Å; G393-W397 VanDerWaalsContact O-N 3.1Å; F394-W397 HydrophobicContact CD2-CE3 4.41Å; F394-W397 HydrophobicContact CE2-CE3 4.29Å; F394-W397 HydrophobicContact CE2-CZ3 4.31Å; F394-W397 PolarHBondContact O-N 3.43Å; H395-W397 VanDerWaalsContact C-N 3.34Å; H395-W397 PolarHBondContact O-N 2.95Å; W397-R400 PolarHBondContact O-N 2.9Å; W397-N401 HydrophobicContact CZ2-CB 4.44Å; W397-N401 PolarHBondContact NE1-ND2 3.5Å; W397-N401 PolarHBondContact O-N 3.3Å; W397-N401 PolarHBondContact O-ND2 2.73Å; W397-W404 AromaticContact CH2-CE2 3.58Å; W397-W404 AromaticContact CH2-CZ2 3.54Å; W397-W404 HydrophobicContact CH2-CZ2 3.54Å; W397-W404 AromaticContact CH2-NE1 3.31Å; W397-W404 VanDerWaalsContact CH2-NE1 3.31Å; W397-W404 HydrophobicContact CZ2-CZ2 4.29Å; W397-W404 AromaticContact CZ2-NE1 3.82Å; W397-W404 HydrophobicContact CZ3-CZ2 4.5Å
398	V	59.9	Low	53.9	Low	58 Å²	58	90.5 Å²	90.5	35%	0.352	47%	0.468	S	S	.	.	H	α-helix	trans	-62.7	-42.3	177.6	170.1	0	0	0	0	111	F394 H395 R400 N401	F394-V398 HydrophobicContact CD1-CG2 3.93Å; F394-V398 HydrophobicContact CD2-CG2 4.17Å; F394-V398 HydrophobicContact CE1-CG2 3.53Å; F394-V398 HydrophobicContact CE2-CG2 3.79Å; F394-V398 HydrophobicContact CG-CG2 4.24Å; F394-V398 HydrophobicContact CZ-CG2 3.45Å; F394-V398 VanDerWaalsContact CZ-CG2 3.45Å; F394-V398 WeakPolarHBondContact O-CG2 3.09Å; F394-V398 PolarHBondContact O-N 3.31Å; H395-V398 PolarHBondContact O-N 3.32Å; V398-R400 PolarHBondContact O-N 3.45Å; V398-N401 PolarHBondContact O-N 2.91Å
399	Q	58.7	Low	52	Low	88 Å²	88	94.7 Å²	94.7	41%	0.411	49%	0.492	S	S	.	.	H	α-helix	trans	-62.4	-32.9	178.2	-73.8	-67.5	-15.5	0	0	112.7	H395 R402	H395-Q399 WeakPolarHBondContact O-CB 3.32Å; H395-Q399 VanDerWaalsContact O-CG 3.27Å; H395-Q399 WeakPolarHBondContact O-CG 3.26Å; H395-Q399 PolarHBondContact O-N 3.27Å; Q399-R402 WeakPolarHBondContact O-CG 3Å; Q399-R402 PolarHBondContact O-NE 3.37Å
400	R	58.4	Low	50.3	Low	96 Å²	96	94.3 Å²	94.3	36%	0.362	49%	0.493	S	S	.	.	H	α-helix	trans	-84.1	-29.7	-178.5	-67	174.8	-160.8	-160.5	5.7	113.8	D396 W397 V398 E450 Y457	D396-R400 WeakPolarHBondContact O-CG 3.05Å; D396-R400 PolarHBondContact O-N 2.89Å; D396-R400 IonicContact OD1-CZ 3.11Å; D396-R400 IonicContact OD1-NE 3.89Å; D396-R400 PolarHBondContact OD1-NE 2.84Å; D396-R400 IonicContact OD1-NH2 2.71Å; D396-R400 PolarHBondContact OD1-NH2 3.22Å; D396-R400 IonicContact OD2-CZ 2.71Å; D396-R400 VanDerWaalsContact OD2-CZ 3.28Å; D396-R400 IonicContact OD2-NE 2.8Å; D396-R400 IonicContact OD2-NH2 3.74Å; D396-R400 PolarHBondContact OD2-NH2 2.97Å; W397-R400 PolarHBondContact O-N 2.9Å; V398-R400 PolarHBondContact O-N 3.45Å; R400-E450 IonicContact NH1-OE1 2.74Å; R400-Y457 PolarHBondContact NH2-OH 2.85Å
401	N	54.8	Low	49.6	Very low	36 Å²	36	98.4 Å²	98.4	19%	0.193	51%	0.511	C	S	.	.			trans	-110.6	55.5	-175.1	-62.9	-82.2	0	0	0	112.4	W397 V398 L403	W397-N401 HydrophobicContact CZ2-CB 4.44Å; W397-N401 PolarHBondContact NE1-ND2 3.5Å; W397-N401 PolarHBondContact O-N 3.3Å; W397-N401 PolarHBondContact O-ND2 2.73Å; V398-N401 PolarHBondContact O-N 2.91Å; N401-L403 VanDerWaalsContact C-N 3.3Å; N401-L403 PolarHBondContact O-N 3.1Å
402	R	47.1	Very low	49.1	Very low	195 Å²	195	98.6 Å²	98.6	74%	0.736	50%	0.502	S	S	*	.			trans	-66.5	-23.3	-175.9	-66	-179.2	-179.1	-171.4	-5.1	114.9	Q399 W404	Q399-R402 WeakPolarHBondContact O-CG 3Å; Q399-R402 PolarHBondContact O-NE 3.37Å; R402-W404 PolarHBondContact O-N 3.49Å; R402-W404 VanDerWaalsContact O-N 3.08Å
403	L	43.6	Very low	48.3	Very low	175 Å²	175	101.3 Å²	101.3	92%	0.916	52%	0.516	S	S	*	.			trans	-86.3	60.8	-178.7	-68.4	165.6	0	0	0	110.7	N401	N401-L403 VanDerWaalsContact C-N 3.3Å; N401-L403 PolarHBondContact O-N 3.1Å
404	W	44.8	Very low	47.6	Very low	119 Å²	119	109.8 Å²	109.8	45%	0.451	55%	0.552	S	S	.	*			trans	-85.5	112.1	171.2	-106.5	57.4	0	0	0	110.2	W397 R402 M408	W397-W404 AromaticContact CH2-CE2 3.58Å; W397-W404 AromaticContact CH2-CZ2 3.54Å; W397-W404 HydrophobicContact CH2-CZ2 3.54Å; W397-W404 AromaticContact CH2-NE1 3.31Å; W397-W404 VanDerWaalsContact CH2-NE1 3.31Å; W397-W404 HydrophobicContact CZ2-CZ2 4.29Å; W397-W404 AromaticContact CZ2-NE1 3.82Å; W397-W404 HydrophobicContact CZ3-CZ2 4.5Å; R402-W404 PolarHBondContact O-N 3.49Å; R402-W404 VanDerWaalsContact O-N 3.08Å; W404-M408 HydrophobicContact CE3-CB 4.2Å; W404-M408 HydrophobicContact CH2-CB 3.35Å; W404-M408 HydrophobicContact CH2-CE 3.58Å; W404-M408 HydrophobicContact CH2-CG 4.22Å; W404-M408 HydrophobicContact CH2-SD 3.96Å; W404-M408 HydrophobicContact CZ2-CB 4.04Å; W404-M408 HydrophobicContact CZ2-CE 3.39Å; W404-M408 HydrophobicContact CZ2-SD 3.67Å; W404-M408 HydrophobicContact CZ3-CB 3.42Å; W404-M408 VanDerWaalsContact CZ3-CB 3.42Å
405	T	35	Very low	47.1	Very low	122 Å²	122	106.6 Å²	106.6	75%	0.748	55%	0.551	S	S	*	*			trans	-75	133.4	158.8	48.1	0	0	0	0	108.7	G407	T405-G407 PolarHBondContact O-N 3.07Å
406	K	40.6	Very low	46.3	Very low	187 Å²	187	105.2 Å²	105.2	81%	0.813	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-51.3	2.2	-177.6	-128.3	175.2	-178.6	-178.8	0	117.1	M408 L409	K406-M408 PolarHBondContact O-N 3.09Å; K406-L409 HydrophobicContact CG-CD1 4.47Å
407	G	36.3	Very low	45.5	Very low	64 Å²	64	106.6 Å²	106.6	66%	0.66	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-75.9	-13.4	-175.7	0	0	0	0	0	116.2	T405	T405-G407 PolarHBondContact O-N 3.07Å
408	M	39.8	Very low	44.8	Very low	112 Å²	112	109.4 Å²	109.4	55%	0.552	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-91.4	5.5	175.2	-89.6	174.6	72.6	0	0	114.3	W404 K406 S410	W404-M408 HydrophobicContact CE3-CB 4.2Å; W404-M408 HydrophobicContact CH2-CB 3.35Å; W404-M408 HydrophobicContact CH2-CE 3.58Å; W404-M408 HydrophobicContact CH2-CG 4.22Å; W404-M408 HydrophobicContact CH2-SD 3.96Å; W404-M408 HydrophobicContact CZ2-CB 4.04Å; W404-M408 HydrophobicContact CZ2-CE 3.39Å; W404-M408 HydrophobicContact CZ2-SD 3.67Å; W404-M408 HydrophobicContact CZ3-CB 3.42Å; W404-M408 VanDerWaalsContact CZ3-CB 3.42Å; K406-M408 PolarHBondContact O-N 3.09Å; M408-S410 VanDerWaalsContact C-N 3.31Å
409	L	40.5	Very low	44.1	Very low	120 Å²	120	111.8 Å²	111.8	63%	0.628	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-92.9	18.1	169.1	-79.4	163.7	0	0	0	112.6	K406 D411	K406-L409 HydrophobicContact CG-CD1 4.47Å; L409-D411 PolarHBondContact O-N 2.84Å
410	S	37.4	Very low	43.7	Very low	79 Å²	79	114.9 Å²	114.9	55%	0.552	61%	0.61	S	S	*	*			trans	-75.6	109.8	167.2	178.6	0	0	0	0	108.2	M408 D412	M408-S410 VanDerWaalsContact C-N 3.31Å; S410-D412 PolarHBondContact O-N 3.28Å
411	D	46.4	Very low	43.9	Very low	160 Å²	160	115 Å²	115	86%	0.856	62%	0.615	S	S	*	*			trans	-70.4	45.6	179.1	-73.7	-38.1	0	0	0	113.2	L409 P413	L409-D411 PolarHBondContact O-N 2.84Å; D411-P413 WeakPolarHBondContact O-CD 3.41Å
412	D	42.3	Very low	44.8	Very low	80 Å²	80	117.6 Å²	117.6	43%	0.428	63%	0.628	S	S	.	*			trans	-112.7	92.8	162.3	-161.9	-13.8	0	0	0	111.3	S410 K414 A415 I416	S410-D412 PolarHBondContact O-N 3.28Å; D412-K414 PolarHBondContact O-N 3Å; D412-K414 VanDerWaalsContact O-N 3.09Å; D412-K414 WeakPolarHBondContact OD1-CB 3.39Å; D412-K414 PolarHBondContact OD1-N 3.37Å; D412-K414 VanDerWaalsContact OD1-N 3.07Å; D412-A415 HydrophobicContact CB-CB 4.38Å; D412-A415 PolarHBondContact O-N 3.39Å; D412-A415 VanDerWaalsContact O-N 3.1Å; D412-I416 PolarHBondContact O-N 3.43Å
413	P	41.2	Very low	46.3	Very low	99 Å²	99	110.5 Å²	110.5	64%	0.643	60%	0.604	S	S	*	*	H	α-helix	trans	-57	-22.9	177.5	-23.2	32.2	0	0	0	114	D411 A417	D411-P413 WeakPolarHBondContact O-CD 3.41Å; P413-A417 WeakPolarHBondContact O-CB 3.33Å; P413-A417 PolarHBondContact O-N 2.91Å
414	K	42.9	Very low	48	Very low	178 Å²	178	105 Å²	105	77%	0.774	57%	0.574	S	S	*	*	H	α-helix	trans	-76.9	-27.1	179.7	-69.8	-178.6	178.8	177	0	112.3	D412	D412-K414 PolarHBondContact O-N 3Å; D412-K414 VanDerWaalsContact O-N 3.09Å; D412-K414 WeakPolarHBondContact OD1-CB 3.39Å; D412-K414 PolarHBondContact OD1-N 3.37Å; D412-K414 VanDerWaalsContact OD1-N 3.07Å
415	A	45	Very low	49.7	Very low	70 Å²	70	100.8 Å²	100.8	58%	0.579	56%	0.558	S	S	*	*	H	α-helix	trans	-78.6	-32.4	175.6	0	0	0	0	0	112.5	D412	D412-A415 HydrophobicContact CB-CB 4.38Å; D412-A415 PolarHBondContact O-N 3.39Å; D412-A415 VanDerWaalsContact O-N 3.1Å
416	I	41.6	Very low	51.7	Low	89 Å²	89	95.8 Å²	95.8	46%	0.456	53%	0.527	S	S	.	.	H	α-helix	trans	-79.8	-22.6	-179.6	-58.3	173.7	0	0	0	111.9	D412 V418	D412-I416 PolarHBondContact O-N 3.43Å; I416-V418 VanDerWaalsContact C-N 3.3Å; I416-V418 PolarHBondContact O-N 3.36Å
417	A	40.5	Very low	53.6	Low	67 Å²	67	90.1 Å²	90.1	55%	0.554	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-8.5	-173.8	0	0	0	0	0	115.4	P413 N419	P413-A417 WeakPolarHBondContact O-CB 3.33Å; P413-A417 PolarHBondContact O-N 2.91Å; A417-N419 VanDerWaalsContact C-N 3.3Å; A417-N419 PolarHBondContact O-N 3.35Å
418	V	43.1	Very low	55.5	Low	104 Å²	104	88.3 Å²	88.3	63%	0.63	49%	0.489	S	S	*	.	S	Bend	trans	-85.9	77.9	176.5	-165	0	0	0	0	109.5	I416 H420	I416-V418 VanDerWaalsContact C-N 3.3Å; I416-V418 PolarHBondContact O-N 3.36Å; V418-H420 PolarHBondContact O-N 2.82Å; V418-H420 PolarHBondContact O-ND1 3.01Å
419	N	45.6	Very low	57.4	Low	108 Å²	108	88.7 Å²	88.7	58%	0.578	50%	0.5	S	S	*	.			trans	19.4	59.4	157.5	-76.7	-17.2	0	0	0	118	A417 E421	A417-N419 VanDerWaalsContact C-N 3.3Å; A417-N419 PolarHBondContact O-N 3.35Å; N419-E421 VanDerWaalsContact C-N 3.29Å; N419-E421 PolarHBondContact O-N 3.1Å
420	H	50.4	Low	59.4	Low	153 Å²	153	85.8 Å²	85.8	71%	0.708	48%	0.481	S	S	*	.			trans	-80.7	86.9	162.5	-73.6	80.2	0	0	0	108.2	V418 I422	V418-H420 PolarHBondContact O-N 2.82Å; V418-H420 PolarHBondContact O-ND1 3.01Å; H420-I422 PolarHBondContact O-N 3.23Å
421	E	63.8	Low	61.3	Low	97 Å²	97	84 Å²	84	45%	0.453	47%	0.469	S	S	.	.			trans	-69.6	110.7	165.4	-60.7	-173.2	145.3	0	0	108.2	N419 K451	N419-E421 VanDerWaalsContact C-N 3.29Å; N419-E421 PolarHBondContact O-N 3.1Å; E421-K451 VanDerWaalsContact OE1-CE 3.27Å; E421-K451 WeakPolarHBondContact OE1-CE 3.39Å; E421-K451 IonicContact OE1-NZ 3.59Å; E421-K451 PolarHBondContact OE1-NZ 3.27Å; E421-K451 WeakPolarHBondContact OE2-CE 3.45Å; E421-K451 IonicContact OE2-NZ 2.79Å; E421-K451 PolarHBondContact OE2-NZ 2.99Å
422	I	73.8	Confident	62.9	Low	92 Å²	92	82.4 Å²	82.4	47%	0.472	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	119.6	-178.8	-59.4	172.6	0	0	0	108.3	H420 Q424 K451 V452	H420-I422 PolarHBondContact O-N 3.23Å; I422-Q424 HydrophobicContact CG2-CB 4.39Å; I422-K451 CarbonylContact O-C 3.6Å; I422-K451 WeakPolarHBondContact O-CA 3.16Å; I422-V452 PolarHBondContact N-O 3.45Å; I422-V452 PolarHBondContact O-N 3.1Å
423	I	78.7	Confident	64.8	Low	45 Å²	45	79.9 Å²	79.9	23%	0.231	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	123.2	171.3	-61.1	174	0	0	0	107.4	E450 K451 L460 V464 C465 L470	I423-E450 WeakPolarHBondContact CA-O 3.47Å; I423-K451 HydrophobicContact CG1-CB 4.36Å; I423-K451 HydrophobicContact CG1-CG 4.32Å; I423-L460 HydrophobicContact CG1-CD1 4.49Å; I423-L460 HydrophobicContact CG2-CD1 4.35Å; I423-V464 HydrophobicContact CD1-CG1 4.24Å; I423-C465 VanDerWaalsContact CG2-SG 3.55Å; I423-L470 HydrophobicContact CG2-CD1 4.13Å; I423-L470 VanDerWaalsContact O-CD1 3.3Å; I423-L470 WeakPolarHBondContact O-CD1 3.38Å
424	Q	78.8	Confident	66.4	Low	60 Å²	60	78.7 Å²	78.7	28%	0.28	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	157.5	-175.3	64	176.7	10.4	0	0	112.9	I422 V426 E450	I422-Q424 HydrophobicContact CG2-CB 4.39Å; Q424-V426 HydrophobicContact CG-CG2 4.06Å; Q424-E450 PolarHBondContact N-O 2.03Å; Q424-E450 PolarHBondContact O-N 2.99Å
425	W	79.6	Confident	67.7	Low	31 Å²	31	72.6 Å²	72.6	12%	0.117	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.3	167.2	-68.9	111.7	0	0	0	110.7	V447 R448 C449 D462 C465 I466 L470 K472 P473	W425-V447 HydrophobicContact CB-CG1 4.45Å; W425-V447 HydrophobicContact CD2-CG1 4.42Å; W425-V447 HydrophobicContact CE3-CG1 3.82Å; W425-V447 HydrophobicContact CZ3-CG1 4.47Å; W425-R448 WeakPolarHBondContact CA-O 3.02Å; W425-C449 HydrophobicContact CE3-CB 4.11Å; W425-C449 HydrophobicContact CH2-CB 4.22Å; W425-C449 HydrophobicContact CZ3-CB 3.82Å; W425-D462 HydrophobicContact CH2-CB 3.69Å; W425-D462 HydrophobicContact CZ3-CB 4.2Å; W425-D462 WeakPolarHBondContact CZ3-OD1 3.18Å; W425-C465 HydrophobicContact CD2-CB 4.03Å; W425-C465 HydrophobicContact CH2-CB 3.94Å; W425-C465 HydrophobicContact CZ2-CB 3.33Å; W425-I466 HydrophobicContact CH2-CG1 4.48Å; W425-I466 HydrophobicContact CZ2-CG1 4.02Å; W425-L470 PolarHBondContact NE1-O 3.4Å; W425-K472 HydrophobicContact CD2-CB 4.28Å; W425-K472 HydrophobicContact CD2-CG 4.07Å; W425-K472 HydrophobicContact CE3-CG 4.05Å; W425-K472 HydrophobicContact CH2-CB 4.22Å; W425-K472 HydrophobicContact CH2-CD 3.64Å; W425-K472 HydrophobicContact CH2-CG 3.84Å; W425-K472 HydrophobicContact CZ2-CB 3.71Å; W425-K472 HydrophobicContact CZ2-CD 4.03Å; W425-K472 HydrophobicContact CZ2-CG 3.85Å; W425-K472 HydrophobicContact CZ3-CD 3.9Å; W425-K472 HydrophobicContact CZ3-CG 3.93Å; W425-P473 HydrophobicContact CB-CG 3.97Å
426	V	77.5	Confident	68.8	Low	17 Å²	17	74.9 Å²	74.9	10%	0.103	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129.3	175.1	-179.8	0	0	0	0	109.7	Q424 V447 R448 E450	Q424-V426 HydrophobicContact CG-CG2 4.06Å; V426-V447 WeakPolarHBondContact O-CA 3.36Å; V426-R448 PolarHBondContact N-O 2.7Å; V426-R448 PolarHBondContact O-N 2.61Å; V426-E450 HydrophobicContact CB-CG 4.16Å; V426-E450 HydrophobicContact CG2-CB 3.92Å; V426-E450 HydrophobicContact CG2-CG 3.94Å; V426-E450 WeakPolarHBondContact CG2-OE2 3.38Å
427	V	80	Confident	70.2	Confident	68 Å²	68	72.7 Å²	72.7	41%	0.412	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	129	-178.6	-63.7	0	0	0	0	111.1	V447 P473	V427-V447 HydrophobicContact CG1-CG1 4.45Å; V427-V447 HydrophobicContact CG1-CG2 4.23Å; V427-P473 HydrophobicContact CG1-CB 3.65Å; V427-P473 HydrophobicContact CG1-CG 3.75Å
428	G	76.5	Confident	71.2	Confident	26 Å²	26	70.3 Å²	70.3	27%	0.268	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-79.8	173.9	170.7	0	0	0	0	0	113.1	V446	G428-V446 PolarHBondContact N-O 3.45Å
429	P	80.9	Confident	72.2	Confident	119 Å²	119	72.7 Å²	72.7	77%	0.773	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-64.6	153.1	172.9	29.7	-34.8	0	0	0	111	R445	P429-R445 WeakPolarHBondContact O-CB 3.37Å
430	W	81.7	Confident	73.1	Confident	59 Å²	59	72.3 Å²	72.3	22%	0.223	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-73.1	139.6	170.4	-70.1	105.3	0	0	0	110.6	Q443 F444 R445 S475 R477	W430-Q443 HydrophobicContact CB-CB 4.29Å; W430-Q443 HydrophobicContact CD2-CB 4.41Å; W430-Q443 HydrophobicContact CE3-CB 3.84Å; W430-Q443 WeakPolarHBondContact CZ3-O 2.88Å; W430-F444 CarbonylContact C-O 3.56Å; W430-F444 WeakPolarHBondContact CA-O 3.32Å; W430-F444 VanDerWaalsContact CE3-C 3.47Å; W430-R445 HydrophobicContact CD2-CB 3.98Å; W430-R445 HydrophobicContact CD2-CG 4.06Å; W430-R445 HydrophobicContact CE3-CB 3.69Å; W430-R445 HydrophobicContact CE3-CG 3.78Å; W430-R445 HydrophobicContact CH2-CG 3.73Å; W430-R445 VanDerWaalsContact CZ2-CD 3.48Å; W430-R445 HydrophobicContact CZ2-CG 4.02Å; W430-R445 VanDerWaalsContact CZ2-CZ 3.42Å; W430-R445 HydrophobicContact CZ3-CB 3.99Å; W430-R445 HydrophobicContact CZ3-CG 3.59Å; W430-S475 WeakPolarHBondContact CZ3-O 3.19Å; W430-R477 VanDerWaalsContact CD1-NH1 3.28Å; W430-R477 HydrophobicContact CD2-CG 3.9Å; W430-R477 VanDerWaalsContact CE2-CD 3.43Å; W430-R477 HydrophobicContact CE3-CG 3.77Å; W430-R477 HydrophobicContact CH2-CB 3.67Å; W430-R477 HydrophobicContact CH2-CG 3.73Å; W430-R477 HydrophobicContact CZ2-CB 3.95Å; W430-R477 HydrophobicContact CZ2-CG 3.85Å; W430-R477 HydrophobicContact CZ3-CB 4.01Å; W430-R477 HydrophobicContact CZ3-CG 3.7Å
431	S	76.1	Confident	74.4	Confident	43 Å²	43	65 Å²	65	30%	0.301	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-59.6	168	171.2	70.1	0	0	0	0	111.2	Q443 F444	S431-Q443 VanDerWaalsContact O-CG 3.28Å; S431-Q443 WeakPolarHBondContact O-CG 3.44Å; S431-Q443 PolarHBondContact O-NE2 3.13Å; S431-F444 WeakPolarHBondContact CB-O 3.22Å; S431-F444 PolarHBondContact N-O 3.45Å; S431-F444 PolarHBondContact OG-N 3.05Å; S431-F444 PolarHBondContact OG-O 3.45Å
432	T	81.1	Confident	75.4	Confident	125 Å²	125	64.8 Å²	64.8	77%	0.767	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-56.9	153.6	158.7	50	0	0	0	0	109.7
433	C	81.3	Confident	75.9	Confident	28 Å²	28	61.9 Å²	61.9	19%	0.189	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-62.3	138.1	177.2	-167.1	0	0	0	0	109.3	T435 Q443 C479 L480	C433-T435 WeakPolarHBondContact CB-O 3.4Å; C433-T435 PolarHBondContact O-N 3.29Å; C433-T435 VanDerWaalsContact O-N 3.1Å; C433-T435 PolarHBondContact SG-O 3.15Å; C433-Q443 HydrophobicContact CB-CG 4.29Å; C433-C479 WeakPolarHBondContact CA-SG 3.43Å; C433-C479 HydrophobicContact CB-CB 3.94Å; C433-C479 WeakPolarHBondContact CB-SG 3.38Å; C433-C479 WeakPolarHBondContact SG-CB 3.47Å; C433-C479 CovalentContact SG-SG 2.03Å; C433-C479 PolarHBondContact SG-SG 2.67Å; C433-L480 HydrophobicContact CB-CD1 4.26Å
434	S	75.8	Confident	76.2	Confident	74 Å²	74	64.6 Å²	64.6	52%	0.517	38%	0.376	S	S	.	.	S	Bend	trans	-57.5	-24.9	-178.9	63.5	0	0	0	0	113	G441 Q442	S434-G441 WeakPolarHBondContact OG-CA 3.44Å; S434-Q442 WeakPolarHBondContact CB-O 3.35Å; S434-Q442 PolarHBondContact N-O 3.13Å; S434-Q442 PolarHBondContact OG-N 3.35Å; S434-Q442 PolarHBondContact OG-O 3.42Å
435	T	69.3	Low	76.2	Confident	49 Å²	49	63.9 Å²	63.9	30%	0.301	37%	0.371	S	S	.	.			trans	-121.8	144.3	175.7	54.9	0	0	0	0	109.4	C433 G441 L480	C433-T435 WeakPolarHBondContact CB-O 3.4Å; C433-T435 PolarHBondContact O-N 3.29Å; C433-T435 VanDerWaalsContact O-N 3.1Å; C433-T435 PolarHBondContact SG-O 3.15Å; T435-G441 VanDerWaalsContact OG1-CA 3.29Å; T435-G441 WeakPolarHBondContact OG1-CA 3.35Å; T435-L480 WeakPolarHBondContact O-CD1 3.49Å
436	S	69.2	Low	76.3	Confident	119 Å²	119	66.4 Å²	66.4	83%	0.832	39%	0.39	S	S	*	.	S	Bend	trans	-87	-20.7	174.6	49.8	0	0	0	0	112.8
437	C	70.2	Confident	76.6	Confident	42 Å²	42	66.2 Å²	66.2	28%	0.284	39%	0.389	S	S	.	.	S	Bend	trans	-158	156.7	174.1	72.3	0	0	0	0	109.5	C485	C437-C485 HydrophobicContact CB-CB 3.95Å; C437-C485 WeakPolarHBondContact CB-SG 3.42Å; C437-C485 WeakPolarHBondContact SG-CB 3.48Å; C437-C485 CovalentContact SG-SG 2.05Å; C437-C485 PolarHBondContact SG-SG 3.09Å
438	G	62.7	Low	76.8	Confident	18 Å²	18	68.3 Å²	68.3	19%	0.186	39%	0.389	C	S	.	.	B	Isolated β-bridge	trans	119.7	-178.6	177.4	0	0	0	0	0	115.2	T440 C485	G438-T440 PolarHBondContact O-N 3.4Å; G438-C485 PolarHBondContact N-SG 3.27Å
439	Q	62.9	Low	77.2	Confident	154 Å²	154	67.1 Å²	67.1	72%	0.72	38%	0.376	S	S	*	.	S	Bend	trans	-63	-42.3	-162.9	-86.1	-179.7	-2.7	0	0	115.6	N483	Q439-N483 WeakPolarHBondContact CG-OD1 3.41Å
440	T	65.7	Low	77.3	Confident	100 Å²	100	61.8 Å²	61.8	61%	0.613	34%	0.341	S	S	*	.			trans	-151.2	128.4	174.3	56.3	0	0	0	0	110.8	G438	G438-T440 PolarHBondContact O-N 3.4Å
441	G	76.8	Confident	77.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	166.1	166.8	0	0	0	0	0	111.5	S434 T435 K478 C479	S434-G441 WeakPolarHBondContact OG-CA 3.44Å; T435-G441 VanDerWaalsContact OG1-CA 3.29Å; T435-G441 WeakPolarHBondContact OG1-CA 3.35Å; G441-K478 WeakPolarHBondContact O-CA 3.44Å; G441-C479 CarbonylContact C-O 3.54Å; G441-C479 WeakPolarHBondContact CA-O 3.38Å; G441-C479 VanDerWaalsContact CA-SG 3.6Å; G441-C479 PolarHBondContact N-O 3.2Å; G441-C479 PolarHBondContact O-N 3.48Å; G441-C479 VanDerWaalsContact O-O 3.12Å; G441-C479 PolarHBondContact O-SG 2.9Å
442	Q	84.8	Confident	77	Confident	92 Å²	92	59.7 Å²	59.7	43%	0.43	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	141.2	171.2	-63.2	-174	-1.2	0	0	110.7	S434 F444 T476 R477 C479	S434-Q442 WeakPolarHBondContact CB-O 3.35Å; S434-Q442 PolarHBondContact N-O 3.13Å; S434-Q442 PolarHBondContact OG-N 3.35Å; S434-Q442 PolarHBondContact OG-O 3.42Å; Q442-F444 HydrophobicContact CB-CE2 4.1Å; Q442-F444 HydrophobicContact CB-CZ 3.91Å; Q442-T476 HydrophobicContact CB-CG2 4.28Å; Q442-R477 CarbonylContact C-O 3.56Å; Q442-R477 WeakPolarHBondContact CA-O 3.46Å; Q442-C479 PolarHBondContact N-SG 3.01Å
443	Q	83.8	Confident	76.3	Confident	31 Å²	31	54.2 Å²	54.2	15%	0.145	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143.7	167.1	-76.3	175.7	-46.1	0	0	109.1	W430 S431 C433 T476 R477 C479	W430-Q443 HydrophobicContact CB-CB 4.29Å; W430-Q443 HydrophobicContact CD2-CB 4.41Å; W430-Q443 HydrophobicContact CE3-CB 3.84Å; W430-Q443 WeakPolarHBondContact CZ3-O 2.88Å; S431-Q443 VanDerWaalsContact O-CG 3.28Å; S431-Q443 WeakPolarHBondContact O-CG 3.44Å; S431-Q443 PolarHBondContact O-NE2 3.13Å; C433-Q443 HydrophobicContact CB-CG 4.29Å; Q443-T476 CarbonylContact O-C 3.54Å; Q443-T476 WeakPolarHBondContact O-CA 3.5Å; Q443-R477 HydrophobicContact CB-CG 3.88Å; Q443-R477 PolarHBondContact N-O 3.39Å; Q443-R477 PolarHBondContact O-N 2.8Å; Q443-C479 HydrophobicContact CG-CB 3.89Å
444	F	85.4	Confident	75.3	Confident	101 Å²	101	55.9 Å²	55.9	44%	0.443	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	148.1	-180	-56	-84.9	0	0	0	109.5	W430 S431 Q442 S475 T476	W430-F444 CarbonylContact C-O 3.56Å; W430-F444 WeakPolarHBondContact CA-O 3.32Å; W430-F444 VanDerWaalsContact CE3-C 3.47Å; S431-F444 WeakPolarHBondContact CB-O 3.22Å; S431-F444 PolarHBondContact N-O 3.45Å; S431-F444 PolarHBondContact OG-N 3.05Å; S431-F444 PolarHBondContact OG-O 3.45Å; Q442-F444 HydrophobicContact CB-CE2 4.1Å; Q442-F444 HydrophobicContact CB-CZ 3.91Å; F444-S475 CarbonylContact C-O 2.86Å; F444-S475 VanDerWaalsContact CA-O 3.31Å; F444-S475 WeakPolarHBondContact CA-O 3.08Å; F444-T476 HydrophobicContact CD1-CG2 4.02Å; F444-T476 HydrophobicContact CE1-CG2 3.79Å
445	R	79.5	Confident	75	Confident	46 Å²	46	56.8 Å²	56.8	17%	0.174	30%	0.3	C	S	.	.			trans	-140.2	152.4	169.7	68.5	177.2	173.3	-176.8	-2.6	110.2	P429 W430 V447 P474 S475	P429-R445 WeakPolarHBondContact O-CB 3.37Å; W430-R445 HydrophobicContact CD2-CB 3.98Å; W430-R445 HydrophobicContact CD2-CG 4.06Å; W430-R445 HydrophobicContact CE3-CB 3.69Å; W430-R445 HydrophobicContact CE3-CG 3.78Å; W430-R445 HydrophobicContact CH2-CG 3.73Å; W430-R445 VanDerWaalsContact CZ2-CD 3.48Å; W430-R445 HydrophobicContact CZ2-CG 4.02Å; W430-R445 VanDerWaalsContact CZ2-CZ 3.42Å; W430-R445 HydrophobicContact CZ3-CB 3.99Å; W430-R445 HydrophobicContact CZ3-CG 3.59Å; R445-V447 HydrophobicContact CG-CG2 4.14Å; R445-P474 PolarHBondContact NE-O 3.42Å; R445-P474 PolarHBondContact NH2-O 2.81Å; R445-S475 PolarHBondContact N-O 3.48Å; R445-S475 WeakPolarHBondContact O-CB 3.16Å
446	V	80.5	Confident	75	Confident	83 Å²	83	56.7 Å²	56.7	50%	0.503	30%	0.296	S	S	.	.			trans	-81.9	132.8	174.3	-176	0	0	0	0	109	G428 R448	G428-V446 PolarHBondContact N-O 3.45Å; V446-R448 HydrophobicContact CG1-CG 3.78Å
447	V	84.8	Confident	75.4	Confident	13 Å²	13	51.4 Å²	51.4	8%	0.079	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	119	175.9	-178.2	0	0	0	0	107	W425 V426 V427 R445 K472 P473	W425-V447 HydrophobicContact CB-CG1 4.45Å; W425-V447 HydrophobicContact CD2-CG1 4.42Å; W425-V447 HydrophobicContact CE3-CG1 3.82Å; W425-V447 HydrophobicContact CZ3-CG1 4.47Å; V426-V447 WeakPolarHBondContact O-CA 3.36Å; V427-V447 HydrophobicContact CG1-CG1 4.45Å; V427-V447 HydrophobicContact CG1-CG2 4.23Å; R445-V447 HydrophobicContact CG-CG2 4.14Å; V447-K472 HydrophobicContact CG1-CG 4.02Å; V447-P473 HydrophobicContact CG1-CB 4.26Å; V447-P473 HydrophobicContact CG1-CG 4.18Å; V447-P473 HydrophobicContact CG2-CB 4.5Å
448	R	84.3	Confident	75.9	Confident	113 Å²	113	50.9 Å²	50.9	43%	0.426	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	142.4	-175.2	-63.1	-179.9	178.5	168.1	-0.5	110.8	W425 V426 V446 E450 I459	W425-R448 WeakPolarHBondContact CA-O 3.02Å; V426-R448 PolarHBondContact N-O 2.7Å; V426-R448 PolarHBondContact O-N 2.61Å; V446-R448 HydrophobicContact CG1-CG 3.78Å; R448-E450 HydrophobicContact CB-CG 4.34Å; R448-I459 HydrophobicContact CB-CG2 4.25Å; R448-I459 HydrophobicContact CG-CG2 4.47Å
449	C	85.4	Confident	76.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	120.6	166	-175.5	0	0	0	0	108.6	W425 L460 C465	W425-C449 HydrophobicContact CE3-CB 4.11Å; W425-C449 HydrophobicContact CH2-CB 4.22Å; W425-C449 HydrophobicContact CZ3-CB 3.82Å; C449-L460 HydrophobicContact CB-CB 4.26Å; C449-L460 PolarHBondContact O-N 3.45Å; C449-C465 VanDerWaalsContact CA-SG 3.52Å; C449-C465 HydrophobicContact CB-CB 3.78Å; C449-C465 WeakPolarHBondContact CB-SG 3.02Å; C449-C465 WeakPolarHBondContact SG-CB 3.44Å; C449-C465 PolarHBondContact SG-N 3.03Å; C449-C465 VanDerWaalsContact SG-N 3.38Å; C449-C465 CovalentContact SG-SG 2.03Å; C449-C465 PolarHBondContact SG-SG 2.79Å
450	E	82.5	Confident	77.7	Confident	8 Å²	8	45 Å²	45	4%	0.037	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	140.8	178.1	-62.5	-171.3	178.3	0	0	110.6	R400 I423 Q424 V426 R448 Q458 I459	R400-E450 IonicContact NH1-OE1 2.74Å; I423-E450 WeakPolarHBondContact CA-O 3.47Å; Q424-E450 PolarHBondContact N-O 2.03Å; Q424-E450 PolarHBondContact O-N 2.99Å; V426-E450 HydrophobicContact CB-CG 4.16Å; V426-E450 HydrophobicContact CG2-CB 3.92Å; V426-E450 HydrophobicContact CG2-CG 3.94Å; V426-E450 WeakPolarHBondContact CG2-OE2 3.38Å; R448-E450 HydrophobicContact CB-CG 4.34Å; E450-Q458 CarbonylContact C-O 3.53Å; E450-Q458 VanDerWaalsContact CA-O 3.24Å; E450-Q458 WeakPolarHBondContact CA-O 3.44Å; E450-I459 HydrophobicContact CG-CG1 4.34Å
451	K	81.7	Confident	78.6	Confident	35 Å²	35	45 Å²	45	15%	0.152	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.5	167.8	176.1	-177.7	-179.7	179.6	0	108.7	E421 I422 I423 Y457 Q458 L460	E421-K451 VanDerWaalsContact OE1-CE 3.27Å; E421-K451 WeakPolarHBondContact OE1-CE 3.39Å; E421-K451 IonicContact OE1-NZ 3.59Å; E421-K451 PolarHBondContact OE1-NZ 3.27Å; E421-K451 WeakPolarHBondContact OE2-CE 3.45Å; E421-K451 IonicContact OE2-NZ 2.79Å; E421-K451 PolarHBondContact OE2-NZ 2.99Å; I422-K451 CarbonylContact O-C 3.6Å; I422-K451 WeakPolarHBondContact O-CA 3.16Å; I423-K451 HydrophobicContact CG1-CB 4.36Å; I423-K451 HydrophobicContact CG1-CG 4.32Å; K451-Y457 CarbonylContact O-C 3.58Å; K451-Y457 VanDerWaalsContact O-CA 3.29Å; K451-Y457 WeakPolarHBondContact O-CA 3.2Å; K451-Q458 HydrophobicContact CB-CB 4.33Å; K451-Q458 PolarHBondContact N-O 3.46Å; K451-Q458 PolarHBondContact O-N 2.94Å; K451-L460 HydrophobicContact CB-CD1 3.63Å; K451-L460 HydrophobicContact CB-CD2 4.27Å; K451-L460 HydrophobicContact CB-CG 3.94Å
452	V	70	Confident	79	Confident	23 Å²	23	47.2 Å²	47.2	14%	0.139	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	122.5	-179.6	-173.8	0	0	0	0	109	I422	I422-V452 PolarHBondContact N-O 3.45Å; I422-V452 PolarHBondContact O-N 3.1Å
453	D	65.3	Low	78.9	Confident	9 Å²	9	47.4 Å²	47.4	5%	0.048	23%	0.229	C	C	.	.			trans	-114.7	163.8	163.4	176.6	19.5	0	0	0	108	M295 R455 F456	M295-D453 WeakPolarHBondContact CE-O 3.26Å; D453-R455 PolarHBondContact O-N 3.49Å; D453-R455 IonicContact OD2-CZ 3.42Å; D453-R455 VanDerWaalsContact OD2-CZ 3.28Å; D453-R455 IonicContact OD2-NE 3.71Å; D453-R455 PolarHBondContact OD2-NE 3.47Å; D453-R455 IonicContact OD2-NH2 3.75Å; D453-R455 PolarHBondContact OD2-NH2 3.13Å; D453-F456 HydrophobicContact CB-CD2 4.46Å; D453-F456 HydrophobicContact CB-CE2 4.15Å; D453-F456 HydrophobicContact CB-CZ 4.39Å; D453-F456 PolarHBondContact N-O 3.47Å
454	S	61.8	Low	78.9	Confident	63 Å²	63	48.4 Å²	48.4	44%	0.441	24%	0.237	S	C	.	.	S	Bend	trans	-48.2	-24.5	167.5	63.4	0	0	0	0	115.3	R296	R296-S454 VanDerWaalsContact CD-O 3.32Å; R296-S454 WeakPolarHBondContact CD-O 3.48Å; R296-S454 PolarHBondContact NE-O 3.36Å; R296-S454 VanDerWaalsContact NH2-CB 3.27Å; R296-S454 PolarHBondContact NH2-OG 2.87Å
455	R	67.7	Low	78.6	Confident	94 Å²	94	43.6 Å²	43.6	36%	0.355	22%	0.216	S	C	.	.	S	Bend	trans	-101	-41	-174.6	-69.4	169.2	-74.3	-151.5	-8.1	114.9	M295 R296 V298 D453	M295-R455 PolarHBondContact N-O 3.41Å; M295-R455 VanDerWaalsContact N-O 3.11Å; R296-R455 VanDerWaalsContact NE-CG 3.3Å; V298-R455 HydrophobicContact CG1-CB 4.15Å; V298-R455 HydrophobicContact CG1-CG 4.13Å; D453-R455 PolarHBondContact O-N 3.49Å; D453-R455 IonicContact OD2-CZ 3.42Å; D453-R455 VanDerWaalsContact OD2-CZ 3.28Å; D453-R455 IonicContact OD2-NE 3.71Å; D453-R455 PolarHBondContact OD2-NE 3.47Å; D453-R455 IonicContact OD2-NH2 3.75Å; D453-R455 PolarHBondContact OD2-NH2 3.13Å
456	F	70.4	Confident	78.6	Confident	47 Å²	47	45.2 Å²	45.2	21%	0.206	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	155	-171.3	49.3	-102.1	0	0	0	109.5	I292 V293 D453 Q458	I292-F456 HydrophobicContact CG2-CB 4.47Å; V293-F456 WeakPolarHBondContact O-CA 3.27Å; V293-F456 VanDerWaalsContact O-CB 3.25Å; V293-F456 WeakPolarHBondContact O-CB 3.33Å; D453-F456 HydrophobicContact CB-CD2 4.46Å; D453-F456 HydrophobicContact CB-CE2 4.15Å; D453-F456 HydrophobicContact CB-CZ 4.39Å; D453-F456 PolarHBondContact N-O 3.47Å; F456-Q458 HydrophobicContact CD2-CG 3.72Å; F456-Q458 HydrophobicContact CE2-CG 4.03Å
457	Y	77.1	Confident	78.4	Confident	8 Å²	8	46.4 Å²	46.4	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	145.6	161.1	69.7	-99.3	0	0	0	109.6	V293 M295 R388 D396 R400 K451	V293-Y457 HydrophobicContact CB-CD1 3.81Å; V293-Y457 HydrophobicContact CB-CD2 3.99Å; V293-Y457 HydrophobicContact CB-CE1 3.49Å; V293-Y457 VanDerWaalsContact CB-CE1 3.49Å; V293-Y457 HydrophobicContact CB-CE2 3.64Å; V293-Y457 HydrophobicContact CB-CG 4.07Å; V293-Y457 VanDerWaalsContact CB-CZ 3.41Å; V293-Y457 HydrophobicContact CG1-CD1 3.98Å; V293-Y457 HydrophobicContact CG1-CE1 3.35Å; V293-Y457 HydrophobicContact CG1-CE2 4.32Å; V293-Y457 HydrophobicContact CG2-CD2 4.07Å; V293-Y457 HydrophobicContact CG2-CE1 4.02Å; V293-Y457 HydrophobicContact CG2-CE2 3.37Å; V293-Y457 PolarHBondContact N-O 2.79Å; V293-Y457 PolarHBondContact O-N 3.48Å; V293-Y457 VanDerWaalsContact O-N 3.16Å; M295-Y457 HydrophobicContact CG-CD1 3.97Å; M295-Y457 HydrophobicContact SD-CD1 3.88Å; R388-Y457 PolarHBondContact NH1-OH 2.83Å; D396-Y457 PolarHBondContact OD2-OH 3.3Å; R400-Y457 PolarHBondContact NH2-OH 2.85Å; K451-Y457 CarbonylContact O-C 3.58Å; K451-Y457 VanDerWaalsContact O-CA 3.29Å; K451-Y457 WeakPolarHBondContact O-CA 3.2Å
458	Q	81	Confident	78	Confident	31 Å²	31	52.2 Å²	52.2	15%	0.145	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.8	178.4	-50.9	-176.7	-1.1	0	0	108.8	T291 I292 E450 K451 F456 L460	T291-Q458 CarbonylContact O-C 3.59Å; T291-Q458 WeakPolarHBondContact O-CA 3.14Å; I292-Q458 HydrophobicContact CG1-CG 4.3Å; E450-Q458 CarbonylContact C-O 3.53Å; E450-Q458 VanDerWaalsContact CA-O 3.24Å; E450-Q458 WeakPolarHBondContact CA-O 3.44Å; K451-Q458 HydrophobicContact CB-CB 4.33Å; K451-Q458 PolarHBondContact N-O 3.46Å; K451-Q458 PolarHBondContact O-N 2.94Å; F456-Q458 HydrophobicContact CD2-CG 3.72Å; F456-Q458 HydrophobicContact CE2-CG 4.03Å; Q458-L460 HydrophobicContact CB-CD2 4.18Å; Q458-L460 PolarHBondContact O-N 2.74Å
459	I	82.1	Confident	77.5	Confident	27 Å²	27	54.3 Å²	54.3	14%	0.138	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	115.9	167.7	-56	175.6	0	0	0	106.6	L290 T291 R448 E450	L290-I459 WeakPolarHBondContact CD2-O 3.32Å; T291-I459 HydrophobicContact CG2-CD1 4.29Å; T291-I459 PolarHBondContact O-N 2.9Å; R448-I459 HydrophobicContact CB-CG2 4.25Å; R448-I459 HydrophobicContact CG-CG2 4.47Å; E450-I459 HydrophobicContact CG-CG1 4.34Å
460	L	81.9	Confident	77	Confident	22 Å²	22	57 Å²	57	12%	0.115	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	165.7	-178.4	-60.7	-177.3	0	0	0	110.9	L290 I423 C449 K451 Q458 V464	L290-L460 HydrophobicContact CD2-CD2 3.76Å; I423-L460 HydrophobicContact CG1-CD1 4.49Å; I423-L460 HydrophobicContact CG2-CD1 4.35Å; C449-L460 HydrophobicContact CB-CB 4.26Å; C449-L460 PolarHBondContact O-N 3.45Å; K451-L460 HydrophobicContact CB-CD1 3.63Å; K451-L460 HydrophobicContact CB-CD2 4.27Å; K451-L460 HydrophobicContact CB-CG 3.94Å; Q458-L460 HydrophobicContact CB-CD2 4.18Å; Q458-L460 PolarHBondContact O-N 2.74Å; L460-V464 HydrophobicContact CB-CB 4.43Å; L460-V464 HydrophobicContact CB-CG2 4.44Å; L460-V464 HydrophobicContact CD1-CB 4.14Å; L460-V464 HydrophobicContact CD1-CG1 3.81Å
461	N	84.7	Confident	76.5	Confident	98 Å²	98	62.1 Å²	62.1	52%	0.524	32%	0.321	S	S	.	.			trans	-65.8	137.5	164.6	-170.5	-35.3	0	0	0	109.5	Q463 V464	N461-Q463 PolarHBondContact O-N 3.35Å; N461-Q463 VanDerWaalsContact O-N 3.08Å; N461-Q463 PolarHBondContact OD1-N 2.85Å; N461-V464 WeakPolarHBondContact O-CB 3.3Å; N461-V464 PolarHBondContact O-N 2.9Å
462	D	83.5	Confident	76.6	Confident	47 Å²	47	65.1 Å²	65.1	25%	0.251	34%	0.335	S	S	.	.	H	α-helix	trans	-46.8	-35.6	174.3	-77.7	9.9	0	0	0	113.4	W425 V464 C465 I466 K472	W425-D462 HydrophobicContact CH2-CB 3.69Å; W425-D462 HydrophobicContact CZ3-CB 4.2Å; W425-D462 WeakPolarHBondContact CZ3-OD1 3.18Å; D462-V464 PolarHBondContact O-N 3.44Å; D462-C465 PolarHBondContact O-N 3.33Å; D462-C465 VanDerWaalsContact O-N 3.12Å; D462-I466 HydrophobicContact CB-CD1 4.42Å; D462-I466 WeakPolarHBondContact O-CG1 3.22Å; D462-I466 PolarHBondContact O-N 3.45Å; D462-I466 VanDerWaalsContact O-N 3.08Å; D462-K472 IonicContact OD2-NZ 2.68Å; D462-K472 PolarHBondContact OD2-NZ 2.03Å
463	Q	84	Confident	77.3	Confident	97 Å²	97	65.7 Å²	65.7	45%	0.453	34%	0.339	S	S	.	.	H	α-helix	trans	-55	-35.1	177.8	-165.7	62.5	33.5	0	0	112.6	N461 C465 I466 D467	N461-Q463 PolarHBondContact O-N 3.35Å; N461-Q463 VanDerWaalsContact O-N 3.08Å; N461-Q463 PolarHBondContact OD1-N 2.85Å; Q463-C465 PolarHBondContact O-N 2.81Å; Q463-I466 PolarHBondContact O-N 3.29Å; Q463-D467 PolarHBondContact NE2-OD1 3.33Å; Q463-D467 WeakPolarHBondContact O-CB 3.16Å; Q463-D467 PolarHBondContact O-N 2.86Å
464	V	83.9	Confident	78.3	Confident	52 Å²	52	69.3 Å²	69.3	32%	0.315	36%	0.363	S	S	.	.	H	α-helix	trans	-65.6	-39	-179	-175.5	0	0	0	0	111.7	I423 L460 N461 D462 K468	I423-V464 HydrophobicContact CD1-CG1 4.24Å; L460-V464 HydrophobicContact CB-CB 4.43Å; L460-V464 HydrophobicContact CB-CG2 4.44Å; L460-V464 HydrophobicContact CD1-CB 4.14Å; L460-V464 HydrophobicContact CD1-CG1 3.81Å; N461-V464 WeakPolarHBondContact O-CB 3.3Å; N461-V464 PolarHBondContact O-N 2.9Å; D462-V464 PolarHBondContact O-N 3.44Å; V464-K468 VanDerWaalsContact O-CG 3.29Å; V464-K468 WeakPolarHBondContact O-CG 3.38Å; V464-K468 PolarHBondContact O-N 3.14Å
465	C	78.8	Confident	79.3	Confident	0 Å²	0	69 Å²	69	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-74.7	-34.5	175.6	-77.8	0	0	0	0	111.8	I423 W425 C449 D462 Q463 K468 L469 L470	I423-C465 VanDerWaalsContact CG2-SG 3.55Å; W425-C465 HydrophobicContact CD2-CB 4.03Å; W425-C465 HydrophobicContact CH2-CB 3.94Å; W425-C465 HydrophobicContact CZ2-CB 3.33Å; C449-C465 VanDerWaalsContact CA-SG 3.52Å; C449-C465 HydrophobicContact CB-CB 3.78Å; C449-C465 WeakPolarHBondContact CB-SG 3.02Å; C449-C465 WeakPolarHBondContact SG-CB 3.44Å; C449-C465 PolarHBondContact SG-N 3.03Å; C449-C465 VanDerWaalsContact SG-N 3.38Å; C449-C465 CovalentContact SG-SG 2.03Å; C449-C465 PolarHBondContact SG-SG 2.79Å; D462-C465 PolarHBondContact O-N 3.33Å; D462-C465 VanDerWaalsContact O-N 3.12Å; Q463-C465 PolarHBondContact O-N 2.81Å; C465-K468 CarbonylContact O-C 3.56Å; C465-K468 PolarHBondContact O-N 2.94Å; C465-L469 PolarHBondContact O-N 2.98Å; C465-L470 HydrophobicContact CB-CB 4.39Å; C465-L470 HydrophobicContact CB-CD1 4.16Å; C465-L470 WeakPolarHBondContact O-CB 3.46Å; C465-L470 PolarHBondContact O-N 2.85Å
466	I	78.7	Confident	80.2	Confident	80 Å²	80	67.2 Å²	67.2	41%	0.41	36%	0.36	S	S	.	.	H	α-helix	trans	-65.3	-44.8	176.5	-64.8	166.3	0	0	0	110.8	W425 D462 Q463 K468 L469	W425-I466 HydrophobicContact CH2-CG1 4.48Å; W425-I466 HydrophobicContact CZ2-CG1 4.02Å; D462-I466 HydrophobicContact CB-CD1 4.42Å; D462-I466 WeakPolarHBondContact O-CG1 3.22Å; D462-I466 PolarHBondContact O-N 3.45Å; D462-I466 VanDerWaalsContact O-N 3.08Å; Q463-I466 PolarHBondContact O-N 3.29Å; I466-K468 PolarHBondContact O-N 2.9Å; I466-L469 WeakPolarHBondContact O-CA 3.47Å; I466-L469 PolarHBondContact O-N 2.95Å
467	D	77.8	Confident	80.8	Confident	107 Å²	107	70.2 Å²	70.2	57%	0.572	37%	0.37	S	S	*	.	H	α-helix	trans	-62.9	-27.6	176.4	-66.5	-14.3	0	0	0	112	Q463 L469	Q463-D467 PolarHBondContact NE2-OD1 3.33Å; Q463-D467 WeakPolarHBondContact O-CB 3.16Å; Q463-D467 PolarHBondContact O-N 2.86Å; D467-L469 PolarHBondContact O-N 3.36Å
468	K	75.5	Confident	81	Confident	136 Å²	136	78.3 Å²	78.3	59%	0.591	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	6.4	171.7	-67.9	-67.1	-174.6	-177.5	0	113.5	V464 C465 I466 L470	V464-K468 VanDerWaalsContact O-CG 3.29Å; V464-K468 WeakPolarHBondContact O-CG 3.38Å; V464-K468 PolarHBondContact O-N 3.14Å; C465-K468 CarbonylContact O-C 3.56Å; C465-K468 PolarHBondContact O-N 2.94Å; I466-K468 PolarHBondContact O-N 2.9Å; K468-L470 HydrophobicContact CB-CD1 4.23Å; K468-L470 HydrophobicContact CB-CG 4.02Å; K468-L470 PolarHBondContact O-N 2.94Å
469	L	73.6	Confident	80.8	Confident	157 Å²	157	77.7 Å²	77.7	82%	0.822	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	28.4	-179.5	-55.9	172.6	0	0	0	113.4	C465 I466 D467	C465-L469 PolarHBondContact O-N 2.98Å; I466-L469 WeakPolarHBondContact O-CA 3.47Å; I466-L469 PolarHBondContact O-N 2.95Å; D467-L469 PolarHBondContact O-N 3.36Å
470	L	74.3	Confident	80.1	Confident	56 Å²	56	80 Å²	80	29%	0.293	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-80.8	122.6	177	-59.6	175.3	0	0	0	109.5	I423 W425 C465 K468 K472	I423-L470 HydrophobicContact CG2-CD1 4.13Å; I423-L470 VanDerWaalsContact O-CD1 3.3Å; I423-L470 WeakPolarHBondContact O-CD1 3.38Å; W425-L470 PolarHBondContact NE1-O 3.4Å; C465-L470 HydrophobicContact CB-CB 4.39Å; C465-L470 HydrophobicContact CB-CD1 4.16Å; C465-L470 WeakPolarHBondContact O-CB 3.46Å; C465-L470 PolarHBondContact O-N 2.85Å; K468-L470 HydrophobicContact CB-CD1 4.23Å; K468-L470 HydrophobicContact CB-CG 4.02Å; K468-L470 PolarHBondContact O-N 2.94Å; L470-K472 PolarHBondContact O-N 3.14Å
471	P	73.8	Confident	78.7	Confident	115 Å²	115	88.4 Å²	88.4	75%	0.747	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-68.4	118.3	-177.8	26.1	-33	0	0	0	110.8	P473	P471-P473 VanDerWaalsContact O-CD 3.26Å; P471-P473 WeakPolarHBondContact O-CD 3.4Å
472	K	83.6	Confident	77.1	Confident	99 Å²	99	87 Å²	87	43%	0.43	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-68.9	120.1	-179.7	-172.4	174.8	179.9	177.5	0	110.5	W425 V447 D462 L470	W425-K472 HydrophobicContact CD2-CB 4.28Å; W425-K472 HydrophobicContact CD2-CG 4.07Å; W425-K472 HydrophobicContact CE3-CG 4.05Å; W425-K472 HydrophobicContact CH2-CB 4.22Å; W425-K472 HydrophobicContact CH2-CD 3.64Å; W425-K472 HydrophobicContact CH2-CG 3.84Å; W425-K472 HydrophobicContact CZ2-CB 3.71Å; W425-K472 HydrophobicContact CZ2-CD 4.03Å; W425-K472 HydrophobicContact CZ2-CG 3.85Å; W425-K472 HydrophobicContact CZ3-CD 3.9Å; W425-K472 HydrophobicContact CZ3-CG 3.93Å; V447-K472 HydrophobicContact CG1-CG 4.02Å; D462-K472 IonicContact OD2-NZ 2.68Å; D462-K472 PolarHBondContact OD2-NZ 2.03Å; L470-K472 PolarHBondContact O-N 3.14Å
473	P	84.7	Confident	75.8	Confident	34 Å²	34	90.7 Å²	90.7	22%	0.221	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-59.1	150.9	176.2	-25	33.5	0	0	0	112.7	W425 V427 V447 P471 S475	W425-P473 HydrophobicContact CB-CG 3.97Å; V427-P473 HydrophobicContact CG1-CB 3.65Å; V427-P473 HydrophobicContact CG1-CG 3.75Å; V447-P473 HydrophobicContact CG1-CB 4.26Å; V447-P473 HydrophobicContact CG1-CG 4.18Å; V447-P473 HydrophobicContact CG2-CB 4.5Å; P471-P473 VanDerWaalsContact O-CD 3.26Å; P471-P473 WeakPolarHBondContact O-CD 3.4Å; P473-S475 PolarHBondContact O-N 2.64Å
474	P	84.9	Confident	74.8	Confident	85 Å²	85	91.6 Å²	91.6	55%	0.552	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-65.4	133	-179.1	24.6	-33.3	0	0	0	111.1	R445	R445-P474 PolarHBondContact NE-O 3.42Å; R445-P474 PolarHBondContact NH2-O 2.81Å
475	S	84.3	Confident	74.4	Confident	56 Å²	56	91.6 Å²	91.6	39%	0.392	48%	0.477	S	S	.	.	S	Bend	trans	-87.7	-9	176.4	55.3	0	0	0	0	113.5	W430 F444 R445 P473	W430-S475 WeakPolarHBondContact CZ3-O 3.19Å; F444-S475 CarbonylContact C-O 2.86Å; F444-S475 VanDerWaalsContact CA-O 3.31Å; F444-S475 WeakPolarHBondContact CA-O 3.08Å; R445-S475 PolarHBondContact N-O 3.48Å; R445-S475 WeakPolarHBondContact O-CB 3.16Å; P473-S475 PolarHBondContact O-N 2.64Å
476	T	84.8	Confident	74.5	Confident	58 Å²	58	92.7 Å²	92.7	36%	0.356	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137.9	-176.8	-50.7	0	0	0	0	110	Q442 Q443 F444	Q442-T476 HydrophobicContact CB-CG2 4.28Å; Q443-T476 CarbonylContact O-C 3.54Å; Q443-T476 WeakPolarHBondContact O-CA 3.5Å; F444-T476 HydrophobicContact CD1-CG2 4.02Å; F444-T476 HydrophobicContact CE1-CG2 3.79Å
477	R	84.5	Confident	74.8	Confident	110 Å²	110	90.6 Å²	90.6	42%	0.415	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	152	171.2	72	174.1	-179	-174.7	0.8	111.1	W430 Q442 Q443	W430-R477 VanDerWaalsContact CD1-NH1 3.28Å; W430-R477 HydrophobicContact CD2-CG 3.9Å; W430-R477 VanDerWaalsContact CE2-CD 3.43Å; W430-R477 HydrophobicContact CE3-CG 3.77Å; W430-R477 HydrophobicContact CH2-CB 3.67Å; W430-R477 HydrophobicContact CH2-CG 3.73Å; W430-R477 HydrophobicContact CZ2-CB 3.95Å; W430-R477 HydrophobicContact CZ2-CG 3.85Å; W430-R477 HydrophobicContact CZ3-CB 4.01Å; W430-R477 HydrophobicContact CZ3-CG 3.7Å; Q442-R477 CarbonylContact C-O 3.56Å; Q442-R477 WeakPolarHBondContact CA-O 3.46Å; Q443-R477 HydrophobicContact CB-CG 3.88Å; Q443-R477 PolarHBondContact N-O 3.39Å; Q443-R477 PolarHBondContact O-N 2.8Å
478	K	79.8	Confident	75.3	Confident	178 Å²	178	86.8 Å²	86.8	77%	0.774	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	142.4	170.4	-61.9	-177.1	-179.1	-178	0	110.2	G441	G441-K478 WeakPolarHBondContact O-CA 3.44Å
479	C	78.6	Confident	75.9	Confident	17 Å²	17	84.5 Å²	84.5	12%	0.115	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	160.5	173.5	56.2	0	0	0	0	109.9	C433 G441 Q442 Q443	C433-C479 WeakPolarHBondContact CA-SG 3.43Å; C433-C479 HydrophobicContact CB-CB 3.94Å; C433-C479 WeakPolarHBondContact CB-SG 3.38Å; C433-C479 WeakPolarHBondContact SG-CB 3.47Å; C433-C479 CovalentContact SG-SG 2.03Å; C433-C479 PolarHBondContact SG-SG 2.67Å; G441-C479 CarbonylContact C-O 3.54Å; G441-C479 WeakPolarHBondContact CA-O 3.38Å; G441-C479 VanDerWaalsContact CA-SG 3.6Å; G441-C479 PolarHBondContact N-O 3.2Å; G441-C479 PolarHBondContact O-N 3.48Å; G441-C479 VanDerWaalsContact O-O 3.12Å; G441-C479 PolarHBondContact O-SG 2.9Å; Q442-C479 PolarHBondContact N-SG 3.01Å; Q443-C479 HydrophobicContact CG-CB 3.89Å
480	L	66.4	Low	76.6	Confident	77 Å²	77	78.7 Å²	78.7	40%	0.403	42%	0.418	S	S	.	.			trans	54.5	122.3	-177.2	-70.5	169	0	0	0	115.4	C433 T435	C433-L480 HydrophobicContact CB-CD1 4.26Å; T435-L480 WeakPolarHBondContact O-CD1 3.49Å
481	E	53.1	Low	77	Confident	198 Å²	198	80.5 Å²	80.5	93%	0.925	43%	0.425	S	S	*	.			trans	-125.3	36.9	179.4	-140.7	166.3	-141.9	0	0	109.9
482	S	50.9	Low	77.6	Confident	69 Å²	69	81.1 Å²	81.1	48%	0.483	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-123.2	116.5	-176	-164.7	0	0	0	0	112.4	K484	S482-K484 VanDerWaalsContact C-N 3.28Å; S482-K484 PolarHBondContact O-N 2.88Å
483	N	56.3	Low	77.5	Confident	123 Å²	123	83 Å²	83	66%	0.658	43%	0.426	S	S	*	.			trans	-77.4	8.9	-173.1	-77	-13.8	0	0	0	115.8	Q439	Q439-N483 WeakPolarHBondContact CG-OD1 3.41Å
484	K	63	Low	77.6	Confident	117 Å²	117	84.6 Å²	84.6	51%	0.509	43%	0.433	S	S	.	.			trans	-123.9	108.6	-172.6	-56.5	-168.1	-178.6	-170.6	0	111	S482 I518	S482-K484 VanDerWaalsContact C-N 3.28Å; S482-K484 PolarHBondContact O-N 2.88Å; K484-I518 HydrophobicContact CB-CG2 3.89Å; K484-I518 WeakPolarHBondContact O-CG2 3.24Å
485	C	75.5	Confident	77.3	Confident	51 Å²	51	85.3 Å²	85.3	35%	0.345	44%	0.436	S	S	.	.			trans	-89.8	152.1	170.8	-80.9	0	0	0	0	111	C437 G438	C437-C485 HydrophobicContact CB-CB 3.95Å; C437-C485 WeakPolarHBondContact CB-SG 3.42Å; C437-C485 WeakPolarHBondContact SG-CB 3.48Å; C437-C485 CovalentContact SG-SG 2.05Å; C437-C485 PolarHBondContact SG-SG 3.09Å; G438-C485 PolarHBondContact N-SG 3.27Å
486	P	80.7	Confident	77.3	Confident	23 Å²	23	87.5 Å²	87.5	15%	0.149	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	137.9	166.4	24.8	-30	0	0	0	110.1	M517 I518 L531	P486-M517 CarbonylContact C-O 3.55Å; P486-M517 VanDerWaalsContact CA-O 3.3Å; P486-M517 WeakPolarHBondContact CA-O 3.49Å; P486-I518 HydrophobicContact CB-CD1 4.13Å; P486-I518 HydrophobicContact CB-CG1 3.62Å; P486-I518 HydrophobicContact CG-CD1 4.49Å; P486-I518 HydrophobicContact CG-CG1 4.35Å; P486-L531 HydrophobicContact CB-CD1 4.45Å; P486-L531 HydrophobicContact CG-CD1 4.4Å; P486-L531 WeakPolarHBondContact O-CD1 3.31Å
487	A	84.2	Confident	77.4	Confident	37 Å²	37	88 Å²	88	31%	0.306	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	155.4	173.7	0	0	0	0	0	110.6	F489 M517 C528	A487-F489 HydrophobicContact CB-CD2 4.45Å; A487-F489 HydrophobicContact CB-CE2 3.71Å; A487-F489 HydrophobicContact CB-CZ 4.14Å; A487-F489 VanDerWaalsContact O-CD2 3.24Å; A487-F489 WeakPolarHBondContact O-CD2 3.46Å; A487-F489 WeakPolarHBondContact O-CE2 3.34Å; A487-M517 PolarHBondContact N-O 3.14Å; A487-M517 PolarHBondContact O-N 3.5Å; A487-C528 VanDerWaalsContact C-SG 3.58Å
488	W	89.2	Confident	77.7	Confident	26 Å²	26	84.8 Å²	84.8	10%	0.098	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	133.5	174	-71.2	112.5	0	0	0	110.7	L514 C516 T525 C528 L531 K533 P534	W488-L514 HydrophobicContact CB-CD2 4.23Å; W488-L514 HydrophobicContact CE3-CB 4.17Å; W488-L514 HydrophobicContact CE3-CD2 4.3Å; W488-L514 HydrophobicContact CZ3-CB 4.37Å; W488-C516 HydrophobicContact CE3-CB 4.22Å; W488-C516 HydrophobicContact CZ3-CB 4.09Å; W488-T525 HydrophobicContact CH2-CG2 3.94Å; W488-T525 HydrophobicContact CZ3-CG2 4.1Å; W488-C528 HydrophobicContact CD2-CB 3.68Å; W488-C528 HydrophobicContact CE3-CB 4.28Å; W488-C528 HydrophobicContact CG-CB 4.08Å; W488-C528 HydrophobicContact CH2-CB 4.12Å; W488-C528 HydrophobicContact CZ2-CB 3.49Å; W488-C528 VanDerWaalsContact CZ2-CB 3.49Å; W488-C528 HydrophobicContact CZ3-CB 4.48Å; W488-C528 PolarHBondContact NE1-O 2.8Å; W488-L531 PolarHBondContact NE1-O 2.79Å; W488-K533 HydrophobicContact CD2-CG 4.37Å; W488-K533 HydrophobicContact CG-CG 4.28Å; W488-P534 HydrophobicContact CB-CG 3.91Å
489	F	88.3	Confident	78.2	Confident	89 Å²	89	78.2 Å²	78.2	39%	0.39	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	155.6	174.2	-64.7	-93.9	0	0	0	109.6	A487 L514 V515 M517	A487-F489 HydrophobicContact CB-CD2 4.45Å; A487-F489 HydrophobicContact CB-CE2 3.71Å; A487-F489 HydrophobicContact CB-CZ 4.14Å; A487-F489 VanDerWaalsContact O-CD2 3.24Å; A487-F489 WeakPolarHBondContact O-CD2 3.46Å; A487-F489 WeakPolarHBondContact O-CE2 3.34Å; F489-L514 CarbonylContact O-C 3.52Å; F489-L514 WeakPolarHBondContact O-CA 3.47Å; F489-V515 HydrophobicContact CB-CG2 4.11Å; F489-V515 PolarHBondContact N-O 3.39Å; F489-V515 PolarHBondContact O-N 3.41Å; F489-M517 HydrophobicContact CB-CE 3.47Å; F489-M517 VanDerWaalsContact CB-CE 3.47Å; F489-M517 HydrophobicContact CD1-CE 3.79Å; F489-M517 HydrophobicContact CD2-CB 3.66Å; F489-M517 HydrophobicContact CD2-CE 3.39Å; F489-M517 HydrophobicContact CD2-CG 3.86Å; F489-M517 HydrophobicContact CD2-SD 4.48Å; F489-M517 HydrophobicContact CE1-CE 4.36Å; F489-M517 HydrophobicContact CE2-CB 3.8Å; F489-M517 HydrophobicContact CE2-CE 4.02Å; F489-M517 HydrophobicContact CE2-CG 4.48Å; F489-M517 HydrophobicContact CG-CE 3.26Å; F489-M517 HydrophobicContact CZ-CE 4.46Å
490	V	86.9	Confident	78.6	Confident	35 Å²	35	82.4 Å²	82.4	21%	0.212	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	108.2	176.7	-172.1	0	0	0	0	108.3	R493 N513 L514 P534 M536	V490-R493 HydrophobicContact CB-CB 4.19Å; V490-R493 HydrophobicContact CB-CG 4.45Å; V490-R493 HydrophobicContact CG1-CB 3.76Å; V490-R493 HydrophobicContact CG1-CG 3.99Å; V490-N513 CarbonylContact C-O 3.5Å; V490-N513 WeakPolarHBondContact CA-O 3.49Å; V490-L514 HydrophobicContact CG2-CD2 4.39Å; V490-P534 HydrophobicContact CG2-CB 3.98Å; V490-P534 HydrophobicContact CG2-CG 4.14Å; V490-M536 HydrophobicContact CG1-CE 4.26Å
491	E	83.9	Confident	79.7	Confident	94 Å²	94	85.5 Å²	85.5	44%	0.439	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	140.3	173.5	-169.4	175.2	-125.3	0	0	109.8	R493 G512 N513 V515	E491-R493 VanDerWaalsContact C-N 3.28Å; E491-R493 PolarHBondContact O-N 2.79Å; E491-G512 WeakPolarHBondContact O-CA 3.35Å; E491-N513 PolarHBondContact N-O 2.81Å; E491-N513 PolarHBondContact O-N 3.38Å; E491-V515 HydrophobicContact CB-CG1 4.08Å; E491-V515 HydrophobicContact CB-CG2 4.03Å
492	N	85.2	Confident	81.5	Confident	127 Å²	127	77 Å²	77	68%	0.679	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53	42	-177.9	-57	-32.2	0	0	0	113.6	D494	N492-D494 PolarHBondContact O-N 3.3Å; N492-D494 VanDerWaalsContact O-N 3.11Å
493	R	83	Confident	83.4	Confident	140 Å²	140	77.2 Å²	77.2	53%	0.528	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	110.3	178.7	-170.4	-178.3	-172.3	-158	2.3	110.3	V490 E491 I510 S511	V490-R493 HydrophobicContact CB-CB 4.19Å; V490-R493 HydrophobicContact CB-CG 4.45Å; V490-R493 HydrophobicContact CG1-CB 3.76Å; V490-R493 HydrophobicContact CG1-CG 3.99Å; E491-R493 VanDerWaalsContact C-N 3.28Å; E491-R493 PolarHBondContact O-N 2.79Å; R493-I510 HydrophobicContact CG-CG2 4.28Å; R493-S511 WeakPolarHBondContact CA-O 3.24Å
494	D	85.2	Confident	85	Confident	67 Å²	67	73.4 Å²	73.4	36%	0.358	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	103.5	170.8	-172	-6.6	0	0	0	109.5	N492 S496 V497 I510 S511	N492-D494 PolarHBondContact O-N 3.3Å; N492-D494 VanDerWaalsContact O-N 3.11Å; D494-S496 PolarHBondContact O-N 3.46Å; D494-S496 WeakPolarHBondContact OD1-CB 3.23Å; D494-S496 PolarHBondContact OD1-N 3.36Å; D494-S496 PolarHBondContact OD1-OG 2.87Å; D494-S496 PolarHBondContact OD2-OG 2.86Å; D494-V497 WeakPolarHBondContact OD2-CG2 3.22Å; D494-I510 WeakPolarHBondContact O-CG2 3.36Å; D494-S511 PolarHBondContact N-O 2.95Å
495	T	80.1	Confident	86.4	Confident	100 Å²	100	70 Å²	70	61%	0.613	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	-15.1	-179.7	26.8	0	0	0	0	113.2	V497 I510	T495-V497 VanDerWaalsContact C-N 3.35Å; T495-I510 HydrophobicContact CG2-CD1 4.29Å; T495-I510 HydrophobicContact CG2-CG2 4.32Å
496	S	83.3	Confident	87.1	Confident	101 Å²	101	68.9 Å²	68.9	71%	0.706	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	-20.1	179.4	71.4	0	0	0	0	113	D494	D494-S496 PolarHBondContact O-N 3.46Å; D494-S496 WeakPolarHBondContact OD1-CB 3.23Å; D494-S496 PolarHBondContact OD1-N 3.36Å; D494-S496 PolarHBondContact OD1-OG 2.87Å; D494-S496 PolarHBondContact OD2-OG 2.86Å
497	V	86.7	Confident	87.7	Confident	69 Å²	69	71.3 Å²	71.3	42%	0.418	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	106.4	-177.1	-177.3	0	0	0	0	110.2	D494 T495 S511	D494-V497 WeakPolarHBondContact OD2-CG2 3.22Å; T495-V497 VanDerWaalsContact C-N 3.35Å; V497-S511 PolarHBondContact O-N 3.49Å; V497-S511 VanDerWaalsContact O-N 3.12Å
498	C	90.6	Very high	88	Confident	43 Å²	43	69.6 Å²	69.6	29%	0.291	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	117.9	169.9	-165.4	0	0	0	0	109.5	C538	C498-C538 VanDerWaalsContact CA-SG 3.53Å; C498-C538 HydrophobicContact CB-CB 3.92Å; C498-C538 WeakPolarHBondContact CB-SG 3.33Å; C498-C538 WeakPolarHBondContact SG-CB 3.48Å; C498-C538 CovalentContact SG-SG 2.03Å; C498-C538 PolarHBondContact SG-SG 3.45Å
499	T	90.1	Very high	88.1	Confident	39 Å²	39	68.5 Å²	68.5	24%	0.239	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	160.2	-178.4	66.5	0	0	0	0	111.7	R501 S509 N540	T499-R501 PolarHBondContact O-N 2.86Å; T499-S509 WeakPolarHBondContact CB-O 3.42Å; T499-S509 PolarHBondContact N-O 3.36Å; T499-S509 WeakPolarHBondContact OG1-CB 3.47Å; T499-S509 PolarHBondContact OG1-O 3.45Å; T499-N540 PolarHBondContact O-ND2 2.79Å
500	D	87.8	Confident	88.1	Confident	105 Å²	105	64.9 Å²	64.9	56%	0.561	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	-1.3	174.7	61.2	-10.4	0	0	0	113.8	C502 I542	D500-C502 VanDerWaalsContact C-N 3.35Å; D500-C502 PolarHBondContact O-N 3.32Å; D500-C502 PolarHBondContact O-SG 3.5Å; D500-C502 VanDerWaalsContact O-SG 3.36Å; D500-I542 HydrophobicContact CB-CD1 3.93Å
501	R	89.5	Confident	88.1	Confident	142 Å²	142	65.3 Å²	65.3	54%	0.536	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	91	170	-168.6	178.8	71.9	154.7	0.6	110.3	T499 L503 G508 S509	T499-R501 PolarHBondContact O-N 2.86Å; R501-L503 PolarHBondContact O-N 2.96Å; R501-G508 CarbonylContact O-C 3.59Å; R501-S509 PolarHBondContact NH2-OG 3.3Å; R501-S509 PolarHBondContact O-N 2.83Å; R501-S509 VanDerWaalsContact O-N 3.07Å
502	C	91	Very high	88.3	Confident	19 Å²	19	61.9 Å²	61.9	13%	0.128	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	124.7	-179.9	-59.5	0	0	0	0	112.1	D500 K507 C543 W573	D500-C502 VanDerWaalsContact C-N 3.35Å; D500-C502 PolarHBondContact O-N 3.32Å; D500-C502 PolarHBondContact O-SG 3.5Å; D500-C502 VanDerWaalsContact O-SG 3.36Å; C502-K507 CarbonylContact C-O 3.52Å; C502-K507 WeakPolarHBondContact CA-O 3.27Å; C502-C543 WeakPolarHBondContact CA-SG 3.3Å; C502-C543 HydrophobicContact CB-CB 3.62Å; C502-C543 WeakPolarHBondContact CB-SG 3.39Å; C502-C543 WeakPolarHBondContact SG-CA 3.43Å; C502-C543 WeakPolarHBondContact SG-CB 3.25Å; C502-C543 CovalentContact SG-SG 2.03Å; C502-C543 PolarHBondContact SG-SG 2.85Å; C502-W573 HydrophobicContact CB-CD2 3.98Å; C502-W573 HydrophobicContact CB-CE3 3.91Å; C502-W573 HydrophobicContact CB-CH2 3.31Å; C502-W573 HydrophobicContact CB-CZ2 3.37Å; C502-W573 HydrophobicContact CB-CZ3 3.59Å
503	L	90.2	Very high	88.3	Confident	74 Å²	74	60.6 Å²	60.6	39%	0.387	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-32.5	176.5	-60.4	178.8	0	0	0	111.3	R501 K507 E537	R501-L503 PolarHBondContact O-N 2.96Å; L503-K507 PolarHBondContact N-O 3.23Å; L503-E537 HydrophobicContact CD1-CG 3.89Å
504	D	91.5	Very high	88.6	Confident	44 Å²	44	56.7 Å²	56.7	24%	0.235	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	175.7	177	-161.7	-3.2	0	0	0	109.5	G506 K507 L583 H587	D504-G506 PolarHBondContact O-N 3.41Å; D504-K507 HydrophobicContact CB-CB 4.01Å; D504-K507 HydrophobicContact CB-CD 4.01Å; D504-K507 HydrophobicContact CB-CG 4.2Å; D504-K507 PolarHBondContact N-O 3.3Å; D504-K507 PolarHBondContact O-N 3.43Å; D504-K507 VanDerWaalsContact O-O 3.09Å; D504-L583 WeakPolarHBondContact OD1-CD2 3.27Å; D504-H587 IonicContact OD1-CD2 2.78Å; D504-H587 IonicContact OD1-CE1 3.79Å; D504-H587 IonicContact OD1-NE2 3.29Å; D504-H587 PolarHBondContact OD1-NE2 2.84Å
505	V	90.5	Very high	88.8	Confident	45 Å²	45	54.7 Å²	54.7	27%	0.273	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	124.3	174.5	179.4	0	0	0	0	109.9	K507 C543 V545 H587	V505-K507 PolarHBondContact O-N 3.09Å; V505-C543 CarbonylContact C-O 3.54Å; V505-C543 VanDerWaalsContact CA-O 3.29Å; V505-C543 WeakPolarHBondContact CA-O 3.39Å; V505-V545 HydrophobicContact CG2-CG1 4.09Å; V505-V545 HydrophobicContact CG2-CG2 3.81Å; V505-H587 WeakPolarHBondContact CG2-CD2 3.02Å; V505-H587 WeakPolarHBondContact CG2-NE2 3.23Å
506	G	91.7	Very high	89.3	Confident	28 Å²	28	50.1 Å²	50.1	29%	0.289	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	6.2	-175.1	0	0	0	0	0	114.4	D504 E539 N540 C543	D504-G506 PolarHBondContact O-N 3.41Å; G506-E539 CarbonylContact O-C 3.48Å; G506-E539 WeakPolarHBondContact O-CA 3.34Å; G506-N540 CarbonylContact C-O 3.58Å; G506-N540 VanDerWaalsContact C-O 3.26Å; G506-N540 WeakPolarHBondContact CA-O 3.16Å; G506-N540 PolarHBondContact O-N 3.34Å; G506-C543 PolarHBondContact N-O 2.84Å
507	K	92.8	Very high	89.3	Confident	74 Å²	74	47.2 Å²	47.2	32%	0.322	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	117.7	-177.4	-57.6	-170.5	-177.4	179.6	0	112.8	C502 L503 D504 V505 E537 C538	C502-K507 CarbonylContact C-O 3.52Å; C502-K507 WeakPolarHBondContact CA-O 3.27Å; L503-K507 PolarHBondContact N-O 3.23Å; D504-K507 HydrophobicContact CB-CB 4.01Å; D504-K507 HydrophobicContact CB-CD 4.01Å; D504-K507 HydrophobicContact CB-CG 4.2Å; D504-K507 PolarHBondContact N-O 3.3Å; D504-K507 PolarHBondContact O-N 3.43Å; D504-K507 VanDerWaalsContact O-O 3.09Å; V505-K507 PolarHBondContact O-N 3.09Å; K507-E537 HydrophobicContact CD-CG 4.34Å; K507-E537 WeakPolarHBondContact CD-OE2 3.37Å; K507-E537 IonicContact NZ-OE2 2.83Å; K507-E537 PolarHBondContact NZ-OE2 2.87Å; K507-C538 CarbonylContact C-O 3.43Å; K507-C538 VanDerWaalsContact CA-O 3.23Å; K507-C538 WeakPolarHBondContact CA-O 3.47Å
508	G	90.6	Very high	89.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-172.6	171	0	0	0	0	0	112.9	R501 E537 C538	R501-G508 CarbonylContact O-C 3.59Å; G508-E537 WeakPolarHBondContact O-CA 3.25Å; G508-C538 VanDerWaalsContact C-SG 3.55Å; G508-C538 PolarHBondContact N-O 3.05Å; G508-C538 PolarHBondContact O-N 3.13Å
509	S	90.5	Very high	88.4	Confident	3 Å²	3	46 Å²	46	2%	0.021	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.8	174.5	179.1	0	0	0	0	110.4	T499 R501 M536	T499-S509 WeakPolarHBondContact CB-O 3.42Å; T499-S509 PolarHBondContact N-O 3.36Å; T499-S509 WeakPolarHBondContact OG1-CB 3.47Å; T499-S509 PolarHBondContact OG1-O 3.45Å; R501-S509 PolarHBondContact NH2-OG 3.3Å; R501-S509 PolarHBondContact O-N 2.83Å; R501-S509 VanDerWaalsContact O-N 3.07Å; S509-M536 CarbonylContact C-O 3.26Å; S509-M536 VanDerWaalsContact CA-O 3.3Å; S509-M536 WeakPolarHBondContact CA-O 3.26Å
510	I	90	Very high	88	Confident	14 Å²	14	52.6 Å²	52.6	7%	0.072	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	145.7	172.1	-60.6	167.7	0	0	0	109.2	R493 D494 T495 M536 C538	R493-I510 HydrophobicContact CG-CG2 4.28Å; D494-I510 WeakPolarHBondContact O-CG2 3.36Å; T495-I510 HydrophobicContact CG2-CD1 4.29Å; T495-I510 HydrophobicContact CG2-CG2 4.32Å; I510-M536 PolarHBondContact N-O 3.02Å; I510-M536 WeakPolarHBondContact O-CE 3.37Å; I510-C538 HydrophobicContact CD1-CB 4.39Å; I510-C538 HydrophobicContact CG1-CB 3.62Å; I510-C538 PolarHBondContact N-SG 3.06Å
511	S	86.6	Confident	87.7	Confident	44 Å²	44	57 Å²	57	31%	0.308	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	130.1	173.9	-173.9	0	0	0	0	111.9	R493 D494 V497	R493-S511 WeakPolarHBondContact CA-O 3.24Å; D494-S511 PolarHBondContact N-O 2.95Å; V497-S511 PolarHBondContact O-N 3.49Å; V497-S511 VanDerWaalsContact O-N 3.12Å
512	G	86.7	Confident	87.4	Confident	21 Å²	21	54.8 Å²	54.8	22%	0.216	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154	161.1	177.9	0	0	0	0	0	113.2	E491	E491-G512 WeakPolarHBondContact O-CA 3.35Å
513	N	86.5	Confident	87.2	Confident	101 Å²	101	55.9 Å²	55.9	54%	0.54	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.8	-178.8	-69.2	-34.6	0	0	0	111.3	V490 E491 V515	V490-N513 CarbonylContact C-O 3.5Å; V490-N513 WeakPolarHBondContact CA-O 3.49Å; E491-N513 PolarHBondContact N-O 2.81Å; E491-N513 PolarHBondContact O-N 3.38Å; N513-V515 PolarHBondContact O-N 2.88Å
514	L	88.5	Confident	86.9	Confident	58 Å²	58	55 Å²	55	30%	0.304	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	115.6	173	-82.7	154.1	0	0	0	110.5	W488 F489 V490 P534 M536	W488-L514 HydrophobicContact CB-CD2 4.23Å; W488-L514 HydrophobicContact CE3-CB 4.17Å; W488-L514 HydrophobicContact CE3-CD2 4.3Å; W488-L514 HydrophobicContact CZ3-CB 4.37Å; F489-L514 CarbonylContact O-C 3.52Å; F489-L514 WeakPolarHBondContact O-CA 3.47Å; V490-L514 HydrophobicContact CG2-CD2 4.39Å; L514-P534 HydrophobicContact CD2-CG 3.9Å; L514-M536 HydrophobicContact CD1-SD 3.55Å; L514-M536 VanDerWaalsContact CD1-SD 3.55Å; L514-M536 HydrophobicContact CG-SD 3.82Å
515	V	89.7	Confident	86.5	Confident	25 Å²	25	56.8 Å²	56.8	15%	0.152	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	136.8	176	-64	0	0	0	0	110.5	F489 E491 N513 M517	F489-V515 HydrophobicContact CB-CG2 4.11Å; F489-V515 PolarHBondContact N-O 3.39Å; F489-V515 PolarHBondContact O-N 3.41Å; E491-V515 HydrophobicContact CB-CG1 4.08Å; E491-V515 HydrophobicContact CB-CG2 4.03Å; N513-V515 PolarHBondContact O-N 2.88Å; V515-M517 HydrophobicContact CG2-CG 4.04Å; V515-M517 HydrophobicContact CG2-SD 4.25Å
516	C	90	Very high	86	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.02	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	121.5	174.4	179.7	0	0	0	0	108.3	W488 V523 C528	W488-C516 HydrophobicContact CE3-CB 4.22Å; W488-C516 HydrophobicContact CZ3-CB 4.09Å; C516-V523 HydrophobicContact CB-CG2 4.29Å; C516-V523 WeakPolarHBondContact O-CG2 3.35Å; C516-V523 PolarHBondContact O-N 2.96Å; C516-V523 VanDerWaalsContact SG-CG2 3.58Å; C516-C528 HydrophobicContact CB-CB 3.78Å; C516-C528 WeakPolarHBondContact CB-SG 3.22Å; C516-C528 WeakPolarHBondContact SG-CB 3.49Å; C516-C528 CovalentContact SG-SG 2.03Å; C516-C528 PolarHBondContact SG-SG 3.15Å
517	M	84.7	Confident	85.4	Confident	40 Å²	40	65.8 Å²	65.8	20%	0.197	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	143.6	-178.9	-53.6	-160.3	-75.5	0	0	112.3	P486 A487 F489 V515 R521 T522	P486-M517 CarbonylContact C-O 3.55Å; P486-M517 VanDerWaalsContact CA-O 3.3Å; P486-M517 WeakPolarHBondContact CA-O 3.49Å; A487-M517 PolarHBondContact N-O 3.14Å; A487-M517 PolarHBondContact O-N 3.5Å; F489-M517 HydrophobicContact CB-CE 3.47Å; F489-M517 VanDerWaalsContact CB-CE 3.47Å; F489-M517 HydrophobicContact CD1-CE 3.79Å; F489-M517 HydrophobicContact CD2-CB 3.66Å; F489-M517 HydrophobicContact CD2-CE 3.39Å; F489-M517 HydrophobicContact CD2-CG 3.86Å; F489-M517 HydrophobicContact CD2-SD 4.48Å; F489-M517 HydrophobicContact CE1-CE 4.36Å; F489-M517 HydrophobicContact CE2-CB 3.8Å; F489-M517 HydrophobicContact CE2-CE 4.02Å; F489-M517 HydrophobicContact CE2-CG 4.48Å; F489-M517 HydrophobicContact CG-CE 3.26Å; F489-M517 HydrophobicContact CZ-CE 4.46Å; V515-M517 HydrophobicContact CG2-CG 4.04Å; V515-M517 HydrophobicContact CG2-SD 4.25Å; M517-R521 CarbonylContact C-O 3.55Å; M517-R521 VanDerWaalsContact CA-O 3.23Å; M517-R521 WeakPolarHBondContact CA-O 3.49Å; M517-T522 HydrophobicContact CG-CG2 3.97Å; M517-T522 HydrophobicContact SD-CG2 3.96Å
518	I	80.8	Confident	85.1	Confident	56 Å²	56	62.3 Å²	62.3	29%	0.287	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	101.8	166.6	-61.9	174.8	0	0	0	107.3	K484 P486 E520 R521 V523	K484-I518 HydrophobicContact CB-CG2 3.89Å; K484-I518 WeakPolarHBondContact O-CG2 3.24Å; P486-I518 HydrophobicContact CB-CD1 4.13Å; P486-I518 HydrophobicContact CB-CG1 3.62Å; P486-I518 HydrophobicContact CG-CD1 4.49Å; P486-I518 HydrophobicContact CG-CG1 4.35Å; I518-E520 PolarHBondContact O-N 2.6Å; I518-R521 PolarHBondContact N-O 2.91Å; I518-R521 PolarHBondContact O-N 3.32Å; I518-V523 HydrophobicContact CB-CG1 4.38Å; I518-V523 HydrophobicContact CD1-CG1 4Å; I518-V523 HydrophobicContact CD1-CG2 4.13Å; I518-V523 HydrophobicContact CG1-CG1 4.1Å; I518-V523 HydrophobicContact CG1-CG2 3.9Å
519	G	77.2	Confident	84.7	Confident	30 Å²	30	67.1 Å²	67.1	31%	0.309	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	-119.4	-170.3	0	0	0	0	0	111.5
520	E	81.2	Confident	84.2	Confident	179 Å²	179	77 Å²	77	84%	0.836	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	1.6	179.4	-69.2	169.8	-170.7	0	0	113.2	I518	I518-E520 PolarHBondContact O-N 2.6Å
521	R	81.3	Confident	83.8	Confident	197 Å²	197	79.9 Å²	79.9	74%	0.743	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.2	-176.7	-65.9	-174.6	-178.4	-167.2	0.1	111	M517 I518	M517-R521 CarbonylContact C-O 3.55Å; M517-R521 VanDerWaalsContact CA-O 3.23Å; M517-R521 WeakPolarHBondContact CA-O 3.49Å; I518-R521 PolarHBondContact N-O 2.91Å; I518-R521 PolarHBondContact O-N 3.32Å
522	T	84	Confident	83.7	Confident	95 Å²	95	85.3 Å²	85.3	58%	0.583	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	134.1	167.3	52.5	0	0	0	0	109.9	M517	M517-T522 HydrophobicContact CG-CG2 3.97Å; M517-T522 HydrophobicContact SD-CG2 3.96Å
523	V	85.5	Confident	83.6	Confident	43 Å²	43	90.7 Å²	90.7	26%	0.261	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	165.3	-179.4	-62.9	0	0	0	0	110.3	C516 I518 Y527	C516-V523 HydrophobicContact CB-CG2 4.29Å; C516-V523 WeakPolarHBondContact O-CG2 3.35Å; C516-V523 PolarHBondContact O-N 2.96Å; C516-V523 VanDerWaalsContact SG-CG2 3.58Å; I518-V523 HydrophobicContact CB-CG1 4.38Å; I518-V523 HydrophobicContact CD1-CG1 4Å; I518-V523 HydrophobicContact CD1-CG2 4.13Å; I518-V523 HydrophobicContact CG1-CG1 4.1Å; I518-V523 HydrophobicContact CG1-CG2 3.9Å; V523-Y527 HydrophobicContact CB-CD2 3.98Å; V523-Y527 HydrophobicContact CB-CE2 4.42Å; V523-Y527 HydrophobicContact CG2-CD2 3.95Å
524	A	84.6	Confident	83.6	Confident	54 Å²	54	88 Å²	88	45%	0.446	44%	0.443	S	S	.	.			trans	-58.3	140.5	179	0	0	0	0	0	112.3	K526 Y527	A524-K526 HydrophobicContact CB-CG 4.04Å; A524-K526 PolarHBondContact O-N 3.35Å; A524-Y527 HydrophobicContact CB-CD2 4.22Å; A524-Y527 HydrophobicContact CB-CE2 4.11Å; A524-Y527 WeakPolarHBondContact O-CD2 3.36Å; A524-Y527 PolarHBondContact O-N 2.95Å; A524-Y527 VanDerWaalsContact O-N 3.14Å
525	T	83.7	Confident	83.4	Confident	82 Å²	82	90.4 Å²	90.4	50%	0.503	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-55.1	-30.5	-176	49	0	0	0	0	114.3	W488 Y527 C528 D529	W488-T525 HydrophobicContact CH2-CG2 3.94Å; W488-T525 HydrophobicContact CZ3-CG2 4.1Å; T525-Y527 PolarHBondContact O-N 3.22Å; T525-C528 PolarHBondContact O-N 2.82Å; T525-D529 PolarHBondContact O-N 3.4Å
526	K	80.2	Confident	83.3	Confident	139 Å²	139	90.1 Å²	90.1	60%	0.604	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-50.3	-26.4	175.8	68.1	178.6	-179.9	-180	0	115.2	A524 C528 D529	A524-K526 HydrophobicContact CB-CG 4.04Å; A524-K526 PolarHBondContact O-N 3.35Å; K526-C528 VanDerWaalsContact C-N 3.32Å; K526-D529 WeakPolarHBondContact CA-OD2 3.28Å
527	Y	79.2	Confident	83.2	Confident	124 Å²	124	93.8 Å²	93.8	49%	0.486	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-78	-16.9	178.4	-61.9	-68.4	0	0	0	113.2	V523 A524 T525	V523-Y527 HydrophobicContact CB-CD2 3.98Å; V523-Y527 HydrophobicContact CB-CE2 4.42Å; V523-Y527 HydrophobicContact CG2-CD2 3.95Å; A524-Y527 HydrophobicContact CB-CD2 4.22Å; A524-Y527 HydrophobicContact CB-CE2 4.11Å; A524-Y527 WeakPolarHBondContact O-CD2 3.36Å; A524-Y527 PolarHBondContact O-N 2.95Å; A524-Y527 VanDerWaalsContact O-N 3.14Å; T525-Y527 PolarHBondContact O-N 3.22Å
528	C	85.2	Confident	83.5	Confident	0 Å²	0	93.1 Å²	93.1	0%	0	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-3.4	-179.9	-60.8	0	0	0	0	114.1	A487 W488 C516 T525 K526 K530 L531	A487-C528 VanDerWaalsContact C-SG 3.58Å; W488-C528 HydrophobicContact CD2-CB 3.68Å; W488-C528 HydrophobicContact CE3-CB 4.28Å; W488-C528 HydrophobicContact CG-CB 4.08Å; W488-C528 HydrophobicContact CH2-CB 4.12Å; W488-C528 HydrophobicContact CZ2-CB 3.49Å; W488-C528 VanDerWaalsContact CZ2-CB 3.49Å; W488-C528 HydrophobicContact CZ3-CB 4.48Å; W488-C528 PolarHBondContact NE1-O 2.8Å; C516-C528 HydrophobicContact CB-CB 3.78Å; C516-C528 WeakPolarHBondContact CB-SG 3.22Å; C516-C528 WeakPolarHBondContact SG-CB 3.49Å; C516-C528 CovalentContact SG-SG 2.03Å; C516-C528 PolarHBondContact SG-SG 3.15Å; T525-C528 PolarHBondContact O-N 2.82Å; K526-C528 VanDerWaalsContact C-N 3.32Å; C528-K530 PolarHBondContact O-N 2.91Å; C528-L531 HydrophobicContact CB-CD1 4.07Å; C528-L531 WeakPolarHBondContact O-CB 3.26Å; C528-L531 PolarHBondContact O-N 3.04Å
529	D	82.3	Confident	83.9	Confident	102 Å²	102	99 Å²	99	55%	0.545	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-29.4	-175.1	-75.2	-13.8	0	0	0	115	T525 K526	T525-D529 PolarHBondContact O-N 3.4Å; K526-D529 WeakPolarHBondContact CA-OD2 3.28Å
530	K	80.7	Confident	84.6	Confident	209 Å²	209	98.3 Å²	98.3	91%	0.909	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	2.7	179	-60.6	-173.1	179.5	-175.4	0	114.2	C528	C528-K530 PolarHBondContact O-N 2.91Å
531	L	81.7	Confident	85.1	Confident	76 Å²	76	94.5 Å²	94.5	40%	0.398	48%	0.475	S	S	.	.	S	Bend	trans	-96.5	150.5	-179.9	-59.6	176.7	0	0	0	110.3	P486 W488 C528 K533	P486-L531 HydrophobicContact CB-CD1 4.45Å; P486-L531 HydrophobicContact CG-CD1 4.4Å; P486-L531 WeakPolarHBondContact O-CD1 3.31Å; W488-L531 PolarHBondContact NE1-O 2.79Å; C528-L531 HydrophobicContact CB-CD1 4.07Å; C528-L531 WeakPolarHBondContact O-CB 3.26Å; C528-L531 PolarHBondContact O-N 3.04Å; L531-K533 PolarHBondContact O-N 3.21Å
532	D	83.5	Confident	85.6	Confident	157 Å²	157	88.8 Å²	88.8	84%	0.84	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-59.4	126.6	177.4	-63.5	-39.8	0	0	0	110.7
533	K	85.1	Confident	86.1	Confident	134 Å²	134	84.2 Å²	84.2	58%	0.583	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-80.1	141.9	175.9	-69.8	178.1	-177.8	175.5	0	109.6	W488 L531	W488-K533 HydrophobicContact CD2-CG 4.37Å; W488-K533 HydrophobicContact CG-CG 4.28Å; L531-K533 PolarHBondContact O-N 3.21Å
534	P	85.7	Confident	86.5	Confident	45 Å²	45	87.7 Å²	87.7	29%	0.292	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-53.3	143.4	172	-24.7	27.6	0	0	0	111.5	W488 V490 L514 M536	W488-P534 HydrophobicContact CB-CG 3.91Å; V490-P534 HydrophobicContact CG2-CB 3.98Å; V490-P534 HydrophobicContact CG2-CG 4.14Å; L514-P534 HydrophobicContact CD2-CG 3.9Å; P534-M536 PolarHBondContact O-N 2.84Å
535	N	85.5	Confident	87	Confident	108 Å²	108	85.8 Å²	85.8	58%	0.578	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-65.1	123.1	172.6	-173.6	13.2	0	0	0	110	E537	N535-E537 WeakPolarHBondContact OD1-CB 3.28Å; N535-E537 VanDerWaalsContact OD1-CG 3.31Å; N535-E537 WeakPolarHBondContact OD1-CG 3.15Å; N535-E537 PolarHBondContact OD1-N 3.12Å
536	M	86.3	Confident	87.5	Confident	19 Å²	19	87.6 Å²	87.6	9%	0.094	43%	0.425	C	S	.	.			trans	-110.5	7.5	176.9	-62.9	-162.8	72.7	0	0	112.9	V490 S509 I510 L514 P534	V490-M536 HydrophobicContact CG1-CE 4.26Å; S509-M536 CarbonylContact C-O 3.26Å; S509-M536 VanDerWaalsContact CA-O 3.3Å; S509-M536 WeakPolarHBondContact CA-O 3.26Å; I510-M536 PolarHBondContact N-O 3.02Å; I510-M536 WeakPolarHBondContact O-CE 3.37Å; L514-M536 HydrophobicContact CD1-SD 3.55Å; L514-M536 VanDerWaalsContact CD1-SD 3.55Å; L514-M536 HydrophobicContact CG-SD 3.82Å; P534-M536 PolarHBondContact O-N 2.84Å
537	E	88.5	Confident	88.2	Confident	81 Å²	81	82.6 Å²	82.6	38%	0.379	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	137.5	179.4	-66.9	176.2	-168.8	0	0	112.2	L503 K507 G508 N535	L503-E537 HydrophobicContact CD1-CG 3.89Å; K507-E537 HydrophobicContact CD-CG 4.34Å; K507-E537 WeakPolarHBondContact CD-OE2 3.37Å; K507-E537 IonicContact NZ-OE2 2.83Å; K507-E537 PolarHBondContact NZ-OE2 2.87Å; G508-E537 WeakPolarHBondContact O-CA 3.25Å; N535-E537 WeakPolarHBondContact OD1-CB 3.28Å; N535-E537 VanDerWaalsContact OD1-CG 3.31Å; N535-E537 WeakPolarHBondContact OD1-CG 3.15Å; N535-E537 PolarHBondContact OD1-N 3.12Å
538	C	91.5	Very high	88.8	Confident	25 Å²	25	80 Å²	80	17%	0.169	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	155.3	165.6	45.9	0	0	0	0	109.9	C498 K507 G508 I510 N540	C498-C538 VanDerWaalsContact CA-SG 3.53Å; C498-C538 HydrophobicContact CB-CB 3.92Å; C498-C538 WeakPolarHBondContact CB-SG 3.33Å; C498-C538 WeakPolarHBondContact SG-CB 3.48Å; C498-C538 CovalentContact SG-SG 2.03Å; C498-C538 PolarHBondContact SG-SG 3.45Å; K507-C538 CarbonylContact C-O 3.43Å; K507-C538 VanDerWaalsContact CA-O 3.23Å; K507-C538 WeakPolarHBondContact CA-O 3.47Å; G508-C538 VanDerWaalsContact C-SG 3.55Å; G508-C538 PolarHBondContact N-O 3.05Å; G508-C538 PolarHBondContact O-N 3.13Å; I510-C538 HydrophobicContact CD1-CB 4.39Å; I510-C538 HydrophobicContact CG1-CB 3.62Å; I510-C538 PolarHBondContact N-SG 3.06Å; C538-N540 PolarHBondContact O-N 2.8Å
539	E	90	Very high	89.2	Confident	180 Å²	180	82.4 Å²	82.4	84%	0.841	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	123.4	174.9	-69.2	174.7	-168.1	0	0	109.9	G506	G506-E539 CarbonylContact O-C 3.48Å; G506-E539 WeakPolarHBondContact O-CA 3.34Å
540	N	91.9	Very high	89.6	Confident	15 Å²	15	79.5 Å²	79.5	8%	0.08	40%	0.398	C	S	.	.			trans	-139.2	104.5	176.7	-164.4	-14.1	0	0	0	110.9	T499 G506 C538 I542 C543	T499-N540 PolarHBondContact O-ND2 2.79Å; G506-N540 CarbonylContact C-O 3.58Å; G506-N540 VanDerWaalsContact C-O 3.26Å; G506-N540 WeakPolarHBondContact CA-O 3.16Å; G506-N540 PolarHBondContact O-N 3.34Å; C538-N540 PolarHBondContact O-N 2.8Å; N540-I542 WeakPolarHBondContact ND2-CD1 3.42Å; N540-I542 PolarHBondContact O-N 3.3Å; N540-I542 VanDerWaalsContact OD1-CG1 3.23Å; N540-I542 WeakPolarHBondContact OD1-CG1 3.48Å; N540-I542 PolarHBondContact OD1-N 2.8Å; N540-C543 WeakPolarHBondContact O-CB 3.37Å; N540-C543 PolarHBondContact O-N 2.81Å
541	P	91.1	Very high	90.3	Very high	100 Å²	100	76.7 Å²	76.7	65%	0.649	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-15.5	-174.1	27.7	-34.9	0	0	0	114.1	C543 Q544	P541-C543 PolarHBondContact O-N 3.38Å; P541-Q544 WeakPolarHBondContact O-CG 3.41Å; P541-Q544 PolarHBondContact O-NE2 2.61Å
542	I	92.3	Very high	90.9	Very high	76 Å²	76	76.4 Å²	76.4	39%	0.39	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-18.3	176.1	80.6	-167.7	0	0	0	112.2	D500 N540 Q544 H575	D500-I542 HydrophobicContact CB-CD1 3.93Å; N540-I542 WeakPolarHBondContact ND2-CD1 3.42Å; N540-I542 PolarHBondContact O-N 3.3Å; N540-I542 VanDerWaalsContact OD1-CG1 3.23Å; N540-I542 WeakPolarHBondContact OD1-CG1 3.48Å; N540-I542 PolarHBondContact OD1-N 2.8Å; I542-Q544 PolarHBondContact O-N 3.37Å; I542-H575 PolarHBondContact O-ND1 3.34Å
543	C	93.8	Very high	91.4	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	36%	0.364	C	S	.	.			trans	-77.6	65.5	-179.5	-64.9	0	0	0	0	111	C502 V505 G506 N540 P541 W573	C502-C543 WeakPolarHBondContact CA-SG 3.3Å; C502-C543 HydrophobicContact CB-CB 3.62Å; C502-C543 WeakPolarHBondContact CB-SG 3.39Å; C502-C543 WeakPolarHBondContact SG-CA 3.43Å; C502-C543 WeakPolarHBondContact SG-CB 3.25Å; C502-C543 CovalentContact SG-SG 2.03Å; C502-C543 PolarHBondContact SG-SG 2.85Å; V505-C543 CarbonylContact C-O 3.54Å; V505-C543 VanDerWaalsContact CA-O 3.29Å; V505-C543 WeakPolarHBondContact CA-O 3.39Å; G506-C543 PolarHBondContact N-O 2.84Å; N540-C543 WeakPolarHBondContact O-CB 3.37Å; N540-C543 PolarHBondContact O-N 2.81Å; P541-C543 PolarHBondContact O-N 3.38Å; C543-W573 HydrophobicContact CB-CZ3 3.97Å
544	Q	94.1	Very high	91.7	Very high	116 Å²	116	73.5 Å²	73.5	54%	0.542	38%	0.376	S	S	.	.			trans	-109.1	143.4	174.3	-64.2	-178.8	14.9	0	0	110.1	P541 I542 S574	P541-Q544 WeakPolarHBondContact O-CG 3.41Å; P541-Q544 PolarHBondContact O-NE2 2.61Å; I542-Q544 PolarHBondContact O-N 3.37Å; Q544-S574 WeakPolarHBondContact O-CB 3.4Å; Q544-S574 PolarHBondContact O-N 2.88Å; Q544-S574 PolarHBondContact O-OG 2.93Å
545	V	94.4	Very high	92.1	Very high	14 Å²	14	72.8 Å²	72.8	9%	0.085	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	150.7	179.4	-64	0	0	0	0	111.3	V505 T572 W573 A580 L583 L589	V505-V545 HydrophobicContact CG2-CG1 4.09Å; V505-V545 HydrophobicContact CG2-CG2 3.81Å; V545-T572 CarbonylContact C-O 3.56Å; V545-T572 WeakPolarHBondContact CA-O 3.33Å; V545-W573 HydrophobicContact CG1-CD2 4.22Å; V545-W573 HydrophobicContact CG1-CE3 3.58Å; V545-W573 HydrophobicContact CG1-CH2 4.15Å; V545-W573 HydrophobicContact CG1-CZ3 3.54Å; V545-A580 HydrophobicContact CG1-CB 3.65Å; V545-L583 HydrophobicContact CG1-CB 4.02Å; V545-L583 HydrophobicContact CG1-CD1 4.36Å; V545-L589 HydrophobicContact CG2-CD1 4Å; V545-L589 HydrophobicContact CG2-CD2 3.89Å; V545-L589 WeakPolarHBondContact O-CD2 3.46Å
546	R	94.7	Very high	92.4	Very high	120 Å²	120	71.3 Å²	71.3	45%	0.453	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	151.5	175.3	66.4	-179.3	-175.8	133	-2	111.3	N548 T572	R546-N548 PolarHBondContact O-N 3.18Å; R546-T572 PolarHBondContact N-O 3.08Å; R546-T572 PolarHBondContact O-N 3.47Å; R546-T572 PolarHBondContact O-OG1 2.86Å
547	W	94.4	Very high	92.3	Very high	34 Å²	34	76.9 Å²	76.9	13%	0.129	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	115.3	169.2	-67.8	120.9	0	0	0	110.2	L569 C571 C584 Y585 L589 A590 I591 P592	W547-L569 HydrophobicContact CB-CD1 4.4Å; W547-L569 HydrophobicContact CD2-CD2 3.57Å; W547-L569 HydrophobicContact CD2-CG 4.14Å; W547-L569 HydrophobicContact CE3-CD2 3.14Å; W547-L569 HydrophobicContact CE3-CG 3.7Å; W547-L569 HydrophobicContact CG-CD2 4.33Å; W547-L569 HydrophobicContact CH2-CD2 3.76Å; W547-L569 HydrophobicContact CZ2-CD2 4.13Å; W547-L569 HydrophobicContact CZ3-CD2 3.25Å; W547-L569 HydrophobicContact CZ3-CG 4.2Å; W547-C571 HydrophobicContact CE3-CB 4.06Å; W547-C571 HydrophobicContact CH2-CB 4.33Å; W547-C571 HydrophobicContact CZ3-CB 3.65Å; W547-C584 HydrophobicContact CD2-CB 3.93Å; W547-C584 VanDerWaalsContact CE2-CB 3.49Å; W547-C584 HydrophobicContact CE3-CB 4.06Å; W547-C584 HydrophobicContact CH2-CB 3.42Å; W547-C584 VanDerWaalsContact CH2-CB 3.42Å; W547-C584 HydrophobicContact CZ2-CB 3.24Å; W547-C584 HydrophobicContact CZ3-CB 3.82Å; W547-Y585 HydrophobicContact CH2-CD1 4.19Å; W547-Y585 AromaticContact CH2-CD2 3.92Å; W547-Y585 HydrophobicContact CH2-CD2 3.92Å; W547-Y585 AromaticContact CH2-CE1 3.87Å; W547-Y585 HydrophobicContact CH2-CE1 3.87Å; W547-Y585 AromaticContact CH2-CE2 3.58Å; W547-Y585 HydrophobicContact CH2-CE2 3.58Å; W547-Y585 HydrophobicContact CH2-CG 4.21Å; W547-Y585 AromaticContact CH2-CZ 3.55Å; W547-Y585 HydrophobicContact CZ2-CD1 4.22Å; W547-Y585 HydrophobicContact CZ2-CE1 4.09Å; W547-Y585 HydrophobicContact CZ2-CG 4.48Å; W547-Y585 HydrophobicContact CZ3-CE2 4.38Å; W547-L589 PolarHBondContact NE1-O 2.92Å; W547-A590 PolarHBondContact NE1-O 2.88Å; W547-I591 HydrophobicContact CZ2-CG1 4.15Å; W547-P592 HydrophobicContact CB-CG 3.93Å; W547-P592 VanDerWaalsContact CD1-CD 3.5Å; W547-P592 HydrophobicContact CG-CG 4.26Å
548	N	92.9	Very high	92.2	Very high	69 Å²	69	78.4 Å²	78.4	37%	0.369	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	126.8	167.9	-166.4	17	0	0	0	109.2	R546 L570 T572	R546-N548 PolarHBondContact O-N 3.18Å; N548-L570 PolarHBondContact N-O 3.42Å; N548-L570 PolarHBondContact O-N 2.89Å; N548-T572 HydrophobicContact CB-CG2 3.98Å
549	V	92.4	Very high	91.9	Very high	51 Å²	51	79.4 Å²	79.4	31%	0.309	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.6	-174.5	-63.3	0	0	0	0	110.9	H568 L569 P592	V549-H568 WeakPolarHBondContact CA-O 3.35Å; V549-L569 HydrophobicContact CG1-CD1 3.58Å; V549-L569 HydrophobicContact CG1-CG 4.36Å; V549-P592 HydrophobicContact CG1-CB 4.08Å; V549-P592 HydrophobicContact CG1-CG 4.11Å
550	S	92.2	Very high	91.3	Very high	40 Å²	40	72.7 Å²	72.7	28%	0.28	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-74.9	169.9	174.2	79.9	0	0	0	0	111.7	H568	S550-H568 PolarHBondContact N-O 2.68Å; S550-H568 PolarHBondContact OG-N 2.86Å
551	N	94	Very high	90.9	Very high	151 Å²	151	73.4 Å²	73.4	81%	0.807	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-58	150.2	163.5	-67.5	-22.1	0	0	0	110.5
552	W	94.7	Very high	90.8	Very high	69 Å²	69	72.6 Å²	72.6	26%	0.261	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-63.4	140.5	171.2	-70.1	105.9	0	0	0	110.7	Q565 R567 D593 V594 R596	W552-Q565 HydrophobicContact CB-CB 4.23Å; W552-Q565 HydrophobicContact CD2-CB 4.44Å; W552-Q565 HydrophobicContact CE3-CB 3.87Å; W552-Q565 VanDerWaalsContact CZ3-O 3.3Å; W552-Q565 WeakPolarHBondContact CZ3-O 2.99Å; W552-R567 HydrophobicContact CD2-CB 4.24Å; W552-R567 HydrophobicContact CD2-CG 4.21Å; W552-R567 HydrophobicContact CE3-CB 3.94Å; W552-R567 HydrophobicContact CE3-CG 3.9Å; W552-R567 HydrophobicContact CH2-CG 3.97Å; W552-R567 HydrophobicContact CZ2-CG 4.27Å; W552-R567 HydrophobicContact CZ3-CB 4.28Å; W552-R567 HydrophobicContact CZ3-CG 3.78Å; W552-D593 HydrophobicContact CH2-CB 4.47Å; W552-D593 WeakPolarHBondContact CH2-O 3.43Å; W552-V594 WeakPolarHBondContact CZ3-O 3.05Å; W552-R596 HydrophobicContact CH2-CB 3.8Å; W552-R596 HydrophobicContact CZ2-CB 4.2Å; W552-R596 HydrophobicContact CZ3-CB 4.04Å
553	S	93.3	Very high	90.6	Very high	52 Å²	52	69.1 Å²	69.1	36%	0.364	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-62.4	163.5	171.1	74.5	0	0	0	0	110.6	Q565 A566	S553-Q565 WeakPolarHBondContact O-CG 3.31Å; S553-Q565 PolarHBondContact O-NE2 3.13Å; S553-A566 VanDerWaalsContact CB-O 3.28Å; S553-A566 WeakPolarHBondContact CB-O 3.38Å; S553-A566 PolarHBondContact N-O 3.3Å; S553-A566 PolarHBondContact OG-N 3.02Å; S553-A566 PolarHBondContact OG-O 3.1Å
554	Q	92.3	Very high	90.7	Very high	178 Å²	178	72.6 Å²	72.6	83%	0.832	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-57.5	152.8	163.5	-61.5	-178.4	32.1	0	0	109.8	S556	Q554-S556 PolarHBondContact O-N 3.09Å
555	C	93.2	Very high	90.7	Very high	31 Å²	31	68.8 Å²	68.8	21%	0.209	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-60.8	136.5	178.1	-166.4	0	0	0	0	109.6	R557 Q565 C598 V600	C555-R557 PolarHBondContact O-N 3.35Å; C555-Q565 HydrophobicContact CB-CG 4.46Å; C555-C598 VanDerWaalsContact CA-SG 3.51Å; C555-C598 HydrophobicContact CB-CB 3.95Å; C555-C598 WeakPolarHBondContact CB-SG 3.46Å; C555-C598 WeakPolarHBondContact SG-CB 3.44Å; C555-C598 CovalentContact SG-SG 2.03Å; C555-C598 PolarHBondContact SG-SG 3.41Å; C555-V600 HydrophobicContact CB-CG1 4.06Å
556	S	91.9	Very high	90.6	Very high	77 Å²	77	70.3 Å²	70.3	54%	0.538	40%	0.4	S	S	.	.	S	Bend	trans	-61.2	-15.7	-178.7	70.1	0	0	0	0	113.8	Q554 V564	Q554-S556 PolarHBondContact O-N 3.09Å; S556-V564 WeakPolarHBondContact CB-O 3.06Å; S556-V564 PolarHBondContact N-O 3.14Å; S556-V564 PolarHBondContact OG-N 3.01Å
557	R	85.1	Confident	90.6	Very high	136 Å²	136	66.7 Å²	66.7	51%	0.513	39%	0.386	S	S	.	.			trans	-122.2	139.2	176.3	-60.8	-174.5	-175.3	-174.8	2.4	108.5	C555 V562 V600	C555-R557 PolarHBondContact O-N 3.35Å; R557-V562 WeakPolarHBondContact CD-O 3.5Å; R557-V562 PolarHBondContact NE-O 2.88Å; R557-V562 PolarHBondContact NH1-O 3.48Å; R557-V600 HydrophobicContact CB-CG2 3.79Å; R557-V600 VanDerWaalsContact O-CG1 3.24Å; R557-V600 WeakPolarHBondContact O-CG1 3.43Å
558	S	86.3	Confident	90.4	Very high	113 Å²	113	71.8 Å²	71.8	79%	0.79	41%	0.411	S	S	*	.	S	Bend	trans	-92.4	-23.1	173.6	53	0	0	0	0	112.9
559	C	84.1	Confident	90.4	Very high	46 Å²	46	70.2 Å²	70.2	31%	0.311	40%	0.402	S	S	.	.	S	Bend	trans	-153.2	166.5	170.3	67.1	0	0	0	0	110.4	P601 C603	C559-P601 CarbonylContact C-O 3.59Å; C559-P601 WeakPolarHBondContact CA-O 3.36Å; C559-P601 VanDerWaalsContact CB-O 3.23Å; C559-P601 WeakPolarHBondContact CB-O 3.48Å; C559-C603 HydrophobicContact CB-CB 3.95Å; C559-C603 WeakPolarHBondContact CB-SG 3.34Å; C559-C603 WeakPolarHBondContact SG-CB 3.1Å; C559-C603 CovalentContact SG-SG 2.05Å; C559-C603 PolarHBondContact SG-SG 3.01Å
560	G	78.6	Confident	90.5	Very high	38 Å²	38	71.8 Å²	71.8	39%	0.392	41%	0.409	S	S	.	.	S	Bend	trans	96.2	35.3	172.7	0	0	0	0	0	115.8	P601	G560-P601 PolarHBondContact N-O 3.39Å
561	G	82.3	Confident	90.6	Very high	31 Å²	31	70.2 Å²	70.2	32%	0.32	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	95.7	-136.7	170.9	0	0	0	0	0	114.4	V600	G561-V600 PolarHBondContact N-O 2.62Å; G561-V600 WeakPolarHBondContact O-CG2 3.39Å; G561-V600 PolarHBondContact O-N 3.01Å
562	V	88.9	Confident	90.7	Very high	83 Å²	83	63.2 Å²	63.2	50%	0.503	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	125.8	-171.5	-172.2	0	0	0	0	111.8	R557 C598	R557-V562 WeakPolarHBondContact CD-O 3.5Å; R557-V562 PolarHBondContact NE-O 2.88Å; R557-V562 PolarHBondContact NH1-O 3.48Å; V562-C598 CarbonylContact C-O 3.38Å; V562-C598 WeakPolarHBondContact CA-O 3.49Å
563	G	90	Very high	90.6	Very high	2 Å²	2	60.9 Å²	60.9	2%	0.021	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	-171	168.1	0	0	0	0	0	112.1	S597 C598	G563-S597 WeakPolarHBondContact O-CA 3.42Å; G563-C598 PolarHBondContact N-O 3.39Å; G563-C598 PolarHBondContact O-N 3.4Å; G563-C598 PolarHBondContact O-SG 2.71Å
564	V	94.3	Very high	90.5	Very high	74 Å²	74	60.7 Å²	60.7	45%	0.448	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	146.5	177.1	-64.6	0	0	0	0	112.1	S556 I595 R596 C598	S556-V564 WeakPolarHBondContact CB-O 3.06Å; S556-V564 PolarHBondContact N-O 3.14Å; S556-V564 PolarHBondContact OG-N 3.01Å; V564-I595 HydrophobicContact CB-CG2 4.28Å; V564-I595 HydrophobicContact CG1-CG2 4.43Å; V564-R596 CarbonylContact C-O 3.52Å; V564-R596 WeakPolarHBondContact CA-O 3.31Å; V564-C598 VanDerWaalsContact C-SG 3.56Å; V564-C598 PolarHBondContact N-SG 2.82Å; V564-C598 VanDerWaalsContact N-SG 3.4Å
565	Q	93.8	Very high	90.4	Very high	36 Å²	36	55.6 Å²	55.6	17%	0.168	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.9	168.7	-56.9	-177.4	-73.4	0	0	108.5	W552 S553 C555 I595 R596 C598	W552-Q565 HydrophobicContact CB-CB 4.23Å; W552-Q565 HydrophobicContact CD2-CB 4.44Å; W552-Q565 HydrophobicContact CE3-CB 3.87Å; W552-Q565 VanDerWaalsContact CZ3-O 3.3Å; W552-Q565 WeakPolarHBondContact CZ3-O 2.99Å; S553-Q565 WeakPolarHBondContact O-CG 3.31Å; S553-Q565 PolarHBondContact O-NE2 3.13Å; C555-Q565 HydrophobicContact CB-CG 4.46Å; Q565-I595 WeakPolarHBondContact O-CA 3.18Å; Q565-R596 PolarHBondContact N-O 3.09Å; Q565-R596 PolarHBondContact O-N 3.47Å; Q565-C598 HydrophobicContact CG-CB 3.88Å; Q565-C598 VanDerWaalsContact CG-SG 3.57Å
566	A	93.6	Very high	90.3	Very high	46 Å²	46	57.6 Å²	57.6	38%	0.38	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	152.7	176	0	0	0	0	0	110.4	S553 V594	S553-A566 VanDerWaalsContact CB-O 3.28Å; S553-A566 WeakPolarHBondContact CB-O 3.38Å; S553-A566 PolarHBondContact N-O 3.3Å; S553-A566 PolarHBondContact OG-N 3.02Å; S553-A566 PolarHBondContact OG-O 3.1Å; A566-V594 CarbonylContact C-O 3.55Å; A566-V594 VanDerWaalsContact CA-O 3.3Å; A566-V594 WeakPolarHBondContact CA-O 3.22Å
567	R	94.5	Very high	90.2	Very high	44 Å²	44	55.4 Å²	55.4	17%	0.166	32%	0.324	C	S	.	.			trans	-134.2	158.7	171.3	62.6	-179.5	178.5	177.6	-4.2	110.7	W552 D593 V594	W552-R567 HydrophobicContact CD2-CB 4.24Å; W552-R567 HydrophobicContact CD2-CG 4.21Å; W552-R567 HydrophobicContact CE3-CB 3.94Å; W552-R567 HydrophobicContact CE3-CG 3.9Å; W552-R567 HydrophobicContact CH2-CG 3.97Å; W552-R567 HydrophobicContact CZ2-CG 4.27Å; W552-R567 HydrophobicContact CZ3-CB 4.28Å; W552-R567 HydrophobicContact CZ3-CG 3.78Å; R567-D593 PolarHBondContact NE-O 2.99Å; R567-D593 PolarHBondContact NH2-O 2.89Å; R567-V594 PolarHBondContact N-O 2.03Å; R567-V594 WeakPolarHBondContact O-CG1 3.19Å
568	H	90.9	Very high	90.5	Very high	141 Å²	141	54.9 Å²	54.9	65%	0.653	33%	0.328	S	S	*	.			trans	-87.9	145.8	176	-60.6	-87.8	0	0	0	110.6	V549 S550	V549-H568 WeakPolarHBondContact CA-O 3.35Å; S550-H568 PolarHBondContact N-O 2.68Å; S550-H568 PolarHBondContact OG-N 2.86Å
569	L	92.3	Very high	90.8	Very high	35 Å²	35	55.4 Å²	55.4	18%	0.183	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	119.4	-178.6	-166.8	114.7	0	0	0	108.8	W547 V549 I591 P592 V594	W547-L569 HydrophobicContact CB-CD1 4.4Å; W547-L569 HydrophobicContact CD2-CD2 3.57Å; W547-L569 HydrophobicContact CD2-CG 4.14Å; W547-L569 HydrophobicContact CE3-CD2 3.14Å; W547-L569 HydrophobicContact CE3-CG 3.7Å; W547-L569 HydrophobicContact CG-CD2 4.33Å; W547-L569 HydrophobicContact CH2-CD2 3.76Å; W547-L569 HydrophobicContact CZ2-CD2 4.13Å; W547-L569 HydrophobicContact CZ3-CD2 3.25Å; W547-L569 HydrophobicContact CZ3-CG 4.2Å; V549-L569 HydrophobicContact CG1-CD1 3.58Å; V549-L569 HydrophobicContact CG1-CG 4.36Å; L569-I591 HydrophobicContact CD2-CG2 4.12Å; L569-P592 HydrophobicContact CD1-CB 3.81Å; L569-P592 HydrophobicContact CD1-CG 3.76Å; L569-V594 HydrophobicContact CB-CG2 4.41Å; L569-V594 HydrophobicContact CD1-CG2 4.42Å
570	L	94.2	Very high	91.2	Very high	84 Å²	84	53.6 Å²	53.6	44%	0.44	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.3	-176.4	-69.2	139.9	0	0	0	109.1	N548 T572 L579	N548-L570 PolarHBondContact N-O 3.42Å; N548-L570 PolarHBondContact O-N 2.89Å; L570-T572 HydrophobicContact CB-CG2 4.27Å; L570-T572 PolarHBondContact O-N 3.36Å; L570-L579 HydrophobicContact CB-CD2 4.31Å; L570-L579 HydrophobicContact CD2-CD2 3.65Å
571	C	95	Very high	91.8	Very high	8 Å²	8	54.5 Å²	54.5	5%	0.054	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	118.7	171.3	-176.4	0	0	0	0	108.7	W547 A580 G581 C584	W547-C571 HydrophobicContact CE3-CB 4.06Å; W547-C571 HydrophobicContact CH2-CB 4.33Å; W547-C571 HydrophobicContact CZ3-CB 3.65Å; C571-A580 PolarHBondContact O-N 3.3Å; C571-G581 WeakPolarHBondContact CB-O 3.24Å; C571-C584 VanDerWaalsContact CA-SG 3.51Å; C571-C584 HydrophobicContact CB-CB 3.73Å; C571-C584 WeakPolarHBondContact CB-SG 3.46Å; C571-C584 WeakPolarHBondContact SG-CB 3.37Å; C571-C584 PolarHBondContact SG-N 2.81Å; C571-C584 CovalentContact SG-SG 2.03Å; C571-C584 PolarHBondContact SG-SG 2.57Å
572	T	94.6	Very high	92.3	Very high	4 Å²	4	57 Å²	57	3%	0.025	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152.8	-176.3	58.3	0	0	0	0	111.5	V545 R546 N548 L570 G577 E578 L579	V545-T572 CarbonylContact C-O 3.56Å; V545-T572 WeakPolarHBondContact CA-O 3.33Å; R546-T572 PolarHBondContact N-O 3.08Å; R546-T572 PolarHBondContact O-N 3.47Å; R546-T572 PolarHBondContact O-OG1 2.86Å; N548-T572 HydrophobicContact CB-CG2 3.98Å; L570-T572 HydrophobicContact CB-CG2 4.27Å; L570-T572 PolarHBondContact O-N 3.36Å; T572-G577 WeakPolarHBondContact CG2-O 3.01Å; T572-E578 CarbonylContact C-O 3.53Å; T572-E578 WeakPolarHBondContact CA-O 3.29Å; T572-E578 WeakPolarHBondContact CB-O 3.48Å; T572-L579 HydrophobicContact CG2-CD2 4.48Å
573	W	93.8	Very high	92.5	Very high	20 Å²	20	54.3 Å²	54.3	8%	0.076	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	137.2	168.3	-65.7	112.1	0	0	0	110.3	C502 C543 V545 H575 N576 G577 E578 A580 L583	C502-W573 HydrophobicContact CB-CD2 3.98Å; C502-W573 HydrophobicContact CB-CE3 3.91Å; C502-W573 HydrophobicContact CB-CH2 3.31Å; C502-W573 HydrophobicContact CB-CZ2 3.37Å; C502-W573 HydrophobicContact CB-CZ3 3.59Å; C543-W573 HydrophobicContact CB-CZ3 3.97Å; V545-W573 HydrophobicContact CG1-CD2 4.22Å; V545-W573 HydrophobicContact CG1-CE3 3.58Å; V545-W573 HydrophobicContact CG1-CH2 4.15Å; V545-W573 HydrophobicContact CG1-CZ3 3.54Å; W573-H575 VanDerWaalsContact C-N 3.32Å; W573-H575 AromaticContact CG-CE1 3.99Å; W573-H575 PolarHBondContact O-N 3.03Å; W573-N576 WeakPolarHBondContact CB-OD1 3.4Å; W573-G577 VanDerWaalsContact O-CA 3.24Å; W573-G577 WeakPolarHBondContact O-CA 3.36Å; W573-G577 PolarHBondContact O-N 3.41Å; W573-E578 PolarHBondContact N-O 2.01Å; W573-A580 HydrophobicContact CD2-CB 3.83Å; W573-A580 HydrophobicContact CE3-CB 4.46Å; W573-A580 HydrophobicContact CG-CB 4.01Å; W573-A580 HydrophobicContact CZ2-CB 4.16Å; W573-L583 HydrophobicContact CH2-CD1 3.27Å; W573-L583 HydrophobicContact CZ2-CD1 3.4Å; W573-L583 HydrophobicContact CZ3-CD1 4.23Å
574	S	91.7	Very high	92.6	Very high	47 Å²	47	54.2 Å²	54.2	33%	0.329	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-29.8	-175.4	-59.8	0	0	0	0	112.7	Q544	Q544-S574 WeakPolarHBondContact O-CB 3.4Å; Q544-S574 PolarHBondContact O-N 2.88Å; Q544-S574 PolarHBondContact O-OG 2.93Å
575	H	90.2	Very high	92.5	Very high	72 Å²	72	57.2 Å²	57.2	33%	0.333	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-39.7	-175.2	69	-87.9	0	0	0	113.4	I542 W573	I542-H575 PolarHBondContact O-ND1 3.34Å; W573-H575 VanDerWaalsContact C-N 3.32Å; W573-H575 AromaticContact CG-CE1 3.99Å; W573-H575 PolarHBondContact O-N 3.03Å
576	N	90.7	Very high	92.4	Very high	73 Å²	73	59 Å²	59	39%	0.39	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-12.8	-176.2	68	2.7	0	0	0	114.6	W573 E578	W573-N576 WeakPolarHBondContact CB-OD1 3.4Å; N576-E578 VanDerWaalsContact C-N 3.3Å; N576-E578 HydrophobicContact CB-CG 4.5Å; N576-E578 WeakPolarHBondContact ND2-CG 3.28Å; N576-E578 PolarHBondContact ND2-OE2 3.15Å; N576-E578 PolarHBondContact O-N 2.99Å; N576-E578 WeakPolarHBondContact OD1-CB 3.37Å; N576-E578 PolarHBondContact OD1-N 3.13Å
577	G	89.4	Confident	92.4	Very high	31 Å²	31	60.7 Å²	60.7	32%	0.32	33%	0.333	S	S	.	.			trans	77.7	6.1	-177.2	0	0	0	0	0	115.4	T572 W573	T572-G577 WeakPolarHBondContact CG2-O 3.01Å; W573-G577 VanDerWaalsContact O-CA 3.24Å; W573-G577 WeakPolarHBondContact O-CA 3.36Å; W573-G577 PolarHBondContact O-N 3.41Å
578	E	91.7	Very high	92.2	Very high	125 Å²	125	66.9 Å²	66.9	58%	0.584	36%	0.364	S	S	*	.			trans	-70.9	159.7	176.2	-69.1	-177.6	164.9	0	0	112.2	T572 W573 N576 A580	T572-E578 CarbonylContact C-O 3.53Å; T572-E578 WeakPolarHBondContact CA-O 3.29Å; T572-E578 WeakPolarHBondContact CB-O 3.48Å; W573-E578 PolarHBondContact N-O 2.01Å; N576-E578 VanDerWaalsContact C-N 3.3Å; N576-E578 HydrophobicContact CB-CG 4.5Å; N576-E578 WeakPolarHBondContact ND2-CG 3.28Å; N576-E578 PolarHBondContact ND2-OE2 3.15Å; N576-E578 PolarHBondContact O-N 2.99Å; N576-E578 WeakPolarHBondContact OD1-CB 3.37Å; N576-E578 PolarHBondContact OD1-N 3.13Å; E578-A580 PolarHBondContact O-N 3Å
579	L	93.2	Very high	92.2	Very high	124 Å²	124	62.7 Å²	62.7	65%	0.649	35%	0.346	S	S	*	.	B	Isolated β-bridge	trans	-67.1	123.3	-178.5	-64.6	172.3	0	0	0	111.6	L570 T572	L570-L579 HydrophobicContact CB-CD2 4.31Å; L570-L579 HydrophobicContact CD2-CD2 3.65Å; T572-L579 HydrophobicContact CG2-CD2 4.48Å
580	A	92.3	Very high	92.1	Very high	7 Å²	7	65.5 Å²	65.5	6%	0.058	37%	0.374	C	S	.	.			trans	-97.2	19.3	178.5	0	0	0	0	0	113	V545 C571 W573 E578 S582 L583	V545-A580 HydrophobicContact CG1-CB 3.65Å; C571-A580 PolarHBondContact O-N 3.3Å; W573-A580 HydrophobicContact CD2-CB 3.83Å; W573-A580 HydrophobicContact CE3-CB 4.46Å; W573-A580 HydrophobicContact CG-CB 4.01Å; W573-A580 HydrophobicContact CZ2-CB 4.16Å; E578-A580 PolarHBondContact O-N 3Å; A580-S582 PolarHBondContact O-N 3.43Å; A580-L583 HydrophobicContact CB-CD1 4.36Å; A580-L583 WeakPolarHBondContact O-CB 3.33Å; A580-L583 VanDerWaalsContact O-CG 3.31Å; A580-L583 WeakPolarHBondContact O-CG 3.35Å; A580-L583 PolarHBondContact O-N 3.42Å
581	G	90.4	Very high	92	Very high	58 Å²	58	66.2 Å²	66.2	60%	0.598	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	-126.7	178.8	0	0	0	0	0	113.1	C571	C571-G581 WeakPolarHBondContact CB-O 3.24Å
582	S	92.1	Very high	91.8	Very high	83 Å²	83	67.8 Å²	67.8	58%	0.58	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	7.4	-178.5	54.2	0	0	0	0	114.3	A580 C584 Y585 S586	A580-S582 PolarHBondContact O-N 3.43Å; S582-C584 VanDerWaalsContact C-N 3.29Å; S582-C584 PolarHBondContact O-N 3.33Å; S582-Y585 WeakPolarHBondContact O-CB 3.39Å; S582-Y585 PolarHBondContact O-N 3.22Å; S582-S586 PolarHBondContact O-N 3.48Å; S582-S586 VanDerWaalsContact O-N 3.13Å
583	L	92.8	Very high	91.7	Very high	27 Å²	27	73.2 Å²	73.2	14%	0.141	42%	0.417	C	S	.	.	H	α-helix	trans	-62.2	-32.4	-171.2	-71.7	174.2	0	0	0	114	D504 V545 W573 A580 Y585 S586 H587	D504-L583 WeakPolarHBondContact OD1-CD2 3.27Å; V545-L583 HydrophobicContact CG1-CB 4.02Å; V545-L583 HydrophobicContact CG1-CD1 4.36Å; W573-L583 HydrophobicContact CH2-CD1 3.27Å; W573-L583 HydrophobicContact CZ2-CD1 3.4Å; W573-L583 HydrophobicContact CZ3-CD1 4.23Å; A580-L583 HydrophobicContact CB-CD1 4.36Å; A580-L583 WeakPolarHBondContact O-CB 3.33Å; A580-L583 VanDerWaalsContact O-CG 3.31Å; A580-L583 WeakPolarHBondContact O-CG 3.35Å; A580-L583 PolarHBondContact O-N 3.42Å; L583-Y585 PolarHBondContact O-N 3.34Å; L583-S586 WeakPolarHBondContact CA-OG 3.03Å; L583-S586 PolarHBondContact O-N 2.84Å; L583-S586 PolarHBondContact O-OG 2.7Å; L583-S586 VanDerWaalsContact O-OG 3.04Å; L583-H587 WeakPolarHBondContact O-CB 3.05Å; L583-H587 PolarHBondContact O-CD2 2.73Å; L583-H587 PolarHBondContact O-N 3.21Å
584	C	93.4	Very high	91.7	Very high	0 Å²	0	75.2 Å²	75.2	0%	0	43%	0.431	C	S	.	.	H	α-helix	trans	-64.7	-30.9	176.5	-61.2	0	0	0	0	112.3	W547 C571 S582 Q588 L589	W547-C584 HydrophobicContact CD2-CB 3.93Å; W547-C584 VanDerWaalsContact CE2-CB 3.49Å; W547-C584 HydrophobicContact CE3-CB 4.06Å; W547-C584 HydrophobicContact CH2-CB 3.42Å; W547-C584 VanDerWaalsContact CH2-CB 3.42Å; W547-C584 HydrophobicContact CZ2-CB 3.24Å; W547-C584 HydrophobicContact CZ3-CB 3.82Å; C571-C584 VanDerWaalsContact CA-SG 3.51Å; C571-C584 HydrophobicContact CB-CB 3.73Å; C571-C584 WeakPolarHBondContact CB-SG 3.46Å; C571-C584 WeakPolarHBondContact SG-CB 3.37Å; C571-C584 PolarHBondContact SG-N 2.81Å; C571-C584 CovalentContact SG-SG 2.03Å; C571-C584 PolarHBondContact SG-SG 2.57Å; S582-C584 VanDerWaalsContact C-N 3.29Å; S582-C584 PolarHBondContact O-N 3.33Å; C584-Q588 PolarHBondContact O-N 3.34Å; C584-L589 PolarHBondContact O-N 2.99Å
585	Y	92.2	Very high	91.8	Very high	137 Å²	137	78.5 Å²	78.5	54%	0.537	44%	0.444	S	S	.	.	H	α-helix	trans	-78.8	-43	174.6	-66.2	-71	0	0	0	111.8	W547 S582 L583 H587 Q588 I591	W547-Y585 HydrophobicContact CH2-CD1 4.19Å; W547-Y585 AromaticContact CH2-CD2 3.92Å; W547-Y585 HydrophobicContact CH2-CD2 3.92Å; W547-Y585 AromaticContact CH2-CE1 3.87Å; W547-Y585 HydrophobicContact CH2-CE1 3.87Å; W547-Y585 AromaticContact CH2-CE2 3.58Å; W547-Y585 HydrophobicContact CH2-CE2 3.58Å; W547-Y585 HydrophobicContact CH2-CG 4.21Å; W547-Y585 AromaticContact CH2-CZ 3.55Å; W547-Y585 HydrophobicContact CZ2-CD1 4.22Å; W547-Y585 HydrophobicContact CZ2-CE1 4.09Å; W547-Y585 HydrophobicContact CZ2-CG 4.48Å; W547-Y585 HydrophobicContact CZ3-CE2 4.38Å; S582-Y585 WeakPolarHBondContact O-CB 3.39Å; S582-Y585 PolarHBondContact O-N 3.22Å; L583-Y585 PolarHBondContact O-N 3.34Å; Y585-H587 VanDerWaalsContact C-N 3.27Å; Y585-H587 PolarHBondContact O-N 3.45Å; Y585-Q588 PolarHBondContact O-N 3.47Å; Y585-I591 HydrophobicContact CD1-CD1 4.18Å; Y585-I591 HydrophobicContact CE1-CD1 3.83Å
586	S	91.9	Very high	92	Very high	72 Å²	72	81.1 Å²	81.1	50%	0.503	45%	0.451	S	S	.	.	H	α-helix	trans	-63.9	-33.9	-179.6	63.5	0	0	0	0	112.4	S582 L583 Q588	S582-S586 PolarHBondContact O-N 3.48Å; S582-S586 VanDerWaalsContact O-N 3.13Å; L583-S586 WeakPolarHBondContact CA-OG 3.03Å; L583-S586 PolarHBondContact O-N 2.84Å; L583-S586 PolarHBondContact O-OG 2.7Å; L583-S586 VanDerWaalsContact O-OG 3.04Å; S586-Q588 VanDerWaalsContact C-N 3.33Å
587	H	92.1	Very high	92	Very high	82 Å²	82	81.4 Å²	81.4	38%	0.38	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	9.7	173.8	-71.9	-84.1	0	0	0	113.7	D504 V505 L583 Y585 L589	D504-H587 IonicContact OD1-CD2 2.78Å; D504-H587 IonicContact OD1-CE1 3.79Å; D504-H587 IonicContact OD1-NE2 3.29Å; D504-H587 PolarHBondContact OD1-NE2 2.84Å; V505-H587 WeakPolarHBondContact CG2-CD2 3.02Å; V505-H587 WeakPolarHBondContact CG2-NE2 3.23Å; L583-H587 WeakPolarHBondContact O-CB 3.05Å; L583-H587 PolarHBondContact O-CD2 2.73Å; L583-H587 PolarHBondContact O-N 3.21Å; Y585-H587 VanDerWaalsContact C-N 3.27Å; Y585-H587 PolarHBondContact O-N 3.45Å; H587-L589 VanDerWaalsContact C-N 3.3Å; H587-L589 HydrophobicContact CB-CD1 3.66Å; H587-L589 PolarHBondContact O-N 3.28Å
588	Q	90.2	Very high	92.1	Very high	175 Å²	175	80.8 Å²	80.8	82%	0.818	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	39.1	172.1	-58.4	176	2.2	0	0	114.5	C584 Y585 S586	C584-Q588 PolarHBondContact O-N 3.34Å; Y585-Q588 PolarHBondContact O-N 3.47Å; S586-Q588 VanDerWaalsContact C-N 3.33Å
589	L	91	Very high	92	Very high	52 Å²	52	83.1 Å²	83.1	27%	0.272	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-64	138.1	175.5	-84.2	70.8	0	0	0	110.5	V545 W547 C584 H587 I591	V545-L589 HydrophobicContact CG2-CD1 4Å; V545-L589 HydrophobicContact CG2-CD2 3.89Å; V545-L589 WeakPolarHBondContact O-CD2 3.46Å; W547-L589 PolarHBondContact NE1-O 2.92Å; C584-L589 PolarHBondContact O-N 2.99Å; H587-L589 VanDerWaalsContact C-N 3.3Å; H587-L589 HydrophobicContact CB-CD1 3.66Å; H587-L589 PolarHBondContact O-N 3.28Å; L589-I591 PolarHBondContact O-N 3.47Å
590	A	91.6	Very high	91.6	Very high	94 Å²	94	78.5 Å²	78.5	78%	0.777	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-54	122.8	176.8	0	0	0	0	0	110.9	W547 P592	W547-A590 PolarHBondContact NE1-O 2.88Å; A590-P592 WeakPolarHBondContact O-CD 3.34Å
591	I	91.1	Very high	91.1	Very high	100 Å²	100	82.5 Å²	82.5	51%	0.513	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-87.7	119.2	-172.2	-56.4	168.8	0	0	0	109.1	W547 L569 Y585 L589	W547-I591 HydrophobicContact CZ2-CG1 4.15Å; L569-I591 HydrophobicContact CD2-CG2 4.12Å; Y585-I591 HydrophobicContact CD1-CD1 4.18Å; Y585-I591 HydrophobicContact CE1-CD1 3.83Å; L589-I591 PolarHBondContact O-N 3.47Å
592	P	92.3	Very high	90.3	Very high	40 Å²	40	85.2 Å²	85.2	26%	0.26	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-62.6	148.5	173.1	-21.6	30.9	0	0	0	112.9	W547 V549 L569 A590 V594	W547-P592 HydrophobicContact CB-CG 3.93Å; W547-P592 VanDerWaalsContact CD1-CD 3.5Å; W547-P592 HydrophobicContact CG-CG 4.26Å; V549-P592 HydrophobicContact CG1-CB 4.08Å; V549-P592 HydrophobicContact CG1-CG 4.11Å; L569-P592 HydrophobicContact CD1-CB 3.81Å; L569-P592 HydrophobicContact CD1-CG 3.76Å; A590-P592 WeakPolarHBondContact O-CD 3.34Å; P592-V594 PolarHBondContact O-N 2.9Å
593	D	91.5	Very high	89.6	Confident	119 Å²	119	84.4 Å²	84.4	64%	0.636	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-56.9	129.3	177.7	-63.5	-45.2	0	0	0	111.9	W552 R567	W552-D593 HydrophobicContact CH2-CB 4.47Å; W552-D593 WeakPolarHBondContact CH2-O 3.43Å; R567-D593 PolarHBondContact NE-O 2.99Å; R567-D593 PolarHBondContact NH2-O 2.89Å
594	V	94.1	Very high	88.4	Confident	61 Å²	61	93.2 Å²	93.2	37%	0.37	50%	0.5	S	S	.	.	S	Bend	trans	-96.4	-19.9	-178.5	-173.6	0	0	0	0	111.2	W552 A566 R567 L569 P592	W552-V594 WeakPolarHBondContact CZ3-O 3.05Å; A566-V594 CarbonylContact C-O 3.55Å; A566-V594 VanDerWaalsContact CA-O 3.3Å; A566-V594 WeakPolarHBondContact CA-O 3.22Å; R567-V594 PolarHBondContact N-O 2.03Å; R567-V594 WeakPolarHBondContact O-CG1 3.19Å; L569-V594 HydrophobicContact CB-CG2 4.41Å; L569-V594 HydrophobicContact CD1-CG2 4.42Å; P592-V594 PolarHBondContact O-N 2.9Å
595	I	93.5	Very high	86.6	Confident	116 Å²	116	101.5 Å²	101.5	60%	0.595	54%	0.543	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135	136.3	-175.9	-60.5	173.4	0	0	0	109	V564 Q565	V564-I595 HydrophobicContact CB-CG2 4.28Å; V564-I595 HydrophobicContact CG1-CG2 4.43Å; Q565-I595 WeakPolarHBondContact O-CA 3.18Å
596	R	93.5	Very high	85.1	Confident	127 Å²	127	98.2 Å²	98.2	48%	0.479	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-140.8	153.7	174.2	-169.5	-172.5	66.5	-169.8	-5.1	111	W552 V564 Q565	W552-R596 HydrophobicContact CH2-CB 3.8Å; W552-R596 HydrophobicContact CZ2-CB 4.2Å; W552-R596 HydrophobicContact CZ3-CB 4.04Å; V564-R596 CarbonylContact C-O 3.52Å; V564-R596 WeakPolarHBondContact CA-O 3.31Å; Q565-R596 PolarHBondContact N-O 3.09Å; Q565-R596 PolarHBondContact O-N 3.47Å
597	S	91.4	Very high	84.1	Confident	80 Å²	80	97.3 Å²	97.3	56%	0.559	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	150.7	170.8	52	0	0	0	0	113.2	G563	G563-S597 WeakPolarHBondContact O-CA 3.42Å
598	C	92.5	Very high	83.1	Confident	17 Å²	17	98.8 Å²	98.8	12%	0.115	56%	0.558	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-136.7	147.1	171.3	44.5	0	0	0	0	109.9	C555 V562 G563 V564 Q565	C555-C598 VanDerWaalsContact CA-SG 3.51Å; C555-C598 HydrophobicContact CB-CB 3.95Å; C555-C598 WeakPolarHBondContact CB-SG 3.46Å; C555-C598 WeakPolarHBondContact SG-CB 3.44Å; C555-C598 CovalentContact SG-SG 2.03Å; C555-C598 PolarHBondContact SG-SG 3.41Å; V562-C598 CarbonylContact C-O 3.38Å; V562-C598 WeakPolarHBondContact CA-O 3.49Å; G563-C598 PolarHBondContact N-O 3.39Å; G563-C598 PolarHBondContact O-N 3.4Å; G563-C598 PolarHBondContact O-SG 2.71Å; V564-C598 VanDerWaalsContact C-SG 3.56Å; V564-C598 PolarHBondContact N-SG 2.82Å; V564-C598 VanDerWaalsContact N-SG 3.4Å; Q565-C598 HydrophobicContact CG-CB 3.88Å; Q565-C598 VanDerWaalsContact CG-SG 3.57Å
599	E	89.7	Confident	82.6	Confident	175 Å²	175	92.1 Å²	92.1	82%	0.818	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.3	176.6	-66.3	179.7	-178.4	0	0	110.1
600	V	84.6	Confident	82	Confident	26 Å²	26	97.3 Å²	97.3	16%	0.158	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.4	151.4	175.4	-70	0	0	0	0	112.9	C555 R557 G561	C555-V600 HydrophobicContact CB-CG1 4.06Å; R557-V600 HydrophobicContact CB-CG2 3.79Å; R557-V600 VanDerWaalsContact O-CG1 3.24Å; R557-V600 WeakPolarHBondContact O-CG1 3.43Å; G561-V600 PolarHBondContact N-O 2.62Å; G561-V600 WeakPolarHBondContact O-CG2 3.39Å; G561-V600 PolarHBondContact O-N 3.01Å
601	P	80.8	Confident	81.4	Confident	91 Å²	91	94.8 Å²	94.8	59%	0.591	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-57.1	153.8	-175.7	-23.7	33.4	0	0	0	113.3	C559 G560	C559-P601 CarbonylContact C-O 3.59Å; C559-P601 WeakPolarHBondContact CA-O 3.36Å; C559-P601 VanDerWaalsContact CB-O 3.23Å; C559-P601 WeakPolarHBondContact CB-O 3.48Å; G560-P601 PolarHBondContact N-O 3.39Å
602	P	74.6	Confident	80.9	Confident	115 Å²	115	98.4 Å²	98.4	75%	0.747	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-63.3	141.9	172.8	26.4	-33.2	0	0	0	111.3	K604	P602-K604 PolarHBondContact O-N 2.72Å
603	C	77.6	Confident	80.2	Confident	66 Å²	66	100.9 Å²	100.9	45%	0.446	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-68.1	128.6	179.8	-55.6	0	0	0	0	110.9	C559 L605	C559-C603 HydrophobicContact CB-CB 3.95Å; C559-C603 WeakPolarHBondContact CB-SG 3.34Å; C559-C603 WeakPolarHBondContact SG-CB 3.1Å; C559-C603 CovalentContact SG-SG 2.05Å; C559-C603 PolarHBondContact SG-SG 3.01Å; C603-L605 PolarHBondContact O-N 2.93Å
604	K	67	Low	79.8	Confident	212 Å²	212	95.2 Å²	95.2	92%	0.922	52%	0.52	S	S	*	.			trans	-82.4	110.5	170.3	-72.1	-175.4	179.4	-179.8	0	109.6	P602 G606	P602-K604 PolarHBondContact O-N 2.72Å; K604-G606 PolarHBondContact O-N 3.47Å
605	L	54.9	Low	79.2	Confident	175 Å²	175	96.5 Å²	96.5	92%	0.916	53%	0.531	S	S	*	.			trans	-84.2	94.4	173.7	-73.9	154.6	0	0	0	109.5	C603	C603-L605 PolarHBondContact O-N 2.93Å
606	G	60.4	Low	78.6	Confident	67 Å²	67	98.5 Å²	98.5	69%	0.691	54%	0.535	S	S	*	.			trans	-79.2	126.7	163.2	0	0	0	0	0	109.4	K604	K604-G606 PolarHBondContact O-N 3.47Å
607	C	72.5	Confident	78.1	Confident	53 Å²	53	98.8 Å²	98.8	36%	0.358	54%	0.536	S	S	.	.			trans	-72.9	138.1	176	169.4	0	0	0	0	110.9	C631 E632	C607-C631 HydrophobicContact CB-CB 4.39Å; C607-C631 WeakPolarHBondContact CB-SG 2.93Å; C607-C631 VanDerWaalsContact SG-CA 3.55Å; C607-C631 WeakPolarHBondContact SG-CB 3.49Å; C607-C631 CovalentContact SG-SG 2.01Å; C607-C631 PolarHBondContact SG-SG 3.49Å; C607-E632 PolarHBondContact SG-N 2.94Å
608	V	70.8	Confident	77.5	Confident	113 Å²	113	97 Å²	97	69%	0.685	52%	0.522	S	S	*	.			trans	-131	131.6	179.1	-175.2	0	0	0	0	109.3	M610	V608-M610 PolarHBondContact O-N 3.04Å
609	D	80.1	Confident	76.8	Confident	36 Å²	36	100.5 Å²	100.5	19%	0.193	54%	0.537	C	S	.	.			trans	-65.3	122.5	173.2	-78.2	-11.7	0	0	0	110.8	S611 C614 C630 C631 E632 S633	D609-S611 VanDerWaalsContact C-N 3.3Å; D609-S611 PolarHBondContact O-N 3.39Å; D609-C614 HydrophobicContact CB-CB 3.99Å; D609-C614 WeakPolarHBondContact OD2-CB 3.35Å; D609-C630 WeakPolarHBondContact OD1-CA 3.21Å; D609-C631 PolarHBondContact OD1-N 3.02Å; D609-E632 WeakPolarHBondContact OD1-CA 3.5Å; D609-E632 PolarHBondContact OD1-N 3Å; D609-S633 PolarHBondContact OD1-N 3.15Å; D609-S633 VanDerWaalsContact OD1-N 3.17Å; D609-S633 WeakPolarHBondContact OD2-CB 3.17Å; D609-S633 PolarHBondContact OD2-N 3.23Å; D609-S633 VanDerWaalsContact OD2-N 3.14Å; D609-S633 PolarHBondContact OD2-OG 3.07Å
610	M	78	Confident	76.6	Confident	161 Å²	161	94.1 Å²	94.1	79%	0.793	51%	0.508	S	S	*	.	S	Bend	trans	-79.2	-9.8	-178.9	-58.4	-176.7	79	0	0	113.3	V608 Q629	V608-M610 PolarHBondContact O-N 3.04Å; M610-Q629 WeakPolarHBondContact CB-O 3.45Å; M610-Q629 PolarHBondContact N-O 2.89Å
611	S	79.3	Confident	76.6	Confident	41 Å²	41	93 Å²	93	29%	0.287	50%	0.502	S	S	.	.			trans	-133.9	135.6	-176.5	175.7	0	0	0	0	112.6	D609 H613 C614	D609-S611 VanDerWaalsContact C-N 3.3Å; D609-S611 PolarHBondContact O-N 3.39Å; S611-H613 PolarHBondContact O-N 2.79Å; S611-H613 VanDerWaalsContact O-N 3.11Å; S611-H613 PolarHBondContact OG-N 3.17Å; S611-C614 WeakPolarHBondContact O-CB 3.24Å; S611-C614 PolarHBondContact O-N 2.8Å; S611-C614 VanDerWaalsContact O-N 3.11Å; S611-C614 PolarHBondContact O-SG 2.95Å
612	K	79.2	Confident	76.5	Confident	175 Å²	175	95.3 Å²	95.3	76%	0.761	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-12.7	172.9	65.9	-176.8	178.7	-176.7	0	114.4	C614	K612-C614 VanDerWaalsContact C-N 3.34Å
613	H	78.4	Confident	76.9	Confident	93 Å²	93	95 Å²	95	43%	0.431	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-7.9	177.6	-60.1	96	0	0	0	112.6	S611 S615 K616 R617 Y626	S611-H613 PolarHBondContact O-N 2.79Å; S611-H613 VanDerWaalsContact O-N 3.11Å; S611-H613 PolarHBondContact OG-N 3.17Å; H613-S615 PolarHBondContact O-N 2.93Å; H613-K616 PolarHBondContact O-N 2.91Å; H613-R617 PolarHBondContact O-N 3.03Å; H613-Y626 PolarHBondContact O-OH 2.97Å
614	C	83.6	Confident	76.9	Confident	0 Å²	0	96 Å²	96	0%	0	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-43.8	-176.6	-70.7	0	0	0	0	113	D609 S611 K612 Y626 C630 S633	D609-C614 HydrophobicContact CB-CB 3.99Å; D609-C614 WeakPolarHBondContact OD2-CB 3.35Å; S611-C614 WeakPolarHBondContact O-CB 3.24Å; S611-C614 PolarHBondContact O-N 2.8Å; S611-C614 VanDerWaalsContact O-N 3.11Å; S611-C614 PolarHBondContact O-SG 2.95Å; K612-C614 VanDerWaalsContact C-N 3.34Å; C614-Y626 WeakPolarHBondContact CA-OH 3.12Å; C614-Y626 PolarHBondContact O-OH 3.17Å; C614-C630 WeakPolarHBondContact CA-SG 3.45Å; C614-C630 HydrophobicContact CB-CB 3.41Å; C614-C630 VanDerWaalsContact CB-CB 3.41Å; C614-C630 WeakPolarHBondContact CB-SG 3.2Å; C614-C630 WeakPolarHBondContact SG-CA 3.08Å; C614-C630 WeakPolarHBondContact SG-CB 3.4Å; C614-C630 CovalentContact SG-SG 2.01Å; C614-C630 PolarHBondContact SG-SG 2.9Å; C614-S633 WeakPolarHBondContact CB-OG 2.99Å
615	S	81.4	Confident	77.6	Confident	87 Å²	87	91.9 Å²	91.9	61%	0.608	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-15.1	179.9	-32.1	0	0	0	0	114.6	H613 V618 S633	H613-S615 PolarHBondContact O-N 2.93Å; S615-V618 WeakPolarHBondContact O-CG2 3.25Å; S615-S633 PolarHBondContact N-OG 3.22Å; S615-S633 PolarHBondContact OG-OG 2.63Å
616	K	81	Confident	78.8	Confident	158 Å²	158	84.7 Å²	84.7	69%	0.687	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-22.9	-174.3	-64.1	-173.9	-178.9	-175.4	0	113.8	H613	H613-K616 PolarHBondContact O-N 2.91Å
617	R	82.4	Confident	79.8	Confident	133 Å²	133	86.8 Å²	86.8	50%	0.502	43%	0.428	S	S	.	.			trans	-123.5	53.6	-176.5	-59.7	-71	-68.5	-115.9	-6.5	110.6	H613 E619 L620 Y626	H613-R617 PolarHBondContact O-N 3.03Å; R617-E619 WeakPolarHBondContact CA-OE1 3.47Å; R617-E619 VanDerWaalsContact CA-OE2 3.28Å; R617-E619 WeakPolarHBondContact CA-OE2 3.44Å; R617-E619 WeakPolarHBondContact CB-OE1 3.49Å; R617-E619 WeakPolarHBondContact CD-OE1 3.26Å; R617-E619 IonicContact CZ-OE1 3.28Å; R617-E619 IonicContact NE-OE1 2.81Å; R617-E619 PolarHBondContact NE-OE1 3.17Å; R617-E619 PolarHBondContact O-N 3.41Å; R617-L620 HydrophobicContact CB-CD1 3.57Å; R617-L620 HydrophobicContact CB-CG 3.91Å; R617-L620 HydrophobicContact CG-CD1 4.2Å; R617-L620 VanDerWaalsContact O-CB 3.31Å; R617-L620 WeakPolarHBondContact O-CB 3.46Å; R617-L620 PolarHBondContact O-N 2.95Å; R617-Y626 WeakPolarHBondContact CB-OH 3.46Å; R617-Y626 WeakPolarHBondContact O-CE1 3.4Å; R617-Y626 PolarHBondContact O-OH 3.08Å
618	V	78.7	Confident	80	Confident	43 Å²	43	93.1 Å²	93.1	26%	0.261	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-63	-26.7	-174.5	-160.4	0	0	0	0	111.5	S615 L620 C621 Y637	S615-V618 WeakPolarHBondContact O-CG2 3.25Å; V618-L620 PolarHBondContact O-N 2.99Å; V618-L620 VanDerWaalsContact O-N 3.12Å; V618-C621 VanDerWaalsContact O-CB 3.23Å; V618-C621 WeakPolarHBondContact O-CB 3.26Å; V618-C621 PolarHBondContact O-N 2.98Å; V618-C621 PolarHBondContact O-SG 3.02Å; V618-Y637 HydrophobicContact CB-CD2 4.26Å; V618-Y637 VanDerWaalsContact CG1-CB 3.48Å; V618-Y637 HydrophobicContact CG1-CD1 4.34Å; V618-Y637 HydrophobicContact CG1-CD2 3.18Å; V618-Y637 HydrophobicContact CG1-CE2 3.89Å; V618-Y637 HydrophobicContact CG1-CG 3.42Å; V618-Y637 VanDerWaalsContact CG1-CG 3.42Å
619	E	78.5	Confident	80.4	Confident	90 Å²	90	92.1 Å²	92.1	42%	0.421	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-60.4	-18.7	172.1	72.3	-73.1	169.3	0	0	114	R617 C621 K622	R617-E619 WeakPolarHBondContact CA-OE1 3.47Å; R617-E619 VanDerWaalsContact CA-OE2 3.28Å; R617-E619 WeakPolarHBondContact CA-OE2 3.44Å; R617-E619 WeakPolarHBondContact CB-OE1 3.49Å; R617-E619 WeakPolarHBondContact CD-OE1 3.26Å; R617-E619 IonicContact CZ-OE1 3.28Å; R617-E619 IonicContact NE-OE1 2.81Å; R617-E619 PolarHBondContact NE-OE1 3.17Å; R617-E619 PolarHBondContact O-N 3.41Å; E619-C621 VanDerWaalsContact C-N 3.33Å; E619-K622 WeakPolarHBondContact O-CG 3.43Å
620	L	84.4	Confident	80.6	Confident	42 Å²	42	90.4 Å²	90.4	22%	0.22	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-81.7	-10.1	175.1	-60.1	179.4	0	0	0	112.9	R617 V618 K622 F623 Y626	R617-L620 HydrophobicContact CB-CD1 3.57Å; R617-L620 HydrophobicContact CB-CG 3.91Å; R617-L620 HydrophobicContact CG-CD1 4.2Å; R617-L620 VanDerWaalsContact O-CB 3.31Å; R617-L620 WeakPolarHBondContact O-CB 3.46Å; R617-L620 PolarHBondContact O-N 2.95Å; V618-L620 PolarHBondContact O-N 2.99Å; V618-L620 VanDerWaalsContact O-N 3.12Å; L620-K622 PolarHBondContact O-N 3.41Å; L620-F623 HydrophobicContact CB-CD2 4.36Å; L620-F623 HydrophobicContact CD2-CD2 4.04Å; L620-F623 HydrophobicContact CD2-CE2 3.87Å; L620-F623 WeakPolarHBondContact O-CB 3.07Å; L620-F623 WeakPolarHBondContact O-CD2 3.14Å; L620-F623 PolarHBondContact O-N 2.86Å; L620-Y626 HydrophobicContact CB-CD1 3.7Å; L620-Y626 HydrophobicContact CB-CD2 3.86Å; L620-Y626 HydrophobicContact CB-CE1 3.9Å; L620-Y626 HydrophobicContact CB-CE2 4.06Å; L620-Y626 HydrophobicContact CB-CG 3.67Å; L620-Y626 HydrophobicContact CD1-CD2 4.1Å; L620-Y626 HydrophobicContact CD1-CE2 3.85Å; L620-Y626 WeakPolarHBondContact O-CB 3.29Å
621	C	84.5	Confident	80.8	Confident	3 Å²	3	84.8 Å²	84.8	2%	0.02	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-61.7	-12.6	176.8	-72.1	0	0	0	0	113.9	V618 E619 F623 R627 C634 Y637	V618-C621 VanDerWaalsContact O-CB 3.23Å; V618-C621 WeakPolarHBondContact O-CB 3.26Å; V618-C621 PolarHBondContact O-N 2.98Å; V618-C621 PolarHBondContact O-SG 3.02Å; E619-C621 VanDerWaalsContact C-N 3.33Å; C621-F623 PolarHBondContact O-N 3.45Å; C621-R627 WeakPolarHBondContact O-CD 3.38Å; C621-R627 VanDerWaalsContact O-CG 3.32Å; C621-R627 WeakPolarHBondContact O-CG 3.41Å; C621-R627 PolarHBondContact O-NE 3.31Å; C621-C634 WeakPolarHBondContact CA-SG 3.31Å; C621-C634 HydrophobicContact CB-CB 3.76Å; C621-C634 WeakPolarHBondContact CB-SG 3.45Å; C621-C634 WeakPolarHBondContact SG-CA 3.39Å; C621-C634 WeakPolarHBondContact SG-CB 3.07Å; C621-C634 CovalentContact SG-SG 2.05Å; C621-C634 PolarHBondContact SG-SG 3.15Å; C621-Y637 HydrophobicContact CB-CD1 3.45Å; C621-Y637 VanDerWaalsContact CB-CD1 3.45Å; C621-Y637 HydrophobicContact CB-CE1 3.9Å; C621-Y637 HydrophobicContact CB-CG 4.19Å
622	K	79.8	Confident	80.8	Confident	139 Å²	139	86.4 Å²	86.4	60%	0.604	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-61.3	-32.4	167.3	66.4	-171.4	178.8	-179	0	112.7	E619 L620 R627	E619-K622 WeakPolarHBondContact O-CG 3.43Å; L620-K622 PolarHBondContact O-N 3.41Å; K622-R627 PolarHBondContact O-NH2 3.27Å
623	F	82.7	Confident	80.9	Confident	109 Å²	109	78.7 Å²	78.7	48%	0.478	37%	0.372	S	S	.	.	S	Bend	trans	-84.2	129.3	-179.3	-58.6	-71.5	0	0	0	111.5	L620 C621 I625 Y626 R627	L620-F623 HydrophobicContact CB-CD2 4.36Å; L620-F623 HydrophobicContact CD2-CD2 4.04Å; L620-F623 HydrophobicContact CD2-CE2 3.87Å; L620-F623 WeakPolarHBondContact O-CB 3.07Å; L620-F623 WeakPolarHBondContact O-CD2 3.14Å; L620-F623 PolarHBondContact O-N 2.86Å; C621-F623 PolarHBondContact O-N 3.45Å; F623-I625 VanDerWaalsContact C-N 3.27Å; F623-I625 PolarHBondContact O-N 2.7Å; F623-Y626 PolarHBondContact O-N 3.24Å; F623-Y626 VanDerWaalsContact O-N 3.14Å; F623-R627 PolarHBondContact O-N 2.79Å; F623-R627 VanDerWaalsContact O-N 3.16Å
624	T	77.7	Confident	81.1	Confident	87 Å²	87	74.4 Å²	74.4	53%	0.534	35%	0.352	S	S	.	.	H	α-helix	trans	-57.2	-38.5	-178.1	-48.6	0	0	0	0	112.8	Y626 R627 Y628	T624-Y626 VanDerWaalsContact C-N 3.31Å; T624-Y626 PolarHBondContact O-N 2.67Å; T624-R627 WeakPolarHBondContact O-CB 3.4Å; T624-R627 PolarHBondContact O-N 3.18Å; T624-Y628 HydrophobicContact CG2-CD2 4.16Å; T624-Y628 HydrophobicContact CG2-CE2 4.09Å; T624-Y628 WeakPolarHBondContact O-CD2 3.41Å; T624-Y628 PolarHBondContact O-N 3.09Å; T624-Y628 VanDerWaalsContact O-N 3.12Å
625	I	80.7	Confident	80.9	Confident	124 Å²	124	80 Å²	80	64%	0.636	38%	0.378	S	S	*	.	H	α-helix	trans	-65.6	-36.2	-179.4	-159.8	156.3	0	0	0	112.1	F623 Y628 Q629	F623-I625 VanDerWaalsContact C-N 3.27Å; F623-I625 PolarHBondContact O-N 2.7Å; I625-Y628 PolarHBondContact O-N 2.87Å; I625-Q629 PolarHBondContact O-N 2.81Å
626	Y	81.3	Confident	80.5	Confident	24 Å²	24	83.1 Å²	83.1	9%	0.094	38%	0.377	C	S	.	.	H	α-helix	trans	-71	-36.8	176	-162.8	-99.7	0	0	0	110.8	H613 C614 R617 L620 F623 T624 Y628 Q629 C630	H613-Y626 PolarHBondContact O-OH 2.97Å; C614-Y626 WeakPolarHBondContact CA-OH 3.12Å; C614-Y626 PolarHBondContact O-OH 3.17Å; R617-Y626 WeakPolarHBondContact CB-OH 3.46Å; R617-Y626 WeakPolarHBondContact O-CE1 3.4Å; R617-Y626 PolarHBondContact O-OH 3.08Å; L620-Y626 HydrophobicContact CB-CD1 3.7Å; L620-Y626 HydrophobicContact CB-CD2 3.86Å; L620-Y626 HydrophobicContact CB-CE1 3.9Å; L620-Y626 HydrophobicContact CB-CE2 4.06Å; L620-Y626 HydrophobicContact CB-CG 3.67Å; L620-Y626 HydrophobicContact CD1-CD2 4.1Å; L620-Y626 HydrophobicContact CD1-CE2 3.85Å; L620-Y626 WeakPolarHBondContact O-CB 3.29Å; F623-Y626 PolarHBondContact O-N 3.24Å; F623-Y626 VanDerWaalsContact O-N 3.14Å; T624-Y626 VanDerWaalsContact C-N 3.31Å; T624-Y626 PolarHBondContact O-N 2.67Å; Y626-Y628 VanDerWaalsContact C-N 3.31Å; Y626-Y628 PolarHBondContact O-N 2.87Å; Y626-Q629 PolarHBondContact O-N 2.87Å; Y626-C630 HydrophobicContact CD1-CB 4.12Å; Y626-C630 HydrophobicContact CE1-CB 3.94Å; Y626-C630 VanDerWaalsContact CZ-SG 3.6Å; Y626-C630 WeakPolarHBondContact O-CA 3.03Å; Y626-C630 WeakPolarHBondContact O-CB 3.11Å; Y626-C630 PolarHBondContact O-N 3.08Å
627	R	79.7	Confident	80	Confident	112 Å²	112	78.9 Å²	78.9	42%	0.423	36%	0.357	S	S	.	.	H	α-helix	trans	-60.7	-35.4	172.7	-78.2	-176.4	-111	162.7	-0.3	113.6	C621 K622 F623 T624 C630 C631 C634	C621-R627 WeakPolarHBondContact O-CD 3.38Å; C621-R627 VanDerWaalsContact O-CG 3.32Å; C621-R627 WeakPolarHBondContact O-CG 3.41Å; C621-R627 PolarHBondContact O-NE 3.31Å; K622-R627 PolarHBondContact O-NH2 3.27Å; F623-R627 PolarHBondContact O-N 2.79Å; F623-R627 VanDerWaalsContact O-N 3.16Å; T624-R627 WeakPolarHBondContact O-CB 3.4Å; T624-R627 PolarHBondContact O-N 3.18Å; R627-C630 CarbonylContact O-C 3.58Å; R627-C631 WeakPolarHBondContact O-CA 3.48Å; R627-C631 VanDerWaalsContact O-CB 3.28Å; R627-C631 WeakPolarHBondContact O-CB 3.29Å; R627-C631 PolarHBondContact O-N 3.14Å; R627-C634 HydrophobicContact CB-CB 4.48Å; R627-C634 HydrophobicContact CG-CB 3.8Å
628	Y	76.9	Confident	79.5	Confident	185 Å²	185	76.4 Å²	76.4	73%	0.725	36%	0.357	S	S	*	.	H	α-helix	trans	-70.3	-43.4	176	-92.5	-76	0	0	0	112.4	T624 I625 Y626	T624-Y628 HydrophobicContact CG2-CD2 4.16Å; T624-Y628 HydrophobicContact CG2-CE2 4.09Å; T624-Y628 WeakPolarHBondContact O-CD2 3.41Å; T624-Y628 PolarHBondContact O-N 3.09Å; T624-Y628 VanDerWaalsContact O-N 3.12Å; I625-Y628 PolarHBondContact O-N 2.87Å; Y626-Y628 VanDerWaalsContact C-N 3.31Å; Y626-Y628 PolarHBondContact O-N 2.87Å
629	Q	80.8	Confident	79.1	Confident	92 Å²	92	80.2 Å²	80.2	43%	0.43	37%	0.371	S	S	.	.	H	α-helix	trans	-75.6	-29	-179.6	-68.1	179.9	-10.6	0	0	112.8	M610 I625 Y626	M610-Q629 WeakPolarHBondContact CB-O 3.45Å; M610-Q629 PolarHBondContact N-O 2.89Å; I625-Q629 PolarHBondContact O-N 2.81Å; Y626-Q629 PolarHBondContact O-N 2.87Å
630	C	84.3	Confident	78.5	Confident	0 Å²	0	82.2 Å²	82.2	0%	0	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	54.1	-173.8	-61.2	0	0	0	0	110.7	D609 C614 Y626 R627 C634	D609-C630 WeakPolarHBondContact OD1-CA 3.21Å; C614-C630 WeakPolarHBondContact CA-SG 3.45Å; C614-C630 HydrophobicContact CB-CB 3.41Å; C614-C630 VanDerWaalsContact CB-CB 3.41Å; C614-C630 WeakPolarHBondContact CB-SG 3.2Å; C614-C630 WeakPolarHBondContact SG-CA 3.08Å; C614-C630 WeakPolarHBondContact SG-CB 3.4Å; C614-C630 CovalentContact SG-SG 2.01Å; C614-C630 PolarHBondContact SG-SG 2.9Å; Y626-C630 HydrophobicContact CD1-CB 4.12Å; Y626-C630 HydrophobicContact CE1-CB 3.94Å; Y626-C630 VanDerWaalsContact CZ-SG 3.6Å; Y626-C630 WeakPolarHBondContact O-CA 3.03Å; Y626-C630 WeakPolarHBondContact O-CB 3.11Å; Y626-C630 PolarHBondContact O-N 3.08Å; R627-C630 CarbonylContact O-C 3.58Å; C630-C634 VanDerWaalsContact O-CB 3.28Å; C630-C634 WeakPolarHBondContact O-CB 3.27Å; C630-C634 PolarHBondContact O-N 2.74Å; C630-C634 PolarHBondContact O-SG 2.64Å; C630-C634 VanDerWaalsContact O-SG 3.37Å
631	C	80.6	Confident	77.5	Confident	43 Å²	43	83.6 Å²	83.6	29%	0.291	39%	0.389	S	S	.	.	H	α-helix	trans	-70.5	-33.4	-169.6	145.4	0	0	0	0	113.3	C607 D609 R627 Q635	C607-C631 HydrophobicContact CB-CB 4.39Å; C607-C631 WeakPolarHBondContact CB-SG 2.93Å; C607-C631 VanDerWaalsContact SG-CA 3.55Å; C607-C631 WeakPolarHBondContact SG-CB 3.49Å; C607-C631 CovalentContact SG-SG 2.01Å; C607-C631 PolarHBondContact SG-SG 3.49Å; D609-C631 PolarHBondContact OD1-N 3.02Å; R627-C631 WeakPolarHBondContact O-CA 3.48Å; R627-C631 VanDerWaalsContact O-CB 3.28Å; R627-C631 WeakPolarHBondContact O-CB 3.29Å; R627-C631 PolarHBondContact O-N 3.14Å; C631-Q635 WeakPolarHBondContact O-CB 3.31Å; C631-Q635 PolarHBondContact O-N 2.89Å; C631-Q635 VanDerWaalsContact O-N 3.08Å
632	E	80.4	Confident	76.5	Confident	75 Å²	75	86.3 Å²	86.3	35%	0.35	41%	0.409	S	S	.	.	H	α-helix	trans	-71.5	-49	173.5	-169.9	-173.4	168.2	0	0	110.8	C607 D609 C634 Q635 R636	C607-E632 PolarHBondContact SG-N 2.94Å; D609-E632 WeakPolarHBondContact OD1-CA 3.5Å; D609-E632 PolarHBondContact OD1-N 3Å; E632-C634 VanDerWaalsContact C-N 3.34Å; E632-C634 PolarHBondContact O-N 2.78Å; E632-Q635 PolarHBondContact O-N 2.9Å; E632-R636 PolarHBondContact O-N 2.85Å; E632-R636 IonicContact OE1-CZ 3.67Å; E632-R636 VanDerWaalsContact OE1-CZ 3.31Å; E632-R636 IonicContact OE1-NH1 3.31Å; E632-R636 PolarHBondContact OE1-NH1 3.08Å; E632-R636 IonicContact OE1-NH2 2.7Å; E632-R636 PolarHBondContact OE1-NH2 2.04Å
633	S	80	Confident	75.4	Confident	13 Å²	13	83 Å²	83	9%	0.091	40%	0.402	C	S	.	.	H	α-helix	trans	-60.6	-41.2	179.9	-73.3	0	0	0	0	112.5	D609 C614 S615 Y637	D609-S633 PolarHBondContact OD1-N 3.15Å; D609-S633 VanDerWaalsContact OD1-N 3.17Å; D609-S633 WeakPolarHBondContact OD2-CB 3.17Å; D609-S633 PolarHBondContact OD2-N 3.23Å; D609-S633 VanDerWaalsContact OD2-N 3.14Å; D609-S633 PolarHBondContact OD2-OG 3.07Å; C614-S633 WeakPolarHBondContact CB-OG 2.99Å; S615-S633 PolarHBondContact N-OG 3.22Å; S615-S633 PolarHBondContact OG-OG 2.63Å; S633-Y637 PolarHBondContact O-N 3.34Å
634	C	82.9	Confident	74	Confident	4 Å²	4	81.6 Å²	81.6	3%	0.027	40%	0.403	C	S	.	.	H	α-helix	trans	-77.6	-27	179	-66.8	0	0	0	0	113.8	C621 R627 C630 E632 Y637 V638	C621-C634 WeakPolarHBondContact CA-SG 3.31Å; C621-C634 HydrophobicContact CB-CB 3.76Å; C621-C634 WeakPolarHBondContact CB-SG 3.45Å; C621-C634 WeakPolarHBondContact SG-CA 3.39Å; C621-C634 WeakPolarHBondContact SG-CB 3.07Å; C621-C634 CovalentContact SG-SG 2.05Å; C621-C634 PolarHBondContact SG-SG 3.15Å; R627-C634 HydrophobicContact CB-CB 4.48Å; R627-C634 HydrophobicContact CG-CB 3.8Å; C630-C634 VanDerWaalsContact O-CB 3.28Å; C630-C634 WeakPolarHBondContact O-CB 3.27Å; C630-C634 PolarHBondContact O-N 2.74Å; C630-C634 PolarHBondContact O-SG 2.64Å; C630-C634 VanDerWaalsContact O-SG 3.37Å; E632-C634 VanDerWaalsContact C-N 3.34Å; E632-C634 PolarHBondContact O-N 2.78Å; C634-Y637 PolarHBondContact O-N 3.12Å; C634-V638 WeakPolarHBondContact O-CG2 3.3Å; C634-V638 PolarHBondContact O-N 3.15Å; C634-V638 VanDerWaalsContact O-N 3.08Å
635	Q	79.5	Confident	72.9	Confident	116 Å²	116	84.6 Å²	84.6	54%	0.542	41%	0.409	S	S	.	.	H	α-helix	trans	-62.7	-43.4	172.3	-174.7	175.4	-1.5	0	0	111.2	C631 E632 Y637 Q639	C631-Q635 WeakPolarHBondContact O-CB 3.31Å; C631-Q635 PolarHBondContact O-N 2.89Å; C631-Q635 VanDerWaalsContact O-N 3.08Å; E632-Q635 PolarHBondContact O-N 2.9Å; Q635-Y637 PolarHBondContact O-N 3.11Å; Q635-Q639 PolarHBondContact O-N 3.14Å
636	R	73.6	Confident	71.5	Confident	154 Å²	154	83.4 Å²	83.4	58%	0.581	40%	0.404	S	S	*	.	H	α-helix	trans	-63.6	-38	173.5	-72.6	-170.5	179.9	123.8	13.4	112.8	E632 Q639 M640	E632-R636 PolarHBondContact O-N 2.85Å; E632-R636 IonicContact OE1-CZ 3.67Å; E632-R636 VanDerWaalsContact OE1-CZ 3.31Å; E632-R636 IonicContact OE1-NH1 3.31Å; E632-R636 PolarHBondContact OE1-NH1 3.08Å; E632-R636 IonicContact OE1-NH2 2.7Å; E632-R636 PolarHBondContact OE1-NH2 2.04Å; R636-Q639 PolarHBondContact O-N 3.32Å; R636-M640 PolarHBondContact O-N 2.03Å
637	Y	71.3	Confident	70	Confident	69 Å²	69	86 Å²	86	27%	0.271	43%	0.426	S	S	.	.	H	α-helix	trans	-64.9	-42.6	178.5	179.1	-114.1	0	0	0	113.6	V618 C621 S633 C634 Q635 Q639 M640 I641	V618-Y637 HydrophobicContact CB-CD2 4.26Å; V618-Y637 VanDerWaalsContact CG1-CB 3.48Å; V618-Y637 HydrophobicContact CG1-CD1 4.34Å; V618-Y637 HydrophobicContact CG1-CD2 3.18Å; V618-Y637 HydrophobicContact CG1-CE2 3.89Å; V618-Y637 HydrophobicContact CG1-CG 3.42Å; V618-Y637 VanDerWaalsContact CG1-CG 3.42Å; C621-Y637 HydrophobicContact CB-CD1 3.45Å; C621-Y637 VanDerWaalsContact CB-CD1 3.45Å; C621-Y637 HydrophobicContact CB-CE1 3.9Å; C621-Y637 HydrophobicContact CB-CG 4.19Å; S633-Y637 PolarHBondContact O-N 3.34Å; C634-Y637 PolarHBondContact O-N 3.12Å; Q635-Y637 PolarHBondContact O-N 3.11Å; Y637-Q639 VanDerWaalsContact C-N 3.26Å; Y637-Q639 PolarHBondContact O-N 3.29Å; Y637-M640 PolarHBondContact O-N 2.82Å; Y637-I641 HydrophobicContact CD1-CD1 3.72Å; Y637-I641 HydrophobicContact CD2-CD1 4.42Å; Y637-I641 HydrophobicContact CE1-CD1 3.18Å; Y637-I641 HydrophobicContact CE2-CD1 3.97Å; Y637-I641 HydrophobicContact CE1-CG1 4.28Å; Y637-I641 VanDerWaalsContact O-N 3.16Å; Y637-I641 PolarHBondContact O-N 2.94Å; Y637-I641 HydrophobicContact CE2-CG1 4.27Å; Y637-I641 HydrophobicContact CG-CD1 4.34Å
638	V	70.3	Confident	68.4	Low	81 Å²	81	86.8 Å²	86.8	49%	0.491	44%	0.437	S	S	.	.	H	α-helix	trans	-63.4	-35	178.8	172.9	0	0	0	0	111.3	C634 M640 I641 S642	C634-V638 WeakPolarHBondContact O-CG2 3.3Å; C634-V638 PolarHBondContact O-N 3.15Å; C634-V638 VanDerWaalsContact O-N 3.08Å; V638-M640 VanDerWaalsContact C-N 3.34Å; V638-I641 PolarHBondContact O-N 2.94Å; V638-S642 PolarHBondContact O-N 2.82Å; V638-S642 PolarHBondContact O-OG 3.15Å
639	Q	72	Confident	67	Low	122 Å²	122	84.7 Å²	84.7	57%	0.57	43%	0.432	S	S	*	.	H	α-helix	trans	-66.4	-33	173.2	-69.7	176	-19	0	0	112.7	Q635 R636 Y637 S642	Q635-Q639 PolarHBondContact O-N 3.14Å; R636-Q639 PolarHBondContact O-N 3.32Å; Y637-Q639 VanDerWaalsContact C-N 3.26Å; Y637-Q639 PolarHBondContact O-N 3.29Å; Q639-S642 WeakPolarHBondContact CA-OG 3.19Å; Q639-S642 PolarHBondContact O-OG 3.02Å
640	M	64.3	Low	65.4	Low	133 Å²	133	85.5 Å²	85.5	66%	0.655	44%	0.439	S	S	*	.	H	α-helix	trans	-73.6	-32.5	175.9	-77	-138.5	-88.7	0	0	114.3	R636 Y637 V638 S643 T644	R636-M640 PolarHBondContact O-N 2.03Å; Y637-M640 PolarHBondContact O-N 2.82Å; V638-M640 VanDerWaalsContact C-N 3.34Å; M640-S643 PolarHBondContact O-OG 2.99Å; M640-T644 PolarHBondContact O-OG1 3.44Å
641	I	64.4	Low	63.5	Low	70 Å²	70	93.1 Å²	93.1	36%	0.359	47%	0.473	S	S	.	.	H	α-helix	trans	-76.7	-34.1	178.2	-64	163.5	0	0	0	111.8	Y637 V638 S643 T644 K645	Y637-I641 HydrophobicContact CD1-CD1 3.72Å; Y637-I641 HydrophobicContact CD2-CD1 4.42Å; Y637-I641 HydrophobicContact CE1-CD1 3.18Å; Y637-I641 HydrophobicContact CE2-CD1 3.97Å; Y637-I641 HydrophobicContact CE1-CG1 4.28Å; Y637-I641 VanDerWaalsContact O-N 3.16Å; Y637-I641 PolarHBondContact O-N 2.94Å; Y637-I641 HydrophobicContact CE2-CG1 4.27Å; Y637-I641 HydrophobicContact CG-CD1 4.34Å; V638-I641 PolarHBondContact O-N 2.94Å; I641-S643 VanDerWaalsContact C-N 3.29Å; I641-S643 PolarHBondContact O-N 2.79Å; I641-T644 PolarHBondContact O-N 3.18Å; I641-T644 PolarHBondContact O-OG1 2.72Å; I641-K645 PolarHBondContact O-N 2.91Å
642	S	63.2	Low	61.9	Low	61 Å²	61	98.2 Å²	98.2	43%	0.427	49%	0.492	S	S	.	.	H	α-helix	trans	-61.5	-40.4	177.7	35.7	0	0	0	0	111	V638 Q639 T644 K645 D646	V638-S642 PolarHBondContact O-N 2.82Å; V638-S642 PolarHBondContact O-OG 3.15Å; Q639-S642 WeakPolarHBondContact CA-OG 3.19Å; Q639-S642 PolarHBondContact O-OG 3.02Å; S642-T644 PolarHBondContact O-N 3.1Å; S642-K645 PolarHBondContact O-N 2.84Å; S642-D646 PolarHBondContact O-N 3.29Å
643	S	56.5	Low	60.3	Low	68 Å²	68	99.9 Å²	99.9	48%	0.476	50%	0.503	S	S	.	.	H	α-helix	trans	-67	-30.6	176.7	66.4	0	0	0	0	114.3	M640 I641 S647	M640-S643 PolarHBondContact O-OG 2.99Å; I641-S643 VanDerWaalsContact C-N 3.29Å; I641-S643 PolarHBondContact O-N 2.79Å; S643-S647 PolarHBondContact O-N 2.76Å; S643-S647 PolarHBondContact O-OG 2.91Å
644	T	54.6	Low	58.8	Low	80 Å²	80	106.1 Å²	106.1	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-76.4	-30.2	178.5	5.2	0	0	0	0	113.1	M640 I641 S642 D646 L648	M640-T644 PolarHBondContact O-OG1 3.44Å; I641-T644 PolarHBondContact O-N 3.18Å; I641-T644 PolarHBondContact O-OG1 2.72Å; S642-T644 PolarHBondContact O-N 3.1Å; T644-D646 VanDerWaalsContact C-N 3.33Å; T644-L648 PolarHBondContact O-N 3.4Å
645	K	53.1	Low	56.9	Low	150 Å²	150	114.6 Å²	114.6	65%	0.652	57%	0.568	S	S	*	*	H	α-helix	trans	-68.8	-32.8	173.3	-91.6	-175.6	174.2	-178.9	0	112.4	I641 S642 K649	I641-K645 PolarHBondContact O-N 2.91Å; S642-K645 PolarHBondContact O-N 2.84Å; K645-K649 PolarHBondContact O-N 3.07Å
646	D	52.2	Low	55.2	Low	99 Å²	99	116.8 Å²	116.8	53%	0.529	58%	0.576	S	S	.	*	H	α-helix	trans	-70.8	-34.9	177.1	-69.4	-25.8	0	0	0	111.7	S642 T644 K649 N650	S642-D646 PolarHBondContact O-N 3.29Å; T644-D646 VanDerWaalsContact C-N 3.33Å; D646-K649 PolarHBondContact O-N 2.74Å; D646-N650 PolarHBondContact O-N 2.99Å
647	S	49.3	Very low	53.9	Low	80 Å²	80	113.8 Å²	113.8	56%	0.559	58%	0.578	S	S	*	*	H	α-helix	trans	-65.6	-37.9	174.4	-50.7	0	0	0	0	113.8	S643 N650 F651	S643-S647 PolarHBondContact O-N 2.76Å; S643-S647 PolarHBondContact O-OG 2.91Å; S647-N650 PolarHBondContact O-N 3.31Å; S647-F651 PolarHBondContact O-N 2.88Å
648	L	47.2	Very low	52.6	Low	127 Å²	127	116.9 Å²	116.9	67%	0.665	60%	0.6	S	S	*	*	H	α-helix	trans	-73.8	-31.4	177.8	-83.7	159.2	0	0	0	112.8	T644 N650 F651	T644-L648 PolarHBondContact O-N 3.4Å; L648-N650 VanDerWaalsContact C-N 3.34Å; L648-F651 PolarHBondContact O-N 2.85Å
649	K	47.4	Very low	51.3	Low	142 Å²	142	118.7 Å²	118.7	62%	0.617	61%	0.605	S	S	*	*	H	α-helix	trans	-66.1	-36.4	171.9	-96.4	-177.2	172	-177.4	0	112.2	K645 D646 Q652 N653	K645-K649 PolarHBondContact O-N 3.07Å; D646-K649 PolarHBondContact O-N 2.74Å; K649-Q652 PolarHBondContact O-N 2.87Å; K649-N653 PolarHBondContact O-N 3.47Å
650	N	46.1	Very low	49.7	Very low	109 Å²	109	122.6 Å²	122.6	58%	0.583	62%	0.621	S	S	*	*	H	α-helix	trans	-68.7	-33.1	177.9	-74.7	-12.9	0	0	0	112.7	D646 S647 L648 Q652 N653	D646-N650 PolarHBondContact O-N 2.99Å; S647-N650 PolarHBondContact O-N 3.31Å; L648-N650 VanDerWaalsContact C-N 3.34Å; N650-Q652 VanDerWaalsContact C-N 3.35Å; N650-Q652 PolarHBondContact O-N 2.65Å; N650-N653 PolarHBondContact O-N 3.27Å
651	F	45.3	Very low	48.5	Very low	160 Å²	160	123.6 Å²	123.6	70%	0.702	64%	0.641	S	S	*	*	H	α-helix	trans	-70.7	-26.6	178	-149.3	-94	0	0	0	113.6	S647 L648	S647-F651 PolarHBondContact O-N 2.88Å; L648-F651 PolarHBondContact O-N 2.85Å
652	Q	46	Very low	47.7	Very low	150 Å²	150	126.3 Å²	126.3	70%	0.701	66%	0.655	S	S	*	*	H	α-helix	trans	-78.2	-24.1	174.7	-74.5	-169.3	-34.9	0	0	113.1	K649 N650	K649-Q652 PolarHBondContact O-N 2.87Å; N650-Q652 VanDerWaalsContact C-N 3.35Å; N650-Q652 PolarHBondContact O-N 2.65Å
653	N	47.1	Very low	46.9	Very low	109 Å²	109	129.7 Å²	129.7	58%	0.583	67%	0.667	S	S	*	*	H	α-helix	trans	-80	-20.9	-178.8	-75.1	-13.5	0	0	0	113.7	K649 N650 K655	K649-N653 PolarHBondContact O-N 3.47Å; N650-N653 PolarHBondContact O-N 3.27Å; N653-K655 PolarHBondContact O-N 2.04Å
654	E	47.7	Very low	46.4	Very low	145 Å²	145	133.2 Å²	133.2	68%	0.678	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-18.4	179.4	-78.6	-172.9	160	0	0	114.3
655	K	44.6	Very low	45.9	Very low	181 Å²	181	136.3 Å²	136.3	79%	0.787	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-13.5	-178.8	-132.8	177.8	-174.1	-179.7	0	114.6	N653	N653-K655 PolarHBondContact O-N 2.04Å
656	F	43.3	Very low	45.5	Very low	163 Å²	163	135.4 Å²	135.4	72%	0.715	69%	0.691	S	S	*	*	S	Bend	trans	-104.9	-2.4	-175.4	-85.3	-79.8	0	0	0	115.2
657	S	45.7	Very low	45	Very low	90 Å²	90	137.9 Å²	137.9	63%	0.629	70%	0.702	S	S	*	*	S	Bend	trans	-101.3	-2.9	-179.6	-57.8	0	0	0	0	114.9	I659	S657-I659 VanDerWaalsContact C-N 3.31Å; S657-I659 PolarHBondContact O-N 3.46Å
658	N	45.5	Very low	44.7	Very low	135 Å²	135	142 Å²	142	72%	0.722	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	20.8	172.7	-80.5	-9.9	0	0	0	113.9
659	I	42	Very low	44.5	Very low	119 Å²	119	143.2 Å²	143.2	61%	0.61	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113	-3.2	178.1	-64.2	175	0	0	0	112.4	S657	S657-I659 VanDerWaalsContact C-N 3.31Å; S657-I659 PolarHBondContact O-N 3.46Å
660	F	38.7	Very low	44.3	Very low	204 Å²	204	143.3 Å²	143.3	90%	0.895	72%	0.723	S	S	*	*			trans	-123.5	38.3	177.8	-77.6	-74.9	0	0	0	114
661	S	39.5	Very low	44.1	Very low	154 Å²	154	146.4 Å²	146.4	100%	1.077	74%	0.736	S	S	*	*			trans	-138.1	0	163.7	55.2	0	0	0	0	107.5

Retrieved 661 of 661 residues in 166.6 ms (Link to these results)

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