A0A3Q0KL52_SCHMA Loading...

Leishmanolysin-like peptidase

AlphaFold DB , UniProt , Accession A0A3Q0KL52, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 753 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	31	Very low	31.9	Very low	222 Å²	222	171.3 Å²	171.3	100%	1.094	82%	0.822	S	S	*	*				0	86.1	0	-71	174.9	71	0	0	109.5
2	W	33.1	Very low	32	Very low	259 Å²	259	170.7 Å²	170.7	98%	0.981	82%	0.824	S	S	*	*			trans	-107.2	123.6	166.3	-87.1	41.3	0	0	0	107.4
3	K	29.5	Very low	32	Very low	193 Å²	193	172.1 Å²	172.1	84%	0.839	82%	0.824	S	S	*	*			trans	-79.6	129.8	-162.8	-74.4	173.8	173.5	174.8	0	110.8	K5	K3-K5 PolarHBondContact O-N 3.07Å; K3-K5 VanDerWaalsContact O-N 3.07Å
4	I	36.1	Very low	31.5	Very low	148 Å²	148	164.6 Å²	164.6	76%	0.759	82%	0.815	S	S	*	*	S	Bend	trans	-73.8	82.3	173	-59.6	165.6	0	0	0	109.1	I7	I4-I7 HydrophobicContact CG2-CD1 4.07Å
5	K	35.3	Very low	31.5	Very low	186 Å²	186	162 Å²	162	81%	0.809	81%	0.811	S	S	*	*			trans	-140.4	2.8	168.3	-89.8	-157.4	175.2	-176.1	0	118.4	K3	K3-K5 PolarHBondContact O-N 3.07Å; K3-K5 VanDerWaalsContact O-N 3.07Å
6	D	35.6	Very low	31.1	Very low	158 Å²	158	162.7 Å²	162.7	85%	0.845	81%	0.811	S	S	*	*			trans	-104	37.4	174.6	-59.5	-35.9	0	0	0	113.1	I8	D6-I8 VanDerWaalsContact C-N 3.3Å; D6-I8 PolarHBondContact O-N 3.24Å; D6-I8 VanDerWaalsContact O-N 3.15Å
7	I	32.4	Very low	30.8	Very low	132 Å²	132	161.9 Å²	161.9	68%	0.677	81%	0.809	S	S	*	*			trans	-80.2	84.1	162.1	-59.4	175.1	0	0	0	106.8	I4	I4-I7 HydrophobicContact CG2-CD1 4.07Å
8	I	32.2	Very low	30.5	Very low	134 Å²	134	161.1 Å²	161.1	69%	0.687	81%	0.806	S	S	*	*			trans	-102.7	105.6	163.4	-64	179.9	0	0	0	107.4	D6 F10	D6-I8 VanDerWaalsContact C-N 3.3Å; D6-I8 PolarHBondContact O-N 3.24Å; D6-I8 VanDerWaalsContact O-N 3.15Å; I8-F10 HydrophobicContact CG2-CD2 4.37Å; I8-F10 HydrophobicContact CG2-CE2 4.44Å; I8-F10 PolarHBondContact O-N 3.5Å
9	L	27	Very low	30.2	Very low	156 Å²	156	160.7 Å²	160.7	82%	0.817	81%	0.805	S	S	*	*			trans	-55.1	111.1	169.6	-73.9	134	0	0	0	110.5
10	F	28.7	Very low	30	Very low	182 Å²	182	157.7 Å²	157.7	80%	0.798	80%	0.8	S	S	*	*			trans	-106.7	117.8	154.4	-98.2	-86.6	0	0	0	107.7	I8 I12	I8-F10 HydrophobicContact CG2-CD2 4.37Å; I8-F10 HydrophobicContact CG2-CE2 4.44Å; I8-F10 PolarHBondContact O-N 3.5Å; F10-I12 PolarHBondContact O-N 3.13Å
11	P	30.3	Very low	29.7	Very low	114 Å²	114	152.3 Å²	152.3	74%	0.74	78%	0.784	S	S	*	*			trans	-70.5	106.7	-179.6	29.1	-29.5	0	0	0	107.6	F13	P11-F13 PolarHBondContact O-N 3.09Å; P11-F13 VanDerWaalsContact O-N 3.12Å
12	I	32.6	Very low	29.6	Very low	164 Å²	164	148.2 Å²	148.2	84%	0.841	77%	0.766	S	S	*	*			trans	-59.3	117	164.9	-66.9	173.3	0	0	0	105.8	F10 G14	F10-I12 PolarHBondContact O-N 3.13Å; I12-G14 PolarHBondContact O-N 3.31Å; I12-G14 VanDerWaalsContact O-N 3.11Å
13	F	32.2	Very low	29.3	Very low	189 Å²	189	145.2 Å²	145.2	83%	0.829	75%	0.754	S	S	*	*			trans	-26.4	113.8	168.7	-89.6	-104	0	0	0	110.6	P11 V15	P11-F13 PolarHBondContact O-N 3.09Å; P11-F13 VanDerWaalsContact O-N 3.12Å; F13-V15 VanDerWaalsContact C-N 3.26Å; F13-V15 PolarHBondContact O-N 3.47Å
14	G	25.8	Very low	29.5	Very low	67 Å²	67	140 Å²	140	69%	0.691	74%	0.736	S	S	*	*			trans	-54.9	98.3	165	0	0	0	0	0	107.7	I12 H16	I12-G14 PolarHBondContact O-N 3.31Å; I12-G14 VanDerWaalsContact O-N 3.11Å; G14-H16 PolarHBondContact O-N 3.12Å
15	V	30.5	Very low	29.4	Very low	126 Å²	126	137.5 Å²	137.5	76%	0.764	72%	0.724	S	S	*	*			trans	-60.7	101.1	159.3	176.4	0	0	0	0	103.6	F13 L17	F13-V15 VanDerWaalsContact C-N 3.26Å; F13-V15 PolarHBondContact O-N 3.47Å; V15-L17 PolarHBondContact O-N 3.15Å
16	H	25.2	Very low	29.2	Very low	173 Å²	173	137.6 Å²	137.6	80%	0.801	72%	0.719	S	S	*	*			trans	-50.8	96.8	163.8	-92.7	-77.7	0	0	0	106.3	G14 I18	G14-H16 PolarHBondContact O-N 3.12Å; H16-I18 PolarHBondContact O-N 3.44Å
17	L	26	Very low	29.5	Very low	150 Å²	150	137.1 Å²	137.1	79%	0.785	71%	0.71	S	S	*	*			trans	-59	99.5	160.3	-133.2	92.8	0	0	0	103.4	V15 I19	V15-L17 PolarHBondContact O-N 3.15Å; L17-I19 VanDerWaalsContact C-N 3.27Å; L17-I19 PolarHBondContact O-N 3.3Å
18	I	26.3	Very low	30.4	Very low	146 Å²	146	132.2 Å²	132.2	75%	0.749	69%	0.687	S	S	*	*			trans	-58.2	105.1	171.2	-66.5	173.6	0	0	0	103.8	H16 S20	H16-I18 PolarHBondContact O-N 3.44Å; I18-S20 PolarHBondContact O-N 3.18Å
19	I	24.2	Very low	31.6	Very low	155 Å²	155	127.6 Å²	127.6	80%	0.795	67%	0.665	S	S	*	*			trans	-65	79.4	165.9	-58.6	171.6	0	0	0	104.5	L17 G21	L17-I19 VanDerWaalsContact C-N 3.27Å; L17-I19 PolarHBondContact O-N 3.3Å; I19-G21 PolarHBondContact O-N 3.4Å
20	S	26.5	Very low	33.3	Very low	100 Å²	100	120.5 Å²	120.5	70%	0.699	63%	0.628	S	S	*	*			trans	-73.5	64.5	155	52.5	0	0	0	0	106.7	I18 L22	I18-S20 PolarHBondContact O-N 3.18Å; S20-L22 PolarHBondContact O-N 3.02Å
21	G	24.1	Very low	34.8	Very low	45 Å²	45	112 Å²	112	46%	0.464	59%	0.591	S	S	.	*			trans	-60	133.1	160.3	0	0	0	0	0	107.8	I19	I19-G21 PolarHBondContact O-N 3.4Å
22	L	29	Very low	36	Very low	136 Å²	136	109.5 Å²	109.5	71%	0.712	57%	0.569	S	S	*	*			trans	60.2	60.9	149.3	-58.4	163.4	0	0	0	115.1	S20	S20-L22 PolarHBondContact O-N 3.02Å
23	R	26.4	Very low	37.3	Very low	195 Å²	195	102.3 Å²	102.3	74%	0.736	53%	0.532	S	S	*	.			trans	-122.5	77.3	146.5	-123.8	-177.2	-177.2	-168.1	2.4	108	D25 R26	R23-D25 PolarHBondContact O-N 3.15Å; R23-R26 PolarHBondContact O-N 2.66Å
24	N	33.9	Very low	38.3	Very low	85 Å²	85	94.1 Å²	94.1	46%	0.455	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	2.1	-177.3	-87	4.9	0	0	0	115.3
25	D	33.5	Very low	39.9	Very low	94 Å²	94	95.5 Å²	95.5	50%	0.503	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	5.5	-173.3	-109.7	37	0	0	0	114.2	R23 F27 K195	R23-D25 PolarHBondContact O-N 3.15Å; D25-F27 VanDerWaalsContact C-N 3.25Å; D25-F27 PolarHBondContact O-N 3.31Å; D25-K195 IonicContact OD2-NZ 2.92Å; D25-K195 PolarHBondContact OD2-NZ 3.19Å
26	R	31.7	Very low	41.4	Very low	188 Å²	188	90.7 Å²	90.7	71%	0.709	46%	0.46	S	S	*	.	S	Bend	trans	-71	-13.3	179.8	-82.9	-160.9	-168.5	-161.6	4.8	114.8	R23	R23-R26 PolarHBondContact O-N 2.66Å
27	F	41.1	Very low	43.5	Very low	149 Å²	149	85.8 Å²	85.8	65%	0.654	44%	0.44	S	S	*	.	S	Bend	trans	-108.6	-10.5	-166.5	-76.8	-79.3	0	0	0	116.2	D25 T29	D25-F27 VanDerWaalsContact C-N 3.25Å; D25-F27 PolarHBondContact O-N 3.31Å; F27-T29 PolarHBondContact O-N 3.26Å
28	S	51.3	Low	45.6	Very low	28 Å²	28	80.1 Å²	80.1	20%	0.196	41%	0.409	C	S	.	.			trans	-92.5	104.4	168.8	73.4	0	0	0	0	109	M30	S28-M30 PolarHBondContact O-N 3.23Å
29	T	58.2	Low	47.8	Very low	37 Å²	37	75.1 Å²	75.1	23%	0.227	39%	0.387	C	S	.	.			trans	-73.4	124	172.8	-56.6	0	0	0	0	108.3	F27 L197 T364 Y365	F27-T29 PolarHBondContact O-N 3.26Å; T29-L197 HydrophobicContact CG2-CD1 3.23Å; T29-L197 HydrophobicContact CG2-CD2 3.42Å; T29-L197 VanDerWaalsContact CG2-CD2 3.42Å; T29-L197 HydrophobicContact CG2-CG 3.16Å; T29-T364 WeakPolarHBondContact O-CA 3.47Å; T29-Y365 PolarHBondContact O-N 2.55Å
30	M	61.4	Low	50.4	Low	8 Å²	8	71.7 Å²	71.7	4%	0.039	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-120.9	132.9	-169.8	-64.8	-179.6	62.8	0	0	111.7	S28 K195 D342 V346 A363 T364 L508	S28-M30 PolarHBondContact O-N 3.23Å; M30-K195 CarbonylContact C-O 3.32Å; M30-K195 HydrophobicContact CB-CB 4.25Å; M30-K195 PolarHBondContact N-O 3.27Å; M30-K195 CarbonylContact O-C 3.57Å; M30-K195 HydrophobicContact SD-CD 3.95Å; M30-D342 HydrophobicContact CE-CB 4.28Å; M30-D342 WeakPolarHBondContact CE-OD2 3.24Å; M30-V346 HydrophobicContact CE-CG1 4.23Å; M30-V346 HydrophobicContact CE-CG2 3.84Å; M30-A363 CarbonylContact C-O 3.52Å; M30-A363 WeakPolarHBondContact CA-O 3.43Å; M30-T364 HydrophobicContact CG-CG2 3.74Å; M30-L508 HydrophobicContact CE-CD1 3.71Å; M30-L508 HydrophobicContact CE-CD2 4.12Å; M30-L508 HydrophobicContact CE-CG 4.26Å; M30-L508 HydrophobicContact SD-CD1 4.45Å
31	C	60.2	Low	53.1	Low	2 Å²	2	67.7 Å²	67.7	1%	0.014	34%	0.339	C	S	.	.			trans	-77.4	126.2	168.6	-61.5	0	0	0	0	109	H240 V346 A363	C31-H240 WeakPolarHBondContact CB-NE2 3.29Å; C31-V346 WeakPolarHBondContact O-CG2 3.33Å; C31-A363 PolarHBondContact N-O 3.27Å
32	H	55	Low	56	Low	63 Å²	63	66.3 Å²	66.3	29%	0.292	32%	0.322	S	S	.	.			trans	-124.1	101.3	178.7	-164.8	81	0	0	0	109.4	G34 V196 A344	H32-G34 PolarHBondContact O-N 2.97Å; H32-G34 VanDerWaalsContact O-N 3.13Å; H32-V196 HydrophobicContact CB-CG2 3.48Å; H32-V196 VanDerWaalsContact CB-CG2 3.48Å; H32-A344 PolarHBondContact CE1-O 3.27Å; H32-A344 PolarHBondContact ND1-O 3.48Å; H32-A344 PolarHBondContact NE2-O 3.08Å
33	H	60.8	Low	58.6	Low	13 Å²	13	60.5 Å²	60.5	6%	0.06	29%	0.292	C	S	.	.			trans	-82.1	92.6	-178.7	-61.8	89.6	0	0	0	110	H240 E241 H244 G345 H350	H33-H240 AromaticContact CE1-NE2 3.37Å; H33-H240 PolarHBondContact CE1-NE2 2.97Å; H33-H240 AromaticContact NE2-NE2 3.94Å; H33-E241 IonicContact CD2-OE2 3.8Å; H33-E241 IonicContact NE2-OE1 3.19Å; H33-E241 IonicContact NE2-OE2 3.8Å; H33-E241 PolarHBondContact NE2-OE2 3.19Å; H33-E241 VanDerWaalsContact NE2-OE2 3.09Å; H33-H244 AromaticContact CD2-CD2 3.65Å; H33-H244 AromaticContact CD2-CG 3.83Å; H33-H244 AromaticContact CE1-CD2 3.18Å; H33-H244 PolarHBondContact CE1-CD2 3.29Å; H33-H244 AromaticContact CE1-CE1 3.66Å; H33-H244 AromaticContact CE1-CG 3.99Å; H33-H244 AromaticContact CE1-NE2 2.95Å; H33-H244 PolarHBondContact CE1-NE2 3.16Å; H33-H244 AromaticContact ND1-CD2 3.98Å; H33-H244 AromaticContact ND1-CE1 3.83Å; H33-H244 AromaticContact ND1-NE2 3.57Å; H33-H244 AromaticContact NE2-CD2 2.93Å; H33-H244 PolarHBondContact NE2-CD2 3.32Å; H33-H244 AromaticContact NE2-CG 3.59Å; H33-H244 AromaticContact NE2-NE2 3.3Å; H33-H244 PolarHBondContact NE2-NE2 2.66Å; H33-G345 PolarHBondContact N-O 3.09Å; H33-G345 WeakPolarHBondContact O-CA 2.98Å; H33-H350 AromaticContact CE1-CE1 3.8Å; H33-H350 AromaticContact CE1-NE2 3.24Å; H33-H350 PolarHBondContact CE1-NE2 2.98Å; H33-H350 AromaticContact ND1-CE1 3.38Å; H33-H350 PolarHBondContact ND1-CE1 2.88Å; H33-H350 AromaticContact ND1-NE2 3.27Å; H33-H350 PolarHBondContact ND1-NE2 2.76Å
34	G	52.6	Low	61.3	Low	17 Å²	17	52.2 Å²	52.2	18%	0.175	26%	0.261	C	S	.	.			trans	-63.4	140.2	176.2	0	0	0	0	0	112	H32 R190	H32-G34 PolarHBondContact O-N 2.97Å; H32-G34 VanDerWaalsContact O-N 3.13Å; G34-R190 PolarHBondContact O-NH1 2.92Å
35	M	60.6	Low	63.5	Low	95 Å²	95	48.1 Å²	48.1	47%	0.468	24%	0.24	S	C	.	.			trans	-41.8	130.5	-178.2	-51.1	166	-164	0	0	112.5	R190 G284 A344	M35-R190 PolarHBondContact O-NH2 2.63Å; M35-G284 WeakPolarHBondContact SD-CA 3.45Å; M35-A344 HydrophobicContact CE-CB 3.4Å; M35-A344 VanDerWaalsContact CE-CB 3.4Å
36	I	61.2	Low	65.6	Low	26 Å²	26	45.7 Å²	45.7	13%	0.133	23%	0.226	C	C	.	.			trans	-74.4	131.3	169.9	-55.5	174.8	0	0	0	107.6	H38 V41 A201 S251	I36-H38 PolarHBondContact O-N 3.08Å; I36-V41 HydrophobicContact CG2-CG2 3.29Å; I36-A201 HydrophobicContact CD1-CB 3.38Å; I36-A201 HydrophobicContact CG1-CB 3.58Å; I36-S251 WeakPolarHBondContact CD1-OG 3.31Å
37	N	69.6	Low	67.2	Low	69 Å²	69	37.6 Å²	37.6	37%	0.369	20%	0.198	S	C	.	.			trans	-74.2	113	167	-177.4	2.6	0	0	0	108.5	S39 E40	N37-S39 PolarHBondContact ND2-OG 3.43Å; N37-S39 PolarHBondContact O-N 2.9Å; N37-S39 VanDerWaalsContact O-N 3.15Å; N37-S39 PolarHBondContact OD1-N 3.12Å; N37-S39 PolarHBondContact OD1-OG 3.1Å; N37-E40 HydrophobicContact CB-CG 4.03Å; N37-E40 WeakPolarHBondContact O-CB 2.94Å; N37-E40 PolarHBondContact O-N 2.71Å
38	H	69.2	Low	67.7	Low	32 Å²	32	31.9 Å²	31.9	15%	0.148	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-59.7	-27.8	-177.9	177.7	-77.7	0	0	0	112.6	I36 E40 V41 W278 Y287	I36-H38 PolarHBondContact O-N 3.08Å; H38-E40 PolarHBondContact O-N 2.94Å; H38-E40 VanDerWaalsContact O-N 3.13Å; H38-V41 PolarHBondContact O-N 2.9Å; H38-V41 VanDerWaalsContact O-N 3.08Å; H38-W278 HydrophobicContact CB-CH2 3.72Å; H38-W278 HydrophobicContact CB-CZ3 4.05Å; H38-W278 AromaticContact CG-CH2 3.58Å; H38-W278 AromaticContact ND1-CH2 3.99Å; H38-Y287 AromaticContact CD2-CE2 3.23Å; H38-Y287 WeakPolarHBondContact CD2-CE2 3.32Å; H38-Y287 AromaticContact CD2-CZ 3.77Å; H38-Y287 PolarHBondContact CE1-OH 3.02Å; H38-Y287 AromaticContact NE2-CE2 3.14Å; H38-Y287 WeakPolarHBondContact NE2-CE2 3.44Å; H38-Y287 AromaticContact NE2-CZ 3.41Å; H38-Y287 PolarHBondContact NE2-OH 3.48Å
39	S	73	Confident	67.6	Low	41 Å²	41	35.8 Å²	35.8	29%	0.287	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-63.8	-16.3	175.5	71.9	0	0	0	0	113.2	N37 G118	N37-S39 PolarHBondContact ND2-OG 3.43Å; N37-S39 PolarHBondContact O-N 2.9Å; N37-S39 VanDerWaalsContact O-N 3.15Å; N37-S39 PolarHBondContact OD1-N 3.12Å; N37-S39 PolarHBondContact OD1-OG 3.1Å; S39-G118 WeakPolarHBondContact O-CA 3.35Å
40	E	78.9	Confident	67	Low	83 Å²	83	38 Å²	38	39%	0.388	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-94.6	-12.2	177	-60	176.2	-176.9	0	0	113.1	N37 H38	N37-E40 HydrophobicContact CB-CG 4.03Å; N37-E40 WeakPolarHBondContact O-CB 2.94Å; N37-E40 PolarHBondContact O-N 2.71Å; H38-E40 PolarHBondContact O-N 2.94Å; H38-E40 VanDerWaalsContact O-N 3.13Å
41	V	83.9	Confident	66	Low	16 Å²	16	43.2 Å²	43.2	10%	0.097	23%	0.232	C	C	.	.			trans	-89.4	118.6	179.2	-178.1	0	0	0	0	110.1	I36 H38 T43 C203 L205	I36-V41 HydrophobicContact CG2-CG2 3.29Å; H38-V41 PolarHBondContact O-N 2.9Å; H38-V41 VanDerWaalsContact O-N 3.08Å; V41-T43 HydrophobicContact CG1-CG2 4.46Å; V41-T43 PolarHBondContact O-N 2.7Å; V41-C203 WeakPolarHBondContact CA-O 3.49Å; V41-L205 HydrophobicContact CG1-CG 4.47Å
42	V	83.7	Confident	65.3	Low	15 Å²	15	52.7 Å²	52.7	9%	0.091	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	106.7	174.2	-170.1	0	0	0	0	109	V45 D112 V114 C203 Q204 L205	V42-V45 HydrophobicContact CB-CG2 4.23Å; V42-V45 HydrophobicContact CG1-CG2 3.74Å; V42-D112 HydrophobicContact CG1-CB 4.02Å; V42-V114 HydrophobicContact CG2-CB 4.42Å; V42-V114 HydrophobicContact CG2-CG2 3.57Å; V42-C203 PolarHBondContact N-O 3.45Å; V42-Q204 HydrophobicContact CB-CG 4.01Å; V42-Q204 HydrophobicContact CG2-CG 4.44Å; V42-Q204 VanDerWaalsContact O-CA 3.29Å; V42-Q204 WeakPolarHBondContact O-CA 3.45Å; V42-L205 PolarHBondContact O-N 2.85Å
43	T	84.7	Confident	64.5	Low	14 Å²	14	57.4 Å²	57.4	9%	0.086	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	167.3	172.3	60	0	0	0	0	111	V41 V45 I131 L205	V41-T43 HydrophobicContact CG1-CG2 4.46Å; V41-T43 PolarHBondContact O-N 2.7Å; T43-V45 VanDerWaalsContact C-N 3.34Å; T43-V45 PolarHBondContact O-N 3.07Å; T43-I131 VanDerWaalsContact O-CD1 3.29Å; T43-I131 WeakPolarHBondContact O-CD1 3.01Å; T43-L205 HydrophobicContact CG2-CD1 4.38Å
44	H	82.1	Confident	63.8	Low	21 Å²	21	59.3 Å²	59.3	10%	0.097	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	56	40	169.5	-146.7	83.2	0	0	0	116.1	I131 L205 A207	H44-I131 HydrophobicContact CB-CD1 3.47Å; H44-I131 VanDerWaalsContact CB-CD1 3.47Å; H44-I131 HydrophobicContact CB-CG1 3.97Å; H44-L205 PolarHBondContact N-O 3.01Å; H44-A207 HydrophobicContact CB-CB 4.22Å; H44-A207 PolarHBondContact ND1-O 3.2Å
45	V	80.9	Confident	63.3	Low	0 Å²	0	69 Å²	69	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	126.1	176.2	-178.3	0	0	0	0	109.8	V42 T43 D112 Q204 L205 A207 M213	V42-V45 HydrophobicContact CB-CG2 4.23Å; V42-V45 HydrophobicContact CG1-CG2 3.74Å; T43-V45 VanDerWaalsContact C-N 3.34Å; T43-V45 PolarHBondContact O-N 3.07Å; V45-D112 HydrophobicContact CG1-CB 4.37Å; V45-D112 HydrophobicContact CG2-CB 4.21Å; V45-Q204 HydrophobicContact CG2-CB 4.17Å; V45-L205 PolarHBondContact N-O 2.95Å; V45-A207 WeakPolarHBondContact O-CB 3.3Å; V45-A207 PolarHBondContact O-N 3.35Å; V45-M213 HydrophobicContact CB-SD 4.07Å; V45-M213 HydrophobicContact CG1-CE 4.29Å; V45-M213 HydrophobicContact CG1-SD 4.14Å
46	M	77.5	Confident	62.5	Low	43 Å²	43	76.4 Å²	76.4	21%	0.212	36%	0.364	C	S	.	.			trans	-91.5	121.7	178.5	-84.6	-73.7	163.3	0	0	111	S48 L130 A207	M46-S48 PolarHBondContact O-N 2.9Å; M46-L130 HydrophobicContact CB-CD2 3.85Å; M46-L130 HydrophobicContact CG-CD2 3.71Å; M46-A207 HydrophobicContact CE-CB 3.21Å; M46-A207 HydrophobicContact CG-CB 4.06Å; M46-A207 HydrophobicContact SD-CB 3.98Å
47	S	65.1	Low	61.7	Low	18 Å²	18	82.8 Å²	82.8	13%	0.126	40%	0.399	C	S	.	.			trans	-69.5	115.1	174.3	-170.3	0	0	0	0	110.4	N49 P106	S47-N49 PolarHBondContact O-N 3.29Å; S47-P106 VanDerWaalsContact OG-CB 3.25Å; S47-P106 WeakPolarHBondContact OG-CB 3.42Å; S47-P106 WeakPolarHBondContact OG-CG 3.41Å
48	S	51.2	Low	60.8	Low	28 Å²	28	82.1 Å²	82.1	20%	0.196	40%	0.403	C	S	.	.	S	Bend	trans	-69.8	131.5	178.3	64.6	0	0	0	0	111	M46	M46-S48 PolarHBondContact O-N 2.9Å
49	N	49.2	Very low	60.4	Low	111 Å²	111	86.4 Å²	86.4	59%	0.594	42%	0.423	S	S	*	.			trans	73.1	58.8	174.8	-56.4	-20.5	0	0	0	116.1	S47 Q51	S47-N49 PolarHBondContact O-N 3.29Å; N49-Q51 PolarHBondContact O-N 3.31Å
50	V	46.8	Very low	60.6	Low	83 Å²	83	85.2 Å²	85.2	50%	0.503	41%	0.414	S	S	.	.			trans	-62.2	94.7	161.2	179.2	0	0	0	0	108.7	K52 A104	V50-K52 PolarHBondContact O-N 2.93Å; V50-A104 HydrophobicContact CB-CB 3.74Å; V50-A104 HydrophobicContact CG1-CB 3.24Å; V50-A104 HydrophobicContact CG2-CB 3.94Å
51	Q	39.7	Very low	61	Low	117 Å²	117	86.2 Å²	86.2	55%	0.547	42%	0.418	S	S	.	.			trans	-62.7	109.9	162.4	-77.3	-173	-9.6	0	0	107.3	N49 L53	N49-Q51 PolarHBondContact O-N 3.31Å; Q51-L53 PolarHBondContact O-N 2.03Å
52	K	44.5	Very low	61.4	Low	202 Å²	202	85.5 Å²	85.5	88%	0.878	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	8	176.1	-89.1	-178.1	174.7	177.4	0	114.5	V50	V50-K52 PolarHBondContact O-N 2.93Å
53	L	38.5	Very low	61.9	Low	161 Å²	161	88 Å²	88	84%	0.843	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.1	26.8	-166.3	-76.3	166.2	0	0	0	114.6	Q51 R55	Q51-L53 PolarHBondContact O-N 2.03Å; L53-R55 PolarHBondContact O-N 2.78Å
54	I	46.5	Very low	62.4	Low	54 Å²	54	88 Å²	88	28%	0.277	42%	0.421	S	S	.	.	S	Bend	trans	-74.7	123.1	167	-58.2	-179.6	0	0	0	108.3	R56 S102 M105	I54-R56 PolarHBondContact O-N 3.26Å; I54-S102 WeakPolarHBondContact CB-OG 3.23Å; I54-S102 WeakPolarHBondContact CG2-OG 3.38Å; I54-M105 HydrophobicContact CD1-CB 4.41Å
55	R	42.3	Very low	63.1	Low	221 Å²	221	90 Å²	90	83%	0.834	43%	0.431	S	S	*	.			trans	-44.4	125.4	175.2	-82.8	178.4	167	169.2	-4.1	109.6	L53 N57 A58	L53-R55 PolarHBondContact O-N 2.78Å; R55-N57 PolarHBondContact O-N 2.81Å; R55-A58 PolarHBondContact O-N 3.36Å
56	R	43	Very low	63.8	Low	249 Å²	249	91.6 Å²	91.6	94%	0.94	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-7	-175.2	-79.3	-178.1	173.6	172.4	-2.5	116.7	I54	I54-R56 PolarHBondContact O-N 3.26Å
57	N	44.3	Very low	64.8	Low	161 Å²	161	91.6 Å²	91.6	86%	0.861	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.2	7	-174.9	-83.2	7.3	0	0	0	115.8	R55 Q59	R55-N57 PolarHBondContact O-N 2.81Å; N57-Q59 PolarHBondContact O-N 3.45Å
58	A	52.1	Low	66.3	Low	55 Å²	55	91.5 Å²	91.5	46%	0.455	44%	0.437	S	S	.	.			trans	-89.2	104.3	171.9	0	0	0	0	0	109.5	R55 T60	R55-A58 PolarHBondContact O-N 3.36Å; A58-T60 PolarHBondContact O-N 2.86Å
59	Q	60.5	Low	68.5	Low	122 Å²	122	92 Å²	92	57%	0.57	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-55.1	129.8	161.7	-71.1	174.7	-33.2	0	0	107.7	N57 L98 I386	N57-Q59 PolarHBondContact O-N 3.45Å; Q59-L98 HydrophobicContact CB-CD1 4.31Å; Q59-I386 HydrophobicContact CG-CD1 4.43Å
60	T	76.8	Confident	70.7	Confident	15 Å²	15	96.7 Å²	96.7	9%	0.092	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	123.2	-177	-51.9	0	0	0	0	108.5	A58 L99 M105	A58-T60 PolarHBondContact O-N 2.86Å; T60-L99 HydrophobicContact CG2-CD1 4.25Å; T60-L99 WeakPolarHBondContact O-CB 3.31Å; T60-L99 PolarHBondContact O-N 2.84Å; T60-M105 HydrophobicContact CG2-CG 4.24Å; T60-M105 HydrophobicContact CG2-SD 4.42Å
61	E	88.3	Confident	73	Confident	104 Å²	104	93.6 Å²	93.6	49%	0.486	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	140.8	173.8	-65.1	164.3	174.1	0	0	110.6	R63 N178	E61-R63 HydrophobicContact CB-CG 4.44Å; E61-R63 PolarHBondContact O-N 2.85Å; E61-R63 IonicContact OE2-CZ 3.51Å; E61-R63 IonicContact OE2-NE 2.64Å; E61-R63 PolarHBondContact OE2-NE 3.11Å; E61-R63 IonicContact OE2-NH2 2.79Å; E61-R63 PolarHBondContact OE2-NH2 2.8Å; E61-N178 PolarHBondContact O-ND2 2.83Å
62	L	92.5	Very high	75.6	Confident	2 Å²	2	88 Å²	88	1%	0.01	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-63.9	131.4	163	179	64.3	0	0	0	108.1	I64 E94 L97 L99 N178 F179 L246 Y385	L62-I64 HydrophobicContact CD1-CG1 4.37Å; L62-I64 HydrophobicContact CD2-CD1 4.07Å; L62-I64 HydrophobicContact CD2-CG1 4.3Å; L62-I64 HydrophobicContact CG-CD1 4.37Å; L62-I64 HydrophobicContact CG-CG1 4.06Å; L62-E94 WeakPolarHBondContact O-CG 3.04Å; L62-L97 VanDerWaalsContact CB-O 3.28Å; L62-L97 WeakPolarHBondContact CB-O 3.26Å; L62-L97 HydrophobicContact CD2-CB 4.07Å; L62-L97 HydrophobicContact CD2-CD1 4.38Å; L62-L99 HydrophobicContact CD1-CD2 4.31Å; L62-N178 WeakPolarHBondContact CD1-OD1 3.46Å; L62-F179 HydrophobicContact CD1-CB 4.38Å; L62-L246 HydrophobicContact CD2-CD1 4.17Å; L62-L246 HydrophobicContact CD2-CD2 4.4Å; L62-Y385 HydrophobicContact CD1-CE1 4.23Å
63	R	92.9	Very high	77.9	Confident	67 Å²	67	83.7 Å²	83.7	25%	0.253	38%	0.383	S	S	.	.			trans	-132.8	101.5	-179.3	-70.4	-177.1	176.9	-115.6	-6.2	109.5	E61 E94 R176 A177 N178 F179	E61-R63 HydrophobicContact CB-CG 4.44Å; E61-R63 PolarHBondContact O-N 2.85Å; E61-R63 IonicContact OE2-CZ 3.51Å; E61-R63 IonicContact OE2-NE 2.64Å; E61-R63 PolarHBondContact OE2-NE 3.11Å; E61-R63 IonicContact OE2-NH2 2.79Å; E61-R63 PolarHBondContact OE2-NH2 2.8Å; R63-E94 VanDerWaalsContact CA-OE1 3.32Å; R63-E94 WeakPolarHBondContact CA-OE1 3.25Å; R63-R176 WeakPolarHBondContact CD-O 3.23Å; R63-A177 WeakPolarHBondContact O-CA 3.46Å; R63-N178 PolarHBondContact N-ND2 3.21Å; R63-N178 PolarHBondContact N-OD1 3.31Å; R63-N178 PolarHBondContact O-N 2.87Å; R63-N178 PolarHBondContact O-OD1 3.36Å; R63-F179 PolarHBondContact O-N 3.05Å
64	I	95.7	Very high	80.5	Confident	15 Å²	15	80.4 Å²	80.4	8%	0.077	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	112.5	-176.5	-61.4	176.4	0	0	0	108.9	L62 T66 I90 W93 E94 F179 L181 I242 L246	L62-I64 HydrophobicContact CD1-CG1 4.37Å; L62-I64 HydrophobicContact CD2-CD1 4.07Å; L62-I64 HydrophobicContact CD2-CG1 4.3Å; L62-I64 HydrophobicContact CG-CD1 4.37Å; L62-I64 HydrophobicContact CG-CG1 4.06Å; I64-T66 HydrophobicContact CG2-CG2 4.47Å; I64-I90 HydrophobicContact CB-CG2 3.94Å; I64-I90 HydrophobicContact CD1-CG2 4.29Å; I64-I90 HydrophobicContact CG2-CG1 4.47Å; I64-I90 HydrophobicContact CG2-CG2 4.23Å; I64-W93 HydrophobicContact CD1-CB 4.46Å; I64-E94 HydrophobicContact CD1-CG 4.39Å; I64-E94 HydrophobicContact CG1-CG 4.34Å; I64-E94 PolarHBondContact N-OE1 3.49Å; I64-F179 HydrophobicContact CG1-CB 4.34Å; I64-F179 HydrophobicContact CG1-CD1 4.13Å; I64-F179 HydrophobicContact CG2-CD1 4.13Å; I64-L181 HydrophobicContact CG2-CB 3.82Å; I64-L181 HydrophobicContact CG2-CD2 4.3Å; I64-I242 HydrophobicContact CD1-CG2 4.38Å; I64-L246 HydrophobicContact CD1-CD1 4.45Å; I64-L246 HydrophobicContact CD1-CD2 4.47Å
65	H	96.1	Very high	82.5	Confident	63 Å²	63	80.2 Å²	80.2	29%	0.292	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	127.6	166.5	179.7	81	0	0	0	110.4	I174 A177 F179 I180 L181	H65-I174 HydrophobicContact CB-CG2 3.62Å; H65-I174 VanDerWaalsContact CG-CG2 3.44Å; H65-A177 HydrophobicContact CB-CB 3.61Å; H65-F179 PolarHBondContact N-O 2.93Å; H65-I180 WeakPolarHBondContact O-CA 3.31Å; H65-L181 PolarHBondContact O-N 2.81Å
66	T	97.4	Very high	84.5	Confident	33 Å²	33	79.9 Å²	79.9	20%	0.202	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	128	174.7	43.5	0	0	0	0	112.5	I64 Y68 I90 L181 I183	I64-T66 HydrophobicContact CG2-CG2 4.47Å; T66-Y68 WeakPolarHBondContact OG1-CE2 3.11Å; T66-Y68 PolarHBondContact OG1-OH 2.86Å; T66-I90 HydrophobicContact CG2-CD1 3.14Å; T66-I90 HydrophobicContact CG2-CG1 4.29Å; T66-L181 WeakPolarHBondContact CA-O 3.27Å; T66-I183 HydrophobicContact CG2-CD1 3.85Å
67	H	97.7	Very high	86.6	Confident	42 Å²	42	71.8 Å²	71.8	19%	0.194	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	116.2	167.4	-175.1	84	0	0	0	110	P149 H152 L181 Y182 I183	H67-P149 WeakPolarHBondContact CE1-CG 3.43Å; H67-H152 AromaticContact CG-CE1 3.94Å; H67-H152 AromaticContact ND1-CE1 3.54Å; H67-L181 PolarHBondContact N-O 3.01Å; H67-Y182 HydrophobicContact CB-CD1 3.66Å; H67-Y182 HydrophobicContact CB-CE1 3.84Å; H67-Y182 AromaticContact CD2-CD1 3.72Å; H67-Y182 AromaticContact CG-CD1 3.87Å; H67-Y182 AromaticContact CG-CE1 3.96Å; H67-Y182 WeakPolarHBondContact O-CA 3.4Å; H67-I183 PolarHBondContact O-N 3.26Å
68	Y	97.4	Very high	88.8	Confident	17 Å²	17	64.9 Å²	64.9	7%	0.067	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	117.7	179.7	-60.9	-85.2	0	0	0	110.6	T66 I72 K73 F78 K82 I86 I183	T66-Y68 WeakPolarHBondContact OG1-CE2 3.11Å; T66-Y68 PolarHBondContact OG1-OH 2.86Å; Y68-I72 HydrophobicContact CD1-CG2 4.1Å; Y68-K73 WeakPolarHBondContact O-CE 3.46Å; Y68-K73 PolarHBondContact O-NZ 2.83Å; Y68-F78 AromaticContact CD1-CE2 3.63Å; Y68-F78 HydrophobicContact CD1-CE2 3.63Å; Y68-F78 AromaticContact CD1-CZ 3.67Å; Y68-F78 HydrophobicContact CD1-CZ 3.67Å; Y68-F78 HydrophobicContact CD2-CZ 4.3Å; Y68-F78 HydrophobicContact CE1-CE2 4.13Å; Y68-F78 HydrophobicContact CE1-CZ 4.19Å; Y68-F78 HydrophobicContact CG-CE2 4.14Å; Y68-F78 AromaticContact CG-CZ 3.72Å; Y68-F78 HydrophobicContact CG-CZ 3.72Å; Y68-K82 HydrophobicContact CE1-CG 4.26Å; Y68-K82 HydrophobicContact CE2-CD 4.2Å; Y68-K82 HydrophobicContact CE2-CG 4.43Å; Y68-I86 HydrophobicContact CE1-CD1 3.83Å; Y68-I86 HydrophobicContact CE1-CG2 4.01Å; Y68-I86 WeakPolarHBondContact OH-CG2 3.44Å; Y68-I183 HydrophobicContact CD1-CB 4.31Å; Y68-I183 HydrophobicContact CD1-CD1 4.44Å; Y68-I183 HydrophobicContact CE1-CD1 3.97Å
69	D	96.6	Very high	90.8	Very high	39 Å²	39	68.4 Å²	68.4	21%	0.209	32%	0.322	C	S	.	.			trans	-63.8	161.1	173	179.6	55.6	0	0	0	111.9	S71 I72 K73 I146 I183	D69-S71 PolarHBondContact O-N 2.73Å; D69-S71 WeakPolarHBondContact OD2-CB 3.41Å; D69-S71 PolarHBondContact OD2-N 2.76Å; D69-S71 PolarHBondContact OD2-OG 3.13Å; D69-I72 WeakPolarHBondContact O-CG2 3.49Å; D69-I72 PolarHBondContact O-N 2.83Å; D69-K73 WeakPolarHBondContact O-CG 3.38Å; D69-K73 PolarHBondContact O-N 3.05Å; D69-I146 HydrophobicContact CB-CG2 4.21Å; D69-I183 WeakPolarHBondContact CB-O 3.46Å; D69-I183 PolarHBondContact N-O 3.5Å
70	R	96	Very high	92.3	Very high	209 Å²	209	66.2 Å²	66.2	79%	0.789	32%	0.315	S	S	*	.	H	α-helix	trans	-58.8	-36.1	176.8	-174.1	178.6	179.9	-178.4	0.3	112.2	I72 K73 S74	R70-I72 PolarHBondContact O-N 3.42Å; R70-K73 PolarHBondContact O-N 3.37Å; R70-S74 PolarHBondContact O-N 2.73Å; R70-S74 VanDerWaalsContact O-N 3.1Å
71	S	94.4	Very high	93	Very high	17 Å²	17	65.7 Å²	65.7	12%	0.119	31%	0.312	C	S	.	.	H	α-helix	trans	-57.7	-50.2	-178.9	57.4	0	0	0	0	112.2	D69 S74 S184 S185	D69-S71 PolarHBondContact O-N 2.73Å; D69-S71 WeakPolarHBondContact OD2-CB 3.41Å; D69-S71 PolarHBondContact OD2-N 2.76Å; D69-S71 PolarHBondContact OD2-OG 3.13Å; S71-S74 PolarHBondContact O-N 3.02Å; S71-S74 PolarHBondContact O-OG 3.43Å; S71-S184 WeakPolarHBondContact OG-CB 3.15Å; S71-S185 WeakPolarHBondContact CB-O 3.33Å; S71-S185 PolarHBondContact OG-N 3.27Å
72	I	93.7	Very high	93.3	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-72.4	-34.8	179.7	-164.8	167.5	0	0	0	112.5	Y68 D69 R70 S74 L75 F78 I86 I183 F219 L224	Y68-I72 HydrophobicContact CD1-CG2 4.1Å; D69-I72 WeakPolarHBondContact O-CG2 3.49Å; D69-I72 PolarHBondContact O-N 2.83Å; R70-I72 PolarHBondContact O-N 3.42Å; I72-S74 PolarHBondContact O-N 3.09Å; I72-L75 HydrophobicContact CG1-CD1 3.89Å; I72-L75 WeakPolarHBondContact O-CB 3.47Å; I72-L75 WeakPolarHBondContact O-CG 3.48Å; I72-L75 PolarHBondContact O-N 3.17Å; I72-F78 HydrophobicContact CG1-CD2 4.03Å; I72-F78 HydrophobicContact CG1-CE2 4.1Å; I72-F78 HydrophobicContact CG2-CE2 4.08Å; I72-F78 WeakPolarHBondContact O-CD2 3.11Å; I72-I86 HydrophobicContact CD1-CD1 3.72Å; I72-I183 HydrophobicContact CD1-CG2 3.54Å; I72-I183 WeakPolarHBondContact CG2-O 3.37Å; I72-F219 HydrophobicContact CD1-CD2 4.16Å; I72-F219 HydrophobicContact CD1-CE2 4.49Å; I72-L224 HydrophobicContact CD1-CD1 3.99Å
73	K	94.2	Very high	93.4	Very high	111 Å²	111	69.9 Å²	69.9	48%	0.483	33%	0.328	S	S	.	.	H	α-helix	trans	-61.6	-24	174.6	-74.5	172.1	172.3	153.6	0	113.2	Y68 D69 R70 L75 F78	Y68-K73 WeakPolarHBondContact O-CE 3.46Å; Y68-K73 PolarHBondContact O-NZ 2.83Å; D69-K73 WeakPolarHBondContact O-CG 3.38Å; D69-K73 PolarHBondContact O-N 3.05Å; R70-K73 PolarHBondContact O-N 3.37Å; K73-L75 VanDerWaalsContact C-N 3.32Å; K73-F78 HydrophobicContact CB-CE1 4.49Å; K73-F78 HydrophobicContact CG-CD1 4.34Å; K73-F78 HydrophobicContact CG-CE1 3.85Å; K73-F78 HydrophobicContact CG-CE2 4.41Å; K73-F78 HydrophobicContact CG-CZ 3.9Å
74	S	92	Very high	93.3	Very high	92 Å²	92	68.5 Å²	68.5	64%	0.643	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-6	-179.1	73.8	0	0	0	0	114.5	R70 S71 I72	R70-S74 PolarHBondContact O-N 2.73Å; R70-S74 VanDerWaalsContact O-N 3.1Å; S71-S74 PolarHBondContact O-N 3.02Å; S71-S74 PolarHBondContact O-OG 3.43Å; I72-S74 PolarHBondContact O-N 3.09Å
75	L	88.8	Confident	93.1	Very high	50 Å²	50	67.8 Å²	67.8	26%	0.262	32%	0.322	S	S	.	.	S	Bend	trans	-67	136.2	174.9	-61.3	178.4	0	0	0	110.6	I72 K73 N77 F78 I81	I72-L75 HydrophobicContact CG1-CD1 3.89Å; I72-L75 WeakPolarHBondContact O-CB 3.47Å; I72-L75 WeakPolarHBondContact O-CG 3.48Å; I72-L75 PolarHBondContact O-N 3.17Å; K73-L75 VanDerWaalsContact C-N 3.32Å; L75-N77 PolarHBondContact O-N 3.27Å; L75-N77 VanDerWaalsContact O-N 3.12Å; L75-F78 HydrophobicContact CB-CB 4.38Å; L75-F78 VanDerWaalsContact O-CB 3.31Å; L75-F78 WeakPolarHBondContact O-CB 3.39Å; L75-F78 PolarHBondContact O-N 2.8Å; L75-I81 HydrophobicContact CB-CD1 4.46Å; L75-I81 HydrophobicContact CD1-CD1 4.02Å
76	K	85.1	Confident	93.1	Very high	215 Å²	215	65 Å²	65	94%	0.935	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-35.8	-176.4	-70.1	-176.7	179.7	178.2	0	113.4
77	N	85.6	Confident	93.1	Very high	78 Å²	78	66.6 Å²	66.6	42%	0.417	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	29.4	-178.4	-60.7	-14.8	0	0	0	112.2	L75 Q79 D80 I81	L75-N77 PolarHBondContact O-N 3.27Å; L75-N77 VanDerWaalsContact O-N 3.12Å; N77-Q79 VanDerWaalsContact C-N 3.33Å; N77-Q79 PolarHBondContact O-N 2.83Å; N77-D80 PolarHBondContact O-N 3.42Å; N77-D80 VanDerWaalsContact O-N 3.16Å; N77-I81 HydrophobicContact CB-CD1 4.43Å; N77-I81 WeakPolarHBondContact O-CG1 3.32Å; N77-I81 PolarHBondContact O-N 2.85Å
78	F	92	Very high	93	Very high	17 Å²	17	67.5 Å²	67.5	8%	0.075	32%	0.323	C	S	.	.	H	α-helix	trans	-55.3	-42.7	-173.6	170.7	-111.6	0	0	0	113.7	Y68 I72 K73 L75 D80 I81 K82	Y68-F78 AromaticContact CD1-CE2 3.63Å; Y68-F78 HydrophobicContact CD1-CE2 3.63Å; Y68-F78 AromaticContact CD1-CZ 3.67Å; Y68-F78 HydrophobicContact CD1-CZ 3.67Å; Y68-F78 HydrophobicContact CD2-CZ 4.3Å; Y68-F78 HydrophobicContact CE1-CE2 4.13Å; Y68-F78 HydrophobicContact CE1-CZ 4.19Å; Y68-F78 HydrophobicContact CG-CE2 4.14Å; Y68-F78 AromaticContact CG-CZ 3.72Å; Y68-F78 HydrophobicContact CG-CZ 3.72Å; I72-F78 HydrophobicContact CG1-CD2 4.03Å; I72-F78 HydrophobicContact CG1-CE2 4.1Å; I72-F78 HydrophobicContact CG2-CE2 4.08Å; I72-F78 WeakPolarHBondContact O-CD2 3.11Å; K73-F78 HydrophobicContact CB-CE1 4.49Å; K73-F78 HydrophobicContact CG-CD1 4.34Å; K73-F78 HydrophobicContact CG-CE1 3.85Å; K73-F78 HydrophobicContact CG-CE2 4.41Å; K73-F78 HydrophobicContact CG-CZ 3.9Å; L75-F78 HydrophobicContact CB-CB 4.38Å; L75-F78 VanDerWaalsContact O-CB 3.31Å; L75-F78 WeakPolarHBondContact O-CB 3.39Å; L75-F78 PolarHBondContact O-N 2.8Å; F78-D80 VanDerWaalsContact C-N 3.3Å; F78-D80 PolarHBondContact O-N 3.22Å; F78-I81 PolarHBondContact O-N 3.14Å; F78-K82 HydrophobicContact CE1-CD 4.25Å; F78-K82 HydrophobicContact CE2-CB 4.27Å; F78-K82 HydrophobicContact CZ-CB 4.26Å; F78-K82 HydrophobicContact CZ-CD 4.07Å; F78-K82 WeakPolarHBondContact O-CB 3.39Å; F78-K82 PolarHBondContact O-N 3.01Å
79	Q	94.2	Very high	93	Very high	128 Å²	128	66.7 Å²	66.7	60%	0.598	32%	0.319	S	S	*	.	H	α-helix	trans	-64.1	-38.2	-178.8	-64.4	-59.1	-27	0	0	112	N77 K83	N77-Q79 VanDerWaalsContact C-N 3.33Å; N77-Q79 PolarHBondContact O-N 2.83Å; Q79-K83 WeakPolarHBondContact O-CB 3.26Å; Q79-K83 PolarHBondContact O-N 2.81Å
80	D	90.6	Very high	93.1	Very high	77 Å²	77	65.2 Å²	65.2	41%	0.412	31%	0.311	S	S	.	.	H	α-helix	trans	-70.3	-44.9	176.6	-71.7	-34.5	0	0	0	111.8	N77 F78 K82 K83 N84 N226	N77-D80 PolarHBondContact O-N 3.42Å; N77-D80 VanDerWaalsContact O-N 3.16Å; F78-D80 VanDerWaalsContact C-N 3.3Å; F78-D80 PolarHBondContact O-N 3.22Å; D80-K82 VanDerWaalsContact C-N 3.31Å; D80-K82 PolarHBondContact O-N 2.89Å; D80-K83 PolarHBondContact O-N 2.75Å; D80-N84 WeakPolarHBondContact O-CB 3.49Å; D80-N84 PolarHBondContact O-N 2.8Å; D80-N84 PolarHBondContact O-ND2 2.92Å; D80-N226 HydrophobicContact CB-CB 4.02Å; D80-N226 WeakPolarHBondContact CB-ND2 3.48Å
81	I	91.3	Very high	93.1	Very high	4 Å²	4	59.2 Å²	59.2	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-58.4	-46.3	174.1	-69.9	167.2	0	0	0	110.1	L75 N77 F78 I85 I86 L224 N226	L75-I81 HydrophobicContact CB-CD1 4.46Å; L75-I81 HydrophobicContact CD1-CD1 4.02Å; N77-I81 HydrophobicContact CB-CD1 4.43Å; N77-I81 WeakPolarHBondContact O-CG1 3.32Å; N77-I81 PolarHBondContact O-N 2.85Å; F78-I81 PolarHBondContact O-N 3.14Å; I81-I85 WeakPolarHBondContact O-CA 3.11Å; I81-I85 VanDerWaalsContact O-CB 3.23Å; I81-I85 WeakPolarHBondContact O-CB 3.4Å; I81-I85 PolarHBondContact O-N 3.02Å; I81-I86 HydrophobicContact CG2-CD1 4.02Å; I81-I86 HydrophobicContact CG2-CG1 4.35Å; I81-I86 PolarHBondContact O-N 2.81Å; I81-I86 VanDerWaalsContact O-N 3.09Å; I81-L224 HydrophobicContact CD1-CB 4.1Å; I81-L224 HydrophobicContact CG2-CB 4.29Å; I81-L224 HydrophobicContact CG2-CD1 3.86Å; I81-N226 HydrophobicContact CG1-CB 4.32Å
82	K	95	Very high	93.3	Very high	57 Å²	57	61.2 Å²	61.2	25%	0.248	30%	0.302	C	S	.	.	I	π-helix	trans	-56.6	-55.8	177.8	176.3	-177.2	169.4	-162.4	0	110.8	Y68 F78 D80 I86 E87	Y68-K82 HydrophobicContact CE1-CG 4.26Å; Y68-K82 HydrophobicContact CE2-CD 4.2Å; Y68-K82 HydrophobicContact CE2-CG 4.43Å; F78-K82 HydrophobicContact CE1-CD 4.25Å; F78-K82 HydrophobicContact CE2-CB 4.27Å; F78-K82 HydrophobicContact CZ-CB 4.26Å; F78-K82 HydrophobicContact CZ-CD 4.07Å; F78-K82 WeakPolarHBondContact O-CB 3.39Å; F78-K82 PolarHBondContact O-N 3.01Å; D80-K82 VanDerWaalsContact C-N 3.31Å; D80-K82 PolarHBondContact O-N 2.89Å; K82-I86 PolarHBondContact O-N 3.02Å; K82-E87 WeakPolarHBondContact CE-OE1 3.17Å; K82-E87 HydrophobicContact CG-CG 4.41Å; K82-E87 IonicContact NZ-OE1 3.54Å; K82-E87 WeakPolarHBondContact O-CB 3.49Å; K82-E87 WeakPolarHBondContact O-CG 3.06Å; K82-E87 PolarHBondContact O-N 3.32Å
83	K	95	Very high	93.5	Very high	136 Å²	136	61.2 Å²	61.2	59%	0.591	30%	0.302	S	S	*	.	I	π-helix	trans	-70.5	-43.8	-173.8	-176.4	-178.6	177.4	-175.5	0	113.2	Q79 D80	Q79-K83 WeakPolarHBondContact O-CB 3.26Å; Q79-K83 PolarHBondContact O-N 2.81Å; D80-K83 PolarHBondContact O-N 2.75Å
84	N	90.7	Very high	93.6	Very high	39 Å²	39	58.5 Å²	58.5	21%	0.209	29%	0.291	C	S	.	.	I	π-helix	trans	-97.7	-13.5	-166.9	-59.8	-42.7	0	0	0	113.9	D80 V88 N226 K231	D80-N84 WeakPolarHBondContact O-CB 3.49Å; D80-N84 PolarHBondContact O-N 2.8Å; D80-N84 PolarHBondContact O-ND2 2.92Å; N84-V88 WeakPolarHBondContact O-CG2 3.36Å; N84-N226 WeakPolarHBondContact CB-OD1 2.87Å; N84-N226 PolarHBondContact ND2-ND2 2.79Å; N84-N226 VanDerWaalsContact ND2-ND2 3.16Å; N84-N226 PolarHBondContact ND2-OD1 3.25Å; N84-K231 WeakPolarHBondContact O-CE 3.45Å
85	I	92.4	Very high	93.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.289	C	S	.	.	I	π-helix	trans	-119.5	-63.2	179.1	-53.6	-61.1	0	0	0	110.5	I81 V88 A89 L224 K231 S234 A238	I81-I85 WeakPolarHBondContact O-CA 3.11Å; I81-I85 VanDerWaalsContact O-CB 3.23Å; I81-I85 WeakPolarHBondContact O-CB 3.4Å; I81-I85 PolarHBondContact O-N 3.02Å; I85-V88 PolarHBondContact O-N 3.18Å; I85-A89 WeakPolarHBondContact O-CB 3.37Å; I85-A89 PolarHBondContact O-N 2.89Å; I85-L224 HydrophobicContact CG2-CD2 4.46Å; I85-K231 HydrophobicContact CD1-CB 4.26Å; I85-K231 HydrophobicContact CD1-CG 3.47Å; I85-K231 VanDerWaalsContact CD1-CG 3.47Å; I85-K231 WeakPolarHBondContact CD1-O 3.48Å; I85-S234 WeakPolarHBondContact CG2-O 3.32Å; I85-A238 HydrophobicContact CG2-CB 3.8Å
86	I	95.6	Very high	94.2	Very high	4 Å²	4	57.1 Å²	57.1	2%	0.021	28%	0.276	C	S	.	.	I	π-helix	trans	-70.2	-50.6	-167.7	-62.9	173	0	0	0	110.8	Y68 I72 I81 K82 V88 A89 I90 I183	Y68-I86 HydrophobicContact CE1-CD1 3.83Å; Y68-I86 HydrophobicContact CE1-CG2 4.01Å; Y68-I86 WeakPolarHBondContact OH-CG2 3.44Å; I72-I86 HydrophobicContact CD1-CD1 3.72Å; I81-I86 HydrophobicContact CG2-CD1 4.02Å; I81-I86 HydrophobicContact CG2-CG1 4.35Å; I81-I86 PolarHBondContact O-N 2.81Å; I81-I86 VanDerWaalsContact O-N 3.09Å; K82-I86 PolarHBondContact O-N 3.02Å; I86-V88 VanDerWaalsContact C-N 3.3Å; I86-V88 PolarHBondContact O-N 2.81Å; I86-A89 PolarHBondContact O-N 3.3Å; I86-I90 HydrophobicContact CG2-CD1 3.64Å; I86-I90 VanDerWaalsContact O-CD1 3.28Å; I86-I90 WeakPolarHBondContact O-CD1 3.46Å; I86-I90 VanDerWaalsContact O-CG1 3.28Å; I86-I90 WeakPolarHBondContact O-CG1 3.44Å; I86-I90 PolarHBondContact O-N 3.36Å; I86-I183 HydrophobicContact CD1-CG2 4.32Å; I86-I183 HydrophobicContact CG2-CD1 3.52Å
87	E	97.3	Very high	94.7	Very high	66 Å²	66	46.9 Å²	46.9	31%	0.308	23%	0.232	S	C	.	.	H	α-helix	trans	-63.6	-35.9	177.6	-72.5	177.7	173.7	0	0	111.8	K82 I90 N91	K82-E87 WeakPolarHBondContact CE-OE1 3.17Å; K82-E87 HydrophobicContact CG-CG 4.41Å; K82-E87 IonicContact NZ-OE1 3.54Å; K82-E87 WeakPolarHBondContact O-CB 3.49Å; K82-E87 WeakPolarHBondContact O-CG 3.06Å; K82-E87 PolarHBondContact O-N 3.32Å; E87-I90 PolarHBondContact O-N 3.46Å; E87-N91 WeakPolarHBondContact O-CB 3.4Å; E87-N91 PolarHBondContact O-N 2.68Å; E87-N91 PolarHBondContact O-ND2 2.96Å; E87-N91 PolarHBondContact O-OD1 2.81Å
88	V	95.7	Very high	95.1	Very high	61 Å²	61	45.6 Å²	45.6	37%	0.37	23%	0.225	S	C	.	.	H	α-helix	trans	-62.5	-46.8	174.5	-179.1	0	0	0	0	111	N84 I85 I86 I90 N91 F92 L235	N84-V88 WeakPolarHBondContact O-CG2 3.36Å; I85-V88 PolarHBondContact O-N 3.18Å; I86-V88 VanDerWaalsContact C-N 3.3Å; I86-V88 PolarHBondContact O-N 2.81Å; V88-I90 VanDerWaalsContact C-N 3.33Å; V88-I90 PolarHBondContact O-N 3.07Å; V88-N91 PolarHBondContact O-N 3.14Å; V88-F92 PolarHBondContact O-N 3.13Å; V88-L235 HydrophobicContact CB-CD1 3.98Å; V88-L235 HydrophobicContact CG1-CD1 3.73Å; V88-L235 HydrophobicContact CG1-CD2 4.38Å
89	A	96.8	Very high	95	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65	-34.6	178	0	0	0	0	0	112.9	I85 I86 W93 L235 A238 T239 I242	I85-A89 WeakPolarHBondContact O-CB 3.37Å; I85-A89 PolarHBondContact O-N 2.89Å; I86-A89 PolarHBondContact O-N 3.3Å; A89-W93 VanDerWaalsContact O-CD1 3.28Å; A89-W93 PolarHBondContact O-N 3.08Å; A89-L235 HydrophobicContact CB-CD1 4.16Å; A89-A238 HydrophobicContact CB-CB 3.75Å; A89-T239 WeakPolarHBondContact CB-OG1 3.35Å; A89-I242 HydrophobicContact CB-CD1 3.7Å
90	I	98.2	Very high	94.4	Very high	8 Å²	8	41 Å²	41	4%	0.041	20%	0.202	C	C	.	.	H	α-helix	trans	-69	-50.7	176	-71.2	156	0	0	0	110.9	I64 T66 I86 E87 V88 F92 W93 E94 I242	I64-I90 HydrophobicContact CB-CG2 3.94Å; I64-I90 HydrophobicContact CD1-CG2 4.29Å; I64-I90 HydrophobicContact CG2-CG1 4.47Å; I64-I90 HydrophobicContact CG2-CG2 4.23Å; T66-I90 HydrophobicContact CG2-CD1 3.14Å; T66-I90 HydrophobicContact CG2-CG1 4.29Å; I86-I90 HydrophobicContact CG2-CD1 3.64Å; I86-I90 VanDerWaalsContact O-CD1 3.28Å; I86-I90 WeakPolarHBondContact O-CD1 3.46Å; I86-I90 VanDerWaalsContact O-CG1 3.28Å; I86-I90 WeakPolarHBondContact O-CG1 3.44Å; I86-I90 PolarHBondContact O-N 3.36Å; E87-I90 PolarHBondContact O-N 3.46Å; V88-I90 VanDerWaalsContact C-N 3.33Å; V88-I90 PolarHBondContact O-N 3.07Å; I90-F92 PolarHBondContact O-N 2.82Å; I90-W93 PolarHBondContact O-N 2.83Å; I90-E94 HydrophobicContact CG2-CG 4.19Å; I90-E94 PolarHBondContact O-N 3.34Å; I90-I242 HydrophobicContact CG1-CD1 3.86Å
91	N	97.7	Very high	93.3	Very high	84 Å²	84	40.9 Å²	40.9	45%	0.449	20%	0.199	S	C	.	.	H	α-helix	trans	-57.7	-40	179.7	-67.2	-12.9	0	0	0	110.7	E87 V88 W93 E94 D95	E87-N91 WeakPolarHBondContact O-CB 3.4Å; E87-N91 PolarHBondContact O-N 2.68Å; E87-N91 PolarHBondContact O-ND2 2.96Å; E87-N91 PolarHBondContact O-OD1 2.81Å; V88-N91 PolarHBondContact O-N 3.14Å; N91-W93 VanDerWaalsContact C-N 3.31Å; N91-W93 PolarHBondContact O-N 3.43Å; N91-E94 PolarHBondContact O-N 3.29Å; N91-D95 WeakPolarHBondContact O-CB 3.28Å; N91-D95 VanDerWaalsContact O-CG 3.31Å; N91-D95 PolarHBondContact O-N 2.84Å
92	F	97.3	Very high	91.4	Very high	59 Å²	59	43.6 Å²	43.6	26%	0.259	22%	0.218	S	C	.	.	H	α-helix	trans	-53.1	-46.5	173.5	174.4	-92.4	0	0	0	112.6	V88 I90 D95 A96 T239 L360 I371 L391	V88-F92 PolarHBondContact O-N 3.13Å; I90-F92 PolarHBondContact O-N 2.82Å; F92-D95 PolarHBondContact O-N 3.11Å; F92-A96 WeakPolarHBondContact O-CB 3.31Å; F92-A96 PolarHBondContact O-N 3.15Å; F92-T239 HydrophobicContact CD1-CG2 3.37Å; F92-T239 HydrophobicContact CE1-CG2 3.72Å; F92-T239 HydrophobicContact CG-CG2 4.07Å; F92-L360 HydrophobicContact CE1-CD2 4.41Å; F92-I371 HydrophobicContact CE1-CD1 3.99Å; F92-I371 HydrophobicContact CE2-CG2 4.46Å; F92-I371 HydrophobicContact CZ-CB 4.04Å; F92-I371 HydrophobicContact CZ-CD1 3.83Å; F92-I371 HydrophobicContact CZ-CG2 3.88Å; F92-L391 HydrophobicContact CE2-CD1 4.34Å
93	W	97.8	Very high	89.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-76.2	-32.7	179.7	-74.2	116.3	0	0	0	113.9	I64 A89 I90 N91 D95 A96 L97 T239 I242 L243 L246 L360 I371	I64-W93 HydrophobicContact CD1-CB 4.46Å; A89-W93 VanDerWaalsContact O-CD1 3.28Å; A89-W93 PolarHBondContact O-N 3.08Å; I90-W93 PolarHBondContact O-N 2.83Å; N91-W93 VanDerWaalsContact C-N 3.31Å; N91-W93 PolarHBondContact O-N 3.43Å; W93-D95 VanDerWaalsContact C-N 3.27Å; W93-D95 PolarHBondContact O-N 3.1Å; W93-A96 HydrophobicContact CE3-CB 3.89Å; W93-A96 HydrophobicContact CZ3-CB 4.25Å; W93-A96 PolarHBondContact O-N 2.7Å; W93-L97 HydrophobicContact CE3-CD1 3.78Å; W93-L97 HydrophobicContact CE3-CG 4.05Å; W93-L97 HydrophobicContact CZ3-CD1 4.3Å; W93-L97 PolarHBondContact O-N 3.31Å; W93-T239 HydrophobicContact CZ2-CG2 4.21Å; W93-T239 PolarHBondContact NE1-O 3.01Å; W93-I242 HydrophobicContact CB-CG2 4.38Å; W93-I242 HydrophobicContact CG-CG2 3.92Å; W93-L243 HydrophobicContact CD2-CD1 4.11Å; W93-L243 HydrophobicContact CE3-CD1 3.84Å; W93-L243 HydrophobicContact CH2-CB 4.08Å; W93-L243 HydrophobicContact CH2-CD1 3.28Å; W93-L243 HydrophobicContact CH2-CD2 3.42Å; W93-L243 VanDerWaalsContact CH2-CD2 3.42Å; W93-L243 HydrophobicContact CH2-CG 3.74Å; W93-L243 HydrophobicContact CZ2-CB 3.56Å; W93-L243 HydrophobicContact CZ2-CD1 3.54Å; W93-L243 HydrophobicContact CZ2-CD2 3.75Å; W93-L243 HydrophobicContact CZ2-CG 3.77Å; W93-L243 HydrophobicContact CZ3-CD1 3.43Å; W93-L243 VanDerWaalsContact CZ3-CD1 3.43Å; W93-L243 HydrophobicContact CZ3-CD2 4.3Å; W93-L243 HydrophobicContact CZ3-CG 4.38Å; W93-L246 HydrophobicContact CB-CD1 4.05Å; W93-L246 HydrophobicContact CD2-CD1 4.36Å; W93-L246 HydrophobicContact CG-CD1 4.05Å; W93-L360 HydrophobicContact CH2-CD2 4.13Å; W93-L360 HydrophobicContact CZ2-CD2 3.55Å; W93-I371 HydrophobicContact CH2-CD1 3.45Å; W93-I371 VanDerWaalsContact CH2-CD1 3.45Å; W93-I371 HydrophobicContact CZ2-CD1 4.47Å; W93-I371 HydrophobicContact CZ3-CD1 3.68Å
94	E	96.6	Very high	87.4	Confident	54 Å²	54	35.7 Å²	35.7	25%	0.252	19%	0.186	S	C	.	.	H	α-helix	trans	-63.4	-35	171.7	-67.4	-169.9	151.3	0	0	111.6	L62 R63 I64 I90 N91	L62-E94 WeakPolarHBondContact O-CG 3.04Å; R63-E94 VanDerWaalsContact CA-OE1 3.32Å; R63-E94 WeakPolarHBondContact CA-OE1 3.25Å; I64-E94 HydrophobicContact CD1-CG 4.39Å; I64-E94 HydrophobicContact CG1-CG 4.34Å; I64-E94 PolarHBondContact N-OE1 3.49Å; I90-E94 HydrophobicContact CG2-CG 4.19Å; I90-E94 PolarHBondContact O-N 3.34Å; N91-E94 PolarHBondContact O-N 3.29Å
95	D	96	Very high	85.7	Confident	111 Å²	111	36 Å²	36	59%	0.594	19%	0.187	S	C	*	.	H	α-helix	trans	-78.6	-30.8	174.4	-70.3	-22.7	0	0	0	113	N91 F92 W93 N388	N91-D95 WeakPolarHBondContact O-CB 3.28Å; N91-D95 VanDerWaalsContact O-CG 3.31Å; N91-D95 PolarHBondContact O-N 2.84Å; F92-D95 PolarHBondContact O-N 3.11Å; W93-D95 VanDerWaalsContact C-N 3.27Å; W93-D95 PolarHBondContact O-N 3.1Å; D95-N388 PolarHBondContact O-ND2 2.87Å
96	A	97.1	Very high	84.3	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-78.9	-28.5	-177.7	0	0	0	0	0	113.4	F92 W93 L376 N388 L391	F92-A96 WeakPolarHBondContact O-CB 3.31Å; F92-A96 PolarHBondContact O-N 3.15Å; W93-A96 HydrophobicContact CE3-CB 3.89Å; W93-A96 HydrophobicContact CZ3-CB 4.25Å; W93-A96 PolarHBondContact O-N 2.7Å; A96-L376 HydrophobicContact CB-CD2 4.4Å; A96-N388 PolarHBondContact O-N 3.12Å; A96-L391 HydrophobicContact CB-CD1 3.57Å
97	L	96	Very high	83.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	128.5	-169.1	-58.7	175.9	0	0	0	112.5	L62 W93 L246 M379 Y385 I386	L62-L97 VanDerWaalsContact CB-O 3.28Å; L62-L97 WeakPolarHBondContact CB-O 3.26Å; L62-L97 HydrophobicContact CD2-CB 4.07Å; L62-L97 HydrophobicContact CD2-CD1 4.38Å; W93-L97 HydrophobicContact CE3-CD1 3.78Å; W93-L97 HydrophobicContact CE3-CG 4.05Å; W93-L97 HydrophobicContact CZ3-CD1 4.3Å; W93-L97 PolarHBondContact O-N 3.31Å; L97-L246 HydrophobicContact CD1-CD1 4.13Å; L97-M379 HydrophobicContact CD1-CE 4.07Å; L97-M379 HydrophobicContact CD2-CB 3.82Å; L97-M379 HydrophobicContact CD2-CG 4.39Å; L97-Y385 HydrophobicContact CB-CD1 4.13Å; L97-Y385 HydrophobicContact CB-CG 4.37Å; L97-Y385 HydrophobicContact CD1-CD1 4.33Å; L97-Y385 HydrophobicContact CD1-CD2 4.39Å; L97-Y385 HydrophobicContact CD1-CG 4.23Å; L97-Y385 HydrophobicContact CD2-CG 4.4Å; L97-I386 WeakPolarHBondContact CA-O 3.14Å
98	L	93.3	Very high	82.7	Confident	52 Å²	52	42.1 Å²	42.1	27%	0.272	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	155.3	166.9	-58.7	173.7	0	0	0	109.8	Q59 Y385 I386	Q59-L98 HydrophobicContact CB-CD1 4.31Å; L98-Y385 CarbonylContact O-C 3.57Å; L98-Y385 WeakPolarHBondContact O-CA 3.37Å; L98-I386 HydrophobicContact CB-CB 4.27Å; L98-I386 PolarHBondContact N-O 2.85Å; L98-I386 PolarHBondContact O-N 2.83Å
99	L	89.7	Confident	82.4	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	131.8	174.1	-59.5	-178.2	0	0	0	110.9	T60 L62 H103 N178 Y385	T60-L99 HydrophobicContact CG2-CD1 4.25Å; T60-L99 WeakPolarHBondContact O-CB 3.31Å; T60-L99 PolarHBondContact O-N 2.84Å; L62-L99 HydrophobicContact CD1-CD2 4.31Å; L99-H103 HydrophobicContact CD1-CB 4.17Å; L99-N178 HydrophobicContact CD1-CB 4.09Å; L99-N178 WeakPolarHBondContact CD1-ND2 2.97Å; L99-Y385 HydrophobicContact CD2-CD1 3.94Å; L99-Y385 HydrophobicContact CD2-CE1 3.82Å
100	R	83.4	Confident	82.2	Confident	48 Å²	48	39.4 Å²	39.4	18%	0.181	20%	0.198	C	C	.	.	S	Bend	trans	-67.9	-42.6	-175	175.1	173	-80.7	159.7	1.3	113.4	E380 W384 I386	R100-E380 PolarHBondContact NH1-O 3.37Å; R100-E380 PolarHBondContact NH2-O 3.31Å; R100-E380 IonicContact NH2-OE1 3.49Å; R100-W384 PolarHBondContact N-O 3.32Å; R100-I386 HydrophobicContact CB-CG1 4.07Å; R100-I386 HydrophobicContact CG-CG1 4.44Å
101	Q	67.1	Low	82	Confident	73 Å²	73	39 Å²	39	34%	0.341	20%	0.196	S	C	.	.	S	Bend	trans	-99	164	179.7	-64.4	-168.5	-12.9	0	0	110.2	H103	Q101-H103 PolarHBondContact O-CD2 2.88Å; Q101-H103 PolarHBondContact O-N 3.29Å
102	S	51.5	Low	81.9	Confident	62 Å²	62	35.5 Å²	35.5	43%	0.434	18%	0.177	S	C	.	.			trans	-66.1	69.1	155	-153	0	0	0	0	107.3	I54 A104	I54-S102 WeakPolarHBondContact CB-OG 3.23Å; I54-S102 WeakPolarHBondContact CG2-OG 3.38Å; S102-A104 VanDerWaalsContact C-N 3.3Å; S102-A104 PolarHBondContact O-N 2.87Å
103	H	53	Low	81.8	Confident	12 Å²	12	34.4 Å²	34.4	6%	0.056	17%	0.171	C	C	.	.			trans	-55	110.7	159.2	-68.7	-93.7	0	0	0	102.7	L99 Q101 M105 E206	L99-H103 HydrophobicContact CD1-CB 4.17Å; Q101-H103 PolarHBondContact O-CD2 2.88Å; Q101-H103 PolarHBondContact O-N 3.29Å; H103-M105 VanDerWaalsContact C-N 3.35Å; H103-M105 PolarHBondContact O-N 3.37Å; H103-E206 IonicContact CE1-OE2 2.8Å; H103-E206 PolarHBondContact CE1-OE2 3.13Å; H103-E206 IonicContact ND1-OE1 2.67Å; H103-E206 IonicContact ND1-OE2 3.56Å; H103-E206 PolarHBondContact ND1-OE2 2.82Å
104	A	51.5	Low	81.6	Confident	14 Å²	14	35.1 Å²	35.1	12%	0.116	18%	0.175	C	C	.	.			trans	-57.8	110.2	-179.9	0	0	0	0	0	105.9	V50 S102 P106	V50-A104 HydrophobicContact CB-CB 3.74Å; V50-A104 HydrophobicContact CG1-CB 3.24Å; V50-A104 HydrophobicContact CG2-CB 3.94Å; S102-A104 VanDerWaalsContact C-N 3.3Å; S102-A104 PolarHBondContact O-N 2.87Å; A104-P106 WeakPolarHBondContact O-CD 3.39Å
105	M	56.6	Low	81.4	Confident	45 Å²	45	33 Å²	33	22%	0.222	17%	0.167	C	C	.	.			trans	-56.6	111.3	178	-131.5	-171.5	109.9	0	0	104.9	I54 T60 H103 N107 R176	I54-M105 HydrophobicContact CD1-CB 4.41Å; T60-M105 HydrophobicContact CG2-CG 4.24Å; T60-M105 HydrophobicContact CG2-SD 4.42Å; H103-M105 VanDerWaalsContact C-N 3.35Å; H103-M105 PolarHBondContact O-N 3.37Å; M105-N107 PolarHBondContact O-N 2.57Å; M105-R176 HydrophobicContact CE-CB 3.82Å; M105-R176 HydrophobicContact CE-CG 3.91Å
106	P	63.1	Low	81.3	Confident	7 Å²	7	30 Å²	30	5%	0.045	15%	0.152	C	C	.	.			trans	-61	136	174.2	22.6	-27.5	0	0	0	106.5	S47 A104 R108 L109	S47-P106 VanDerWaalsContact OG-CB 3.25Å; S47-P106 WeakPolarHBondContact OG-CB 3.42Å; S47-P106 WeakPolarHBondContact OG-CG 3.41Å; A104-P106 WeakPolarHBondContact O-CD 3.39Å; P106-R108 PolarHBondContact O-N 2.84Å; P106-R108 VanDerWaalsContact O-N 3.16Å; P106-L109 HydrophobicContact CG-CB 4.01Å; P106-L109 HydrophobicContact CG-CD1 4.26Å
107	N	72.8	Confident	80.9	Confident	79 Å²	79	36.7 Å²	36.7	42%	0.422	19%	0.188	S	C	.	.	S	Bend	trans	-53.3	-36.5	169.2	-75.5	-12.1	0	0	0	109.8	M105 Y175	M105-N107 PolarHBondContact O-N 2.57Å; N107-Y175 WeakPolarHBondContact O-CD2 3.36Å
108	R	85.6	Confident	80.5	Confident	113 Å²	113	37.7 Å²	37.7	43%	0.426	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	122.3	169.9	-62.5	-163.6	-175.7	-87.8	-0.4	112.3	P106 E172 I174	P106-R108 PolarHBondContact O-N 2.84Å; P106-R108 VanDerWaalsContact O-N 3.16Å; R108-E172 WeakPolarHBondContact CD-O 3.35Å; R108-I174 CarbonylContact C-O 3.53Å; R108-I174 VanDerWaalsContact CA-O 3.28Å; R108-I174 WeakPolarHBondContact CA-O 3.27Å
109	L	89.8	Confident	80.4	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	121.4	175.9	178.1	57.5	0	0	0	109.7	P106 G173 I174 A177 I180 M213	P106-L109 HydrophobicContact CG-CB 4.01Å; P106-L109 HydrophobicContact CG-CD1 4.26Å; L109-G173 CarbonylContact O-C 3.33Å; L109-G173 VanDerWaalsContact O-CA 3.24Å; L109-G173 WeakPolarHBondContact O-CA 3.46Å; L109-I174 HydrophobicContact CB-CB 4.41Å; L109-I174 PolarHBondContact N-O 2.89Å; L109-I174 PolarHBondContact O-N 2.83Å; L109-A177 HydrophobicContact CD2-CB 4.48Å; L109-I180 HydrophobicContact CD2-CD1 3.89Å; L109-I180 HydrophobicContact CD2-CG1 3.62Å; L109-I180 HydrophobicContact CG-CD1 3.95Å; L109-I180 HydrophobicContact CG-CG1 4.26Å; L109-M213 HydrophobicContact CD1-CE 3.24Å
110	T	92.1	Very high	80.5	Confident	3 Å²	3	39 Å²	39	2%	0.018	21%	0.211	C	C	.	.			trans	-123.1	146.2	175.4	47	0	0	0	0	109.3	H152 N154	T110-H152 WeakPolarHBondContact CA-O 3.45Å; T110-N154 WeakPolarHBondContact CB-OD1 3.46Å; T110-N154 PolarHBondContact OG1-ND2 2.85Å; T110-N154 VanDerWaalsContact OG1-ND2 3.09Å; T110-N154 PolarHBondContact OG1-OD1 3.06Å; T110-N154 VanDerWaalsContact OG1-OD1 3.12Å
111	L	94.3	Very high	80.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-105.1	147.5	-179.5	-63.2	-174.7	0	0	0	110.3	V148 H152 L153 N154 I180 Y182 Q204 A214	L111-V148 HydrophobicContact CD1-CG1 4.32Å; L111-H152 PolarHBondContact N-O 3.36Å; L111-L153 HydrophobicContact CB-CD2 4.15Å; L111-L153 CarbonylContact O-C 3.58Å; L111-L153 WeakPolarHBondContact O-CA 3.36Å; L111-N154 PolarHBondContact O-N 2.82Å; L111-I180 HydrophobicContact CD1-CD1 4.05Å; L111-I180 HydrophobicContact CD2-CD1 4.24Å; L111-I180 HydrophobicContact CG-CD1 4Å; L111-Y182 HydrophobicContact CD1-CE2 3.89Å; L111-Y182 VanDerWaalsContact CD1-OH 3.28Å; L111-Y182 WeakPolarHBondContact CD1-OH 3.37Å; L111-Q204 VanDerWaalsContact CB-OE1 3.25Å; L111-Q204 HydrophobicContact CD2-CB 4.44Å; L111-Q204 HydrophobicContact CD2-CG 4.49Å; L111-A214 HydrophobicContact CD1-CB 3.71Å; L111-A214 HydrophobicContact CD2-CB 3.88Å; L111-A214 HydrophobicContact CG-CB 4.48Å
112	D	94.5	Very high	82	Confident	9 Å²	9	40.6 Å²	40.6	5%	0.048	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-84.8	154.8	177.9	-74.3	-17.2	0	0	0	111	V42 V45 N154 R157 Q204	V42-D112 HydrophobicContact CG1-CB 4.02Å; V45-D112 HydrophobicContact CG1-CB 4.37Å; V45-D112 HydrophobicContact CG2-CB 4.21Å; D112-N154 WeakPolarHBondContact OD1-CB 3.01Å; D112-N154 PolarHBondContact OD1-ND2 2.88Å; D112-R157 IonicContact OD1-CZ 2.69Å; D112-R157 IonicContact OD1-NH1 3.11Å; D112-R157 PolarHBondContact OD1-NH1 3.43Å; D112-R157 IonicContact OD1-NH2 3.6Å; D112-R157 PolarHBondContact OD1-NH2 2.8Å; D112-R157 IonicContact OD2-CZ 2.76Å; D112-R157 IonicContact OD2-NH1 3.59Å; D112-R157 PolarHBondContact OD2-NH1 2.05Å; D112-R157 IonicContact OD2-NH2 3.75Å; D112-Q204 PolarHBondContact O-NE2 2.04Å
113	R	95.2	Very high	83.8	Confident	36 Å²	36	39.5 Å²	39.5	14%	0.136	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-77.5	146.4	-179.6	-66.3	-179	-178.4	-100.8	-0.4	111	C137 T141 L153 N154	R113-C137 HydrophobicContact CB-CB 3.94Å; R113-T141 WeakPolarHBondContact CA-OG1 3.35Å; R113-L153 HydrophobicContact CG-CB 4.4Å; R113-L153 HydrophobicContact CG-CD1 4.38Å; R113-L153 HydrophobicContact CG-CD2 4.48Å; R113-N154 PolarHBondContact NE-O 2.64Å
114	V	93.9	Very high	85.5	Confident	16 Å²	16	43.8 Å²	43.8	10%	0.097	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-70.1	138.8	173.1	169	0	0	0	0	109.7	V42 C137 V138 T141	V42-V114 HydrophobicContact CG2-CB 4.42Å; V42-V114 HydrophobicContact CG2-CG2 3.57Å; V114-C137 WeakPolarHBondContact O-CA 3.39Å; V114-V138 HydrophobicContact CB-CG2 3.87Å; V114-V138 HydrophobicContact CG1-CG1 4.49Å; V114-V138 HydrophobicContact CG1-CG2 4.08Å; V114-V138 WeakPolarHBondContact O-CG2 3.32Å; V114-V138 PolarHBondContact O-N 2.6Å; V114-T141 HydrophobicContact CB-CG2 4.38Å; V114-T141 HydrophobicContact CG2-CG2 3.88Å; V114-T141 PolarHBondContact N-OG1 2.83Å
115	C	94	Very high	87.2	Confident	10 Å²	10	45.5 Å²	45.5	7%	0.068	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-85	151.9	177.8	-58.3	0	0	0	0	111.2	D117 G118 A119 T120 C133	C115-D117 PolarHBondContact O-N 2.89Å; C115-G118 PolarHBondContact O-N 2.65Å; C115-A119 WeakPolarHBondContact CB-O 3.19Å; C115-T120 HydrophobicContact CB-CG2 4.14Å; C115-T120 VanDerWaalsContact SG-CG2 3.54Å; C115-C133 WeakPolarHBondContact CA-SG 3.16Å; C115-C133 HydrophobicContact CB-CB 3.5Å; C115-C133 VanDerWaalsContact CB-CB 3.5Å; C115-C133 WeakPolarHBondContact CB-SG 3.11Å; C115-C133 WeakPolarHBondContact SG-CA 3.34Å; C115-C133 WeakPolarHBondContact SG-CB 3.11Å; C115-C133 CovalentContact SG-SG 2.02Å; C115-C133 PolarHBondContact SG-SG 2.78Å
116	V	93.4	Very high	88.7	Confident	48 Å²	48	49.3 Å²	49.3	29%	0.291	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-55.4	129.1	170	178.4	0	0	0	0	108.7	G118 A119 D135 G136 V138	V116-G118 PolarHBondContact O-N 2.74Å; V116-A119 PolarHBondContact O-N 2.73Å; V116-D135 HydrophobicContact CB-CB 4.34Å; V116-G136 PolarHBondContact N-O 3.46Å; V116-V138 HydrophobicContact CG2-CG1 4.22Å
117	D	88.4	Confident	89.7	Confident	141 Å²	141	56.8 Å²	56.8	75%	0.754	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	53.5	16.2	-176	-56.4	-37.3	0	0	0	115.8	C115 A119	C115-D117 PolarHBondContact O-N 2.89Å; D117-A119 PolarHBondContact O-N 2.97Å
118	G	87.4	Confident	90.3	Very high	21 Å²	21	59.2 Å²	59.2	22%	0.216	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	66.3	15.4	-173.7	0	0	0	0	0	114	S39 C115 V116 T120	S39-G118 WeakPolarHBondContact O-CA 3.35Å; C115-G118 PolarHBondContact O-N 2.65Å; V116-G118 PolarHBondContact O-N 2.74Å; G118-T120 PolarHBondContact O-N 3.39Å
119	A	90.6	Very high	90.4	Very high	31 Å²	31	56.6 Å²	56.6	26%	0.256	30%	0.302	S	S	.	.			trans	-77.3	116.7	-176.3	0	0	0	0	0	111.2	C115 V116 D117 T134	C115-A119 WeakPolarHBondContact CB-O 3.19Å; V116-A119 PolarHBondContact O-N 2.73Å; D117-A119 PolarHBondContact O-N 2.97Å; A119-T134 WeakPolarHBondContact CB-OG1 3.5Å; A119-T134 PolarHBondContact O-N 3.09Å; A119-T134 PolarHBondContact O-OG1 2.74Å
120	T	91.7	Very high	90.4	Very high	49 Å²	49	57.2 Å²	57.2	30%	0.301	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	152.8	-171.5	59.6	0	0	0	0	113.1	C115 G118 I131 F132	C115-T120 HydrophobicContact CB-CG2 4.14Å; C115-T120 VanDerWaalsContact SG-CG2 3.54Å; G118-T120 PolarHBondContact O-N 3.39Å; T120-I131 HydrophobicContact CG2-CG2 3.72Å; T120-F132 CarbonylContact C-O 3.58Å; T120-F132 WeakPolarHBondContact CA-O 3.38Å
121	K	91.6	Very high	90.3	Very high	120 Å²	120	57.9 Å²	57.9	52%	0.522	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	134.9	171.4	-172	174.2	-176.1	177.2	0	110.4	M123 F132 T134 I159	K121-M123 HydrophobicContact CD-CG 4.49Å; K121-M123 HydrophobicContact CG-CG 4.23Å; K121-F132 PolarHBondContact N-O 2.97Å; K121-F132 PolarHBondContact O-N 3.47Å; K121-T134 HydrophobicContact CB-CG2 4.24Å; K121-I159 HydrophobicContact CB-CD1 3.85Å; K121-I159 HydrophobicContact CD-CD1 3.86Å; K121-I159 HydrophobicContact CG-CD1 4.34Å
122	L	90.5	Very high	90.3	Very high	35 Å²	35	57.9 Å²	57.9	18%	0.183	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	128.9	171.7	-83.8	140.9	0	0	0	109.8	L129 I131 T271 F272	L122-L129 HydrophobicContact CB-CD1 4.27Å; L122-L129 HydrophobicContact CD2-CD1 4.14Å; L122-L129 HydrophobicContact CD2-CD2 3.86Å; L122-L129 HydrophobicContact CD2-CG 3.61Å; L122-I131 HydrophobicContact CD2-CG1 3.99Å; L122-I131 HydrophobicContact CG-CG1 3.99Å; L122-T271 WeakPolarHBondContact CD1-O 3.38Å; L122-F272 HydrophobicContact CD1-CD2 4.02Å
123	M	90.5	Very high	90.3	Very high	39 Å²	39	57.6 Å²	57.6	19%	0.192	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	147.8	178	-61.1	-175.2	72	0	0	110.3	K121 L130 F132 I159 P164	K121-M123 HydrophobicContact CD-CG 4.49Å; K121-M123 HydrophobicContact CG-CG 4.23Å; M123-L130 PolarHBondContact N-O 3.03Å; M123-L130 PolarHBondContact O-N 2.94Å; M123-F132 HydrophobicContact CB-CD2 3.92Å; M123-F132 HydrophobicContact CB-CE2 4.19Å; M123-F132 HydrophobicContact CG-CD2 4.43Å; M123-I159 HydrophobicContact SD-CD1 3.49Å; M123-I159 WeakPolarHBondContact SD-CD1 3.2Å; M123-I159 HydrophobicContact SD-CG1 3.82Å; M123-P164 HydrophobicContact CE-CG 4.33Å
124	T	88.4	Confident	90.3	Very high	101 Å²	101	58.2 Å²	58.2	62%	0.62	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	122.9	170.5	-54	0	0	0	0	109.2	K128	T124-K128 CarbonylContact C-O 3.57Å; T124-K128 WeakPolarHBondContact CA-O 3.28Å
125	F	87.9	Confident	90.2	Very high	51 Å²	51	62.8 Å²	62.8	22%	0.224	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	128.3	176.8	-174.9	-90.4	0	0	0	108.7	N127 K128 L130 F132 P164 I166	F125-N127 VanDerWaalsContact C-N 3.3Å; F125-N127 PolarHBondContact O-N 2.75Å; F125-K128 PolarHBondContact N-O 2.99Å; F125-K128 PolarHBondContact O-N 3.18Å; F125-K128 VanDerWaalsContact O-O 3.05Å; F125-L130 HydrophobicContact CB-CD1 4.26Å; F125-L130 HydrophobicContact CD1-CD1 4.25Å; F125-F132 HydrophobicContact CB-CE2 3.84Å; F125-F132 HydrophobicContact CB-CZ 3.7Å; F125-F132 HydrophobicContact CD1-CZ 4.4Å; F125-F132 AromaticContact CD2-CZ 3.88Å; F125-F132 HydrophobicContact CD2-CZ 3.88Å; F125-F132 HydrophobicContact CG-CE2 4.39Å; F125-F132 AromaticContact CG-CZ 3.74Å; F125-F132 HydrophobicContact CG-CZ 3.74Å; F125-P164 HydrophobicContact CD2-CB 3.9Å; F125-P164 HydrophobicContact CD2-CG 3.86Å; F125-P164 HydrophobicContact CE2-CB 4.4Å; F125-P164 HydrophobicContact CE2-CG 4.37Å; F125-I166 HydrophobicContact CD1-CD1 4.3Å; F125-I166 HydrophobicContact CE1-CD1 3.53Å; F125-I166 HydrophobicContact CZ-CD1 3.76Å; F125-I166 HydrophobicContact CZ-CG1 4.34Å
126	D	86.7	Confident	90.2	Very high	125 Å²	125	63.1 Å²	63.1	67%	0.668	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	45.9	-174.1	-63.9	-21.3	0	0	0	114.1	K128	D126-K128 PolarHBondContact O-N 2.95Å; D126-K128 VanDerWaalsContact O-N 3.13Å
127	N	85.6	Confident	90.3	Very high	163 Å²	163	62.1 Å²	62.1	87%	0.872	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	19.7	-176	-61.4	-28.7	0	0	0	114.8	F125	F125-N127 VanDerWaalsContact C-N 3.3Å; F125-N127 PolarHBondContact O-N 2.75Å
128	K	85.4	Confident	90.6	Very high	131 Å²	131	57.6 Å²	57.6	57%	0.57	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.8	140	175.3	-63.8	174.4	-172.7	170.5	0	109.8	T124 F125 D126 L130	T124-K128 CarbonylContact C-O 3.57Å; T124-K128 WeakPolarHBondContact CA-O 3.28Å; F125-K128 PolarHBondContact N-O 2.99Å; F125-K128 PolarHBondContact O-N 3.18Å; F125-K128 VanDerWaalsContact O-O 3.05Å; D126-K128 PolarHBondContact O-N 2.95Å; D126-K128 VanDerWaalsContact O-N 3.13Å; K128-L130 HydrophobicContact CB-CD2 4.38Å; K128-L130 HydrophobicContact CB-CG 4.2Å; K128-L130 PolarHBondContact O-N 2.92Å
129	L	86.8	Confident	90.7	Very high	58 Å²	58	63.8 Å²	63.8	30%	0.304	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	116.3	170.6	-169.3	66.2	0	0	0	108.3	L122 F272	L122-L129 HydrophobicContact CB-CD1 4.27Å; L122-L129 HydrophobicContact CD2-CD1 4.14Å; L122-L129 HydrophobicContact CD2-CD2 3.86Å; L122-L129 HydrophobicContact CD2-CG 3.61Å; L129-F272 HydrophobicContact CD2-CD2 4.26Å; L129-F272 HydrophobicContact CD2-CE2 3.71Å; L129-F272 HydrophobicContact CD2-CZ 4.3Å
130	L	89	Confident	90.8	Very high	15 Å²	15	69.2 Å²	69.2	8%	0.079	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	153	-177.5	-62.2	178.7	0	0	0	110.5	M46 M123 F125 K128 F132	M46-L130 HydrophobicContact CB-CD2 3.85Å; M46-L130 HydrophobicContact CG-CD2 3.71Å; M123-L130 PolarHBondContact N-O 3.03Å; M123-L130 PolarHBondContact O-N 2.94Å; F125-L130 HydrophobicContact CB-CD1 4.26Å; F125-L130 HydrophobicContact CD1-CD1 4.25Å; K128-L130 HydrophobicContact CB-CD2 4.38Å; K128-L130 HydrophobicContact CB-CG 4.2Å; K128-L130 PolarHBondContact O-N 2.92Å; L130-F132 HydrophobicContact CB-CD2 4.38Å; L130-F132 HydrophobicContact CB-CE2 3.84Å
131	I	90.5	Very high	91	Very high	16 Å²	16	67 Å²	67	8%	0.082	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133.3	169.1	-75.4	-171.3	0	0	0	110.3	T43 H44 T120 L122	T43-I131 VanDerWaalsContact O-CD1 3.29Å; T43-I131 WeakPolarHBondContact O-CD1 3.01Å; H44-I131 HydrophobicContact CB-CD1 3.47Å; H44-I131 VanDerWaalsContact CB-CD1 3.47Å; H44-I131 HydrophobicContact CB-CG1 3.97Å; T120-I131 HydrophobicContact CG2-CG2 3.72Å; L122-I131 HydrophobicContact CD2-CG1 3.99Å; L122-I131 HydrophobicContact CG-CG1 3.99Å
132	F	94	Very high	91.1	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.5	170.2	-71.5	-101.9	0	0	0	110	T120 K121 M123 F125 L130 R157 F158 I159 P164	T120-F132 CarbonylContact C-O 3.58Å; T120-F132 WeakPolarHBondContact CA-O 3.38Å; K121-F132 PolarHBondContact N-O 2.97Å; K121-F132 PolarHBondContact O-N 3.47Å; M123-F132 HydrophobicContact CB-CD2 3.92Å; M123-F132 HydrophobicContact CB-CE2 4.19Å; M123-F132 HydrophobicContact CG-CD2 4.43Å; F125-F132 HydrophobicContact CB-CE2 3.84Å; F125-F132 HydrophobicContact CB-CZ 3.7Å; F125-F132 HydrophobicContact CD1-CZ 4.4Å; F125-F132 AromaticContact CD2-CZ 3.88Å; F125-F132 HydrophobicContact CD2-CZ 3.88Å; F125-F132 HydrophobicContact CG-CE2 4.39Å; F125-F132 AromaticContact CG-CZ 3.74Å; F125-F132 HydrophobicContact CG-CZ 3.74Å; L130-F132 HydrophobicContact CB-CD2 4.38Å; L130-F132 HydrophobicContact CB-CE2 3.84Å; F132-R157 HydrophobicContact CD1-CB 3.66Å; F132-R157 HydrophobicContact CE1-CB 3.8Å; F132-R157 HydrophobicContact CE1-CG 4.41Å; F132-R157 HydrophobicContact CG-CB 4.13Å; F132-R157 HydrophobicContact CZ-CB 4.43Å; F132-F158 WeakPolarHBondContact CD1-O 3.49Å; F132-I159 HydrophobicContact CB-CD1 4.26Å; F132-I159 HydrophobicContact CB-CG1 3.8Å; F132-P164 HydrophobicContact CD1-CB 3.82Å; F132-P164 HydrophobicContact CE1-CB 3.38Å; F132-P164 HydrophobicContact CE2-CB 4.15Å; F132-P164 HydrophobicContact CG-CB 4.42Å; F132-P164 HydrophobicContact CZ-CB 3.58Å
133	C	95.3	Very high	91.3	Very high	4 Å²	4	64.4 Å²	64.4	3%	0.027	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	132.8	171.4	-54.6	0	0	0	0	110.7	C115 G136 C137 R157 F158 I159	C115-C133 WeakPolarHBondContact CA-SG 3.16Å; C115-C133 HydrophobicContact CB-CB 3.5Å; C115-C133 VanDerWaalsContact CB-CB 3.5Å; C115-C133 WeakPolarHBondContact CB-SG 3.11Å; C115-C133 WeakPolarHBondContact SG-CA 3.34Å; C115-C133 WeakPolarHBondContact SG-CB 3.11Å; C115-C133 CovalentContact SG-SG 2.02Å; C115-C133 PolarHBondContact SG-SG 2.78Å; C133-G136 WeakPolarHBondContact CB-O 3.39Å; C133-C137 PolarHBondContact SG-SG 3Å; C133-R157 PolarHBondContact N-O 3.27Å; C133-F158 HydrophobicContact CB-CB 4.27Å; C133-F158 CarbonylContact O-C 3.57Å; C133-F158 WeakPolarHBondContact O-CA 3.48Å; C133-I159 PolarHBondContact O-N 2.91Å
134	T	94.4	Very high	91.4	Very high	48 Å²	48	63.2 Å²	63.2	29%	0.294	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-39.4	179.1	49.4	0	0	0	0	112	A119 K121	A119-T134 WeakPolarHBondContact CB-OG1 3.5Å; A119-T134 PolarHBondContact O-N 3.09Å; A119-T134 PolarHBondContact O-OG1 2.74Å; K121-T134 HydrophobicContact CB-CG2 4.24Å
135	D	92.2	Very high	91.5	Very high	113 Å²	113	60.4 Å²	60.4	60%	0.604	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	27.3	-171.8	-55.1	-67.7	0	0	0	112.2	V116	V116-D135 HydrophobicContact CB-CB 4.34Å
136	G	94.6	Very high	91.9	Very high	16 Å²	16	58 Å²	58	17%	0.165	30%	0.298	C	S	.	.			trans	83.3	177.2	-176.9	0	0	0	0	0	114.1	V116 C133	V116-G136 PolarHBondContact N-O 3.46Å; C133-G136 WeakPolarHBondContact CB-O 3.39Å
137	C	95.2	Very high	92.3	Very high	28 Å²	28	55.9 Å²	55.9	19%	0.189	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-96.5	149.8	177.4	-51.2	0	0	0	0	110.7	R113 V114 C133 C156	R113-C137 HydrophobicContact CB-CB 3.94Å; V114-C137 WeakPolarHBondContact O-CA 3.39Å; C133-C137 PolarHBondContact SG-SG 3Å; C137-C156 HydrophobicContact CB-CB 3.83Å; C137-C156 WeakPolarHBondContact CB-SG 3.45Å; C137-C156 PolarHBondContact N-SG 2.85Å; C137-C156 VanDerWaalsContact N-SG 3.43Å; C137-C156 WeakPolarHBondContact SG-CA 3.29Å; C137-C156 WeakPolarHBondContact SG-CB 3.26Å; C137-C156 CovalentContact SG-SG 2.03Å; C137-C156 PolarHBondContact SG-SG 3.5Å
138	V	93.5	Very high	92.8	Very high	45 Å²	45	48.5 Å²	48.5	27%	0.273	25%	0.247	S	C	.	.			trans	-64.6	149.3	170.1	-58.6	0	0	0	0	110.4	V114 V116 W140	V114-V138 HydrophobicContact CB-CG2 3.87Å; V114-V138 HydrophobicContact CG1-CG1 4.49Å; V114-V138 HydrophobicContact CG1-CG2 4.08Å; V114-V138 WeakPolarHBondContact O-CG2 3.32Å; V114-V138 PolarHBondContact O-N 2.6Å; V116-V138 HydrophobicContact CG2-CG1 4.22Å; V138-W140 VanDerWaalsContact C-N 3.28Å; V138-W140 VanDerWaalsContact CG2-O 3.28Å; V138-W140 WeakPolarHBondContact CG2-O 3.42Å; V138-W140 PolarHBondContact O-N 2.74Å
139	E	91.4	Very high	93.3	Very high	151 Å²	151	43.8 Å²	43.8	71%	0.706	23%	0.23	S	C	*	.	S	Bend	trans	-58.4	-42.6	177.8	-170.3	-175	-168.5	0	0	111.4
140	W	92.4	Very high	93.7	Very high	146 Å²	146	44 Å²	44	55%	0.553	23%	0.233	S	C	*	.	S	Bend	trans	-117.7	104.9	-177.2	-55.7	98.5	0	0	0	111.1	V138	V138-W140 VanDerWaalsContact C-N 3.28Å; V138-W140 VanDerWaalsContact CG2-O 3.28Å; V138-W140 WeakPolarHBondContact CG2-O 3.42Å; V138-W140 PolarHBondContact O-N 2.74Å
141	T	94.9	Very high	94	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.012	24%	0.244	C	C	.	.			trans	-73	129.4	171.7	-65.6	0	0	0	0	109.9	R113 V114 V148 L153	R113-T141 WeakPolarHBondContact CA-OG1 3.35Å; V114-T141 HydrophobicContact CB-CG2 4.38Å; V114-T141 HydrophobicContact CG2-CG2 3.88Å; V114-T141 PolarHBondContact N-OG1 2.83Å; T141-V148 HydrophobicContact CG2-CB 4.3Å; T141-V148 HydrophobicContact CG2-CG2 4.27Å; T141-V148 PolarHBondContact O-N 3.26Å; T141-L153 HydrophobicContact CG2-CD2 3.78Å
142	K	94.1	Very high	94.3	Very high	101 Å²	101	45 Å²	45	44%	0.439	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	152.6	-179.5	-68.6	-175.8	178.9	178.8	0	112	I146 N147	K142-I146 CarbonylContact C-O 3.59Å; K142-I146 VanDerWaalsContact CA-O 3.23Å; K142-I146 WeakPolarHBondContact CA-O 3.42Å; K142-N147 VanDerWaalsContact CE-OD1 3.28Å; K142-N147 WeakPolarHBondContact CE-OD1 3.37Å; K142-N147 WeakPolarHBondContact CG-OD1 3.22Å
143	C	94.9	Very high	94.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	97.8	165.9	-174.3	0	0	0	0	106.7	I146 V148 Y182 C203 G215	C143-I146 PolarHBondContact N-O 3.23Å; C143-I146 PolarHBondContact O-N 3.02Å; C143-V148 HydrophobicContact CB-CG2 3.84Å; C143-Y182 HydrophobicContact CB-CD2 3.75Å; C143-Y182 HydrophobicContact CB-CE2 4.19Å; C143-Y182 HydrophobicContact CB-CG 4.33Å; C143-C203 HydrophobicContact CB-CB 3.82Å; C143-C203 WeakPolarHBondContact CB-SG 3.26Å; C143-C203 WeakPolarHBondContact SG-CB 3.01Å; C143-C203 CovalentContact SG-SG 2.04Å; C143-C203 PolarHBondContact SG-SG 3.35Å; C143-G215 VanDerWaalsContact SG-C 3.52Å
144	G	91.8	Very high	94.3	Very high	13 Å²	13	45.3 Å²	45.3	13%	0.134	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	-133.8	-166	0	0	0	0	0	111.4	I146	G144-I146 PolarHBondContact O-N 2.92Å
145	P	91.7	Very high	94.3	Very high	42 Å²	42	46.5 Å²	46.5	27%	0.273	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-1.2	179.6	33.8	-34.6	0	0	0	113.8	L186 N218	P145-L186 HydrophobicContact CB-CD1 3.75Å; P145-L186 HydrophobicContact CG-CD1 3.99Å; P145-N218 HydrophobicContact CG-CB 3.99Å
146	I	94.9	Very high	94.4	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132.8	-167.7	-51.6	169.6	0	0	0	110.3	D69 K142 C143 G144 Y182 S184	D69-I146 HydrophobicContact CB-CG2 4.21Å; K142-I146 CarbonylContact C-O 3.59Å; K142-I146 VanDerWaalsContact CA-O 3.23Å; K142-I146 WeakPolarHBondContact CA-O 3.42Å; C143-I146 PolarHBondContact N-O 3.23Å; C143-I146 PolarHBondContact O-N 3.02Å; G144-I146 PolarHBondContact O-N 2.92Å; I146-Y182 VanDerWaalsContact CD1-C 3.45Å; I146-Y182 WeakPolarHBondContact CD1-O 3.41Å; I146-Y182 HydrophobicContact CG2-CD1 4.4Å; I146-S184 WeakPolarHBondContact CD1-OG 2.96Å; I146-S184 WeakPolarHBondContact CG1-OG 3.3Å
147	N	95.4	Very high	94.5	Very high	79 Å²	79	42.8 Å²	42.8	42%	0.422	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	127	170.7	-70.7	-18.8	0	0	0	110.1	K142	K142-N147 VanDerWaalsContact CE-OD1 3.28Å; K142-N147 WeakPolarHBondContact CE-OD1 3.37Å; K142-N147 WeakPolarHBondContact CG-OD1 3.22Å
148	V	96.6	Very high	94.5	Very high	9 Å²	9	43.4 Å²	43.4	6%	0.055	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-75.5	125.8	175.2	177.4	0	0	0	0	109.2	L111 T141 C143 H152 L153 Y182	L111-V148 HydrophobicContact CD1-CG1 4.32Å; T141-V148 HydrophobicContact CG2-CB 4.3Å; T141-V148 HydrophobicContact CG2-CG2 4.27Å; T141-V148 PolarHBondContact O-N 3.26Å; C143-V148 HydrophobicContact CB-CG2 3.84Å; V148-H152 HydrophobicContact CG1-CB 4.03Å; V148-L153 HydrophobicContact CB-CD1 4.49Å; V148-L153 HydrophobicContact CB-CD2 4.14Å; V148-L153 HydrophobicContact CB-CG 4.44Å; V148-L153 HydrophobicContact CG1-CD1 4.32Å; V148-L153 HydrophobicContact CG1-CD2 3.56Å; V148-L153 HydrophobicContact CG1-CG 3.78Å; V148-Y182 HydrophobicContact CG1-CE1 4.3Å; V148-Y182 WeakPolarHBondContact CG1-OH 3.06Å; V148-Y182 HydrophobicContact CG2-CE1 4.36Å; V148-Y182 HydrophobicContact CG2-CE2 4.15Å
149	P	96.4	Very high	94.6	Very high	31 Å²	31	42.6 Å²	42.6	20%	0.201	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-57.7	140.4	176.8	-24.4	33.6	0	0	0	112.4	H67 S151 H152	H67-P149 WeakPolarHBondContact CE1-CG 3.43Å; P149-S151 PolarHBondContact O-N 3.06Å; P149-S151 VanDerWaalsContact O-N 3.16Å; P149-H152 WeakPolarHBondContact O-CB 3.22Å; P149-H152 PolarHBondContact O-N 2.98Å
150	V	95	Very high	94.7	Very high	63 Å²	63	42 Å²	42	38%	0.382	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-59.5	-29.4	178.2	178.9	0	0	0	0	112.1	H152 L153 G171	V150-H152 PolarHBondContact O-N 2.84Å; V150-L153 PolarHBondContact O-N 3.04Å; V150-L153 VanDerWaalsContact O-N 3.14Å; V150-G171 WeakPolarHBondContact O-CA 3.04Å
151	S	95.8	Very high	94.7	Very high	42 Å²	42	41.5 Å²	41.5	29%	0.294	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-62.3	-20.6	174	53.9	0	0	0	0	113.6	P149 G171 E172 G173	P149-S151 PolarHBondContact O-N 3.06Å; P149-S151 VanDerWaalsContact O-N 3.16Å; S151-G171 CarbonylContact O-C 3.47Å; S151-G171 WeakPolarHBondContact O-CA 3.34Å; S151-E172 PolarHBondContact O-N 2.88Å; S151-E172 VanDerWaalsContact O-N 3.09Å; S151-G173 PolarHBondContact O-N 2.79Å
152	H	96	Very high	94.5	Very high	10 Å²	10	44.1 Å²	44.1	5%	0.046	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-94.3	-13.7	178	-57.5	-174.5	0	0	0	112.5	H67 T110 L111 V148 P149 V150 I174 Y182	H67-H152 AromaticContact CG-CE1 3.94Å; H67-H152 AromaticContact ND1-CE1 3.54Å; T110-H152 WeakPolarHBondContact CA-O 3.45Å; L111-H152 PolarHBondContact N-O 3.36Å; V148-H152 HydrophobicContact CG1-CB 4.03Å; P149-H152 WeakPolarHBondContact O-CB 3.22Å; P149-H152 PolarHBondContact O-N 2.98Å; V150-H152 PolarHBondContact O-N 2.84Å; H152-I174 WeakPolarHBondContact NE2-CD1 3.04Å; H152-Y182 AromaticContact ND1-CE1 3.67Å; H152-Y182 AromaticContact ND1-CZ 3.72Å; H152-Y182 PolarHBondContact ND1-OH 2.68Å
153	L	95.5	Very high	94.4	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-94.5	144.7	-169.6	-66.1	171.7	0	0	0	112.5	L111 R113 T141 V148 V150 G171	L111-L153 HydrophobicContact CB-CD2 4.15Å; L111-L153 CarbonylContact O-C 3.58Å; L111-L153 WeakPolarHBondContact O-CA 3.36Å; R113-L153 HydrophobicContact CG-CB 4.4Å; R113-L153 HydrophobicContact CG-CD1 4.38Å; R113-L153 HydrophobicContact CG-CD2 4.48Å; T141-L153 HydrophobicContact CG2-CD2 3.78Å; V148-L153 HydrophobicContact CB-CD1 4.49Å; V148-L153 HydrophobicContact CB-CD2 4.14Å; V148-L153 HydrophobicContact CB-CG 4.44Å; V148-L153 HydrophobicContact CG1-CD1 4.32Å; V148-L153 HydrophobicContact CG1-CD2 3.56Å; V148-L153 HydrophobicContact CG1-CG 3.78Å; V150-L153 PolarHBondContact O-N 3.04Å; V150-L153 VanDerWaalsContact O-N 3.14Å; L153-G171 PolarHBondContact O-N 2.84Å
154	N	93.5	Very high	94.4	Very high	9 Å²	9	45 Å²	45	5%	0.048	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-71.2	170.3	161.7	-81.1	-43.1	0	0	0	111.5	T110 L111 D112 R113 K170	T110-N154 WeakPolarHBondContact CB-OD1 3.46Å; T110-N154 PolarHBondContact OG1-ND2 2.85Å; T110-N154 VanDerWaalsContact OG1-ND2 3.09Å; T110-N154 PolarHBondContact OG1-OD1 3.06Å; T110-N154 VanDerWaalsContact OG1-OD1 3.12Å; L111-N154 PolarHBondContact O-N 2.82Å; D112-N154 WeakPolarHBondContact OD1-CB 3.01Å; D112-N154 PolarHBondContact OD1-ND2 2.88Å; R113-N154 PolarHBondContact NE-O 2.64Å; N154-K170 WeakPolarHBondContact OD1-CE 3.43Å
155	Q	94.4	Very high	94.5	Very high	72 Å²	72	48.1 Å²	48.1	34%	0.336	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-63.2	154.4	169.6	-62.6	177.6	-82.4	0	0	110.6	R157 I166 S167 G168 K170	Q155-R157 PolarHBondContact O-N 2.96Å; Q155-I166 HydrophobicContact CB-CG2 3.45Å; Q155-I166 VanDerWaalsContact CB-CG2 3.45Å; Q155-I166 HydrophobicContact CG-CG2 4.2Å; Q155-S167 WeakPolarHBondContact CB-O 3.46Å; Q155-G168 WeakPolarHBondContact CG-O 3.22Å; Q155-G168 PolarHBondContact NE2-O 3.09Å; Q155-K170 HydrophobicContact CG-CB 3.72Å
156	C	95.2	Very high	94.6	Very high	17 Å²	17	49.3 Å²	49.3	12%	0.115	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	125.3	173.5	178	0	0	0	0	109.7	C137 I166 S167	C137-C156 HydrophobicContact CB-CB 3.83Å; C137-C156 WeakPolarHBondContact CB-SG 3.45Å; C137-C156 PolarHBondContact N-SG 2.85Å; C137-C156 VanDerWaalsContact N-SG 3.43Å; C137-C156 WeakPolarHBondContact SG-CA 3.29Å; C137-C156 WeakPolarHBondContact SG-CB 3.26Å; C137-C156 CovalentContact SG-SG 2.03Å; C137-C156 PolarHBondContact SG-SG 3.5Å; C156-I166 VanDerWaalsContact O-CA 3.3Å; C156-I166 WeakPolarHBondContact O-CA 3.2Å; C156-S167 PolarHBondContact N-O 3.44Å; C156-S167 PolarHBondContact O-N 3.13Å
157	R	95	Very high	94.6	Very high	35 Å²	35	52.4 Å²	52.4	13%	0.132	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	116.2	170.5	-60	-173.8	-162.3	121.2	13.3	107.8	D112 F132 C133 Q155 M165 I166	D112-R157 IonicContact OD1-CZ 2.69Å; D112-R157 IonicContact OD1-NH1 3.11Å; D112-R157 PolarHBondContact OD1-NH1 3.43Å; D112-R157 IonicContact OD1-NH2 3.6Å; D112-R157 PolarHBondContact OD1-NH2 2.8Å; D112-R157 IonicContact OD2-CZ 2.76Å; D112-R157 IonicContact OD2-NH1 3.59Å; D112-R157 PolarHBondContact OD2-NH1 2.05Å; D112-R157 IonicContact OD2-NH2 3.75Å; F132-R157 HydrophobicContact CD1-CB 3.66Å; F132-R157 HydrophobicContact CE1-CB 3.8Å; F132-R157 HydrophobicContact CE1-CG 4.41Å; F132-R157 HydrophobicContact CG-CB 4.13Å; F132-R157 HydrophobicContact CZ-CB 4.43Å; C133-R157 PolarHBondContact N-O 3.27Å; Q155-R157 PolarHBondContact O-N 2.96Å; R157-M165 WeakPolarHBondContact CA-O 3.26Å; R157-I166 HydrophobicContact CG-CG1 4.39Å
158	F	95.4	Very high	94.3	Very high	40 Å²	40	50.9 Å²	50.9	18%	0.175	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	165.3	-176.7	68	-75.3	0	0	0	112.2	F132 C133 M165	F132-F158 WeakPolarHBondContact CD1-O 3.49Å; C133-F158 HydrophobicContact CB-CB 4.27Å; C133-F158 CarbonylContact O-C 3.57Å; C133-F158 WeakPolarHBondContact O-CA 3.48Å; F158-M165 HydrophobicContact CD1-CB 4.18Å; F158-M165 HydrophobicContact CD2-CB 4.4Å; F158-M165 HydrophobicContact CE1-CB 3.67Å; F158-M165 HydrophobicContact CE2-CB 3.94Å; F158-M165 HydrophobicContact CE2-CG 4.5Å; F158-M165 HydrophobicContact CE2-SD 4.24Å; F158-M165 HydrophobicContact CZ-CB 3.54Å; F158-M165 HydrophobicContact CZ-CG 4.36Å; F158-M165 HydrophobicContact CZ-SD 4.11Å; F158-M165 PolarHBondContact N-O 2.05Å; F158-M165 PolarHBondContact O-N 2.91Å
159	I	95.9	Very high	94	Very high	28 Å²	28	56.8 Å²	56.8	14%	0.144	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.1	178.3	-56.1	176.5	0	0	0	108.6	K121 M123 F132 C133 T163	K121-I159 HydrophobicContact CB-CD1 3.85Å; K121-I159 HydrophobicContact CD-CD1 3.86Å; K121-I159 HydrophobicContact CG-CD1 4.34Å; M123-I159 HydrophobicContact SD-CD1 3.49Å; M123-I159 WeakPolarHBondContact SD-CD1 3.2Å; M123-I159 HydrophobicContact SD-CG1 3.82Å; F132-I159 HydrophobicContact CB-CD1 4.26Å; F132-I159 HydrophobicContact CB-CG1 3.8Å; C133-I159 PolarHBondContact O-N 2.91Å; I159-T163 WeakPolarHBondContact CA-O 3.31Å
160	Y	94	Very high	93.8	Very high	139 Å²	139	59.7 Å²	59.7	55%	0.545	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	118.8	173.1	-174.4	-105.7	0	0	0	108.9	G162 T163 M165	Y160-G162 PolarHBondContact O-N 3.07Å; Y160-T163 PolarHBondContact N-O 2.99Å; Y160-T163 WeakPolarHBondContact O-CB 3.45Å; Y160-T163 PolarHBondContact O-N 3.29Å; Y160-M165 WeakPolarHBondContact CB-SD 3.2Å; Y160-M165 HydrophobicContact CD1-SD 3.9Å; Y160-M165 HydrophobicContact CG-SD 3.9Å
161	N	92.1	Very high	93.8	Very high	136 Å²	136	56.9 Å²	56.9	73%	0.727	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	44.3	-176	-64.1	-18	0	0	0	113	T163	N161-T163 PolarHBondContact O-N 2.91Å
162	G	90.5	Very high	93.6	Very high	57 Å²	57	61.4 Å²	61.4	59%	0.588	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	-4.2	-179.1	0	0	0	0	0	115.6	Y160	Y160-G162 PolarHBondContact O-N 3.07Å
163	T	93.1	Very high	93.4	Very high	84 Å²	84	61 Å²	61	52%	0.515	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	132.4	-178.5	-52.6	0	0	0	0	110.8	I159 Y160 N161 M165	I159-T163 WeakPolarHBondContact CA-O 3.31Å; Y160-T163 PolarHBondContact N-O 2.99Å; Y160-T163 WeakPolarHBondContact O-CB 3.45Å; Y160-T163 PolarHBondContact O-N 3.29Å; N161-T163 PolarHBondContact O-N 2.91Å; T163-M165 PolarHBondContact O-N 3.46Å
164	P	93.9	Very high	93.3	Very high	35 Å²	35	61.6 Å²	61.6	23%	0.227	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	127.1	173.5	27.3	-32.9	0	0	0	110.8	M123 F125 F132	M123-P164 HydrophobicContact CE-CG 4.33Å; F125-P164 HydrophobicContact CD2-CB 3.9Å; F125-P164 HydrophobicContact CD2-CG 3.86Å; F125-P164 HydrophobicContact CE2-CB 4.4Å; F125-P164 HydrophobicContact CE2-CG 4.37Å; F132-P164 HydrophobicContact CD1-CB 3.82Å; F132-P164 HydrophobicContact CE1-CB 3.38Å; F132-P164 HydrophobicContact CE2-CB 4.15Å; F132-P164 HydrophobicContact CG-CB 4.42Å; F132-P164 HydrophobicContact CZ-CB 3.58Å
165	M	94.5	Very high	93	Very high	79 Å²	79	67.7 Å²	67.7	39%	0.389	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	153	178.3	-65.8	-159	76.7	0	0	111.2	R157 F158 Y160 T163	R157-M165 WeakPolarHBondContact CA-O 3.26Å; F158-M165 HydrophobicContact CD1-CB 4.18Å; F158-M165 HydrophobicContact CD2-CB 4.4Å; F158-M165 HydrophobicContact CE1-CB 3.67Å; F158-M165 HydrophobicContact CE2-CB 3.94Å; F158-M165 HydrophobicContact CE2-CG 4.5Å; F158-M165 HydrophobicContact CE2-SD 4.24Å; F158-M165 HydrophobicContact CZ-CB 3.54Å; F158-M165 HydrophobicContact CZ-CG 4.36Å; F158-M165 HydrophobicContact CZ-SD 4.11Å; F158-M165 PolarHBondContact N-O 2.05Å; F158-M165 PolarHBondContact O-N 2.91Å; Y160-M165 WeakPolarHBondContact CB-SD 3.2Å; Y160-M165 HydrophobicContact CD1-SD 3.9Å; Y160-M165 HydrophobicContact CG-SD 3.9Å; T163-M165 PolarHBondContact O-N 3.46Å
166	I	93.6	Very high	92.6	Very high	67 Å²	67	70 Å²	70	34%	0.344	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	130	174.4	-58	-179.3	0	0	0	108.4	F125 Q155 C156 R157	F125-I166 HydrophobicContact CD1-CD1 4.3Å; F125-I166 HydrophobicContact CE1-CD1 3.53Å; F125-I166 HydrophobicContact CZ-CD1 3.76Å; F125-I166 HydrophobicContact CZ-CG1 4.34Å; Q155-I166 HydrophobicContact CB-CG2 3.45Å; Q155-I166 VanDerWaalsContact CB-CG2 3.45Å; Q155-I166 HydrophobicContact CG-CG2 4.2Å; C156-I166 VanDerWaalsContact O-CA 3.3Å; C156-I166 WeakPolarHBondContact O-CA 3.2Å; R157-I166 HydrophobicContact CG-CG1 4.39Å
167	S	93.8	Very high	92.3	Very high	67 Å²	67	69.4 Å²	69.4	47%	0.469	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	163.6	179.5	-174.1	0	0	0	0	112.8	Q155 C156	Q155-S167 WeakPolarHBondContact CB-O 3.46Å; C156-S167 PolarHBondContact N-O 3.44Å; C156-S167 PolarHBondContact O-N 3.13Å
168	G	89.8	Confident	92.1	Very high	46 Å²	46	67.9 Å²	67.9	47%	0.474	35%	0.354	S	S	.	.	S	Bend	trans	84.5	-179.3	-179.3	0	0	0	0	0	113.7	Q155	Q155-G168 WeakPolarHBondContact CG-O 3.22Å; Q155-G168 PolarHBondContact NE2-O 3.09Å
169	H	90.5	Very high	92	Very high	133 Å²	133	66 Å²	66	62%	0.616	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-84.7	136.8	-178.8	-177.7	72.7	0	0	0	111.6
170	K	92.5	Very high	92.1	Very high	92 Å²	92	64.6 Å²	64.6	40%	0.4	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-86	117.7	168.5	-170	178.3	176	177.2	0	108.9	N154 Q155	N154-K170 WeakPolarHBondContact OD1-CE 3.43Å; Q155-K170 HydrophobicContact CG-CB 3.72Å
171	G	93.8	Very high	92.3	Very high	5 Å²	5	58 Å²	58	5%	0.052	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-64.1	161.3	173.3	0	0	0	0	0	112.9	V150 S151 L153 G173	V150-G171 WeakPolarHBondContact O-CA 3.04Å; S151-G171 CarbonylContact O-C 3.47Å; S151-G171 WeakPolarHBondContact O-CA 3.34Å; L153-G171 PolarHBondContact O-N 2.84Å; G171-G173 PolarHBondContact O-N 3.35Å
172	E	92.9	Very high	92.6	Very high	137 Å²	137	51.5 Å²	51.5	64%	0.64	28%	0.278	S	S	*	.			trans	-60.6	-33.5	177.7	59.9	-177.4	167.1	0	0	112.8	R108 S151	R108-E172 WeakPolarHBondContact CD-O 3.35Å; S151-E172 PolarHBondContact O-N 2.88Å; S151-E172 VanDerWaalsContact O-N 3.09Å
173	G	92	Very high	92.9	Very high	2 Å²	2	48.9 Å²	48.9	2%	0.021	25%	0.25	C	S	.	.			trans	75	160.8	-173.3	0	0	0	0	0	113.5	L109 S151 G171	L109-G173 CarbonylContact O-C 3.33Å; L109-G173 VanDerWaalsContact O-CA 3.24Å; L109-G173 WeakPolarHBondContact O-CA 3.46Å; S151-G173 PolarHBondContact O-N 2.79Å; G171-G173 PolarHBondContact O-N 3.35Å
174	I	92.6	Very high	93.1	Very high	14 Å²	14	44.9 Å²	44.9	7%	0.072	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	125.6	-174.5	-59.1	-53.2	0	0	0	111	H65 R108 L109 H152 A177 I180	H65-I174 HydrophobicContact CB-CG2 3.62Å; H65-I174 VanDerWaalsContact CG-CG2 3.44Å; R108-I174 CarbonylContact C-O 3.53Å; R108-I174 VanDerWaalsContact CA-O 3.28Å; R108-I174 WeakPolarHBondContact CA-O 3.27Å; L109-I174 HydrophobicContact CB-CB 4.41Å; L109-I174 PolarHBondContact N-O 2.89Å; L109-I174 PolarHBondContact O-N 2.83Å; H152-I174 WeakPolarHBondContact NE2-CD1 3.04Å; I174-A177 HydrophobicContact CB-CB 4.46Å; I174-A177 HydrophobicContact CG2-CB 3.52Å; I174-I180 HydrophobicContact CB-CD1 4.36Å; I174-I180 HydrophobicContact CG1-CD1 3.68Å; I174-I180 HydrophobicContact CG1-CG1 4.18Å
175	Y	88	Confident	93.1	Very high	136 Å²	136	43.9 Å²	43.9	53%	0.533	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	140.5	173.9	-167.6	-123.5	0	0	0	111.3	N107 A177	N107-Y175 WeakPolarHBondContact O-CD2 3.36Å; Y175-A177 VanDerWaalsContact C-N 3.28Å; Y175-A177 PolarHBondContact O-N 2.98Å
176	R	85	Confident	93	Very high	122 Å²	122	42.7 Å²	42.7	46%	0.46	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	36.3	170.1	-68.8	179	75	123.9	4.9	116.3	R63 M105	R63-R176 WeakPolarHBondContact CD-O 3.23Å; M105-R176 HydrophobicContact CE-CB 3.82Å; M105-R176 HydrophobicContact CE-CG 3.91Å
177	A	90	Very high	92.8	Very high	3 Å²	3	46.6 Å²	46.6	3%	0.025	23%	0.225	C	C	.	.			trans	-126.5	149	173.1	0	0	0	0	0	111	R63 H65 L109 I174 Y175	R63-A177 WeakPolarHBondContact O-CA 3.46Å; H65-A177 HydrophobicContact CB-CB 3.61Å; L109-A177 HydrophobicContact CD2-CB 4.48Å; I174-A177 HydrophobicContact CB-CB 4.46Å; I174-A177 HydrophobicContact CG2-CB 3.52Å; Y175-A177 VanDerWaalsContact C-N 3.28Å; Y175-A177 PolarHBondContact O-N 2.98Å
178	N	89.7	Confident	92.5	Very high	3 Å²	3	45 Å²	45	2%	0.016	21%	0.212	C	C	.	.	S	Bend	trans	-121.2	-0.1	173.6	52.4	43.3	0	0	0	112.4	E61 L62 R63 L99 R211	E61-N178 PolarHBondContact O-ND2 2.83Å; L62-N178 WeakPolarHBondContact CD1-OD1 3.46Å; R63-N178 PolarHBondContact N-ND2 3.21Å; R63-N178 PolarHBondContact N-OD1 3.31Å; R63-N178 PolarHBondContact O-N 2.87Å; R63-N178 PolarHBondContact O-OD1 3.36Å; L99-N178 HydrophobicContact CD1-CB 4.09Å; L99-N178 WeakPolarHBondContact CD1-ND2 2.97Å; N178-R211 PolarHBondContact O-NH1 2.79Å; N178-R211 PolarHBondContact O-NH2 2.97Å
179	F	94.8	Very high	92.3	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	141	168.4	-172.6	-100.7	0	0	0	110.3	L62 R63 I64 H65 L181 P212 M213 L246	L62-F179 HydrophobicContact CD1-CB 4.38Å; R63-F179 PolarHBondContact O-N 3.05Å; I64-F179 HydrophobicContact CG1-CB 4.34Å; I64-F179 HydrophobicContact CG1-CD1 4.13Å; I64-F179 HydrophobicContact CG2-CD1 4.13Å; H65-F179 PolarHBondContact N-O 2.93Å; F179-L181 HydrophobicContact CD1-CB 4.36Å; F179-L181 HydrophobicContact CE1-CB 4.01Å; F179-L181 HydrophobicContact CE1-CD1 4.11Å; F179-P212 WeakPolarHBondContact CD2-O 3.39Å; F179-P212 HydrophobicContact CE2-CB 3.86Å; F179-M213 CarbonylContact C-O 3.43Å; F179-M213 WeakPolarHBondContact CA-O 3.08Å; F179-L246 HydrophobicContact CD1-CD2 3.92Å; F179-L246 HydrophobicContact CD2-CD2 4.03Å; F179-L246 HydrophobicContact CE1-CD2 3.93Å; F179-L246 HydrophobicContact CE2-CD2 4.06Å; F179-L246 HydrophobicContact CG-CD2 3.96Å; F179-L246 HydrophobicContact CZ-CD2 4.01Å
180	I	97.1	Very high	91.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	122.7	173.4	-55.1	170.9	0	0	0	109.6	H65 L109 L111 I174 Y182 M213 A214 G215	H65-I180 WeakPolarHBondContact O-CA 3.31Å; L109-I180 HydrophobicContact CD2-CD1 3.89Å; L109-I180 HydrophobicContact CD2-CG1 3.62Å; L109-I180 HydrophobicContact CG-CD1 3.95Å; L109-I180 HydrophobicContact CG-CG1 4.26Å; L111-I180 HydrophobicContact CD1-CD1 4.05Å; L111-I180 HydrophobicContact CD2-CD1 4.24Å; L111-I180 HydrophobicContact CG-CD1 4Å; I174-I180 HydrophobicContact CB-CD1 4.36Å; I174-I180 HydrophobicContact CG1-CD1 3.68Å; I174-I180 HydrophobicContact CG1-CG1 4.18Å; I180-Y182 HydrophobicContact CB-CE2 4.19Å; I180-Y182 HydrophobicContact CG2-CD2 4.14Å; I180-Y182 HydrophobicContact CG2-CE1 4.13Å; I180-Y182 HydrophobicContact CG2-CE2 3.54Å; I180-M213 PolarHBondContact N-O 3.35Å; I180-A214 HydrophobicContact CB-CB 4.29Å; I180-A214 CarbonylContact O-C 3.57Å; I180-A214 WeakPolarHBondContact O-CA 3.23Å; I180-G215 PolarHBondContact O-N 3.41Å
181	L	98.3	Very high	91.3	Very high	0 Å²	0	44 Å²	44	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	113.9	177.3	-173.8	60.3	0	0	0	110.3	I64 H65 T66 H67 F179 I183 G215 I217 I242	I64-L181 HydrophobicContact CG2-CB 3.82Å; I64-L181 HydrophobicContact CG2-CD2 4.3Å; H65-L181 PolarHBondContact O-N 2.81Å; T66-L181 WeakPolarHBondContact CA-O 3.27Å; H67-L181 PolarHBondContact N-O 3.01Å; F179-L181 HydrophobicContact CD1-CB 4.36Å; F179-L181 HydrophobicContact CE1-CB 4.01Å; F179-L181 HydrophobicContact CE1-CD1 4.11Å; L181-I183 HydrophobicContact CD2-CD1 4Å; L181-I183 HydrophobicContact CD2-CG1 4.2Å; L181-I183 HydrophobicContact CG-CD1 4.2Å; L181-I183 HydrophobicContact CG-CG1 3.88Å; L181-G215 WeakPolarHBondContact CA-O 3.4Å; L181-I217 HydrophobicContact CD1-CD1 3.99Å; L181-I217 HydrophobicContact CD1-CG1 3.85Å; L181-I217 HydrophobicContact CD2-CD1 3.93Å; L181-I217 HydrophobicContact CG-CD1 4.36Å; L181-I242 HydrophobicContact CD2-CD1 4.34Å; L181-I242 HydrophobicContact CD2-CG1 3.82Å
182	Y	98.2	Very high	90.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	123.7	174.6	-63.6	-84.5	0	0	0	110.3	H67 L111 C143 I146 V148 H152 I180 A214 G215 Y216 I217	H67-Y182 HydrophobicContact CB-CD1 3.66Å; H67-Y182 HydrophobicContact CB-CE1 3.84Å; H67-Y182 AromaticContact CD2-CD1 3.72Å; H67-Y182 AromaticContact CG-CD1 3.87Å; H67-Y182 AromaticContact CG-CE1 3.96Å; H67-Y182 WeakPolarHBondContact O-CA 3.4Å; L111-Y182 HydrophobicContact CD1-CE2 3.89Å; L111-Y182 VanDerWaalsContact CD1-OH 3.28Å; L111-Y182 WeakPolarHBondContact CD1-OH 3.37Å; C143-Y182 HydrophobicContact CB-CD2 3.75Å; C143-Y182 HydrophobicContact CB-CE2 4.19Å; C143-Y182 HydrophobicContact CB-CG 4.33Å; I146-Y182 VanDerWaalsContact CD1-C 3.45Å; I146-Y182 WeakPolarHBondContact CD1-O 3.41Å; I146-Y182 HydrophobicContact CG2-CD1 4.4Å; V148-Y182 HydrophobicContact CG1-CE1 4.3Å; V148-Y182 WeakPolarHBondContact CG1-OH 3.06Å; V148-Y182 HydrophobicContact CG2-CE1 4.36Å; V148-Y182 HydrophobicContact CG2-CE2 4.15Å; H152-Y182 AromaticContact ND1-CE1 3.67Å; H152-Y182 AromaticContact ND1-CZ 3.72Å; H152-Y182 PolarHBondContact ND1-OH 2.68Å; I180-Y182 HydrophobicContact CB-CE2 4.19Å; I180-Y182 HydrophobicContact CG2-CD2 4.14Å; I180-Y182 HydrophobicContact CG2-CE1 4.13Å; I180-Y182 HydrophobicContact CG2-CE2 3.54Å; Y182-A214 HydrophobicContact CE2-CB 4.25Å; Y182-G215 PolarHBondContact N-O 3.25Å; Y182-Y216 CarbonylContact O-C 3.51Å; Y182-Y216 WeakPolarHBondContact O-CA 3.23Å; Y182-Y216 WeakPolarHBondContact O-CB 3.5Å; Y182-I217 PolarHBondContact O-N 2.89Å
183	I	97.7	Very high	89.6	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.1	-172.4	-53	177.4	0	0	0	110.1	T66 H67 Y68 D69 I72 I86 L181 I217 F219	T66-I183 HydrophobicContact CG2-CD1 3.85Å; H67-I183 PolarHBondContact O-N 3.26Å; Y68-I183 HydrophobicContact CD1-CB 4.31Å; Y68-I183 HydrophobicContact CD1-CD1 4.44Å; Y68-I183 HydrophobicContact CE1-CD1 3.97Å; D69-I183 WeakPolarHBondContact CB-O 3.46Å; D69-I183 PolarHBondContact N-O 3.5Å; I72-I183 HydrophobicContact CD1-CG2 3.54Å; I72-I183 WeakPolarHBondContact CG2-O 3.37Å; I86-I183 HydrophobicContact CD1-CG2 4.32Å; I86-I183 HydrophobicContact CG2-CD1 3.52Å; L181-I183 HydrophobicContact CD2-CD1 4Å; L181-I183 HydrophobicContact CD2-CG1 4.2Å; L181-I183 HydrophobicContact CG-CD1 4.2Å; L181-I183 HydrophobicContact CG-CG1 3.88Å; I183-I217 WeakPolarHBondContact CA-O 3.04Å; I183-F219 HydrophobicContact CG2-CD2 3.96Å; I183-F219 HydrophobicContact CG2-CE2 3.63Å
184	S	95.9	Very high	88.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	165.9	-179.5	60.8	0	0	0	0	112.7	S71 I146 I217 N218 F219	S71-S184 WeakPolarHBondContact OG-CB 3.15Å; I146-S184 WeakPolarHBondContact CD1-OG 2.96Å; I146-S184 WeakPolarHBondContact CG1-OG 3.3Å; S184-I217 PolarHBondContact N-O 2.61Å; S184-I217 PolarHBondContact OG-O 3.33Å; S184-N218 PolarHBondContact OG-OD1 3.22Å; S184-F219 PolarHBondContact O-N 2.86Å
185	S	94.1	Very high	86.9	Confident	15 Å²	15	53 Å²	53	11%	0.105	26%	0.261	C	S	.	.			trans	-133.8	72	173.4	-170.8	0	0	0	0	109.8	S71 F219	S71-S185 WeakPolarHBondContact CB-O 3.33Å; S71-S185 PolarHBondContact OG-N 3.27Å; S185-F219 VanDerWaalsContact CA-O 3.25Å; S185-F219 WeakPolarHBondContact CA-O 3.45Å; S185-F219 PolarHBondContact OG-O 2.02Å
186	L	92.3	Very high	86.3	Confident	53 Å²	53	47 Å²	47	28%	0.277	24%	0.238	S	C	.	.			trans	-104.2	135.3	-175.3	-61.1	164.2	0	0	0	111	P145 T188 N218	P145-L186 HydrophobicContact CB-CD1 3.75Å; P145-L186 HydrophobicContact CG-CD1 3.99Å; L186-T188 HydrophobicContact CB-CG2 4.09Å; L186-T188 PolarHBondContact O-N 3.24Å; L186-N218 VanDerWaalsContact CB-OD1 3.27Å; L186-N218 WeakPolarHBondContact CB-OD1 3.42Å; L186-N218 PolarHBondContact N-OD1 2.57Å; L186-N218 PolarHBondContact O-ND2 3.27Å
187	R	90.2	Very high	86.2	Confident	149 Å²	149	41.7 Å²	41.7	56%	0.562	22%	0.219	S	C	*	.			trans	-74.7	87.7	169.9	-165.8	75	176.9	-161.5	-5.5	109.8	N192 P221	R187-N192 PolarHBondContact NE-OD1 3.49Å; R187-P221 HydrophobicContact CB-CG 3.86Å; R187-P221 HydrophobicContact CG-CG 4.43Å
188	T	87.8	Confident	86	Confident	33 Å²	33	41.6 Å²	41.6	20%	0.202	22%	0.218	C	C	.	.			trans	-93.8	169.9	175.4	68.1	0	0	0	0	111.5	L186 R190 C191 Y199	L186-T188 HydrophobicContact CB-CG2 4.09Å; L186-T188 PolarHBondContact O-N 3.24Å; T188-R190 PolarHBondContact O-N 3.46Å; T188-R190 VanDerWaalsContact O-N 3.15Å; T188-C191 WeakPolarHBondContact O-CB 3.26Å; T188-C191 PolarHBondContact O-N 3.27Å; T188-Y199 VanDerWaalsContact CG2-OH 3.24Å; T188-Y199 WeakPolarHBondContact CG2-OH 3.37Å; T188-Y199 PolarHBondContact OG1-OH 3.08Å
189	H	84.5	Confident	86	Confident	163 Å²	163	41.9 Å²	41.9	76%	0.755	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-54.2	-33.6	175.5	-176.3	74.5	0	0	0	112.2	C191 N192	H189-C191 VanDerWaalsContact C-N 3.32Å; H189-C191 PolarHBondContact O-N 3.35Å; H189-N192 WeakPolarHBondContact O-CB 3.35Å; H189-N192 PolarHBondContact O-N 2.93Å; H189-N192 VanDerWaalsContact O-N 3.13Å
190	R	78.3	Confident	85.9	Confident	78 Å²	78	42.1 Å²	42.1	29%	0.294	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-60.9	-41.1	176.3	-58.1	-176.8	-168.6	-166.3	-3.5	111.7	G34 M35 T188 N192 T193 Y199	G34-R190 PolarHBondContact O-NH1 2.92Å; M35-R190 PolarHBondContact O-NH2 2.63Å; T188-R190 PolarHBondContact O-N 3.46Å; T188-R190 VanDerWaalsContact O-N 3.15Å; R190-N192 PolarHBondContact O-N 2.84Å; R190-T193 PolarHBondContact O-N 2.78Å; R190-T193 VanDerWaalsContact O-N 3.09Å; R190-T193 PolarHBondContact O-OG1 3.5Å; R190-Y199 HydrophobicContact CB-CD1 4.34Å; R190-Y199 HydrophobicContact CB-CE1 4.08Å; R190-Y199 HydrophobicContact CG-CE1 4.45Å; R190-Y199 VanDerWaalsContact NH1-CD2 3.34Å
191	C	83.8	Confident	85.7	Confident	9 Å²	9	42.3 Å²	42.3	6%	0.061	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-70.8	-6.5	178.3	-61.2	0	0	0	0	114.6	T188 H189 T193 C220	T188-C191 WeakPolarHBondContact O-CB 3.26Å; T188-C191 PolarHBondContact O-N 3.27Å; H189-C191 VanDerWaalsContact C-N 3.32Å; H189-C191 PolarHBondContact O-N 3.35Å; C191-T193 VanDerWaalsContact C-N 3.3Å; C191-C220 WeakPolarHBondContact CA-SG 3.31Å; C191-C220 HydrophobicContact CB-CB 3.61Å; C191-C220 WeakPolarHBondContact CB-SG 2.98Å; C191-C220 WeakPolarHBondContact SG-CA 3.02Å; C191-C220 WeakPolarHBondContact SG-CB 3.34Å; C191-C220 CovalentContact SG-SG 2.05Å; C191-C220 PolarHBondContact SG-SG 3.16Å
192	N	80.9	Confident	85.6	Confident	98 Å²	98	42.6 Å²	42.6	52%	0.524	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-84.5	-7.5	171.3	-64.8	-26.8	0	0	0	112.5	R187 H189 R190	R187-N192 PolarHBondContact NE-OD1 3.49Å; H189-N192 WeakPolarHBondContact O-CB 3.35Å; H189-N192 PolarHBondContact O-N 2.93Å; H189-N192 VanDerWaalsContact O-N 3.13Å; R190-N192 PolarHBondContact O-N 2.84Å
193	T	70.8	Confident	85.5	Confident	70 Å²	70	42.9 Å²	42.9	43%	0.429	23%	0.226	S	C	.	.	S	Bend	trans	-83.2	126.7	170	62.7	0	0	0	0	109.3	R190 C191 K195 V196	R190-T193 PolarHBondContact O-N 2.78Å; R190-T193 VanDerWaalsContact O-N 3.09Å; R190-T193 PolarHBondContact O-OG1 3.5Å; C191-T193 VanDerWaalsContact C-N 3.3Å; T193-K195 PolarHBondContact O-N 2.58Å; T193-V196 PolarHBondContact O-N 2.69Å; T193-V196 WeakPolarHBondContact OG1-CG2 3.39Å
194	A	59.4	Low	85.4	Confident	114 Å²	114	43 Å²	43	94%	0.942	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-9.9	-172.2	0	0	0	0	0	114.9
195	K	67.8	Low	85.3	Confident	66 Å²	66	43 Å²	43	29%	0.287	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-22.1	-175.2	-63.7	-172.4	174.5	-171.4	0	113.5	D25 M30 T193	D25-K195 IonicContact OD2-NZ 2.92Å; D25-K195 PolarHBondContact OD2-NZ 3.19Å; M30-K195 CarbonylContact C-O 3.32Å; M30-K195 HydrophobicContact CB-CB 4.25Å; M30-K195 PolarHBondContact N-O 3.27Å; M30-K195 CarbonylContact O-C 3.57Å; M30-K195 HydrophobicContact SD-CD 3.95Å; T193-K195 PolarHBondContact O-N 2.58Å
196	V	76.4	Confident	85.1	Confident	9 Å²	9	43 Å²	43	6%	0.055	23%	0.225	C	C	.	.			trans	-91.8	122.2	-166.5	178.9	0	0	0	0	112.3	H32 T193 G198	H32-V196 HydrophobicContact CB-CG2 3.48Å; H32-V196 VanDerWaalsContact CB-CG2 3.48Å; T193-V196 PolarHBondContact O-N 2.69Å; T193-V196 WeakPolarHBondContact OG1-CG2 3.39Å; V196-G198 WeakPolarHBondContact CG1-O 3.3Å
197	L	81.6	Confident	84.9	Confident	12 Å²	12	40.8 Å²	40.8	6%	0.063	21%	0.214	C	C	.	.			trans	-94.4	-32.1	177.9	-63.4	-165.5	0	0	0	114.3	T29 C220 T223 R233 V237	T29-L197 HydrophobicContact CG2-CD1 3.23Å; T29-L197 HydrophobicContact CG2-CD2 3.42Å; T29-L197 VanDerWaalsContact CG2-CD2 3.42Å; T29-L197 HydrophobicContact CG2-CG 3.16Å; L197-C220 WeakPolarHBondContact O-CB 2.99Å; L197-C220 PolarHBondContact O-N 2.82Å; L197-T223 WeakPolarHBondContact CA-OG1 3.09Å; L197-T223 HydrophobicContact CB-CG2 3.72Å; L197-T223 HydrophobicContact CD1-CG2 4.36Å; L197-T223 HydrophobicContact CD2-CG2 4.41Å; L197-T223 HydrophobicContact CG-CG2 4.39Å; L197-T223 WeakPolarHBondContact O-CB 3.31Å; L197-T223 WeakPolarHBondContact O-CG2 3.47Å; L197-T223 PolarHBondContact O-OG1 3.42Å; L197-R233 HydrophobicContact CD1-CG 4.34Å; L197-V237 HydrophobicContact CB-CG1 4.3Å; L197-V237 HydrophobicContact CB-CG2 4Å; L197-V237 HydrophobicContact CD1-CG2 3.43Å; L197-V237 VanDerWaalsContact CD1-CG2 3.43Å; L197-V237 HydrophobicContact CG-CG2 4.41Å
198	G	85.9	Confident	84.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	172.3	-176	0	0	0	0	0	109	V196 N218 E241	V196-G198 WeakPolarHBondContact CG1-O 3.3Å; G198-N218 VanDerWaalsContact CA-O 3.27Å; G198-N218 WeakPolarHBondContact CA-O 3.48Å; G198-E241 VanDerWaalsContact C-OE1 3.27Å
199	Y	89.5	Confident	84.8	Confident	9 Å²	9	36.8 Å²	36.8	4%	0.035	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	148.2	167.4	57.1	-86.3	0	0	0	109.4	T188 R190 Y216 N218 E241	T188-Y199 VanDerWaalsContact CG2-OH 3.24Å; T188-Y199 WeakPolarHBondContact CG2-OH 3.37Å; T188-Y199 PolarHBondContact OG1-OH 3.08Å; R190-Y199 HydrophobicContact CB-CD1 4.34Å; R190-Y199 HydrophobicContact CB-CE1 4.08Å; R190-Y199 HydrophobicContact CG-CE1 4.45Å; R190-Y199 VanDerWaalsContact NH1-CD2 3.34Å; Y199-Y216 AromaticContact CD2-CE2 3.82Å; Y199-Y216 HydrophobicContact CD2-CE2 3.82Å; Y199-Y216 AromaticContact CE2-CE2 3.75Å; Y199-Y216 HydrophobicContact CE2-CE2 3.75Å; Y199-N218 HydrophobicContact CD1-CB 4.49Å; Y199-N218 HydrophobicContact CD2-CB 4.49Å; Y199-N218 HydrophobicContact CE1-CB 3.93Å; Y199-N218 VanDerWaalsContact CE1-ND2 3.27Å; Y199-N218 WeakPolarHBondContact CE1-ND2 3.49Å; Y199-N218 HydrophobicContact CE2-CB 3.93Å; Y199-N218 PolarHBondContact N-O 3.29Å; Y199-N218 VanDerWaalsContact N-O 3.14Å; Y199-N218 PolarHBondContact O-N 2.82Å; Y199-N218 PolarHBondContact OH-ND2 3.05Å; Y199-E241 VanDerWaalsContact CA-OE2 3.23Å; Y199-E241 WeakPolarHBondContact CA-OE2 3.06Å
200	A	93.2	Very high	85.2	Confident	6 Å²	6	29.4 Å²	29.4	5%	0.05	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	158.8	-178.6	0	0	0	0	0	113.1	Y216 I217 E241 H244	A200-Y216 WeakPolarHBondContact CA-O 3.38Å; A200-Y216 WeakPolarHBondContact CB-O 3.23Å; A200-I217 HydrophobicContact CB-CB 4.36Å; A200-I217 HydrophobicContact CB-CG1 3.79Å; A200-E241 HydrophobicContact CB-CB 3.76Å; A200-E241 HydrophobicContact CB-CG 4.5Å; A200-E241 WeakPolarHBondContact CB-O 3.39Å; A200-E241 WeakPolarHBondContact CB-OE2 3.43Å; A200-E241 PolarHBondContact N-OE2 2.93Å; A200-H244 HydrophobicContact CB-CB 4.29Å
201	A	93.9	Very high	86	Confident	3 Å²	3	26 Å²	26	3%	0.025	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	162.2	-179.8	0	0	0	0	0	111.3	I36 G215 Y216 S245	I36-A201 HydrophobicContact CD1-CB 3.38Å; I36-A201 HydrophobicContact CG1-CB 3.58Å; A201-G215 CarbonylContact O-C 3.37Å; A201-G215 WeakPolarHBondContact O-CA 3.4Å; A201-Y216 HydrophobicContact CB-CD1 4.39Å; A201-Y216 HydrophobicContact CB-CE1 3.55Å; A201-Y216 PolarHBondContact N-O 2.87Å; A201-Y216 WeakPolarHBondContact O-CD1 3Å; A201-Y216 PolarHBondContact O-N 3.16Å; A201-S245 PolarHBondContact O-OG 3.21Å
202	H	95.5	Very high	86.5	Confident	6 Å²	6	25.6 Å²	25.6	3%	0.028	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	157.8	166.7	70.9	-81.7	0	0	0	110.9	L205 P212 S251 L252	H202-L205 VanDerWaalsContact CD2-CD2 3.47Å; H202-L205 WeakPolarHBondContact CD2-CD2 3.43Å; H202-P212 HydrophobicContact CB-CB 4Å; H202-P212 HydrophobicContact CB-CG 4.15Å; H202-S251 PolarHBondContact CE1-OG 2.05Å; H202-S251 PolarHBondContact ND1-OG 3.48Å; H202-L252 HydrophobicContact CB-CD1 4.41Å; H202-L252 WeakPolarHBondContact CE1-CD2 3.37Å; H202-L252 VanDerWaalsContact CE1-CG 3.44Å; H202-L252 WeakPolarHBondContact CE1-CG 3.47Å; H202-L252 WeakPolarHBondContact ND1-CD2 3.3Å; H202-L252 WeakPolarHBondContact ND1-CG 3.23Å
203	C	95.8	Very high	87.1	Confident	6 Å²	6	21 Å²	21	4%	0.041	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	-18.3	174.4	62.3	0	0	0	0	113.9	V41 V42 C143 A214	V41-C203 WeakPolarHBondContact CA-O 3.49Å; V42-C203 PolarHBondContact N-O 3.45Å; C143-C203 HydrophobicContact CB-CB 3.82Å; C143-C203 WeakPolarHBondContact CB-SG 3.26Å; C143-C203 WeakPolarHBondContact SG-CB 3.01Å; C143-C203 CovalentContact SG-SG 2.04Å; C143-C203 PolarHBondContact SG-SG 3.35Å; C203-A214 PolarHBondContact N-O 3.39Å
204	Q	95	Very high	88.3	Confident	3 Å²	3	17.7 Å²	17.7	1%	0.014	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	138.3	174.8	-60.5	-151.3	-4.8	0	0	112.8	V42 V45 L111 D112 P212 M213 A214	V42-Q204 HydrophobicContact CB-CG 4.01Å; V42-Q204 HydrophobicContact CG2-CG 4.44Å; V42-Q204 VanDerWaalsContact O-CA 3.29Å; V42-Q204 WeakPolarHBondContact O-CA 3.45Å; V45-Q204 HydrophobicContact CG2-CB 4.17Å; L111-Q204 VanDerWaalsContact CB-OE1 3.25Å; L111-Q204 HydrophobicContact CD2-CB 4.44Å; L111-Q204 HydrophobicContact CD2-CG 4.49Å; D112-Q204 PolarHBondContact O-NE2 2.04Å; Q204-P212 WeakPolarHBondContact O-CA 3.47Å; Q204-M213 PolarHBondContact O-N 3.33Å; Q204-A214 HydrophobicContact CB-CB 4.33Å; Q204-A214 PolarHBondContact N-O 3.38Å
205	L	94.1	Very high	90.1	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.005	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	136.8	-178.8	-56.4	-175.6	0	0	0	112.1	V41 V42 T43 H44 V45 H202 R211 P212 L252 F255	V41-L205 HydrophobicContact CG1-CG 4.47Å; V42-L205 PolarHBondContact O-N 2.85Å; T43-L205 HydrophobicContact CG2-CD1 4.38Å; H44-L205 PolarHBondContact N-O 3.01Å; V45-L205 PolarHBondContact N-O 2.95Å; H202-L205 VanDerWaalsContact CD2-CD2 3.47Å; H202-L205 WeakPolarHBondContact CD2-CD2 3.43Å; L205-R211 WeakPolarHBondContact CA-O 3.43Å; L205-P212 HydrophobicContact CD2-CB 4.32Å; L205-P212 HydrophobicContact CD2-CG 3.97Å; L205-L252 HydrophobicContact CD1-CD2 4.39Å; L205-L252 HydrophobicContact CD2-CD2 3.79Å; L205-F255 HydrophobicContact CD1-CD1 3.77Å; L205-F255 HydrophobicContact CD1-CD2 4.08Å; L205-F255 HydrophobicContact CD1-CE1 3.84Å; L205-F255 HydrophobicContact CD1-CE2 4.14Å; L205-F255 HydrophobicContact CD1-CG 3.88Å; L205-F255 HydrophobicContact CD1-CZ 4.02Å
206	E	91.2	Very high	91.5	Very high	16 Å²	16	9.7 Å²	9.7	8%	0.075	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	135.5	177	-175.8	171.4	-136.2	0	0	112	H103 N208 T209 D210 R211 M213	H103-E206 IonicContact CE1-OE2 2.8Å; H103-E206 PolarHBondContact CE1-OE2 3.13Å; H103-E206 IonicContact ND1-OE1 2.67Å; H103-E206 IonicContact ND1-OE2 3.56Å; H103-E206 PolarHBondContact ND1-OE2 2.82Å; E206-N208 PolarHBondContact O-N 3.46Å; E206-T209 PolarHBondContact OE2-OG1 2.94Å; E206-D210 WeakPolarHBondContact O-CA 3.03Å; E206-D210 PolarHBondContact O-N 3.44Å; E206-R211 HydrophobicContact CB-CB 4.43Å; E206-R211 WeakPolarHBondContact CB-O 2.88Å; E206-R211 PolarHBondContact N-O 2.76Å; E206-R211 IonicContact OE2-NE 2.66Å; E206-M213 WeakPolarHBondContact CA-SD 3.34Å; E206-M213 HydrophobicContact CB-CG 3.76Å; E206-M213 HydrophobicContact CB-SD 3.53Å; E206-M213 VanDerWaalsContact CB-SD 3.53Å; E206-M213 HydrophobicContact CG-SD 3.98Å
207	A	87.9	Confident	92.5	Very high	6 Å²	6	9.4 Å²	9.4	5%	0.05	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-38	-176.6	0	0	0	0	0	117	H44 V45 M46	H44-A207 HydrophobicContact CB-CB 4.22Å; H44-A207 PolarHBondContact ND1-O 3.2Å; V45-A207 WeakPolarHBondContact O-CB 3.3Å; V45-A207 PolarHBondContact O-N 3.35Å; M46-A207 HydrophobicContact CE-CB 3.21Å; M46-A207 HydrophobicContact CG-CB 4.06Å; M46-A207 HydrophobicContact SD-CB 3.98Å
208	N	85.6	Confident	93.1	Very high	92 Å²	92	8.8 Å²	8.8	49%	0.492	5%	0.047	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-18.4	-171.9	-65.1	-37	0	0	0	113.5	E206 N261	E206-N208 PolarHBondContact O-N 3.46Å; N208-N261 PolarHBondContact O-ND2 3.01Å
209	T	89.5	Confident	93.4	Very high	5 Å²	5	8.9 Å²	8.9	3%	0.031	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.5	-11.7	-167.7	68.7	0	0	0	0	112.8	E206 R211 R257 W384	E206-T209 PolarHBondContact OE2-OG1 2.94Å; T209-R211 PolarHBondContact O-N 2.91Å; T209-R211 VanDerWaalsContact O-N 3.16Å; T209-R211 VanDerWaalsContact OG1-CB 3.26Å; T209-R211 WeakPolarHBondContact OG1-CB 2.98Å; T209-R211 PolarHBondContact OG1-N 3.37Å; T209-R257 WeakPolarHBondContact O-CD 3.12Å; T209-R257 PolarHBondContact O-NE 3.41Å; T209-W384 PolarHBondContact O-NE1 2.96Å
210	D	93.7	Very high	93.4	Very high	9 Å²	9	8.6 Å²	8.6	5%	0.048	5%	0.047	C	C	.	.			trans	57.9	12.8	-168.7	-49.8	-49.3	0	0	0	114.5	E206 F255 R257 R267 W384	E206-D210 WeakPolarHBondContact O-CA 3.03Å; E206-D210 PolarHBondContact O-N 3.44Å; D210-F255 HydrophobicContact CB-CB 3.96Å; D210-F255 HydrophobicContact CB-CD1 3.95Å; D210-F255 HydrophobicContact CB-CG 4.4Å; D210-R257 IonicContact OD1-NH2 2.86Å; D210-R257 IonicContact OD2-CZ 2.69Å; D210-R257 IonicContact OD2-NE 2.69Å; D210-R257 PolarHBondContact OD2-NE 3.39Å; D210-R257 IonicContact OD2-NH2 3.09Å; D210-R257 PolarHBondContact OD2-NH2 3.09Å; D210-R267 IonicContact OD2-CZ 2.96Å; D210-R267 IonicContact OD2-NE 3.78Å; D210-R267 IonicContact OD2-NH2 3.8Å; D210-R267 PolarHBondContact OD2-NH2 2.86Å; D210-W384 VanDerWaalsContact O-CZ2 3.27Å; D210-W384 WeakPolarHBondContact O-CZ2 3.29Å
211	R	94.2	Very high	92.9	Very high	6 Å²	6	9.8 Å²	9.8	2%	0.023	5%	0.054	C	C	.	.			trans	-66.9	136.4	179.7	-174.3	-174.9	64.6	83.1	-0.3	110.8	N178 L205 E206 T209 M213 W384	N178-R211 PolarHBondContact O-NH1 2.79Å; N178-R211 PolarHBondContact O-NH2 2.97Å; L205-R211 WeakPolarHBondContact CA-O 3.43Å; E206-R211 HydrophobicContact CB-CB 4.43Å; E206-R211 WeakPolarHBondContact CB-O 2.88Å; E206-R211 PolarHBondContact N-O 2.76Å; E206-R211 IonicContact OE2-NE 2.66Å; T209-R211 PolarHBondContact O-N 2.91Å; T209-R211 VanDerWaalsContact O-N 3.16Å; T209-R211 VanDerWaalsContact OG1-CB 3.26Å; T209-R211 WeakPolarHBondContact OG1-CB 2.98Å; T209-R211 PolarHBondContact OG1-N 3.37Å; R211-M213 PolarHBondContact O-N 3.12Å; R211-W384 HydrophobicContact CB-CB 4.27Å; R211-W384 HydrophobicContact CB-CD2 3.96Å; R211-W384 HydrophobicContact CB-CG 3.7Å; R211-W384 HydrophobicContact CG-CB 3.78Å; R211-W384 HydrophobicContact CG-CD2 3.92Å; R211-W384 HydrophobicContact CG-CE3 4.29Å; R211-W384 HydrophobicContact CG-CG 3.65Å
212	P	95.3	Very high	92	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	123.5	167.8	-28.5	37	0	0	0	112	F179 H202 Q204 L205 S245 L252 W384	F179-P212 WeakPolarHBondContact CD2-O 3.39Å; F179-P212 HydrophobicContact CE2-CB 3.86Å; H202-P212 HydrophobicContact CB-CB 4Å; H202-P212 HydrophobicContact CB-CG 4.15Å; Q204-P212 WeakPolarHBondContact O-CA 3.47Å; L205-P212 HydrophobicContact CD2-CB 4.32Å; L205-P212 HydrophobicContact CD2-CG 3.97Å; P212-S245 WeakPolarHBondContact CB-O 3.41Å; P212-L252 HydrophobicContact CG-CD1 3.71Å; P212-L252 HydrophobicContact CG-CD2 4.08Å; P212-W384 HydrophobicContact CG-CE3 4.44Å; P212-W384 HydrophobicContact CG-CH2 4.18Å; P212-W384 HydrophobicContact CG-CZ3 3.86Å
213	M	93.1	Very high	91.1	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.01	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-22.5	174.2	-66	178.8	65.7	0	0	111.9	V45 L109 F179 I180 Q204 E206 R211	V45-M213 HydrophobicContact CB-SD 4.07Å; V45-M213 HydrophobicContact CG1-CE 4.29Å; V45-M213 HydrophobicContact CG1-SD 4.14Å; L109-M213 HydrophobicContact CD1-CE 3.24Å; F179-M213 CarbonylContact C-O 3.43Å; F179-M213 WeakPolarHBondContact CA-O 3.08Å; I180-M213 PolarHBondContact N-O 3.35Å; Q204-M213 PolarHBondContact O-N 3.33Å; E206-M213 WeakPolarHBondContact CA-SD 3.34Å; E206-M213 HydrophobicContact CB-CG 3.76Å; E206-M213 HydrophobicContact CB-SD 3.53Å; E206-M213 VanDerWaalsContact CB-SD 3.53Å; E206-M213 HydrophobicContact CG-SD 3.98Å; R211-M213 PolarHBondContact O-N 3.12Å
214	A	96.6	Very high	90.1	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	148.7	174.1	0	0	0	0	0	111	L111 I180 Y182 C203 Q204	L111-A214 HydrophobicContact CD1-CB 3.71Å; L111-A214 HydrophobicContact CD2-CB 3.88Å; L111-A214 HydrophobicContact CG-CB 4.48Å; I180-A214 HydrophobicContact CB-CB 4.29Å; I180-A214 CarbonylContact O-C 3.57Å; I180-A214 WeakPolarHBondContact O-CA 3.23Å; Y182-A214 HydrophobicContact CE2-CB 4.25Å; C203-A214 PolarHBondContact N-O 3.39Å; Q204-A214 HydrophobicContact CB-CB 4.33Å; Q204-A214 PolarHBondContact N-O 3.38Å
215	G	97.4	Very high	89.1	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	178.9	172.7	0	0	0	0	0	111.1	C143 I180 L181 Y182 A201	C143-G215 VanDerWaalsContact SG-C 3.52Å; I180-G215 PolarHBondContact O-N 3.41Å; L181-G215 WeakPolarHBondContact CA-O 3.4Å; Y182-G215 PolarHBondContact N-O 3.25Å; A201-G215 CarbonylContact O-C 3.37Å; A201-G215 WeakPolarHBondContact O-CA 3.4Å
216	Y	96.9	Very high	87.6	Confident	13 Å²	13	19.6 Å²	19.6	5%	0.051	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	155.7	-178.5	70.4	-86	0	0	0	111.7	Y182 Y199 A200 A201 S245	Y182-Y216 CarbonylContact O-C 3.51Å; Y182-Y216 WeakPolarHBondContact O-CA 3.23Å; Y182-Y216 WeakPolarHBondContact O-CB 3.5Å; Y199-Y216 AromaticContact CD2-CE2 3.82Å; Y199-Y216 HydrophobicContact CD2-CE2 3.82Å; Y199-Y216 AromaticContact CE2-CE2 3.75Å; Y199-Y216 HydrophobicContact CE2-CE2 3.75Å; A200-Y216 WeakPolarHBondContact CA-O 3.38Å; A200-Y216 WeakPolarHBondContact CB-O 3.23Å; A201-Y216 HydrophobicContact CB-CD1 4.39Å; A201-Y216 HydrophobicContact CB-CE1 3.55Å; A201-Y216 PolarHBondContact N-O 2.87Å; A201-Y216 WeakPolarHBondContact O-CD1 3Å; A201-Y216 PolarHBondContact O-N 3.16Å; Y216-S245 PolarHBondContact O-OG 3.3Å
217	I	95.7	Very high	86.5	Confident	2 Å²	2	22.9 Å²	22.9	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	130.5	166.5	-54.7	172.2	0	0	0	107.5	L181 Y182 I183 S184 A200 F219 E241 I242	L181-I217 HydrophobicContact CD1-CD1 3.99Å; L181-I217 HydrophobicContact CD1-CG1 3.85Å; L181-I217 HydrophobicContact CD2-CD1 3.93Å; L181-I217 HydrophobicContact CG-CD1 4.36Å; Y182-I217 PolarHBondContact O-N 2.89Å; I183-I217 WeakPolarHBondContact CA-O 3.04Å; S184-I217 PolarHBondContact N-O 2.61Å; S184-I217 PolarHBondContact OG-O 3.33Å; A200-I217 HydrophobicContact CB-CB 4.36Å; A200-I217 HydrophobicContact CB-CG1 3.79Å; I217-F219 HydrophobicContact CB-CE2 4.3Å; I217-F219 HydrophobicContact CG2-CD1 4.28Å; I217-F219 HydrophobicContact CG2-CD2 3.93Å; I217-F219 HydrophobicContact CG2-CE1 3.97Å; I217-F219 HydrophobicContact CG2-CE2 3.6Å; I217-F219 HydrophobicContact CG2-CG 4.28Å; I217-F219 HydrophobicContact CG2-CZ 3.62Å; I217-E241 HydrophobicContact CD1-CB 3.99Å; I217-E241 HydrophobicContact CG1-CB 4.09Å; I217-E241 HydrophobicContact CG2-CB 3.86Å; I217-E241 HydrophobicContact CG2-CG 4.32Å; I217-I242 HydrophobicContact CD1-CB 4.43Å; I217-I242 HydrophobicContact CD1-CG1 3.52Å
218	N	94.5	Very high	85.2	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	110.5	165.2	179.9	77.3	0	0	0	109.4	P145 S184 L186 G198 Y199	P145-N218 HydrophobicContact CG-CB 3.99Å; S184-N218 PolarHBondContact OG-OD1 3.22Å; L186-N218 VanDerWaalsContact CB-OD1 3.27Å; L186-N218 WeakPolarHBondContact CB-OD1 3.42Å; L186-N218 PolarHBondContact N-OD1 2.57Å; L186-N218 PolarHBondContact O-ND2 3.27Å; G198-N218 VanDerWaalsContact CA-O 3.27Å; G198-N218 WeakPolarHBondContact CA-O 3.48Å; Y199-N218 HydrophobicContact CD1-CB 4.49Å; Y199-N218 HydrophobicContact CD2-CB 4.49Å; Y199-N218 HydrophobicContact CE1-CB 3.93Å; Y199-N218 VanDerWaalsContact CE1-ND2 3.27Å; Y199-N218 WeakPolarHBondContact CE1-ND2 3.49Å; Y199-N218 HydrophobicContact CE2-CB 3.93Å; Y199-N218 PolarHBondContact N-O 3.29Å; Y199-N218 VanDerWaalsContact N-O 3.14Å; Y199-N218 PolarHBondContact O-N 2.82Å; Y199-N218 PolarHBondContact OH-ND2 3.05Å
219	F	92.8	Very high	83.8	Confident	1 Å²	1	25.8 Å²	25.8	0%	0.004	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	133	170.7	-62.5	-80.5	0	0	0	109.5	I72 I183 S184 S185 I217 L224 V237 A238	I72-F219 HydrophobicContact CD1-CD2 4.16Å; I72-F219 HydrophobicContact CD1-CE2 4.49Å; I183-F219 HydrophobicContact CG2-CD2 3.96Å; I183-F219 HydrophobicContact CG2-CE2 3.63Å; S184-F219 PolarHBondContact O-N 2.86Å; S185-F219 VanDerWaalsContact CA-O 3.25Å; S185-F219 WeakPolarHBondContact CA-O 3.45Å; S185-F219 PolarHBondContact OG-O 2.02Å; I217-F219 HydrophobicContact CB-CE2 4.3Å; I217-F219 HydrophobicContact CG2-CD1 4.28Å; I217-F219 HydrophobicContact CG2-CD2 3.93Å; I217-F219 HydrophobicContact CG2-CE1 3.97Å; I217-F219 HydrophobicContact CG2-CE2 3.6Å; I217-F219 HydrophobicContact CG2-CG 4.28Å; I217-F219 HydrophobicContact CG2-CZ 3.62Å; F219-L224 HydrophobicContact CB-CD1 3.8Å; F219-L224 HydrophobicContact CB-CG 3.98Å; F219-L224 HydrophobicContact CD1-CD1 3.97Å; F219-L224 HydrophobicContact CD1-CD2 3.7Å; F219-L224 HydrophobicContact CD1-CG 3.84Å; F219-L224 HydrophobicContact CD2-CD1 3.53Å; F219-L224 HydrophobicContact CD2-CG 4.32Å; F219-L224 HydrophobicContact CE1-CD1 4.41Å; F219-L224 HydrophobicContact CE1-CD2 3.79Å; F219-L224 HydrophobicContact CE1-CG 4.38Å; F219-L224 HydrophobicContact CE2-CD1 4Å; F219-L224 HydrophobicContact CG-CD1 3.49Å; F219-L224 VanDerWaalsContact CG-CD1 3.49Å; F219-L224 HydrophobicContact CG-CD2 4.12Å; F219-L224 HydrophobicContact CG-CG 3.79Å; F219-L224 HydrophobicContact CZ-CD1 4.41Å; F219-L224 HydrophobicContact CZ-CD2 4.29Å; F219-V237 HydrophobicContact CD1-CG1 4.03Å; F219-V237 HydrophobicContact CE1-CG1 3.87Å; F219-A238 HydrophobicContact CE1-CB 4.25Å; F219-A238 HydrophobicContact CZ-CB 3.98Å
220	C	88.9	Confident	83	Confident	4 Å²	4	27.4 Å²	27.4	3%	0.027	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-65.3	145.5	170	-68	0	0	0	0	110.1	C191 L197 T223	C191-C220 WeakPolarHBondContact CA-SG 3.31Å; C191-C220 HydrophobicContact CB-CB 3.61Å; C191-C220 WeakPolarHBondContact CB-SG 2.98Å; C191-C220 WeakPolarHBondContact SG-CA 3.02Å; C191-C220 WeakPolarHBondContact SG-CB 3.34Å; C191-C220 CovalentContact SG-SG 2.05Å; C191-C220 PolarHBondContact SG-SG 3.16Å; L197-C220 WeakPolarHBondContact O-CB 2.99Å; L197-C220 PolarHBondContact O-N 2.82Å; C220-T223 VanDerWaalsContact O-CB 3.24Å; C220-T223 WeakPolarHBondContact O-CB 3.35Å; C220-T223 PolarHBondContact O-N 2.97Å; C220-T223 PolarHBondContact O-OG1 3.44Å; C220-T223 VanDerWaalsContact O-OG1 3.12Å
221	P	82.9	Confident	82.3	Confident	31 Å²	31	30.7 Å²	30.7	20%	0.201	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	146.3	174.3	-26.5	36.6	0	0	0	110.6	R187 T223	R187-P221 HydrophobicContact CB-CG 3.86Å; R187-P221 HydrophobicContact CG-CG 4.43Å; P221-T223 PolarHBondContact O-N 3.32Å
222	D	76.3	Confident	81.6	Confident	147 Å²	147	33 Å²	33	79%	0.786	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.2	-3.6	-177	-40.5	-50	0	0	0	115.4
223	T	75.1	Confident	80.9	Confident	5 Å²	5	35.8 Å²	35.8	3%	0.031	18%	0.176	C	C	.	.			trans	-70	-45.6	173.4	-64.7	0	0	0	0	112.3	L197 C220 P221 R233 V237	L197-T223 WeakPolarHBondContact CA-OG1 3.09Å; L197-T223 HydrophobicContact CB-CG2 3.72Å; L197-T223 HydrophobicContact CD1-CG2 4.36Å; L197-T223 HydrophobicContact CD2-CG2 4.41Å; L197-T223 HydrophobicContact CG-CG2 4.39Å; L197-T223 WeakPolarHBondContact O-CB 3.31Å; L197-T223 WeakPolarHBondContact O-CG2 3.47Å; L197-T223 PolarHBondContact O-OG1 3.42Å; C220-T223 VanDerWaalsContact O-CB 3.24Å; C220-T223 WeakPolarHBondContact O-CB 3.35Å; C220-T223 PolarHBondContact O-N 2.97Å; C220-T223 PolarHBondContact O-OG1 3.44Å; C220-T223 VanDerWaalsContact O-OG1 3.12Å; P221-T223 PolarHBondContact O-N 3.32Å; T223-R233 PolarHBondContact O-NH1 3.48Å; T223-V237 HydrophobicContact CG2-CG1 4.49Å; T223-V237 HydrophobicContact CG2-CG2 4.49Å
224	L	76.1	Confident	80.7	Confident	18 Å²	18	35.7 Å²	35.7	9%	0.094	18%	0.176	C	C	.	.			trans	-89.8	117.9	-171.1	-69	179	0	0	0	110.8	I72 I81 I85 F219	I72-L224 HydrophobicContact CD1-CD1 3.99Å; I81-L224 HydrophobicContact CD1-CB 4.1Å; I81-L224 HydrophobicContact CG2-CB 4.29Å; I81-L224 HydrophobicContact CG2-CD1 3.86Å; I85-L224 HydrophobicContact CG2-CD2 4.46Å; F219-L224 HydrophobicContact CB-CD1 3.8Å; F219-L224 HydrophobicContact CB-CG 3.98Å; F219-L224 HydrophobicContact CD1-CD1 3.97Å; F219-L224 HydrophobicContact CD1-CD2 3.7Å; F219-L224 HydrophobicContact CD1-CG 3.84Å; F219-L224 HydrophobicContact CD2-CD1 3.53Å; F219-L224 HydrophobicContact CD2-CG 4.32Å; F219-L224 HydrophobicContact CE1-CD1 4.41Å; F219-L224 HydrophobicContact CE1-CD2 3.79Å; F219-L224 HydrophobicContact CE1-CG 4.38Å; F219-L224 HydrophobicContact CE2-CD1 4Å; F219-L224 HydrophobicContact CG-CD1 3.49Å; F219-L224 VanDerWaalsContact CG-CD1 3.49Å; F219-L224 HydrophobicContact CG-CD2 4.12Å; F219-L224 HydrophobicContact CG-CG 3.79Å; F219-L224 HydrophobicContact CZ-CD1 4.41Å; F219-L224 HydrophobicContact CZ-CD2 4.29Å
225	S	73.1	Confident	80.4	Confident	21 Å²	21	37.5 Å²	37.5	15%	0.147	19%	0.185	C	C	.	.			trans	-139.8	132.3	174.1	166.7	0	0	0	0	108.7	E227 D230 S234	S225-E227 VanDerWaalsContact C-N 3.26Å; S225-E227 WeakPolarHBondContact OG-CB 3.47Å; S225-E227 WeakPolarHBondContact OG-CG 3.14Å; S225-E227 PolarHBondContact OG-N 3.01Å; S225-D230 VanDerWaalsContact CB-CB 3.45Å; S225-D230 WeakPolarHBondContact CB-OD2 3.23Å; S225-D230 WeakPolarHBondContact OG-CB 3.45Å; S225-D230 PolarHBondContact OG-OD2 2.02Å; S225-S234 PolarHBondContact N-OG 3.39Å; S225-S234 PolarHBondContact O-OG 3.33Å; S225-S234 VanDerWaalsContact O-OG 3.08Å
226	N	63.8	Low	80	Confident	34 Å²	34	37.6 Å²	37.6	18%	0.182	19%	0.186	C	C	.	.			trans	-90.9	9.6	172.8	-172.3	60.4	0	0	0	111.7	D80 I81 N84	D80-N226 HydrophobicContact CB-CB 4.02Å; D80-N226 WeakPolarHBondContact CB-ND2 3.48Å; I81-N226 HydrophobicContact CG1-CB 4.32Å; N84-N226 WeakPolarHBondContact CB-OD1 2.87Å; N84-N226 PolarHBondContact ND2-ND2 2.79Å; N84-N226 VanDerWaalsContact ND2-ND2 3.16Å; N84-N226 PolarHBondContact ND2-OD1 3.25Å
227	E	66.8	Low	79.7	Confident	85 Å²	85	37 Å²	37	40%	0.397	18%	0.183	S	C	.	.	S	Bend	trans	-61.5	143.1	170.3	-61.8	-167.1	173.2	0	0	109.3	S225 N229 D230 K231 K526	S225-E227 VanDerWaalsContact C-N 3.26Å; S225-E227 WeakPolarHBondContact OG-CB 3.47Å; S225-E227 WeakPolarHBondContact OG-CG 3.14Å; S225-E227 PolarHBondContact OG-N 3.01Å; E227-N229 PolarHBondContact O-N 2.87Å; E227-D230 PolarHBondContact O-N 2.82Å; E227-K231 PolarHBondContact O-N 2.84Å; E227-K526 WeakPolarHBondContact OE2-CD 3.19Å; E227-K526 WeakPolarHBondContact OE2-CE 3.11Å; E227-K526 IonicContact OE2-NZ 3.55Å; E227-K526 PolarHBondContact OE2-NZ 3.28Å
228	Y	62	Low	79.6	Confident	132 Å²	132	37 Å²	37	52%	0.518	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-39.4	-166.3	-177.5	-98.5	0	0	0	113.6	K231 T537	Y228-K231 WeakPolarHBondContact O-CB 3.36Å; Y228-T537 HydrophobicContact CE1-CG2 4.07Å; Y228-T537 VanDerWaalsContact CE1-OG1 3.26Å; Y228-T537 WeakPolarHBondContact CE1-OG1 3.4Å; Y228-T537 HydrophobicContact CE2-CG2 4.4Å; Y228-T537 VanDerWaalsContact OH-CG2 3.29Å; Y228-T537 WeakPolarHBondContact OH-CG2 3.4Å; Y228-T537 PolarHBondContact OH-OG1 3.4Å
229	N	56	Low	79.7	Confident	27 Å²	27	37.2 Å²	37.2	14%	0.144	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-30.7	-176.6	-54	-59.5	0	0	0	113.6	E227 K231 S527	E227-N229 PolarHBondContact O-N 2.87Å; N229-K231 PolarHBondContact O-N 2.88Å; N229-S527 VanDerWaalsContact CB-C 3.48Å; N229-S527 VanDerWaalsContact CB-CB 3.49Å; N229-S527 WeakPolarHBondContact CB-O 3.1Å; N229-S527 VanDerWaalsContact CG-C 3.48Å; N229-S527 PolarHBondContact ND2-O 3.19Å
230	D	72.5	Confident	79.9	Confident	39 Å²	39	37.1 Å²	37.1	21%	0.209	19%	0.185	C	C	.	.	H	α-helix	trans	-77.4	-13.1	173.5	-60	-28.8	0	0	0	112.8	S225 E227 T232 R233 S234	S225-D230 VanDerWaalsContact CB-CB 3.45Å; S225-D230 WeakPolarHBondContact CB-OD2 3.23Å; S225-D230 WeakPolarHBondContact OG-CB 3.45Å; S225-D230 PolarHBondContact OG-OD2 2.02Å; E227-D230 PolarHBondContact O-N 2.82Å; D230-T232 PolarHBondContact O-N 3.14Å; D230-R233 PolarHBondContact O-N 3.09Å; D230-S234 WeakPolarHBondContact O-CB 3.39Å; D230-S234 PolarHBondContact O-N 3.17Å; D230-S234 PolarHBondContact O-OG 2.79Å
231	K	78.2	Confident	80.2	Confident	78 Å²	78	37 Å²	37	34%	0.339	18%	0.183	S	C	.	.	H	α-helix	trans	-58.8	-45.6	-178.9	-172	-176.8	177.2	176.9	0	111.4	N84 I85 E227 Y228 N229 S234 L235	N84-K231 WeakPolarHBondContact O-CE 3.45Å; I85-K231 HydrophobicContact CD1-CB 4.26Å; I85-K231 HydrophobicContact CD1-CG 3.47Å; I85-K231 VanDerWaalsContact CD1-CG 3.47Å; I85-K231 WeakPolarHBondContact CD1-O 3.48Å; E227-K231 PolarHBondContact O-N 2.84Å; Y228-K231 WeakPolarHBondContact O-CB 3.36Å; N229-K231 PolarHBondContact O-N 2.88Å; K231-S234 PolarHBondContact O-N 2.8Å; K231-L235 WeakPolarHBondContact O-CB 3.36Å; K231-L235 PolarHBondContact O-N 3.46Å
232	T	79	Confident	80.9	Confident	54 Å²	54	35.5 Å²	35.5	33%	0.331	17%	0.174	S	C	.	.	H	α-helix	trans	-63	-45.3	-179.2	-56.5	0	0	0	0	111.2	D230 L235 F236 Y365 N367 F369	D230-T232 PolarHBondContact O-N 3.14Å; T232-L235 PolarHBondContact O-N 3.19Å; T232-F236 PolarHBondContact O-N 2.91Å; T232-Y365 WeakPolarHBondContact CG2-OH 3.12Å; T232-N367 WeakPolarHBondContact CG2-O 3.37Å; T232-F369 HydrophobicContact CG2-CD1 4.48Å; T232-F369 HydrophobicContact CG2-CE1 3.99Å
233	R	82	Confident	81.9	Confident	58 Å²	58	28.5 Å²	28.5	22%	0.219	14%	0.137	C	C	.	.	H	α-helix	trans	-62.4	-45.1	175.5	-177.6	176.7	173.1	-99.6	20.5	112.1	L197 T223 D230 L235 F236 V237 Y365	L197-R233 HydrophobicContact CD1-CG 4.34Å; T223-R233 PolarHBondContact O-NH1 3.48Å; D230-R233 PolarHBondContact O-N 3.09Å; R233-L235 VanDerWaalsContact C-N 3.3Å; R233-L235 PolarHBondContact O-N 3.23Å; R233-F236 WeakPolarHBondContact O-CB 3.4Å; R233-F236 PolarHBondContact O-N 3.13Å; R233-V237 WeakPolarHBondContact O-CG2 3.38Å; R233-V237 PolarHBondContact O-N 3.23Å; R233-Y365 WeakPolarHBondContact CA-OH 3.32Å; R233-Y365 HydrophobicContact CB-CD1 4.42Å; R233-Y365 HydrophobicContact CB-CE1 3.76Å; R233-Y365 HydrophobicContact CB-CE2 4.16Å; R233-Y365 HydrophobicContact CG-CD1 4.02Å; R233-Y365 HydrophobicContact CG-CE1 3.84Å; R233-Y365 HydrophobicContact CG-CE2 4.45Å; R233-Y365 HydrophobicContact CG-CG 4.36Å; R233-Y365 PolarHBondContact N-OH 2.94Å
234	S	88.3	Confident	82.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.7	-39	177.3	-61.8	0	0	0	0	111.6	I85 S225 D230 K231 A238	I85-S234 WeakPolarHBondContact CG2-O 3.32Å; S225-S234 PolarHBondContact N-OG 3.39Å; S225-S234 PolarHBondContact O-OG 3.33Å; S225-S234 VanDerWaalsContact O-OG 3.08Å; D230-S234 WeakPolarHBondContact O-CB 3.39Å; D230-S234 PolarHBondContact O-N 3.17Å; D230-S234 PolarHBondContact O-OG 2.79Å; K231-S234 PolarHBondContact O-N 2.8Å; S234-A238 WeakPolarHBondContact O-CB 3.41Å; S234-A238 PolarHBondContact O-N 3.44Å
235	L	89.2	Confident	83.9	Confident	39 Å²	39	27.4 Å²	27.4	20%	0.204	13%	0.131	C	C	.	.	H	α-helix	trans	-68	-42.3	176.2	-175.8	64.3	0	0	0	112	V88 A89 K231 T232 R233 A238 T239 F369	V88-L235 HydrophobicContact CB-CD1 3.98Å; V88-L235 HydrophobicContact CG1-CD1 3.73Å; V88-L235 HydrophobicContact CG1-CD2 4.38Å; A89-L235 HydrophobicContact CB-CD1 4.16Å; K231-L235 WeakPolarHBondContact O-CB 3.36Å; K231-L235 PolarHBondContact O-N 3.46Å; T232-L235 PolarHBondContact O-N 3.19Å; R233-L235 VanDerWaalsContact C-N 3.3Å; R233-L235 PolarHBondContact O-N 3.23Å; L235-A238 PolarHBondContact O-N 3.2Å; L235-T239 VanDerWaalsContact O-CB 3.31Å; L235-T239 WeakPolarHBondContact O-CB 3.47Å; L235-T239 PolarHBondContact O-N 3.26Å; L235-T239 PolarHBondContact O-OG1 2.9Å; L235-F369 HydrophobicContact CB-CZ 4.37Å; L235-F369 HydrophobicContact CD2-CZ 4.22Å; L235-F369 HydrophobicContact CG-CZ 4.04Å
236	F	89.6	Confident	85	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.009	12%	0.124	C	C	.	.	H	α-helix	trans	-53.5	-56.8	172.3	169.8	-101.1	0	0	0	110.4	T232 R233 A238 T239 H240 L360 Y365 F369	T232-F236 PolarHBondContact O-N 2.91Å; R233-F236 WeakPolarHBondContact O-CB 3.4Å; R233-F236 PolarHBondContact O-N 3.13Å; F236-A238 PolarHBondContact O-N 3.26Å; F236-T239 PolarHBondContact O-N 2.83Å; F236-H240 WeakPolarHBondContact O-CB 3.31Å; F236-H240 PolarHBondContact O-N 3.46Å; F236-L360 HydrophobicContact CD2-CD1 3.81Å; F236-L360 HydrophobicContact CE2-CD1 4.06Å; F236-Y365 HydrophobicContact CB-CD2 3.64Å; F236-Y365 HydrophobicContact CB-CE2 3.66Å; F236-Y365 AromaticContact CD1-CD2 3.42Å; F236-Y365 HydrophobicContact CD1-CD2 3.42Å; F236-Y365 VanDerWaalsContact CD1-CD2 3.42Å; F236-Y365 HydrophobicContact CD1-CE2 4.32Å; F236-Y365 HydrophobicContact CD1-CG 4.09Å; F236-Y365 HydrophobicContact CD2-CD2 4.06Å; F236-Y365 HydrophobicContact CE1-CD2 4.05Å; F236-Y365 HydrophobicContact CE1-CG 4.44Å; F236-Y365 AromaticContact CG-CD2 3.42Å; F236-Y365 HydrophobicContact CG-CD2 3.42Å; F236-Y365 VanDerWaalsContact CG-CD2 3.42Å; F236-Y365 AromaticContact CG-CE2 3.97Å; F236-Y365 HydrophobicContact CG-CE2 3.97Å; F236-Y365 HydrophobicContact CG-CG 4.48Å; F236-F369 HydrophobicContact CB-CD1 3.6Å; F236-F369 HydrophobicContact CB-CE1 3.55Å; F236-F369 HydrophobicContact CB-CG 4.15Å; F236-F369 HydrophobicContact CB-CZ 4.07Å; F236-F369 HydrophobicContact CD2-CB 3.5Å; F236-F369 VanDerWaalsContact CD2-CB 3.5Å; F236-F369 AromaticContact CD2-CD1 3.75Å; F236-F369 HydrophobicContact CD2-CD1 3.75Å; F236-F369 AromaticContact CD2-CD2 3.98Å; F236-F369 HydrophobicContact CD2-CD2 3.98Å; F236-F369 HydrophobicContact CD2-CE1 4.45Å; F236-F369 AromaticContact CD2-CG 3.47Å; F236-F369 HydrophobicContact CD2-CG 3.47Å; F236-F369 VanDerWaalsContact CD2-CG 3.47Å; F236-F369 HydrophobicContact CE2-CB 3.92Å; F236-F369 HydrophobicContact CE2-CG 4.35Å; F236-F369 HydrophobicContact CG-CD1 4.12Å; F236-F369 HydrophobicContact CG-CG 4.28Å
237	V	90.8	Very high	86.5	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.2	-50.2	-177.3	-179.7	0	0	0	0	110	L197 F219 T223 R233 T239 H240 E241	L197-V237 HydrophobicContact CB-CG1 4.3Å; L197-V237 HydrophobicContact CB-CG2 4Å; L197-V237 HydrophobicContact CD1-CG2 3.43Å; L197-V237 VanDerWaalsContact CD1-CG2 3.43Å; L197-V237 HydrophobicContact CG-CG2 4.41Å; F219-V237 HydrophobicContact CD1-CG1 4.03Å; F219-V237 HydrophobicContact CE1-CG1 3.87Å; T223-V237 HydrophobicContact CG2-CG1 4.49Å; T223-V237 HydrophobicContact CG2-CG2 4.49Å; R233-V237 WeakPolarHBondContact O-CG2 3.38Å; R233-V237 PolarHBondContact O-N 3.23Å; V237-T239 VanDerWaalsContact C-N 3.33Å; V237-T239 PolarHBondContact O-N 2.55Å; V237-H240 PolarHBondContact O-N 2.7Å; V237-E241 HydrophobicContact CG1-CG 3.78Å; V237-E241 VanDerWaalsContact O-CB 3.25Å; V237-E241 WeakPolarHBondContact O-CB 3.41Å; V237-E241 WeakPolarHBondContact O-CG 3.09Å; V237-E241 PolarHBondContact O-N 3.38Å
238	A	94.7	Very high	88	Confident	2 Å²	2	20.8 Å²	20.8	2%	0.017	10%	0.096	C	C	.	.	H	α-helix	trans	-58.4	-45	-179.7	0	0	0	0	0	112.3	I85 A89 F219 S234 L235 F236 I242	I85-A238 HydrophobicContact CG2-CB 3.8Å; A89-A238 HydrophobicContact CB-CB 3.75Å; F219-A238 HydrophobicContact CE1-CB 4.25Å; F219-A238 HydrophobicContact CZ-CB 3.98Å; S234-A238 WeakPolarHBondContact O-CB 3.41Å; S234-A238 PolarHBondContact O-N 3.44Å; L235-A238 PolarHBondContact O-N 3.2Å; F236-A238 PolarHBondContact O-N 3.26Å; A238-I242 WeakPolarHBondContact O-CD1 3.37Å; A238-I242 WeakPolarHBondContact O-CG1 3.14Å; A238-I242 PolarHBondContact O-N 3.42Å; A238-I242 VanDerWaalsContact O-N 3.16Å
239	T	96.2	Very high	89.4	Confident	4 Å²	4	14.9 Å²	14.9	3%	0.025	7%	0.074	C	C	.	.	H	α-helix	trans	-68.9	-40.9	-178.5	-45.8	0	0	0	0	111.3	A89 F92 W93 L235 F236 V237 L360	A89-T239 WeakPolarHBondContact CB-OG1 3.35Å; F92-T239 HydrophobicContact CD1-CG2 3.37Å; F92-T239 HydrophobicContact CE1-CG2 3.72Å; F92-T239 HydrophobicContact CG-CG2 4.07Å; W93-T239 HydrophobicContact CZ2-CG2 4.21Å; W93-T239 PolarHBondContact NE1-O 3.01Å; L235-T239 VanDerWaalsContact O-CB 3.31Å; L235-T239 WeakPolarHBondContact O-CB 3.47Å; L235-T239 PolarHBondContact O-N 3.26Å; L235-T239 PolarHBondContact O-OG1 2.9Å; F236-T239 PolarHBondContact O-N 2.83Å; V237-T239 VanDerWaalsContact C-N 3.33Å; V237-T239 PolarHBondContact O-N 2.55Å; T239-L360 HydrophobicContact CG2-CD1 4.43Å; T239-L360 HydrophobicContact CG2-CD2 3.64Å
240	H	95.5	Very high	91.1	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61	-51.8	176.2	177.1	102.5	0	0	0	112.2	C31 H33 F236 V237 I242 L243 H244 H350 L360 T362	C31-H240 WeakPolarHBondContact CB-NE2 3.29Å; H33-H240 AromaticContact CE1-NE2 3.37Å; H33-H240 PolarHBondContact CE1-NE2 2.97Å; H33-H240 AromaticContact NE2-NE2 3.94Å; F236-H240 WeakPolarHBondContact O-CB 3.31Å; F236-H240 PolarHBondContact O-N 3.46Å; V237-H240 PolarHBondContact O-N 2.7Å; H240-I242 VanDerWaalsContact C-N 3.33Å; H240-I242 PolarHBondContact O-N 3.33Å; H240-L243 WeakPolarHBondContact O-CB 3.35Å; H240-L243 PolarHBondContact O-N 2.88Å; H240-H244 AromaticContact CD2-CD2 3.59Å; H240-H244 AromaticContact CD2-NE2 3.67Å; H240-H244 AromaticContact CE1-NE2 3.72Å; H240-H244 AromaticContact NE2-CD2 3.6Å; H240-H244 AromaticContact NE2-NE2 3.17Å; H240-H244 PolarHBondContact NE2-NE2 2.96Å; H240-H244 VanDerWaalsContact NE2-NE2 3.17Å; H240-H244 PolarHBondContact O-N 3.45Å; H240-H350 AromaticContact CE1-CD2 3.59Å; H240-H350 AromaticContact CE1-NE2 3.65Å; H240-H350 AromaticContact NE2-CD2 3.9Å; H240-H350 AromaticContact NE2-NE2 3.48Å; H240-H350 PolarHBondContact NE2-NE2 3.03Å; H240-L360 HydrophobicContact CB-CD1 4Å; H240-L360 HydrophobicContact CB-CG 4.46Å; H240-L360 PolarHBondContact ND1-O 3.11Å; H240-T362 PolarHBondContact CE1-O 3.3Å
241	E	95.7	Very high	92	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-66.9	-32.6	-175.7	-65.9	-65.7	172.8	0	0	112.5	H33 G198 Y199 A200 I217 V237 L243 H244 S245	H33-E241 IonicContact CD2-OE2 3.8Å; H33-E241 IonicContact NE2-OE1 3.19Å; H33-E241 IonicContact NE2-OE2 3.8Å; H33-E241 PolarHBondContact NE2-OE2 3.19Å; H33-E241 VanDerWaalsContact NE2-OE2 3.09Å; G198-E241 VanDerWaalsContact C-OE1 3.27Å; Y199-E241 VanDerWaalsContact CA-OE2 3.23Å; Y199-E241 WeakPolarHBondContact CA-OE2 3.06Å; A200-E241 HydrophobicContact CB-CB 3.76Å; A200-E241 HydrophobicContact CB-CG 4.5Å; A200-E241 WeakPolarHBondContact CB-O 3.39Å; A200-E241 WeakPolarHBondContact CB-OE2 3.43Å; A200-E241 PolarHBondContact N-OE2 2.93Å; I217-E241 HydrophobicContact CD1-CB 3.99Å; I217-E241 HydrophobicContact CG1-CB 4.09Å; I217-E241 HydrophobicContact CG2-CB 3.86Å; I217-E241 HydrophobicContact CG2-CG 4.32Å; V237-E241 HydrophobicContact CG1-CG 3.78Å; V237-E241 VanDerWaalsContact O-CB 3.25Å; V237-E241 WeakPolarHBondContact O-CB 3.41Å; V237-E241 WeakPolarHBondContact O-CG 3.09Å; V237-E241 PolarHBondContact O-N 3.38Å; E241-L243 VanDerWaalsContact C-N 3.28Å; E241-L243 PolarHBondContact O-N 3.38Å; E241-H244 PolarHBondContact O-N 2.87Å; E241-S245 PolarHBondContact O-N 3.07Å; E241-S245 PolarHBondContact O-OG 3.08Å
242	I	97.4	Very high	92.8	Very high	1 Å²	1	9 Å²	9	1%	0.005	5%	0.048	C	C	.	.	H	α-helix	trans	-59.8	-41.3	171.7	-69.1	165.8	0	0	0	110.3	I64 A89 I90 W93 L181 I217 A238 H240 H244 S245 L246	I64-I242 HydrophobicContact CD1-CG2 4.38Å; A89-I242 HydrophobicContact CB-CD1 3.7Å; I90-I242 HydrophobicContact CG1-CD1 3.86Å; W93-I242 HydrophobicContact CB-CG2 4.38Å; W93-I242 HydrophobicContact CG-CG2 3.92Å; L181-I242 HydrophobicContact CD2-CD1 4.34Å; L181-I242 HydrophobicContact CD2-CG1 3.82Å; I217-I242 HydrophobicContact CD1-CB 4.43Å; I217-I242 HydrophobicContact CD1-CG1 3.52Å; A238-I242 WeakPolarHBondContact O-CD1 3.37Å; A238-I242 WeakPolarHBondContact O-CG1 3.14Å; A238-I242 PolarHBondContact O-N 3.42Å; A238-I242 VanDerWaalsContact O-N 3.16Å; H240-I242 VanDerWaalsContact C-N 3.33Å; H240-I242 PolarHBondContact O-N 3.33Å; I242-H244 VanDerWaalsContact C-N 3.34Å; I242-H244 PolarHBondContact O-N 3.31Å; I242-S245 WeakPolarHBondContact O-CA 3.47Å; I242-S245 WeakPolarHBondContact O-CB 3.27Å; I242-S245 PolarHBondContact O-N 2.96Å; I242-L246 HydrophobicContact CG2-CD1 3.63Å; I242-L246 HydrophobicContact CG2-CG 4.01Å; I242-L246 WeakPolarHBondContact O-CG 3.35Å; I242-L246 PolarHBondContact O-N 3.16Å
243	L	97.7	Very high	93.6	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-66.8	-36	-177	-160.8	59.6	0	0	0	113.2	W93 H240 E241 S245 L246 G247 F248 M361 T375 M379	W93-L243 HydrophobicContact CD2-CD1 4.11Å; W93-L243 HydrophobicContact CE3-CD1 3.84Å; W93-L243 HydrophobicContact CH2-CB 4.08Å; W93-L243 HydrophobicContact CH2-CD1 3.28Å; W93-L243 HydrophobicContact CH2-CD2 3.42Å; W93-L243 VanDerWaalsContact CH2-CD2 3.42Å; W93-L243 HydrophobicContact CH2-CG 3.74Å; W93-L243 HydrophobicContact CZ2-CB 3.56Å; W93-L243 HydrophobicContact CZ2-CD1 3.54Å; W93-L243 HydrophobicContact CZ2-CD2 3.75Å; W93-L243 HydrophobicContact CZ2-CG 3.77Å; W93-L243 HydrophobicContact CZ3-CD1 3.43Å; W93-L243 VanDerWaalsContact CZ3-CD1 3.43Å; W93-L243 HydrophobicContact CZ3-CD2 4.3Å; W93-L243 HydrophobicContact CZ3-CG 4.38Å; H240-L243 WeakPolarHBondContact O-CB 3.35Å; H240-L243 PolarHBondContact O-N 2.88Å; E241-L243 VanDerWaalsContact C-N 3.28Å; E241-L243 PolarHBondContact O-N 3.38Å; L243-S245 PolarHBondContact O-N 3.03Å; L243-L246 HydrophobicContact CD1-CB 4.44Å; L243-L246 PolarHBondContact O-N 3.27Å; L243-L246 VanDerWaalsContact O-N 3.12Å; L243-G247 PolarHBondContact O-N 2.94Å; L243-F248 HydrophobicContact CD2-CB 4.06Å; L243-F248 HydrophobicContact CD2-CD1 4.32Å; L243-F248 HydrophobicContact CG-CB 3.98Å; L243-F248 PolarHBondContact O-N 2.85Å; L243-F248 VanDerWaalsContact O-N 3.12Å; L243-M361 HydrophobicContact CB-CE 4.34Å; L243-M361 HydrophobicContact CB-SD 3.78Å; L243-M361 HydrophobicContact CD2-CE 4.16Å; L243-M361 HydrophobicContact CD2-CG 3.46Å; L243-M361 VanDerWaalsContact CD2-CG 3.46Å; L243-M361 HydrophobicContact CD2-SD 3.38Å; L243-M361 WeakPolarHBondContact CD2-SD 3.16Å; L243-M361 HydrophobicContact CG-SD 4.09Å; L243-T375 HydrophobicContact CD2-CG2 3.59Å; L243-M379 HydrophobicContact CD1-CE 3.6Å; L243-M379 HydrophobicContact CD1-CG 3.76Å; L243-M379 HydrophobicContact CD1-SD 3.44Å; L243-M379 WeakPolarHBondContact CD1-SD 3.42Å; L243-M379 HydrophobicContact CD2-CG 4.42Å; L243-M379 HydrophobicContact CD2-SD 4.25Å; L243-M379 HydrophobicContact CG-CG 4.49Å; L243-M379 HydrophobicContact CG-SD 3.9Å
244	H	96	Very high	94.3	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-59.9	-34.6	172.1	-77.3	-59.6	0	0	0	112.7	H33 A200 H240 E241 I242 F248 T349 H350 M361	H33-H244 AromaticContact CD2-CD2 3.65Å; H33-H244 AromaticContact CD2-CG 3.83Å; H33-H244 AromaticContact CE1-CD2 3.18Å; H33-H244 PolarHBondContact CE1-CD2 3.29Å; H33-H244 AromaticContact CE1-CE1 3.66Å; H33-H244 AromaticContact CE1-CG 3.99Å; H33-H244 AromaticContact CE1-NE2 2.95Å; H33-H244 PolarHBondContact CE1-NE2 3.16Å; H33-H244 AromaticContact ND1-CD2 3.98Å; H33-H244 AromaticContact ND1-CE1 3.83Å; H33-H244 AromaticContact ND1-NE2 3.57Å; H33-H244 AromaticContact NE2-CD2 2.93Å; H33-H244 PolarHBondContact NE2-CD2 3.32Å; H33-H244 AromaticContact NE2-CG 3.59Å; H33-H244 AromaticContact NE2-NE2 3.3Å; H33-H244 PolarHBondContact NE2-NE2 2.66Å; A200-H244 HydrophobicContact CB-CB 4.29Å; H240-H244 AromaticContact CD2-CD2 3.59Å; H240-H244 AromaticContact CD2-NE2 3.67Å; H240-H244 AromaticContact CE1-NE2 3.72Å; H240-H244 AromaticContact NE2-CD2 3.6Å; H240-H244 AromaticContact NE2-NE2 3.17Å; H240-H244 PolarHBondContact NE2-NE2 2.96Å; H240-H244 VanDerWaalsContact NE2-NE2 3.17Å; H240-H244 PolarHBondContact O-N 3.45Å; E241-H244 PolarHBondContact O-N 2.87Å; I242-H244 VanDerWaalsContact C-N 3.34Å; I242-H244 PolarHBondContact O-N 3.31Å; H244-F248 WeakPolarHBondContact CA-O 3.36Å; H244-F248 PolarHBondContact ND1-O 3.03Å; H244-T349 PolarHBondContact CE1-O 3.13Å; H244-H350 AromaticContact CE1-CD2 3.99Å; H244-H350 AromaticContact CE1-NE2 3.9Å; H244-H350 AromaticContact NE2-CD2 3.79Å; H244-H350 AromaticContact NE2-NE2 3.53Å; H244-M361 WeakPolarHBondContact CE1-CE 3.17Å; H244-M361 WeakPolarHBondContact NE2-CE 3.21Å
245	S	96.8	Very high	94.7	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-74.8	-31.4	174.8	-59.1	0	0	0	0	113	A201 P212 Y216 E241 I242 L243	A201-S245 PolarHBondContact O-OG 3.21Å; P212-S245 WeakPolarHBondContact CB-O 3.41Å; Y216-S245 PolarHBondContact O-OG 3.3Å; E241-S245 PolarHBondContact O-N 3.07Å; E241-S245 PolarHBondContact O-OG 3.08Å; I242-S245 WeakPolarHBondContact O-CA 3.47Å; I242-S245 WeakPolarHBondContact O-CB 3.27Å; I242-S245 PolarHBondContact O-N 2.96Å; L243-S245 PolarHBondContact O-N 3.03Å
246	L	97.2	Very high	95.1	Very high	0 Å²	0	2.2 Å²	2.2	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-84.2	-32.2	-176	-71.5	177.7	0	0	0	114	L62 I64 W93 L97 F179 I242 L243 M379 Y385	L62-L246 HydrophobicContact CD2-CD1 4.17Å; L62-L246 HydrophobicContact CD2-CD2 4.4Å; I64-L246 HydrophobicContact CD1-CD1 4.45Å; I64-L246 HydrophobicContact CD1-CD2 4.47Å; W93-L246 HydrophobicContact CB-CD1 4.05Å; W93-L246 HydrophobicContact CD2-CD1 4.36Å; W93-L246 HydrophobicContact CG-CD1 4.05Å; L97-L246 HydrophobicContact CD1-CD1 4.13Å; F179-L246 HydrophobicContact CD1-CD2 3.92Å; F179-L246 HydrophobicContact CD2-CD2 4.03Å; F179-L246 HydrophobicContact CE1-CD2 3.93Å; F179-L246 HydrophobicContact CE2-CD2 4.06Å; F179-L246 HydrophobicContact CG-CD2 3.96Å; F179-L246 HydrophobicContact CZ-CD2 4.01Å; I242-L246 HydrophobicContact CG2-CD1 3.63Å; I242-L246 HydrophobicContact CG2-CG 4.01Å; I242-L246 WeakPolarHBondContact O-CG 3.35Å; I242-L246 PolarHBondContact O-N 3.16Å; L243-L246 HydrophobicContact CD1-CB 4.44Å; L243-L246 PolarHBondContact O-N 3.27Å; L243-L246 VanDerWaalsContact O-N 3.12Å; L246-M379 HydrophobicContact CB-CE 4.05Å; L246-Y385 WeakPolarHBondContact O-CE2 3.41Å; L246-Y385 PolarHBondContact O-OH 3.26Å
247	G	95.8	Very high	95.4	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.019	C	C	.	.	T	Hydrogen-bonded Turn	trans	176.5	-31.5	178.1	0	0	0	0	0	118.4	L243 S249 Y256	L243-G247 PolarHBondContact O-N 2.94Å; G247-S249 VanDerWaalsContact C-N 3.34Å; G247-S249 PolarHBondContact O-N 3.39Å; G247-Y256 PolarHBondContact O-OH 2.84Å
248	F	96.4	Very high	95.6	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	3%	0.026	C	C	.	.			trans	-76.8	87	-177.4	-161.1	131.2	0	0	0	110.1	L243 H244 L338 T349 W351 M361 M378 M379	L243-F248 HydrophobicContact CD2-CB 4.06Å; L243-F248 HydrophobicContact CD2-CD1 4.32Å; L243-F248 HydrophobicContact CG-CB 3.98Å; L243-F248 PolarHBondContact O-N 2.85Å; L243-F248 VanDerWaalsContact O-N 3.12Å; H244-F248 WeakPolarHBondContact CA-O 3.36Å; H244-F248 PolarHBondContact ND1-O 3.03Å; F248-L338 HydrophobicContact CE2-CD2 4.31Å; F248-L338 HydrophobicContact CZ-CD2 4.23Å; F248-T349 WeakPolarHBondContact CD2-O 3.46Å; F248-T349 WeakPolarHBondContact CE2-O 3.34Å; F248-W351 HydrophobicContact CE1-CD2 4.09Å; F248-W351 AromaticContact CE1-CE2 3.32Å; F248-W351 HydrophobicContact CE1-CH2 4.25Å; F248-W351 AromaticContact CE1-CZ2 3.43Å; F248-W351 HydrophobicContact CE1-CZ2 3.43Å; F248-W351 VanDerWaalsContact CE1-CZ2 3.43Å; F248-W351 AromaticContact CE1-NE1 3.36Å; F248-W351 AromaticContact CZ-CD2 3.77Å; F248-W351 HydrophobicContact CZ-CD2 3.77Å; F248-W351 AromaticContact CZ-CE2 3.48Å; F248-W351 VanDerWaalsContact CZ-CE2 3.48Å; F248-W351 HydrophobicContact CZ-CE3 4.24Å; F248-W351 HydrophobicContact CZ-CG 4.22Å; F248-W351 HydrophobicContact CZ-CH2 4.17Å; F248-W351 AromaticContact CZ-CZ2 3.71Å; F248-W351 HydrophobicContact CZ-CZ2 3.71Å; F248-W351 HydrophobicContact CZ-CZ3 4.42Å; F248-W351 AromaticContact CZ-NE1 3.79Å; F248-M361 HydrophobicContact CB-CE 3.95Å; F248-M361 HydrophobicContact CD1-CB 4.39Å; F248-M361 HydrophobicContact CD1-CE 4.26Å; F248-M361 HydrophobicContact CD1-CG 4.11Å; F248-M361 HydrophobicContact CD2-CE 4.1Å; F248-M361 HydrophobicContact CE1-CB 4.19Å; F248-M361 HydrophobicContact CE1-CG 4.37Å; F248-M361 HydrophobicContact CG-CE 3.84Å; F248-M378 HydrophobicContact CD1-CB 4.29Å; F248-M378 HydrophobicContact CD1-CG 3.68Å; F248-M378 HydrophobicContact CE1-CB 4.22Å; F248-M378 HydrophobicContact CE1-CG 3.73Å; F248-M378 HydrophobicContact CE2-CE 4.39Å; F248-M378 HydrophobicContact CG-CG 4.36Å; F248-M378 HydrophobicContact CZ-CE 4.34Å; F248-M378 HydrophobicContact CZ-CG 4.43Å; F248-M379 HydrophobicContact CB-SD 4.22Å
249	S	92.4	Very high	95.4	Very high	9 Å²	9	9.2 Å²	9.2	6%	0.063	5%	0.045	C	C	.	.	S	Bend	trans	-157.9	141.7	177.4	-176	0	0	0	0	110.8	G247 S251 L252 F253	G247-S249 VanDerWaalsContact C-N 3.34Å; G247-S249 PolarHBondContact O-N 3.39Å; S249-S251 PolarHBondContact O-N 3.42Å; S249-S251 PolarHBondContact OG-N 2.84Å; S249-S251 PolarHBondContact OG-OG 3.02Å; S249-L252 WeakPolarHBondContact O-CA 3.45Å; S249-L252 WeakPolarHBondContact O-CB 3.29Å; S249-L252 PolarHBondContact O-N 3.25Å; S249-F253 VanDerWaalsContact C-CE1 3.49Å; S249-F253 WeakPolarHBondContact O-CD1 3.47Å; S249-F253 VanDerWaalsContact O-CE1 3.29Å; S249-F253 WeakPolarHBondContact O-CE1 3.42Å; S249-F253 PolarHBondContact O-N 3.37Å
250	T	91.9	Very high	95.2	Very high	9 Å²	9	14.9 Å²	14.9	6%	0.055	7%	0.071	C	C	.	.	H	α-helix	trans	-56.2	-33.4	174.6	51.7	0	0	0	0	112.5	L252 F253 L348 T349	T250-L252 PolarHBondContact O-N 3.38Å; T250-F253 HydrophobicContact CG2-CD2 4.32Å; T250-F253 HydrophobicContact CG2-CE2 3.78Å; T250-F253 HydrophobicContact CG2-CZ 4.13Å; T250-F253 PolarHBondContact O-N 3.08Å; T250-L348 HydrophobicContact CG2-CB 3.42Å; T250-L348 VanDerWaalsContact CG2-CB 3.42Å; T250-L348 WeakPolarHBondContact CG2-O 3.34Å; T250-T349 HydrophobicContact CG2-CG2 3.6Å; T250-T349 WeakPolarHBondContact OG1-CG2 3.23Å
251	S	90.8	Very high	95	Very high	12 Å²	12	16.5 Å²	16.5	8%	0.084	8%	0.08	C	C	.	.	H	α-helix	trans	-63.9	-17.9	174.9	64.5	0	0	0	0	113.9	I36 H202 S249 F255	I36-S251 WeakPolarHBondContact CD1-OG 3.31Å; H202-S251 PolarHBondContact CE1-OG 2.05Å; H202-S251 PolarHBondContact ND1-OG 3.48Å; S249-S251 PolarHBondContact O-N 3.42Å; S249-S251 PolarHBondContact OG-N 2.84Å; S249-S251 PolarHBondContact OG-OG 3.02Å; S251-F255 WeakPolarHBondContact O-CD2 3.32Å
252	L	95.3	Very high	94.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-106.7	-12.2	179.8	-70.8	173.6	0	0	0	114.1	H202 L205 P212 S249 T250 A254 F255 Y256 W384	H202-L252 HydrophobicContact CB-CD1 4.41Å; H202-L252 WeakPolarHBondContact CE1-CD2 3.37Å; H202-L252 VanDerWaalsContact CE1-CG 3.44Å; H202-L252 WeakPolarHBondContact CE1-CG 3.47Å; H202-L252 WeakPolarHBondContact ND1-CD2 3.3Å; H202-L252 WeakPolarHBondContact ND1-CG 3.23Å; L205-L252 HydrophobicContact CD1-CD2 4.39Å; L205-L252 HydrophobicContact CD2-CD2 3.79Å; P212-L252 HydrophobicContact CG-CD1 3.71Å; P212-L252 HydrophobicContact CG-CD2 4.08Å; S249-L252 WeakPolarHBondContact O-CA 3.45Å; S249-L252 WeakPolarHBondContact O-CB 3.29Å; S249-L252 PolarHBondContact O-N 3.25Å; T250-L252 PolarHBondContact O-N 3.38Å; L252-A254 VanDerWaalsContact C-N 3.28Å; L252-A254 PolarHBondContact O-N 2.79Å; L252-F255 HydrophobicContact CD2-CB 4.48Å; L252-F255 HydrophobicContact CD2-CD2 4.45Å; L252-F255 WeakPolarHBondContact O-CA 3.47Å; L252-F255 WeakPolarHBondContact O-CB 3.46Å; L252-F255 PolarHBondContact O-N 3.39Å; L252-Y256 HydrophobicContact CB-CE1 4.01Å; L252-Y256 WeakPolarHBondContact O-CD1 3.3Å; L252-Y256 WeakPolarHBondContact O-CE1 3.15Å; L252-Y256 PolarHBondContact O-N 3.41Å; L252-W384 HydrophobicContact CB-CH2 4.23Å; L252-W384 HydrophobicContact CD1-CH2 4.3Å; L252-W384 HydrophobicContact CD1-CZ3 4.3Å; L252-W384 HydrophobicContact CD2-CH2 4.09Å; L252-W384 HydrophobicContact CG-CH2 4.44Å
253	F	96.6	Very high	94.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.5	-41	-177.3	-70	-2.9	0	0	0	112.5	S249 T250 F255 Y256 W289 V293 V294 L338 L348 M378	S249-F253 VanDerWaalsContact C-CE1 3.49Å; S249-F253 WeakPolarHBondContact O-CD1 3.47Å; S249-F253 VanDerWaalsContact O-CE1 3.29Å; S249-F253 WeakPolarHBondContact O-CE1 3.42Å; S249-F253 PolarHBondContact O-N 3.37Å; T250-F253 HydrophobicContact CG2-CD2 4.32Å; T250-F253 HydrophobicContact CG2-CE2 3.78Å; T250-F253 HydrophobicContact CG2-CZ 4.13Å; T250-F253 PolarHBondContact O-N 3.08Å; F253-F255 PolarHBondContact O-N 3.45Å; F253-Y256 HydrophobicContact CD1-CE1 4.45Å; F253-Y256 HydrophobicContact CD1-CE2 4.07Å; F253-Y256 AromaticContact CD1-CZ 3.84Å; F253-Y256 PolarHBondContact O-N 2.99Å; F253-W289 HydrophobicContact CB-CB 3.93Å; F253-W289 HydrophobicContact CB-CD2 4.09Å; F253-W289 HydrophobicContact CB-CE3 3.89Å; F253-W289 HydrophobicContact CB-CG 4.14Å; F253-W289 HydrophobicContact CD2-CD2 4.13Å; F253-W289 AromaticContact CD2-CE3 4Å; F253-W289 HydrophobicContact CD2-CE3 4Å; F253-W289 HydrophobicContact CD2-CZ3 4.24Å; F253-W289 HydrophobicContact CG-CE3 4.45Å; F253-V293 HydrophobicContact CB-CG1 3.94Å; F253-V293 HydrophobicContact CG-CG1 4.3Å; F253-V294 HydrophobicContact CD2-CG2 3.96Å; F253-V294 HydrophobicContact CE2-CG2 3.98Å; F253-L338 HydrophobicContact CE2-CD1 3.73Å; F253-L338 HydrophobicContact CZ-CD1 4.11Å; F253-L348 WeakPolarHBondContact CZ-O 3.43Å; F253-M378 HydrophobicContact CD1-CE 4.09Å; F253-M378 HydrophobicContact CE1-CE 3.38Å; F253-M378 HydrophobicContact CZ-CE 3.86Å
254	A	96.7	Very high	94.9	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.008	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-16.3	175.5	0	0	0	0	0	112.9	L252 T265 R267 P274 W289	L252-A254 VanDerWaalsContact C-N 3.28Å; L252-A254 PolarHBondContact O-N 2.79Å; A254-T265 HydrophobicContact CB-CG2 4.48Å; A254-T265 WeakPolarHBondContact O-CB 3.38Å; A254-R267 PolarHBondContact O-NH1 3.22Å; A254-R267 PolarHBondContact O-NH2 2.84Å; A254-P274 HydrophobicContact CB-CB 3.98Å; A254-P274 HydrophobicContact CB-CG 3.8Å; A254-W289 HydrophobicContact CB-CB 4.38Å
255	F	96.7	Very high	95	Very high	6 Å²	6	27.2 Å²	27.2	3%	0.026	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-7.9	-178.2	-67.7	-79.2	0	0	0	114.5	L205 D210 S251 L252 F253 R267 P274 Y287 W384	L205-F255 HydrophobicContact CD1-CD1 3.77Å; L205-F255 HydrophobicContact CD1-CD2 4.08Å; L205-F255 HydrophobicContact CD1-CE1 3.84Å; L205-F255 HydrophobicContact CD1-CE2 4.14Å; L205-F255 HydrophobicContact CD1-CG 3.88Å; L205-F255 HydrophobicContact CD1-CZ 4.02Å; D210-F255 HydrophobicContact CB-CB 3.96Å; D210-F255 HydrophobicContact CB-CD1 3.95Å; D210-F255 HydrophobicContact CB-CG 4.4Å; S251-F255 WeakPolarHBondContact O-CD2 3.32Å; L252-F255 HydrophobicContact CD2-CB 4.48Å; L252-F255 HydrophobicContact CD2-CD2 4.45Å; L252-F255 WeakPolarHBondContact O-CA 3.47Å; L252-F255 WeakPolarHBondContact O-CB 3.46Å; L252-F255 PolarHBondContact O-N 3.39Å; F253-F255 PolarHBondContact O-N 3.45Å; F255-R267 PolarHBondContact O-NH2 3.07Å; F255-P274 HydrophobicContact CD1-CG 4.33Å; F255-P274 HydrophobicContact CE1-CG 3.85Å; F255-P274 HydrophobicContact CE2-CG 4.22Å; F255-P274 HydrophobicContact CZ-CG 3.8Å; F255-Y287 AromaticContact CE2-CD2 3.64Å; F255-Y287 HydrophobicContact CE2-CD2 3.64Å; F255-Y287 HydrophobicContact CE2-CE2 4.13Å; F255-Y287 AromaticContact CZ-CD2 3.59Å; F255-Y287 HydrophobicContact CZ-CD2 3.59Å; F255-Y287 AromaticContact CZ-CE2 3.66Å; F255-Y287 HydrophobicContact CZ-CE2 3.66Å; F255-W384 HydrophobicContact CB-CZ2 4.4Å
256	Y	97.8	Very high	95.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.15	C	C	.	.			trans	-62.9	149.7	-179.3	-71.1	3.7	0	0	0	113.3	G247 L252 F253 L264 V293 L317 M378 T382 W384	G247-Y256 PolarHBondContact O-OH 2.84Å; L252-Y256 HydrophobicContact CB-CE1 4.01Å; L252-Y256 WeakPolarHBondContact O-CD1 3.3Å; L252-Y256 WeakPolarHBondContact O-CE1 3.15Å; L252-Y256 PolarHBondContact O-N 3.41Å; F253-Y256 HydrophobicContact CD1-CE1 4.45Å; F253-Y256 HydrophobicContact CD1-CE2 4.07Å; F253-Y256 AromaticContact CD1-CZ 3.84Å; F253-Y256 PolarHBondContact O-N 2.99Å; Y256-L264 PolarHBondContact O-N 3.01Å; Y256-V293 HydrophobicContact CD2-CG1 3.94Å; Y256-V293 HydrophobicContact CE2-CG1 4.41Å; Y256-L317 HydrophobicContact CD2-CD1 3.74Å; Y256-L317 HydrophobicContact CD2-CD2 4.34Å; Y256-L317 HydrophobicContact CE2-CD1 3.74Å; Y256-M378 HydrophobicContact CE2-CE 3.79Å; Y256-M378 HydrophobicContact CE2-SD 3.92Å; Y256-M378 WeakPolarHBondContact OH-CE 3.41Å; Y256-T382 HydrophobicContact CD1-CG2 4.28Å; Y256-T382 HydrophobicContact CE1-CG2 3.76Å; Y256-T382 HydrophobicContact CE2-CG2 4.39Å; Y256-W384 AromaticContact CD1-CH2 3.98Å; Y256-W384 HydrophobicContact CD1-CH2 3.98Å; Y256-W384 HydrophobicContact CD1-CZ2 4.3Å; Y256-W384 HydrophobicContact CE1-CH2 4.08Å; Y256-W384 HydrophobicContact CE1-CZ3 4.32Å
257	R	95.9	Very high	95	Very high	28 Å²	28	32.6 Å²	32.6	11%	0.106	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-130.4	153.5	-178.8	-59.7	-170.2	170.1	-120.3	4.1	111.2	T209 D210 N261 R262 T382 G383	T209-R257 WeakPolarHBondContact O-CD 3.12Å; T209-R257 PolarHBondContact O-NE 3.41Å; D210-R257 IonicContact OD1-NH2 2.86Å; D210-R257 IonicContact OD2-CZ 2.69Å; D210-R257 IonicContact OD2-NE 2.69Å; D210-R257 PolarHBondContact OD2-NE 3.39Å; D210-R257 IonicContact OD2-NH2 3.09Å; D210-R257 PolarHBondContact OD2-NH2 3.09Å; R257-N261 WeakPolarHBondContact CD-OD1 3.28Å; R257-N261 PolarHBondContact NH1-O 3Å; R257-R262 CarbonylContact C-O 3.46Å; R257-R262 VanDerWaalsContact CA-O 3.23Å; R257-R262 WeakPolarHBondContact CA-O 3.23Å; R257-R262 WeakPolarHBondContact CB-O 3.44Å; R257-T382 PolarHBondContact N-O 3.39Å; R257-T382 CarbonylContact O-C 3.59Å; R257-G383 WeakPolarHBondContact O-CA 3.33Å; R257-G383 PolarHBondContact O-N 3.48Å
258	D	94.8	Very high	94.9	Very high	29 Å²	29	35 Å²	35	16%	0.155	17%	0.171	C	C	.	.			trans	-77	-177.4	175.8	73.8	9.8	0	0	0	113.1	Q260 N261 R262 L264	D258-Q260 PolarHBondContact O-N 3.14Å; D258-Q260 VanDerWaalsContact O-N 3.13Å; D258-Q260 VanDerWaalsContact OD1-C 3.25Å; D258-Q260 VanDerWaalsContact OD1-CA 3.3Å; D258-Q260 WeakPolarHBondContact OD1-CA 3.23Å; D258-Q260 WeakPolarHBondContact OD1-CB 3.29Å; D258-Q260 PolarHBondContact OD1-N 2.9Å; D258-N261 PolarHBondContact O-N 2.81Å; D258-N261 PolarHBondContact OD1-N 3.28Å; D258-N261 VanDerWaalsContact OD1-N 3.09Å; D258-R262 PolarHBondContact N-O 2.93Å; D258-R262 WeakPolarHBondContact OD1-CB 3.41Å; D258-R262 PolarHBondContact OD1-N 2.82Å; D258-R262 IonicContact OD1-NE 2.75Å; D258-R262 IonicContact OD2-CZ 3.61Å; D258-R262 IonicContact OD2-NE 3.72Å; D258-R262 PolarHBondContact OD2-NE 2.96Å; D258-R262 IonicContact OD2-NH2 3.7Å; D258-R262 PolarHBondContact OD2-NH2 2.98Å; D258-L264 HydrophobicContact CB-CD2 3.96Å
259	K	90.4	Very high	94.6	Very high	94 Å²	94	40.2 Å²	40.2	41%	0.409	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-19.1	180	-58.2	-167.8	176.9	-163	0	113.6	T319 E380	K259-T319 PolarHBondContact NZ-OG1 3.35Å; K259-E380 IonicContact NZ-OE1 2.89Å; K259-E380 PolarHBondContact NZ-OE1 3.04Å
260	Q	90.5	Very high	94.5	Very high	124 Å²	124	46.1 Å²	46.1	58%	0.579	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.7	12.8	177.1	-66.5	74	34.4	0	0	112.2	D258 R262	D258-Q260 PolarHBondContact O-N 3.14Å; D258-Q260 VanDerWaalsContact O-N 3.13Å; D258-Q260 VanDerWaalsContact OD1-C 3.25Å; D258-Q260 VanDerWaalsContact OD1-CA 3.3Å; D258-Q260 WeakPolarHBondContact OD1-CA 3.23Å; D258-Q260 WeakPolarHBondContact OD1-CB 3.29Å; D258-Q260 PolarHBondContact OD1-N 2.9Å; Q260-R262 HydrophobicContact CB-CG 4.3Å; Q260-R262 PolarHBondContact O-N 2.92Å
261	N	91.7	Very high	94.3	Very high	34 Å²	34	48.5 Å²	48.5	18%	0.182	25%	0.248	C	C	.	.	S	Bend	trans	62.8	23.5	-177.7	-167.5	51.9	0	0	0	114.2	N208 R257 D258	N208-N261 PolarHBondContact O-ND2 3.01Å; R257-N261 WeakPolarHBondContact CD-OD1 3.28Å; R257-N261 PolarHBondContact NH1-O 3Å; D258-N261 PolarHBondContact O-N 2.81Å; D258-N261 PolarHBondContact OD1-N 3.28Å; D258-N261 VanDerWaalsContact OD1-N 3.09Å
262	R	94.8	Very high	94.2	Very high	150 Å²	150	52.4 Å²	52.4	57%	0.566	26%	0.264	S	S	*	.			trans	-85.7	134	173.6	-56.7	176.5	-65.2	-178.2	2.2	109.5	R257 D258 Q260 L264	R257-R262 CarbonylContact C-O 3.46Å; R257-R262 VanDerWaalsContact CA-O 3.23Å; R257-R262 WeakPolarHBondContact CA-O 3.23Å; R257-R262 WeakPolarHBondContact CB-O 3.44Å; D258-R262 PolarHBondContact N-O 2.93Å; D258-R262 WeakPolarHBondContact OD1-CB 3.41Å; D258-R262 PolarHBondContact OD1-N 2.82Å; D258-R262 IonicContact OD1-NE 2.75Å; D258-R262 IonicContact OD2-CZ 3.61Å; D258-R262 IonicContact OD2-NE 3.72Å; D258-R262 PolarHBondContact OD2-NE 2.96Å; D258-R262 IonicContact OD2-NH2 3.7Å; D258-R262 PolarHBondContact OD2-NH2 2.98Å; Q260-R262 HydrophobicContact CB-CG 4.3Å; Q260-R262 PolarHBondContact O-N 2.92Å; R262-L264 PolarHBondContact O-N 2.83Å
263	P	96.9	Very high	94	Very high	48 Å²	48	54.2 Å²	54.2	31%	0.312	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-57.4	129.9	175.5	-23.8	33.9	0	0	0	112.1	T265 R267	P263-T265 VanDerWaalsContact C-N 3.31Å; P263-T265 VanDerWaalsContact CB-O 3.22Å; P263-T265 WeakPolarHBondContact CB-O 3.35Å; P263-R267 HydrophobicContact CB-CG 3.87Å; P263-R267 HydrophobicContact CG-CG 3.66Å
264	L	98.1	Very high	94	Very high	28 Å²	28	54.6 Å²	54.6	15%	0.147	27%	0.274	C	S	.	.	S	Bend	trans	-75	-27.4	173.3	-67.2	178.7	0	0	0	111.9	Y256 D258 R262 S290 V293 L317	Y256-L264 PolarHBondContact O-N 3.01Å; D258-L264 HydrophobicContact CB-CD2 3.96Å; R262-L264 PolarHBondContact O-N 2.83Å; L264-S290 WeakPolarHBondContact O-CB 3.15Å; L264-S290 PolarHBondContact O-OG 2.76Å; L264-V293 HydrophobicContact CB-CG2 3.77Å; L264-V293 HydrophobicContact CD1-CG2 4.06Å; L264-L317 HydrophobicContact CD1-CD2 3.36Å
265	T	98.3	Very high	93.9	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.295	C	S	.	.	S	Bend	trans	-102.4	132.3	171.3	-58.3	0	0	0	0	109.2	A254 P263 P274 L276 S290	A254-T265 HydrophobicContact CB-CG2 4.48Å; A254-T265 WeakPolarHBondContact O-CB 3.38Å; P263-T265 VanDerWaalsContact C-N 3.31Å; P263-T265 VanDerWaalsContact CB-O 3.22Å; P263-T265 WeakPolarHBondContact CB-O 3.35Å; T265-P274 HydrophobicContact CG2-CB 4.2Å; T265-L276 HydrophobicContact CG2-CD1 3.88Å; T265-L276 HydrophobicContact CG2-CG 4.06Å; T265-S290 PolarHBondContact OG1-N 3.27Å
266	P	97.8	Very high	93.9	Very high	71 Å²	71	60.7 Å²	60.7	46%	0.461	31%	0.314	S	S	.	.			trans	-52.5	143.4	178.2	-27.5	35.4	0	0	0	112.7	A275	P266-A275 HydrophobicContact CB-CB 4.3Å; P266-A275 WeakPolarHBondContact O-CB 3.45Å; P266-A275 PolarHBondContact O-N 3.3Å
267	R	95.2	Very high	93.6	Very high	41 Å²	41	62.2 Å²	62.2	16%	0.155	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-105.3	142.3	177.5	-62.9	-58.6	-168.1	-132.9	-12	111	D210 A254 F255 P263 F272 K273 P274	D210-R267 IonicContact OD2-CZ 2.96Å; D210-R267 IonicContact OD2-NE 3.78Å; D210-R267 IonicContact OD2-NH2 3.8Å; D210-R267 PolarHBondContact OD2-NH2 2.86Å; A254-R267 PolarHBondContact O-NH1 3.22Å; A254-R267 PolarHBondContact O-NH2 2.84Å; F255-R267 PolarHBondContact O-NH2 3.07Å; P263-R267 HydrophobicContact CB-CG 3.87Å; P263-R267 HydrophobicContact CG-CG 3.66Å; R267-F272 WeakPolarHBondContact CD-O 3.43Å; R267-K273 CarbonylContact C-O 3.52Å; R267-K273 WeakPolarHBondContact CA-O 3.03Å; R267-P274 VanDerWaalsContact NH1-CG 3.31Å
268	D	93.7	Very high	93.4	Very high	52 Å²	52	66.6 Å²	66.6	28%	0.278	35%	0.346	S	S	.	.			trans	-68.3	128.4	169.4	175.4	-78.8	0	0	0	108.7	I270 T271 F272 K273 A275	D268-I270 PolarHBondContact O-N 2.77Å; D268-I270 WeakPolarHBondContact OD1-CA 3.44Å; D268-I270 WeakPolarHBondContact OD1-CB 3.28Å; D268-I270 PolarHBondContact OD1-N 3.34Å; D268-T271 WeakPolarHBondContact CB-OG1 3.1Å; D268-T271 PolarHBondContact OD1-N 3.08Å; D268-T271 PolarHBondContact OD1-OG1 2.73Å; D268-F272 WeakPolarHBondContact O-CA 3.4Å; D268-F272 PolarHBondContact O-N 3.24Å; D268-K273 PolarHBondContact N-O 2.93Å; D268-A275 HydrophobicContact CB-CB 4.41Å
269	P	90.8	Very high	93.1	Very high	108 Å²	108	66.9 Å²	66.9	70%	0.701	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-14.7	-172	27.4	-34.9	0	0	0	114
270	I	88.8	Confident	92.6	Very high	133 Å²	133	68.3 Å²	68.3	68%	0.682	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-48.3	-178.8	-59.2	175.5	0	0	0	110	D268	D268-I270 PolarHBondContact O-N 2.77Å; D268-I270 WeakPolarHBondContact OD1-CA 3.44Å; D268-I270 WeakPolarHBondContact OD1-CB 3.28Å; D268-I270 PolarHBondContact OD1-N 3.34Å
271	T	88	Confident	92	Very high	59 Å²	59	63.9 Å²	63.9	36%	0.362	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-14.3	-173.4	65	0	0	0	0	113.8	L122 D268 K273	L122-T271 WeakPolarHBondContact CD1-O 3.38Å; D268-T271 WeakPolarHBondContact CB-OG1 3.1Å; D268-T271 PolarHBondContact OD1-N 3.08Å; D268-T271 PolarHBondContact OD1-OG1 2.73Å; T271-K273 PolarHBondContact O-N 3.22Å; T271-K273 PolarHBondContact OG1-N 3.46Å
272	F	89.7	Confident	90.9	Very high	94 Å²	94	67.8 Å²	67.8	41%	0.412	37%	0.37	S	S	.	.			trans	56.3	13.9	-173.6	-64.7	-89.5	0	0	0	114.9	L122 L129 R267 D268	L122-F272 HydrophobicContact CD1-CD2 4.02Å; L129-F272 HydrophobicContact CD2-CD2 4.26Å; L129-F272 HydrophobicContact CD2-CE2 3.71Å; L129-F272 HydrophobicContact CD2-CZ 4.3Å; R267-F272 WeakPolarHBondContact CD-O 3.43Å; D268-F272 WeakPolarHBondContact O-CA 3.4Å; D268-F272 PolarHBondContact O-N 3.24Å
273	K	91.2	Very high	89.5	Confident	39 Å²	39	60.9 Å²	60.9	17%	0.17	35%	0.345	C	S	.	.	S	Bend	trans	-84.8	162.8	174.6	-73.2	168.9	170.3	-179.6	0	110.8	R267 D268 T271 A275 Y287	R267-K273 CarbonylContact C-O 3.52Å; R267-K273 WeakPolarHBondContact CA-O 3.03Å; D268-K273 PolarHBondContact N-O 2.93Å; T271-K273 PolarHBondContact O-N 3.22Å; T271-K273 PolarHBondContact OG1-N 3.46Å; K273-A275 PolarHBondContact O-N 3.46Å; K273-Y287 WeakPolarHBondContact CD-OH 3.4Å
274	P	95.2	Very high	88	Confident	7 Å²	7	59.7 Å²	59.7	5%	0.045	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-52.9	127.5	172.1	-20.2	27.5	0	0	0	112.2	A254 F255 T265 R267 Y287	A254-P274 HydrophobicContact CB-CB 3.98Å; A254-P274 HydrophobicContact CB-CG 3.8Å; F255-P274 HydrophobicContact CD1-CG 4.33Å; F255-P274 HydrophobicContact CE1-CG 3.85Å; F255-P274 HydrophobicContact CE2-CG 4.22Å; F255-P274 HydrophobicContact CZ-CG 3.8Å; T265-P274 HydrophobicContact CG2-CB 4.2Å; R267-P274 VanDerWaalsContact NH1-CG 3.31Å; P274-Y287 HydrophobicContact CB-CD1 3.82Å; P274-Y287 HydrophobicContact CB-CG 3.83Å; P274-Y287 HydrophobicContact CG-CD1 3.88Å; P274-Y287 HydrophobicContact CG-CD2 3.75Å; P274-Y287 HydrophobicContact CG-CE1 4.44Å; P274-Y287 HydrophobicContact CG-CE2 4.29Å; P274-Y287 HydrophobicContact CG-CG 3.51Å
275	A	96.3	Very high	87.1	Confident	53 Å²	53	64.4 Å²	64.4	44%	0.438	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-10.2	-171.9	0	0	0	0	0	114.6	P266 D268 K273 G277	P266-A275 HydrophobicContact CB-CB 4.3Å; P266-A275 WeakPolarHBondContact O-CB 3.45Å; P266-A275 PolarHBondContact O-N 3.3Å; D268-A275 HydrophobicContact CB-CB 4.41Å; K273-A275 PolarHBondContact O-N 3.46Å; A275-G277 PolarHBondContact O-N 2.75Å
276	L	95.8	Very high	86.6	Confident	83 Å²	83	64.9 Å²	64.9	44%	0.435	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	5.8	-176	-59.8	-176.3	0	0	0	113.7	T265 Q288	T265-L276 HydrophobicContact CG2-CD1 3.88Å; T265-L276 HydrophobicContact CG2-CG 4.06Å; L276-Q288 HydrophobicContact CB-CB 3.8Å; L276-Q288 HydrophobicContact CB-CG 3.79Å; L276-Q288 HydrophobicContact CD1-CG 4.27Å
277	G	92.4	Very high	86.3	Confident	31 Å²	31	62.3 Å²	62.3	32%	0.32	35%	0.346	S	S	.	.			trans	73.1	-150.1	-179.1	0	0	0	0	0	113.1	A275 Y287 Q288	A275-G277 PolarHBondContact O-N 2.75Å; G277-Y287 WeakPolarHBondContact O-CA 3.37Å; G277-Q288 PolarHBondContact O-N 3.1Å
278	W	91.1	Very high	86.3	Confident	121 Å²	121	62.6 Å²	62.6	46%	0.458	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-100.4	141.6	-173.7	-59	101.6	0	0	0	111.6	H38 Q285 Y287	H38-W278 HydrophobicContact CB-CH2 3.72Å; H38-W278 HydrophobicContact CB-CZ3 4.05Å; H38-W278 AromaticContact CG-CH2 3.58Å; H38-W278 AromaticContact ND1-CH2 3.99Å; W278-Q285 HydrophobicContact CE3-CB 3.92Å; W278-Q285 HydrophobicContact CZ3-CB 3.98Å; W278-Q285 VanDerWaalsContact CZ3-O 3.31Å; W278-Q285 WeakPolarHBondContact CZ3-O 3.32Å; W278-Y287 HydrophobicContact CH2-CE1 4.22Å; W278-Y287 HydrophobicContact CH2-CE2 4.44Å; W278-Y287 HydrophobicContact CZ2-CE1 4.34Å; W278-Y287 HydrophobicContact CZ3-CE1 4.45Å
279	Y	88.4	Confident	86.4	Confident	35 Å²	35	60.6 Å²	60.6	14%	0.137	34%	0.338	C	S	.	.			trans	-65.9	134.5	170.8	179.8	-117.8	0	0	0	110.5	N283 V286 Q288 W289 Y347 L348	Y279-N283 HydrophobicContact CD1-CB 4.32Å; Y279-N283 HydrophobicContact CE1-CB 4.35Å; Y279-V286 HydrophobicContact CD1-CG2 4.17Å; Y279-V286 HydrophobicContact CG-CG2 4.32Å; Y279-V286 PolarHBondContact N-O 2.81Å; Y279-Q288 VanDerWaalsContact CD2-OE1 3.32Å; Y279-W289 HydrophobicContact CD1-CH2 4.41Å; Y279-W289 HydrophobicContact CD2-CH2 4.12Å; Y279-W289 HydrophobicContact CD2-CZ2 4.42Å; Y279-W289 HydrophobicContact CE1-CH2 4.44Å; Y279-W289 HydrophobicContact CE2-CH2 4.18Å; Y279-W289 HydrophobicContact CE2-CZ2 4.27Å; Y279-W289 HydrophobicContact CG-CH2 4.24Å; Y279-W289 HydrophobicContact CG-CZ3 4.48Å; Y279-Y347 HydrophobicContact CE1-CE1 4.49Å; Y279-Y347 PolarHBondContact OH-OH 2.82Å; Y279-L348 HydrophobicContact CE1-CD1 4.32Å
280	S	80.5	Confident	86.8	Confident	123 Å²	123	56 Å²	56	86%	0.86	31%	0.308	S	S	*	.			trans	-93.9	2.7	-175.7	55.2	0	0	0	0	114.9
281	G	76.7	Confident	87.2	Confident	32 Å²	32	54.6 Å²	54.6	33%	0.33	30%	0.302	S	S	.	.	S	Bend	trans	-93.5	-162.9	-175.8	0	0	0	0	0	115.4	N283	G281-N283 PolarHBondContact O-N 2.97Å
282	K	69.6	Low	87.6	Confident	115 Å²	115	55.9 Å²	55.9	50%	0.5	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.3	-171.4	-67.6	179	178.5	174.4	0	115	G284 D342 A344 Y347	K282-G284 VanDerWaalsContact C-N 3.35Å; K282-G284 PolarHBondContact O-N 3.45Å; K282-D342 PolarHBondContact NZ-O 2.95Å; K282-A344 WeakPolarHBondContact O-CB 3.41Å; K282-Y347 HydrophobicContact CB-CD1 4.13Å; K282-Y347 HydrophobicContact CB-CE1 4.45Å; K282-Y347 HydrophobicContact CD-CD2 4.48Å; K282-Y347 HydrophobicContact CD-CG 4.41Å
283	N	65.4	Low	88	Confident	6 Å²	6	51.4 Å²	51.4	3%	0.032	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	15.9	-167.8	-76.6	-14	0	0	0	116.6	Y279 G281 V286 G345 Y347	Y279-N283 HydrophobicContact CD1-CB 4.32Å; Y279-N283 HydrophobicContact CE1-CB 4.35Å; G281-N283 PolarHBondContact O-N 2.97Å; N283-V286 HydrophobicContact CB-CG2 4.46Å; N283-G345 PolarHBondContact OD1-N 3.4Å; N283-Y347 PolarHBondContact ND2-O 3.15Å; N283-Y347 PolarHBondContact OD1-O 3.26Å
284	G	64.3	Low	88.3	Confident	23 Å²	23	49.6 Å²	49.6	24%	0.237	28%	0.28	C	S	.	.			trans	68	-158.4	179.8	0	0	0	0	0	113.6	M35 K282 V286	M35-G284 WeakPolarHBondContact SD-CA 3.45Å; K282-G284 VanDerWaalsContact C-N 3.35Å; K282-G284 PolarHBondContact O-N 3.45Å; G284-V286 VanDerWaalsContact C-N 3.31Å; G284-V286 PolarHBondContact O-N 2.92Å
285	Q	78.9	Confident	88.4	Confident	126 Å²	126	54.6 Å²	54.6	59%	0.589	30%	0.297	S	S	*	.	S	Bend	trans	-77.3	74.3	-176.1	-68.3	-179.2	-11.4	0	0	112	W278	W278-Q285 HydrophobicContact CE3-CB 3.92Å; W278-Q285 HydrophobicContact CZ3-CB 3.98Å; W278-Q285 VanDerWaalsContact CZ3-O 3.31Å; W278-Q285 WeakPolarHBondContact CZ3-O 3.32Å
286	V	88.5	Confident	88.4	Confident	10 Å²	10	55.9 Å²	55.9	6%	0.061	30%	0.3	C	S	.	.			trans	-105.8	149.5	165.8	-61	0	0	0	0	110	Y279 N283 G284 W289	Y279-V286 HydrophobicContact CD1-CG2 4.17Å; Y279-V286 HydrophobicContact CG-CG2 4.32Å; Y279-V286 PolarHBondContact N-O 2.81Å; N283-V286 HydrophobicContact CB-CG2 4.46Å; G284-V286 VanDerWaalsContact C-N 3.31Å; G284-V286 PolarHBondContact O-N 2.92Å; V286-W289 HydrophobicContact CG2-CZ3 4.25Å
287	Y	92.9	Very high	88.4	Confident	18 Å²	18	53.4 Å²	53.4	7%	0.071	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-65.5	139.6	174.6	-73.6	-75.9	0	0	0	111.1	H38 F255 K273 P274 G277 W278 W289	H38-Y287 AromaticContact CD2-CE2 3.23Å; H38-Y287 WeakPolarHBondContact CD2-CE2 3.32Å; H38-Y287 AromaticContact CD2-CZ 3.77Å; H38-Y287 PolarHBondContact CE1-OH 3.02Å; H38-Y287 AromaticContact NE2-CE2 3.14Å; H38-Y287 WeakPolarHBondContact NE2-CE2 3.44Å; H38-Y287 AromaticContact NE2-CZ 3.41Å; H38-Y287 PolarHBondContact NE2-OH 3.48Å; F255-Y287 AromaticContact CE2-CD2 3.64Å; F255-Y287 HydrophobicContact CE2-CD2 3.64Å; F255-Y287 HydrophobicContact CE2-CE2 4.13Å; F255-Y287 AromaticContact CZ-CD2 3.59Å; F255-Y287 HydrophobicContact CZ-CD2 3.59Å; F255-Y287 AromaticContact CZ-CE2 3.66Å; F255-Y287 HydrophobicContact CZ-CE2 3.66Å; K273-Y287 WeakPolarHBondContact CD-OH 3.4Å; P274-Y287 HydrophobicContact CB-CD1 3.82Å; P274-Y287 HydrophobicContact CB-CG 3.83Å; P274-Y287 HydrophobicContact CG-CD1 3.88Å; P274-Y287 HydrophobicContact CG-CD2 3.75Å; P274-Y287 HydrophobicContact CG-CE1 4.44Å; P274-Y287 HydrophobicContact CG-CE2 4.29Å; P274-Y287 HydrophobicContact CG-CG 3.51Å; G277-Y287 WeakPolarHBondContact O-CA 3.37Å; W278-Y287 HydrophobicContact CH2-CE1 4.22Å; W278-Y287 HydrophobicContact CH2-CE2 4.44Å; W278-Y287 HydrophobicContact CZ2-CE1 4.34Å; W278-Y287 HydrophobicContact CZ3-CE1 4.45Å; Y287-W289 PolarHBondContact O-N 3.45Å
288	Q	94.6	Very high	88.6	Confident	47 Å²	47	57 Å²	57	22%	0.22	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-64.3	123.6	171.5	179.8	61.8	52.1	0	0	109.8	L276 G277 Y279	L276-Q288 HydrophobicContact CB-CB 3.8Å; L276-Q288 HydrophobicContact CB-CG 3.79Å; L276-Q288 HydrophobicContact CD1-CG 4.27Å; G277-Q288 PolarHBondContact O-N 3.1Å; Y279-Q288 VanDerWaalsContact CD2-OE1 3.32Å
289	W	96.1	Very high	88.9	Confident	9 Å²	9	52.1 Å²	52.1	3%	0.034	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-81.4	160.7	169.1	53.9	80.6	0	0	0	110.8	F253 A254 Y279 V286 Y287 V293 V294 L348	F253-W289 HydrophobicContact CB-CB 3.93Å; F253-W289 HydrophobicContact CB-CD2 4.09Å; F253-W289 HydrophobicContact CB-CE3 3.89Å; F253-W289 HydrophobicContact CB-CG 4.14Å; F253-W289 HydrophobicContact CD2-CD2 4.13Å; F253-W289 AromaticContact CD2-CE3 4Å; F253-W289 HydrophobicContact CD2-CE3 4Å; F253-W289 HydrophobicContact CD2-CZ3 4.24Å; F253-W289 HydrophobicContact CG-CE3 4.45Å; A254-W289 HydrophobicContact CB-CB 4.38Å; Y279-W289 HydrophobicContact CD1-CH2 4.41Å; Y279-W289 HydrophobicContact CD2-CH2 4.12Å; Y279-W289 HydrophobicContact CD2-CZ2 4.42Å; Y279-W289 HydrophobicContact CE1-CH2 4.44Å; Y279-W289 HydrophobicContact CE2-CH2 4.18Å; Y279-W289 HydrophobicContact CE2-CZ2 4.27Å; Y279-W289 HydrophobicContact CG-CH2 4.24Å; Y279-W289 HydrophobicContact CG-CZ3 4.48Å; V286-W289 HydrophobicContact CG2-CZ3 4.25Å; Y287-W289 PolarHBondContact O-N 3.45Å; W289-V293 HydrophobicContact CB-CB 4.22Å; W289-V294 HydrophobicContact CZ2-CG1 4.41Å; W289-V294 PolarHBondContact NE1-O 3.05Å; W289-L348 HydrophobicContact CH2-CD1 3.66Å; W289-L348 HydrophobicContact CZ2-CD1 3.89Å
290	S	97.7	Very high	89.3	Confident	11 Å²	11	54.1 Å²	54.1	8%	0.077	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-79.6	163.2	172.4	71.6	0	0	0	0	112.4	L264 T265 N292 V293 V294	L264-S290 WeakPolarHBondContact O-CB 3.15Å; L264-S290 PolarHBondContact O-OG 2.76Å; T265-S290 PolarHBondContact OG1-N 3.27Å; S290-N292 PolarHBondContact O-N 3.26Å; S290-N292 WeakPolarHBondContact OG-CB 3.24Å; S290-N292 PolarHBondContact OG-N 2.9Å; S290-V293 PolarHBondContact O-N 3.16Å; S290-V294 PolarHBondContact O-N 3.16Å
291	D	97.4	Very high	90.1	Very high	104 Å²	104	48.3 Å²	48.3	56%	0.556	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-1.8	169.6	-70.3	-27.2	0	0	0	113.4	V293 R295 V316	D291-V293 VanDerWaalsContact C-N 3.31Å; D291-R295 HydrophobicContact CB-CG 3.9Å; D291-R295 VanDerWaalsContact O-CG 3.27Å; D291-R295 WeakPolarHBondContact O-CG 3.4Å; D291-R295 PolarHBondContact O-NE 3.25Å; D291-R295 PolarHBondContact O-NH2 3.12Å; D291-V316 VanDerWaalsContact O-CG2 3.28Å; D291-V316 WeakPolarHBondContact O-CG2 3.43Å
292	N	97.8	Very high	91.2	Very high	87 Å²	87	47.9 Å²	47.9	47%	0.465	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-8.1	170.4	-62.4	-38.8	0	0	0	112.6	S290	S290-N292 PolarHBondContact O-N 3.26Å; S290-N292 WeakPolarHBondContact OG-CB 3.24Å; S290-N292 PolarHBondContact OG-N 2.9Å
293	V	98.4	Very high	92.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-61.8	-179.7	-174.4	0	0	0	0	110.1	F253 Y256 L264 W289 S290 D291 V315 V316 L317	F253-V293 HydrophobicContact CB-CG1 3.94Å; F253-V293 HydrophobicContact CG-CG1 4.3Å; Y256-V293 HydrophobicContact CD2-CG1 3.94Å; Y256-V293 HydrophobicContact CE2-CG1 4.41Å; L264-V293 HydrophobicContact CB-CG2 3.77Å; L264-V293 HydrophobicContact CD1-CG2 4.06Å; W289-V293 HydrophobicContact CB-CB 4.22Å; S290-V293 PolarHBondContact O-N 3.16Å; D291-V293 VanDerWaalsContact C-N 3.31Å; V293-V315 WeakPolarHBondContact O-CA 3.03Å; V293-V316 PolarHBondContact O-N 3.2Å; V293-L317 HydrophobicContact CB-CD2 4.42Å; V293-L317 HydrophobicContact CG1-CD1 4.48Å; V293-L317 HydrophobicContact CG1-CD2 4.24Å; V293-L317 HydrophobicContact CG2-CD2 4.39Å
294	V	97.5	Very high	94.1	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	134.1	177.9	167.4	0	0	0	0	109.6	F253 W289 S290 H313 I314 V315 L338	F253-V294 HydrophobicContact CD2-CG2 3.96Å; F253-V294 HydrophobicContact CE2-CG2 3.98Å; W289-V294 HydrophobicContact CZ2-CG1 4.41Å; W289-V294 PolarHBondContact NE1-O 3.05Å; S290-V294 PolarHBondContact O-N 3.16Å; V294-H313 HydrophobicContact CG1-CB 4.2Å; V294-I314 CarbonylContact C-O 3.49Å; V294-I314 WeakPolarHBondContact CA-O 3.46Å; V294-V315 HydrophobicContact CG2-CG2 3.85Å; V294-L338 HydrophobicContact CG1-CD1 4.23Å; V294-L338 HydrophobicContact CG2-CD1 3.74Å
295	R	96.5	Very high	95.6	Very high	111 Å²	111	44.9 Å²	44.9	42%	0.419	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	152.9	174.2	-65.7	-175.6	-170.2	164.1	4.7	110.7	D291 V297 H313 I314 V316	D291-R295 HydrophobicContact CB-CG 3.9Å; D291-R295 VanDerWaalsContact O-CG 3.27Å; D291-R295 WeakPolarHBondContact O-CG 3.4Å; D291-R295 PolarHBondContact O-NE 3.25Å; D291-R295 PolarHBondContact O-NH2 3.12Å; R295-V297 HydrophobicContact CB-CG1 4.47Å; R295-H313 CarbonylContact O-C 3.47Å; R295-H313 WeakPolarHBondContact O-CA 3.39Å; R295-I314 HydrophobicContact CB-CG1 4.14Å; R295-I314 PolarHBondContact N-O 3.14Å; R295-I314 WeakPolarHBondContact O-CG1 3.36Å; R295-I314 PolarHBondContact O-N 2.66Å; R295-V316 HydrophobicContact CB-CG1 4.16Å; R295-V316 HydrophobicContact CG-CG1 3.96Å; R295-V316 HydrophobicContact CG-CG2 4.17Å
296	T	95.4	Very high	96.5	Very high	81 Å²	81	39.5 Å²	39.5	50%	0.497	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.1	167.3	-49.5	0	0	0	0	108.6	L311 A312 H313	T296-L311 HydrophobicContact CG2-CB 4.5Å; T296-L311 HydrophobicContact CG2-CD2 4.01Å; T296-A312 CarbonylContact C-O 3.6Å; T296-A312 WeakPolarHBondContact CA-O 3.38Å; T296-H313 PolarHBondContact OG1-CE1 2.73Å; T296-H313 PolarHBondContact OG1-ND1 3.31Å
297	V	96.9	Very high	97	Very high	31 Å²	31	43.3 Å²	43.3	19%	0.188	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	156.1	-179.5	-61.7	0	0	0	0	110.8	R295 A312 I314	R295-V297 HydrophobicContact CB-CG1 4.47Å; V297-A312 HydrophobicContact CG2-CB 4.23Å; V297-A312 PolarHBondContact N-O 3.33Å; V297-A312 PolarHBondContact O-N 3.43Å; V297-I314 HydrophobicContact CB-CD1 4.41Å; V297-I314 HydrophobicContact CG1-CD1 3.62Å; V297-I314 HydrophobicContact CG1-CG1 4.05Å; V297-I314 HydrophobicContact CG2-CD1 3.87Å; V297-I314 HydrophobicContact CG2-CG1 4.03Å; V297-I314 HydrophobicContact CG2-CG2 3.99Å
298	N	97.1	Very high	97.2	Very high	106 Å²	106	45.7 Å²	45.7	57%	0.567	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	123.7	170.3	-72	-56.5	0	0	0	109.5	L311	N298-L311 WeakPolarHBondContact OD1-CD2 3.36Å
299	R	96.5	Very high	97.3	Very high	18 Å²	18	49.3 Å²	49.3	7%	0.068	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	131.8	172.6	-63.4	-61.3	-163.1	-156.2	-0.3	110	W301 Q309 K310 A312 D334 E337	R299-W301 PolarHBondContact O-N 3.37Å; R299-Q309 WeakPolarHBondContact O-CA 3.47Å; R299-K310 HydrophobicContact CB-CB 4.46Å; R299-K310 PolarHBondContact N-O 2.67Å; R299-K310 PolarHBondContact O-N 3.48Å; R299-A312 HydrophobicContact CG-CB 3.67Å; R299-D334 IonicContact CZ-OD1 3.62Å; R299-D334 VanDerWaalsContact CZ-OD1 3.27Å; R299-D334 IonicContact CZ-OD2 2.97Å; R299-D334 VanDerWaalsContact NH1-CG 3.3Å; R299-D334 IonicContact NH1-OD1 3.3Å; R299-D334 PolarHBondContact NH1-OD1 2.87Å; R299-D334 IonicContact NH1-OD2 3.16Å; R299-D334 PolarHBondContact NH1-OD2 2.73Å; R299-D334 IonicContact NH2-OD1 3.7Å; R299-D334 PolarHBondContact NH2-OD1 3.21Å; R299-D334 IonicContact NH2-OD2 3.46Å; R299-E337 IonicContact CZ-OE1 3.44Å; R299-E337 IonicContact NE-OE1 3.32Å; R299-E337 PolarHBondContact NE-OE1 3.4Å; R299-E337 IonicContact NH2-OE1 3.9Å
300	T	97	Very high	97.2	Very high	77 Å²	77	49.7 Å²	49.7	47%	0.472	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	126.5	166.4	-58.2	0	0	0	0	108.9	T307	T300-T307 HydrophobicContact CG2-CG2 3.34Å
301	W	97.7	Very high	97.1	Very high	1 Å²	1	54 Å²	54	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	105	-171.4	-161.7	-95.7	0	0	0	112	R299 F308 K310 G408 S409 E468 Y469 N510	R299-W301 PolarHBondContact O-N 3.37Å; W301-F308 HydrophobicContact CB-CB 4.36Å; W301-F308 PolarHBondContact N-O 2.92Å; W301-F308 PolarHBondContact O-N 3.04Å; W301-K310 HydrophobicContact CB-CB 4.13Å; W301-K310 HydrophobicContact CD2-CB 4.31Å; W301-K310 HydrophobicContact CD2-CD 3.86Å; W301-K310 HydrophobicContact CE3-CB 4.29Å; W301-K310 HydrophobicContact CE3-CD 3.71Å; W301-K310 HydrophobicContact CG-CB 4.27Å; W301-K310 HydrophobicContact CH2-CD 3.94Å; W301-K310 HydrophobicContact CZ2-CD 4.14Å; W301-K310 HydrophobicContact CZ3-CD 3.75Å; W301-G408 WeakPolarHBondContact CZ3-O 3.34Å; W301-S409 VanDerWaalsContact CE2-CB 3.47Å; W301-E468 PolarHBondContact NE1-O 3.03Å; W301-E468 VanDerWaalsContact NE1-O 3.1Å; W301-Y469 HydrophobicContact CZ2-CE1 4.22Å; W301-Y469 AromaticContact NE1-CD1 3.82Å; W301-Y469 AromaticContact NE1-CE1 3.9Å; W301-N510 HydrophobicContact CH2-CB 4.35Å; W301-N510 WeakPolarHBondContact CH2-OD1 3.31Å; W301-N510 HydrophobicContact CZ2-CB 3.93Å
302	L	98.5	Very high	97	Very high	24 Å²	24	49 Å²	49	13%	0.126	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	130	-179.4	-175.8	64.6	0	0	0	111.8	S409 L411 E412 L415	L302-S409 VanDerWaalsContact O-CB 3.29Å; L302-S409 WeakPolarHBondContact O-CB 3.38Å; L302-S409 PolarHBondContact O-OG 3.15Å; L302-L411 HydrophobicContact CD2-CG 4.46Å; L302-L411 HydrophobicContact CG-CD2 4.16Å; L302-E412 HydrophobicContact CB-CB 4.08Å; L302-E412 HydrophobicContact CB-CG 4.47Å; L302-E412 HydrophobicContact CD2-CB 4.15Å; L302-E412 HydrophobicContact CD2-CG 4.21Å; L302-L415 HydrophobicContact CD2-CD1 3.77Å
303	S	98.3	Very high	96.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	-178.6	171.2	73.9	0	0	0	0	110.7	F305 G306 F308 S467 G491	S303-F305 VanDerWaalsContact C-N 3.26Å; S303-F305 PolarHBondContact O-N 3.46Å; S303-F305 PolarHBondContact OG-N 3.19Å; S303-F305 VanDerWaalsContact OG-N 3.11Å; S303-G306 PolarHBondContact N-O 3.3Å; S303-G306 PolarHBondContact O-N 3.5Å; S303-G306 PolarHBondContact OG-N 3.35Å; S303-G306 PolarHBondContact OG-O 2.67Å; S303-F308 WeakPolarHBondContact OG-CD2 3.45Å; S303-F308 WeakPolarHBondContact OG-CE2 3.18Å; S303-S467 WeakPolarHBondContact CB-O 3.48Å; S303-S467 PolarHBondContact OG-O 2.81Å; S303-G491 WeakPolarHBondContact O-CA 3.23Å; S303-G491 PolarHBondContact O-N 2.91Å; S303-G491 VanDerWaalsContact O-N 3.12Å
304	A	97.5	Very high	96.8	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-32.7	169.9	0	0	0	0	0	112.3	G306 V470 I473 L493 P498	A304-G306 VanDerWaalsContact C-N 3.35Å; A304-V470 HydrophobicContact CB-CG1 4.02Å; A304-V470 VanDerWaalsContact CB-O 3.28Å; A304-V470 WeakPolarHBondContact CB-O 3.04Å; A304-V470 PolarHBondContact N-O 2.99Å; A304-I473 HydrophobicContact CB-CG2 3.88Å; A304-L493 HydrophobicContact CB-CD2 4.44Å; A304-L493 VanDerWaalsContact O-CD2 3.29Å; A304-L493 WeakPolarHBondContact O-CD2 3.37Å; A304-P498 HydrophobicContact CB-CB 4.41Å
305	F	97.6	Very high	96.9	Very high	81 Å²	81	45.9 Å²	45.9	36%	0.355	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-12	-178.4	-72.6	-75.4	0	0	0	114.3	S303 F308 V470 L493 P498 V500	S303-F305 VanDerWaalsContact C-N 3.26Å; S303-F305 PolarHBondContact O-N 3.46Å; S303-F305 PolarHBondContact OG-N 3.19Å; S303-F305 VanDerWaalsContact OG-N 3.11Å; F305-F308 HydrophobicContact CB-CE2 4.07Å; F305-F308 HydrophobicContact CB-CZ 4.23Å; F305-V470 HydrophobicContact CD2-CB 4.1Å; F305-V470 HydrophobicContact CD2-CG2 4.41Å; F305-V470 HydrophobicContact CE2-CB 3.91Å; F305-V470 HydrophobicContact CE2-CG1 4.08Å; F305-V470 HydrophobicContact CE2-CG2 3.9Å; F305-L493 HydrophobicContact CD1-CD1 3.53Å; F305-L493 HydrophobicContact CE1-CD1 3.75Å; F305-L493 HydrophobicContact CG-CD1 4.43Å; F305-P498 HydrophobicContact CE1-CB 4.16Å; F305-P498 HydrophobicContact CE1-CG 3.69Å; F305-P498 HydrophobicContact CE2-CB 4.12Å; F305-P498 HydrophobicContact CE2-CG 4.43Å; F305-P498 HydrophobicContact CZ-CB 3.75Å; F305-P498 HydrophobicContact CZ-CG 3.58Å; F305-V500 HydrophobicContact CE2-CG1 3.96Å; F305-V500 HydrophobicContact CZ-CG1 3.67Å
306	G	97.7	Very high	97	Very high	12 Å²	12	41.6 Å²	41.6	12%	0.124	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.5	-163.1	-175.6	0	0	0	0	0	111.7	S303 A304 F308	S303-G306 PolarHBondContact N-O 3.3Å; S303-G306 PolarHBondContact O-N 3.5Å; S303-G306 PolarHBondContact OG-N 3.35Å; S303-G306 PolarHBondContact OG-O 2.67Å; A304-G306 VanDerWaalsContact C-N 3.35Å; G306-F308 WeakPolarHBondContact O-CD2 3.23Å
307	T	98.2	Very high	97.1	Very high	90 Å²	90	37.7 Å²	37.7	55%	0.552	20%	0.198	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	128.4	-177.4	-56.5	0	0	0	0	110.9	T300	T300-T307 HydrophobicContact CG2-CG2 3.34Å
308	F	97.7	Very high	97.2	Very high	68 Å²	68	40.6 Å²	40.6	30%	0.298	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	169.7	178.1	-68.6	-102.6	0	0	0	110.4	W301 S303 F305 G306 E468	W301-F308 HydrophobicContact CB-CB 4.36Å; W301-F308 PolarHBondContact N-O 2.92Å; W301-F308 PolarHBondContact O-N 3.04Å; S303-F308 WeakPolarHBondContact OG-CD2 3.45Å; S303-F308 WeakPolarHBondContact OG-CE2 3.18Å; F305-F308 HydrophobicContact CB-CE2 4.07Å; F305-F308 HydrophobicContact CB-CZ 4.23Å; G306-F308 WeakPolarHBondContact O-CD2 3.23Å; F308-E468 HydrophobicContact CB-CB 4.21Å; F308-E468 HydrophobicContact CD1-CB 4.09Å; F308-E468 HydrophobicContact CD2-CB 4.27Å; F308-E468 HydrophobicContact CG-CB 3.92Å
309	Q	96.3	Very high	97.3	Very high	123 Å²	123	35.6 Å²	35.6	58%	0.575	19%	0.191	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	115.2	168.1	-65.2	-64.3	-30.4	0	0	108.1	R299	R299-Q309 WeakPolarHBondContact O-CA 3.47Å
310	K	94.1	Very high	97.4	Very high	17 Å²	17	34.8 Å²	34.8	7%	0.074	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	127	174.8	-175.6	-179.6	-169.8	-83.6	0	108.6	R299 W301 A312 D340 E352 Y469 N510	R299-K310 HydrophobicContact CB-CB 4.46Å; R299-K310 PolarHBondContact N-O 2.67Å; R299-K310 PolarHBondContact O-N 3.48Å; W301-K310 HydrophobicContact CB-CB 4.13Å; W301-K310 HydrophobicContact CD2-CB 4.31Å; W301-K310 HydrophobicContact CD2-CD 3.86Å; W301-K310 HydrophobicContact CE3-CB 4.29Å; W301-K310 HydrophobicContact CE3-CD 3.71Å; W301-K310 HydrophobicContact CG-CB 4.27Å; W301-K310 HydrophobicContact CH2-CD 3.94Å; W301-K310 HydrophobicContact CZ2-CD 4.14Å; W301-K310 HydrophobicContact CZ3-CD 3.75Å; K310-A312 PolarHBondContact O-N 2.94Å; K310-D340 WeakPolarHBondContact CE-OD2 3.46Å; K310-D340 IonicContact NZ-OD1 3.06Å; K310-D340 PolarHBondContact NZ-OD1 3.16Å; K310-D340 IonicContact NZ-OD2 3.53Å; K310-D340 PolarHBondContact NZ-OD2 3.36Å; K310-E352 IonicContact NZ-OE2 2.73Å; K310-Y469 WeakPolarHBondContact CE-OH 2.99Å; K310-N510 PolarHBondContact NZ-ND2 3.34Å
311	L	94.4	Very high	97.5	Very high	101 Å²	101	31.7 Å²	31.7	53%	0.529	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	127	169	-72.7	169.8	0	0	0	108.4	T296 N298	T296-L311 HydrophobicContact CG2-CB 4.5Å; T296-L311 HydrophobicContact CG2-CD2 4.01Å; N298-L311 WeakPolarHBondContact OD1-CD2 3.36Å
312	A	95.3	Very high	97.5	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.008	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.2	176.8	0	0	0	0	0	110.3	T296 V297 R299 K310 I314 E337	T296-A312 CarbonylContact C-O 3.6Å; T296-A312 WeakPolarHBondContact CA-O 3.38Å; V297-A312 HydrophobicContact CG2-CB 4.23Å; V297-A312 PolarHBondContact N-O 3.33Å; V297-A312 PolarHBondContact O-N 3.43Å; R299-A312 HydrophobicContact CG-CB 3.67Å; K310-A312 PolarHBondContact O-N 2.94Å; A312-I314 HydrophobicContact CB-CG2 4.42Å; A312-E337 HydrophobicContact CB-CG 4.15Å
313	H	95.6	Very high	97.5	Very high	20 Å²	20	37.8 Å²	37.8	9%	0.093	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	113.2	173.2	-62.7	-73.9	0	0	0	109.3	V294 R295 T296 E337 L338 Y347 L348	V294-H313 HydrophobicContact CG1-CB 4.2Å; R295-H313 CarbonylContact O-C 3.47Å; R295-H313 WeakPolarHBondContact O-CA 3.39Å; T296-H313 PolarHBondContact OG1-CE1 2.73Å; T296-H313 PolarHBondContact OG1-ND1 3.31Å; H313-E337 WeakPolarHBondContact O-CA 3.43Å; H313-L338 PolarHBondContact O-N 3.26Å; H313-Y347 AromaticContact NE2-CZ 3.78Å; H313-Y347 PolarHBondContact NE2-OH 3.26Å; H313-L348 HydrophobicContact CB-CD2 3.25Å
314	I	98.2	Very high	97.5	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	133	-171.3	56.7	164.4	0	0	0	111.5	V294 R295 V297 A312 V316 D334 V336 E337	V294-I314 CarbonylContact C-O 3.49Å; V294-I314 WeakPolarHBondContact CA-O 3.46Å; R295-I314 HydrophobicContact CB-CG1 4.14Å; R295-I314 PolarHBondContact N-O 3.14Å; R295-I314 WeakPolarHBondContact O-CG1 3.36Å; R295-I314 PolarHBondContact O-N 2.66Å; V297-I314 HydrophobicContact CB-CD1 4.41Å; V297-I314 HydrophobicContact CG1-CD1 3.62Å; V297-I314 HydrophobicContact CG1-CG1 4.05Å; V297-I314 HydrophobicContact CG2-CD1 3.87Å; V297-I314 HydrophobicContact CG2-CG1 4.03Å; V297-I314 HydrophobicContact CG2-CG2 3.99Å; A312-I314 HydrophobicContact CB-CG2 4.42Å; I314-V316 HydrophobicContact CD1-CG1 3.79Å; I314-V316 HydrophobicContact CG1-CG1 3.88Å; I314-V316 PolarHBondContact O-N 3.49Å; I314-D334 HydrophobicContact CD1-CB 4.34Å; I314-V336 CarbonylContact C-O 3.51Å; I314-V336 VanDerWaalsContact CA-O 3.3Å; I314-V336 WeakPolarHBondContact CA-O 3.46Å; I314-E337 HydrophobicContact CG2-CG 3.8Å
315	V	98.6	Very high	97.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	119.4	167	177.7	0	0	0	0	108.5	V293 V294 L317 V320 G335 V336 L338 W351 M378	V293-V315 WeakPolarHBondContact O-CA 3.03Å; V294-V315 HydrophobicContact CG2-CG2 3.85Å; V315-L317 HydrophobicContact CG1-CB 3.97Å; V315-L317 HydrophobicContact CG1-CD1 3.59Å; V315-L317 HydrophobicContact CG1-CG 3.7Å; V315-V320 HydrophobicContact CB-CG1 4.3Å; V315-V320 HydrophobicContact CG1-CB 4.19Å; V315-V320 HydrophobicContact CG1-CG1 3.93Å; V315-V320 HydrophobicContact CG1-CG2 4.1Å; V315-G335 CarbonylContact O-C 3.54Å; V315-G335 WeakPolarHBondContact O-CA 3.33Å; V315-V336 PolarHBondContact N-O 2.95Å; V315-V336 PolarHBondContact O-N 3.46Å; V315-V336 VanDerWaalsContact O-N 3.08Å; V315-L338 HydrophobicContact CG2-CD1 3.87Å; V315-L338 HydrophobicContact CG2-CD2 3.8Å; V315-L338 HydrophobicContact CG2-CG 3.8Å; V315-W351 HydrophobicContact CB-CH2 4.1Å; V315-W351 HydrophobicContact CB-CZ3 4.01Å; V315-W351 HydrophobicContact CG1-CH2 4.41Å; V315-W351 HydrophobicContact CG2-CH2 3.84Å; V315-W351 HydrophobicContact CG2-CZ3 3.58Å; V315-M378 HydrophobicContact CG1-CE 4.44Å; V315-M378 HydrophobicContact CG1-SD 3.88Å; V315-M378 HydrophobicContact CG2-CE 4.06Å; V315-M378 HydrophobicContact CG2-SD 4.44Å
316	V	98.5	Very high	97.6	Very high	20 Å²	20	43.6 Å²	43.6	12%	0.121	23%	0.227	C	C	.	.			trans	-106.7	14	-175.8	-58.5	0	0	0	0	113	D291 V293 R295 I314	D291-V316 VanDerWaalsContact O-CG2 3.28Å; D291-V316 WeakPolarHBondContact O-CG2 3.43Å; V293-V316 PolarHBondContact O-N 3.2Å; R295-V316 HydrophobicContact CB-CG1 4.16Å; R295-V316 HydrophobicContact CG-CG1 3.96Å; R295-V316 HydrophobicContact CG-CG2 4.17Å; I314-V316 HydrophobicContact CD1-CG1 3.79Å; I314-V316 HydrophobicContact CG1-CG1 3.88Å; I314-V316 PolarHBondContact O-N 3.49Å
317	L	98.6	Very high	97.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.223	C	C	.	.			trans	-62.2	142	-177.3	-63.9	166.8	0	0	0	111.5	Y256 L264 V293 V315 T319 V320 V321 M378 D381	Y256-L317 HydrophobicContact CD2-CD1 3.74Å; Y256-L317 HydrophobicContact CD2-CD2 4.34Å; Y256-L317 HydrophobicContact CE2-CD1 3.74Å; L264-L317 HydrophobicContact CD1-CD2 3.36Å; V293-L317 HydrophobicContact CB-CD2 4.42Å; V293-L317 HydrophobicContact CG1-CD1 4.48Å; V293-L317 HydrophobicContact CG1-CD2 4.24Å; V293-L317 HydrophobicContact CG2-CD2 4.39Å; V315-L317 HydrophobicContact CG1-CB 3.97Å; V315-L317 HydrophobicContact CG1-CD1 3.59Å; V315-L317 HydrophobicContact CG1-CG 3.7Å; L317-T319 PolarHBondContact O-N 3.1Å; L317-V320 HydrophobicContact CB-CB 4.17Å; L317-V320 HydrophobicContact CB-CG2 4.11Å; L317-V320 PolarHBondContact O-N 3.19Å; L317-V321 WeakPolarHBondContact O-CG2 3.42Å; L317-V321 PolarHBondContact O-N 3.25Å; L317-M378 HydrophobicContact CD1-SD 3.53Å; L317-M378 VanDerWaalsContact CD1-SD 3.53Å; L317-D381 VanDerWaalsContact C-OD2 3.31Å; L317-D381 HydrophobicContact CB-CB 3.68Å; L317-D381 WeakPolarHBondContact CB-OD2 3.13Å; L317-D381 HydrophobicContact CD1-CB 3.77Å; L317-D381 HydrophobicContact CD2-CB 4.37Å; L317-D381 HydrophobicContact CG-CB 4.15Å
318	P	98.3	Very high	97.7	Very high	92 Å²	92	39.2 Å²	39.2	60%	0.597	20%	0.197	S	C	*	.	H	α-helix	trans	-63	-40.5	-165.8	-25.9	35.2	0	0	0	115.8	R322	P318-R322 VanDerWaalsContact O-CB 3.24Å; P318-R322 WeakPolarHBondContact O-CB 3.48Å; P318-R322 PolarHBondContact O-N 2.96Å
319	T	98.5	Very high	97.7	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-73.6	-41.3	177.7	-51.3	0	0	0	0	110.2	K259 L317 V321 R322 I323 A377 E380 D381 Y389	K259-T319 PolarHBondContact NZ-OG1 3.35Å; L317-T319 PolarHBondContact O-N 3.1Å; T319-V321 PolarHBondContact O-N 3.09Å; T319-R322 PolarHBondContact O-N 3.44Å; T319-I323 HydrophobicContact CG2-CG1 4.11Å; T319-I323 WeakPolarHBondContact O-CB 3.36Å; T319-I323 VanDerWaalsContact O-CG1 3.28Å; T319-I323 WeakPolarHBondContact O-CG1 3.29Å; T319-I323 PolarHBondContact O-N 3.27Å; T319-A377 HydrophobicContact CG2-CB 3.91Å; T319-E380 HydrophobicContact CG2-CB 4.36Å; T319-E380 HydrophobicContact CG2-CG 4.32Å; T319-D381 WeakPolarHBondContact CA-OD2 3.5Å; T319-D381 WeakPolarHBondContact CB-OD1 3.38Å; T319-D381 WeakPolarHBondContact CB-OD2 3.11Å; T319-D381 PolarHBondContact N-OD1 3.33Å; T319-D381 PolarHBondContact N-OD2 3.24Å; T319-D381 PolarHBondContact OG1-OD1 2.9Å; T319-Y389 VanDerWaalsContact CG2-OH 3.3Å; T319-Y389 WeakPolarHBondContact CG2-OH 3.36Å
320	V	98.7	Very high	97.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-54.2	-53.9	172.9	170.7	0	0	0	0	110.6	V315 L317 R322 I323 A324 V336 W351 I374 A377 M378 D381	V315-V320 HydrophobicContact CB-CG1 4.3Å; V315-V320 HydrophobicContact CG1-CB 4.19Å; V315-V320 HydrophobicContact CG1-CG1 3.93Å; V315-V320 HydrophobicContact CG1-CG2 4.1Å; L317-V320 HydrophobicContact CB-CB 4.17Å; L317-V320 HydrophobicContact CB-CG2 4.11Å; L317-V320 PolarHBondContact O-N 3.19Å; V320-R322 PolarHBondContact O-N 2.88Å; V320-I323 PolarHBondContact O-N 3.42Å; V320-A324 WeakPolarHBondContact O-CB 3.44Å; V320-A324 PolarHBondContact O-N 2.75Å; V320-V336 HydrophobicContact CG1-CB 4.17Å; V320-V336 HydrophobicContact CG1-CG2 3.7Å; V320-W351 HydrophobicContact CG1-CH2 4.35Å; V320-I374 HydrophobicContact CG1-CG2 4.35Å; V320-A377 HydrophobicContact CG2-CB 4.11Å; V320-M378 HydrophobicContact CG2-CB 4.03Å; V320-M378 HydrophobicContact CG2-SD 4.34Å; V320-D381 PolarHBondContact N-OD2 3.42Å
321	V	98.8	Very high	98	Very high	13 Å²	13	39.2 Å²	39.2	8%	0.079	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-46.3	179.6	175.1	0	0	0	0	111.3	L317 T319 I323 A324 R325	L317-V321 WeakPolarHBondContact O-CG2 3.42Å; L317-V321 PolarHBondContact O-N 3.25Å; T319-V321 PolarHBondContact O-N 3.09Å; V321-I323 PolarHBondContact O-N 3.37Å; V321-A324 PolarHBondContact O-N 3.05Å; V321-R325 HydrophobicContact CG1-CG 4.25Å; V321-R325 VanDerWaalsContact CG1-CZ 3.46Å; V321-R325 WeakPolarHBondContact O-CB 3.31Å; V321-R325 WeakPolarHBondContact O-CG 3.28Å; V321-R325 PolarHBondContact O-N 3.37Å
322	R	98.6	Very high	98.2	Very high	128 Å²	128	38.9 Å²	38.9	48%	0.483	22%	0.216	S	C	.	.	H	α-helix	trans	-59.5	-46.9	179.4	179.7	-176.8	58.5	75.1	1.3	112.1	P318 T319 V320 S326	P318-R322 VanDerWaalsContact O-CB 3.24Å; P318-R322 WeakPolarHBondContact O-CB 3.48Å; P318-R322 PolarHBondContact O-N 2.96Å; T319-R322 PolarHBondContact O-N 3.44Å; V320-R322 PolarHBondContact O-N 2.88Å; R322-S326 PolarHBondContact O-N 3.46Å
323	I	98.6	Very high	98.3	Very high	25 Å²	25	39 Å²	39	13%	0.128	22%	0.217	C	C	.	.	H	α-helix	trans	-68.9	-43.9	-179.9	-68.9	-68.4	0	0	0	110.4	T319 V320 V321 R325 S326 F327 P373 I374 A377 Y389	T319-I323 HydrophobicContact CG2-CG1 4.11Å; T319-I323 WeakPolarHBondContact O-CB 3.36Å; T319-I323 VanDerWaalsContact O-CG1 3.28Å; T319-I323 WeakPolarHBondContact O-CG1 3.29Å; T319-I323 PolarHBondContact O-N 3.27Å; V320-I323 PolarHBondContact O-N 3.42Å; V321-I323 PolarHBondContact O-N 3.37Å; I323-R325 PolarHBondContact O-N 3.12Å; I323-S326 PolarHBondContact O-N 3.03Å; I323-F327 VanDerWaalsContact O-CB 3.25Å; I323-F327 WeakPolarHBondContact O-CB 2.87Å; I323-F327 PolarHBondContact O-N 2.92Å; I323-P373 HydrophobicContact CG2-CB 3.76Å; I323-P373 HydrophobicContact CG2-CG 4.3Å; I323-I374 HydrophobicContact CG2-CG1 4.31Å; I323-A377 HydrophobicContact CB-CB 3.99Å; I323-A377 HydrophobicContact CG1-CB 3.93Å; I323-A377 HydrophobicContact CG2-CB 4.29Å; I323-Y389 HydrophobicContact CD1-CE1 4.09Å; I323-Y389 HydrophobicContact CG1-CE1 4.18Å
324	A	98.7	Very high	98.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.3	-43.5	178.6	0	0	0	0	0	112.5	V320 V321 S326 F327 Y328 L333 V336 I374	V320-A324 WeakPolarHBondContact O-CB 3.44Å; V320-A324 PolarHBondContact O-N 2.75Å; V321-A324 PolarHBondContact O-N 3.05Å; A324-S326 VanDerWaalsContact C-N 3.3Å; A324-S326 PolarHBondContact O-N 2.75Å; A324-F327 PolarHBondContact O-N 2.82Å; A324-Y328 HydrophobicContact CB-CD2 4.13Å; A324-Y328 HydrophobicContact CB-CE2 4.19Å; A324-Y328 WeakPolarHBondContact O-CB 3.29Å; A324-Y328 VanDerWaalsContact O-CD2 3.25Å; A324-Y328 WeakPolarHBondContact O-CD2 3.38Å; A324-Y328 PolarHBondContact O-N 3.06Å; A324-L333 HydrophobicContact CB-CD2 3.69Å; A324-V336 HydrophobicContact CB-CG2 3.39Å; A324-I374 HydrophobicContact CB-CD1 3.89Å; A324-I374 HydrophobicContact CB-CG1 4.14Å
325	R	98.7	Very high	98.4	Very high	101 Å²	101	41 Å²	41	38%	0.381	23%	0.229	S	C	.	.	H	α-helix	trans	-55.1	-46.4	174.6	-74.6	174.5	174.7	171.7	-0.5	111.8	V321 I323 N329 C330 P331 L333	V321-R325 HydrophobicContact CG1-CG 4.25Å; V321-R325 VanDerWaalsContact CG1-CZ 3.46Å; V321-R325 WeakPolarHBondContact O-CB 3.31Å; V321-R325 WeakPolarHBondContact O-CG 3.28Å; V321-R325 PolarHBondContact O-N 3.37Å; I323-R325 PolarHBondContact O-N 3.12Å; R325-N329 VanDerWaalsContact O-CA 3.32Å; R325-N329 WeakPolarHBondContact O-CA 3.31Å; R325-N329 PolarHBondContact O-N 3.08Å; R325-C330 WeakPolarHBondContact CA-O 3.43Å; R325-C330 WeakPolarHBondContact CB-O 2.92Å; R325-C330 VanDerWaalsContact CG-O 3.28Å; R325-C330 WeakPolarHBondContact CG-O 2.97Å; R325-C330 PolarHBondContact O-N 2.89Å; R325-P331 WeakPolarHBondContact CD-O 3.44Å; R325-P331 PolarHBondContact NE-O 3.46Å; R325-P331 VanDerWaalsContact NE-O 3.1Å; R325-L333 HydrophobicContact CG-CB 3.88Å; R325-L333 PolarHBondContact NE-O 2.03Å; R325-L333 PolarHBondContact NH2-O 3.32Å
326	S	98.4	Very high	98.4	Very high	101 Å²	101	41.1 Å²	41.1	71%	0.706	23%	0.229	S	C	*	.	H	α-helix	trans	-69.3	-40.7	177.3	-173.6	0	0	0	0	112.3	R322 I323 A324	R322-S326 PolarHBondContact O-N 3.46Å; I323-S326 PolarHBondContact O-N 3.03Å; A324-S326 VanDerWaalsContact C-N 3.3Å; A324-S326 PolarHBondContact O-N 2.75Å
327	F	98.1	Very high	98.4	Very high	8 Å²	8	40.3 Å²	40.3	4%	0.035	22%	0.224	C	C	.	.	H	α-helix	trans	-67	-50.7	-177	173.2	-105.8	0	0	0	111.4	I323 A324 N329 P373 I374 F395 R399 G400	I323-F327 VanDerWaalsContact O-CB 3.25Å; I323-F327 WeakPolarHBondContact O-CB 2.87Å; I323-F327 PolarHBondContact O-N 2.92Å; A324-F327 PolarHBondContact O-N 2.82Å; F327-N329 VanDerWaalsContact C-N 3.3Å; F327-N329 PolarHBondContact O-N 2.9Å; F327-P373 HydrophobicContact CD2-CG 3.77Å; F327-P373 HydrophobicContact CE2-CG 4.27Å; F327-P373 HydrophobicContact CG-CG 4.23Å; F327-I374 HydrophobicContact CD1-CD1 3.72Å; F327-I374 HydrophobicContact CE1-CD1 4.3Å; F327-I374 HydrophobicContact CG-CD1 4.39Å; F327-F395 HydrophobicContact CE1-CD1 4.44Å; F327-F395 HydrophobicContact CE1-CE1 4.39Å; F327-F395 AromaticContact CE2-CD1 3.84Å; F327-F395 HydrophobicContact CE2-CD1 3.84Å; F327-F395 AromaticContact CZ-CD1 3.5Å; F327-F395 HydrophobicContact CZ-CD1 3.5Å; F327-F395 VanDerWaalsContact CZ-CD1 3.5Å; F327-F395 AromaticContact CZ-CE1 3.78Å; F327-F395 HydrophobicContact CZ-CE1 3.78Å; F327-R399 HydrophobicContact CD2-CB 4.36Å; F327-R399 HydrophobicContact CE2-CB 3.79Å; F327-R399 HydrophobicContact CE2-CG 4.33Å; F327-R399 HydrophobicContact CZ-CB 4.16Å; F327-R399 CarbonylContact O-C 3.58Å; F327-R399 WeakPolarHBondContact O-CA 3.41Å; F327-G400 PolarHBondContact O-N 3.03Å
328	Y	98.3	Very high	98.3	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-76.7	-15.3	178.2	-67.3	-65.6	0	0	0	113.1	A324 L333 L355 I374 G398 G400 R401 G402 F405 A406	A324-Y328 HydrophobicContact CB-CD2 4.13Å; A324-Y328 HydrophobicContact CB-CE2 4.19Å; A324-Y328 WeakPolarHBondContact O-CB 3.29Å; A324-Y328 VanDerWaalsContact O-CD2 3.25Å; A324-Y328 WeakPolarHBondContact O-CD2 3.38Å; A324-Y328 PolarHBondContact O-N 3.06Å; Y328-L333 HydrophobicContact CD2-CD2 3.76Å; Y328-L333 HydrophobicContact CE2-CD2 4.31Å; Y328-L355 PolarHBondContact OH-O 2.71Å; Y328-L355 VanDerWaalsContact OH-O 3.1Å; Y328-I374 HydrophobicContact CD2-CD1 4.34Å; Y328-I374 HydrophobicContact CE2-CD1 3.49Å; Y328-I374 VanDerWaalsContact CE2-CD1 3.49Å; Y328-G398 WeakPolarHBondContact CD1-O 3.46Å; Y328-G400 CarbonylContact O-C 3.5Å; Y328-G400 VanDerWaalsContact O-C 3.25Å; Y328-G400 WeakPolarHBondContact O-CA 3.49Å; Y328-R401 PolarHBondContact O-N 2.99Å; Y328-R401 VanDerWaalsContact O-N 3.09Å; Y328-G402 WeakPolarHBondContact O-CA 3.25Å; Y328-G402 PolarHBondContact O-N 2.62Å; Y328-F405 AromaticContact CD1-CD1 3.97Å; Y328-F405 HydrophobicContact CD1-CD1 3.97Å; Y328-F405 HydrophobicContact CD1-CE1 4.33Å; Y328-F405 AromaticContact CE1-CD1 3.93Å; Y328-F405 HydrophobicContact CE1-CD1 3.93Å; Y328-F405 AromaticContact CE1-CE1 3.88Å; Y328-F405 HydrophobicContact CE1-CE1 3.88Å; Y328-A406 HydrophobicContact CD1-CB 4.41Å; Y328-A406 HydrophobicContact CD2-CB 4.22Å; Y328-A406 HydrophobicContact CG-CB 4.1Å
329	N	98	Very high	98	Very high	108 Å²	108	36 Å²	36	58%	0.578	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	47.8	-165.5	-170.2	36	0	0	0	112	R325 F327	R325-N329 VanDerWaalsContact O-CA 3.32Å; R325-N329 WeakPolarHBondContact O-CA 3.31Å; R325-N329 PolarHBondContact O-N 3.08Å; F327-N329 VanDerWaalsContact C-N 3.3Å; F327-N329 PolarHBondContact O-N 2.9Å
330	C	98.5	Very high	97.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.203	C	C	.	.			trans	-128.2	90.7	176.6	178.1	0	0	0	0	110.5	R325 S332 L333 C403	R325-C330 WeakPolarHBondContact CA-O 3.43Å; R325-C330 WeakPolarHBondContact CB-O 2.92Å; R325-C330 VanDerWaalsContact CG-O 3.28Å; R325-C330 WeakPolarHBondContact CG-O 2.97Å; R325-C330 PolarHBondContact O-N 2.89Å; C330-S332 VanDerWaalsContact C-N 3.26Å; C330-S332 PolarHBondContact O-N 3.19Å; C330-L333 HydrophobicContact CB-CB 4.22Å; C330-L333 WeakPolarHBondContact O-CB 3.14Å; C330-L333 PolarHBondContact O-N 3.47Å; C330-C403 WeakPolarHBondContact CA-SG 3.41Å; C330-C403 HydrophobicContact CB-CB 3.96Å; C330-C403 WeakPolarHBondContact CB-SG 3.14Å; C330-C403 WeakPolarHBondContact SG-CA 3.35Å; C330-C403 WeakPolarHBondContact SG-CB 3.46Å; C330-C403 CovalentContact SG-SG 2.04Å; C330-C403 PolarHBondContact SG-SG 2.67Å
331	P	98.4	Very high	96.5	Very high	101 Å²	101	39.5 Å²	39.5	66%	0.656	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-27.7	-176.7	-26.1	35.7	0	0	0	115	R325 L333	R325-P331 WeakPolarHBondContact CD-O 3.44Å; R325-P331 PolarHBondContact NE-O 3.46Å; R325-P331 VanDerWaalsContact NE-O 3.1Å; P331-L333 VanDerWaalsContact C-N 3.34Å
332	S	98	Very high	95.2	Very high	93 Å²	93	42.2 Å²	42.2	65%	0.65	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-3.4	-179.7	53.5	0	0	0	0	114.2	C330 D334 C403	C330-S332 VanDerWaalsContact C-N 3.26Å; C330-S332 PolarHBondContact O-N 3.19Å; S332-D334 PolarHBondContact O-N 2.86Å; S332-C403 PolarHBondContact OG-SG 2.85Å; S332-C403 VanDerWaalsContact OG-SG 3.34Å
333	L	98.6	Very high	93.6	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.016	22%	0.216	C	C	.	.			trans	-56.4	130.5	-177.6	-171.7	63.3	0	0	0	111	A324 R325 Y328 C330 P331 G335 A406 T407	A324-L333 HydrophobicContact CB-CD2 3.69Å; R325-L333 HydrophobicContact CG-CB 3.88Å; R325-L333 PolarHBondContact NE-O 2.03Å; R325-L333 PolarHBondContact NH2-O 3.32Å; Y328-L333 HydrophobicContact CD2-CD2 3.76Å; Y328-L333 HydrophobicContact CE2-CD2 4.31Å; C330-L333 HydrophobicContact CB-CB 4.22Å; C330-L333 WeakPolarHBondContact O-CB 3.14Å; C330-L333 PolarHBondContact O-N 3.47Å; P331-L333 VanDerWaalsContact C-N 3.34Å; L333-G335 WeakPolarHBondContact CD1-O 3.25Å; L333-G335 WeakPolarHBondContact CG-O 3.48Å; L333-A406 HydrophobicContact CD1-CB 3.83Å; L333-A406 HydrophobicContact CD2-CB 4.41Å; L333-T407 HydrophobicContact CD1-CG2 3.62Å
334	D	97.9	Very high	91.7	Very high	65 Å²	65	37.1 Å²	37.1	35%	0.348	22%	0.218	S	C	.	.			trans	-98.4	-15.3	-174	55.7	-7.6	0	0	0	113.7	R299 I314 S332	R299-D334 IonicContact CZ-OD1 3.62Å; R299-D334 VanDerWaalsContact CZ-OD1 3.27Å; R299-D334 IonicContact CZ-OD2 2.97Å; R299-D334 VanDerWaalsContact NH1-CG 3.3Å; R299-D334 IonicContact NH1-OD1 3.3Å; R299-D334 PolarHBondContact NH1-OD1 2.87Å; R299-D334 IonicContact NH1-OD2 3.16Å; R299-D334 PolarHBondContact NH1-OD2 2.73Å; R299-D334 IonicContact NH2-OD1 3.7Å; R299-D334 PolarHBondContact NH2-OD1 3.21Å; R299-D334 IonicContact NH2-OD2 3.46Å; I314-D334 HydrophobicContact CD1-CB 4.34Å; S332-D334 PolarHBondContact O-N 2.86Å
335	G	98.4	Very high	89.9	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.01	22%	0.22	C	C	.	.			trans	176	179	178.4	0	0	0	0	0	112	V315 L333	V315-G335 CarbonylContact O-C 3.54Å; V315-G335 WeakPolarHBondContact O-CA 3.33Å; L333-G335 WeakPolarHBondContact CD1-O 3.25Å; L333-G335 WeakPolarHBondContact CG-O 3.48Å
336	V	98.5	Very high	88.6	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	131.5	174.9	-176.9	0	0	0	0	109.6	I314 V315 V320 A324 W351 L356 I374	I314-V336 CarbonylContact C-O 3.51Å; I314-V336 VanDerWaalsContact CA-O 3.3Å; I314-V336 WeakPolarHBondContact CA-O 3.46Å; V315-V336 PolarHBondContact N-O 2.95Å; V315-V336 PolarHBondContact O-N 3.46Å; V315-V336 VanDerWaalsContact O-N 3.08Å; V320-V336 HydrophobicContact CG1-CB 4.17Å; V320-V336 HydrophobicContact CG1-CG2 3.7Å; A324-V336 HydrophobicContact CB-CG2 3.39Å; V336-W351 HydrophobicContact CB-CE3 4.39Å; V336-W351 HydrophobicContact CB-CH2 4.44Å; V336-W351 HydrophobicContact CB-CZ3 3.9Å; V336-W351 HydrophobicContact CG1-CD2 4.46Å; V336-W351 HydrophobicContact CG1-CE3 3.76Å; V336-W351 HydrophobicContact CG1-CH2 4.47Å; V336-W351 HydrophobicContact CG1-CZ3 3.78Å; V336-L356 HydrophobicContact CG1-CD1 4.32Å; V336-I374 HydrophobicContact CB-CG2 4.42Å; V336-I374 HydrophobicContact CG1-CG2 4.12Å; V336-I374 HydrophobicContact CG2-CD1 4.38Å; V336-I374 HydrophobicContact CG2-CG2 4.05Å
337	E	97.7	Very high	87.8	Confident	3 Å²	3	28.9 Å²	28.9	1%	0.014	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	132	-175.4	-58.9	178.6	178.1	0	0	111.5	R299 A312 H313 I314 E352 R354 L355	R299-E337 IonicContact CZ-OE1 3.44Å; R299-E337 IonicContact NE-OE1 3.32Å; R299-E337 PolarHBondContact NE-OE1 3.4Å; R299-E337 IonicContact NH2-OE1 3.9Å; A312-E337 HydrophobicContact CB-CG 4.15Å; H313-E337 WeakPolarHBondContact O-CA 3.43Å; I314-E337 HydrophobicContact CG2-CG 3.8Å; E337-E352 HydrophobicContact CB-CB 3.82Å; E337-E352 HydrophobicContact CB-CG 4.29Å; E337-E352 WeakPolarHBondContact O-CB 3.27Å; E337-E352 PolarHBondContact O-N 3.42Å; E337-E352 VanDerWaalsContact O-N 3.08Å; E337-R354 IonicContact OE2-NH2 3.65Å; E337-R354 PolarHBondContact OE2-NH2 2.96Å; E337-L355 HydrophobicContact CB-CD1 3.81Å; E337-L355 HydrophobicContact CG-CD1 3.98Å
338	L	96.5	Very high	87.4	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-88	156	165.3	-64.4	169.4	0	0	0	109.4	F248 F253 V294 H313 V315 D340 L348 H350 W351	F248-L338 HydrophobicContact CE2-CD2 4.31Å; F248-L338 HydrophobicContact CZ-CD2 4.23Å; F253-L338 HydrophobicContact CE2-CD1 3.73Å; F253-L338 HydrophobicContact CZ-CD1 4.11Å; V294-L338 HydrophobicContact CG1-CD1 4.23Å; V294-L338 HydrophobicContact CG2-CD1 3.74Å; H313-L338 PolarHBondContact O-N 3.26Å; V315-L338 HydrophobicContact CG2-CD1 3.87Å; V315-L338 HydrophobicContact CG2-CD2 3.8Å; V315-L338 HydrophobicContact CG2-CG 3.8Å; L338-D340 PolarHBondContact O-N 2.96Å; L338-L348 HydrophobicContact CB-CD2 4.08Å; L338-L348 HydrophobicContact CD1-CB 4.4Å; L338-L348 HydrophobicContact CD1-CD2 4.07Å; L338-H350 WeakPolarHBondContact CA-O 3.27Å; L338-H350 WeakPolarHBondContact CD2-O 3.25Å; L338-W351 HydrophobicContact CD2-CE3 3.7Å; L338-W351 HydrophobicContact CD2-CZ3 3.72Å; L338-W351 HydrophobicContact CG-CZ3 4.47Å
339	E	93.1	Very high	87	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.005	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-59	128.3	178.3	-175.2	46	-123.5	0	0	112	E341 V346 L348 H350 L508	E339-E341 WeakPolarHBondContact OE1-CA 3.31Å; E339-E341 WeakPolarHBondContact OE1-CB 3.49Å; E339-E341 PolarHBondContact OE1-N 3.31Å; E339-V346 HydrophobicContact CG-CG1 3.75Å; E339-L348 PolarHBondContact O-N 2.94Å; E339-H350 HydrophobicContact CB-CB 4.23Å; E339-H350 PolarHBondContact N-O 3.32Å; E339-L508 HydrophobicContact CG-CD2 4.04Å
340	D	87.2	Confident	86.8	Confident	26 Å²	26	23.4 Å²	23.4	14%	0.139	14%	0.144	C	C	.	.			trans	-116.5	-9.5	-176	67.4	-34.7	0	0	0	114.7	K310 L338 Y347	K310-D340 WeakPolarHBondContact CE-OD2 3.46Å; K310-D340 IonicContact NZ-OD1 3.06Å; K310-D340 PolarHBondContact NZ-OD1 3.16Å; K310-D340 IonicContact NZ-OD2 3.53Å; K310-D340 PolarHBondContact NZ-OD2 3.36Å; L338-D340 PolarHBondContact O-N 2.96Å; D340-Y347 HydrophobicContact CB-CE2 4.41Å; D340-Y347 WeakPolarHBondContact O-CD2 3.08Å
341	E	77.2	Confident	86.8	Confident	48 Å²	48	23.4 Å²	23.4	22%	0.224	14%	0.144	C	C	.	.	S	Bend	trans	-87.3	168.7	174.3	-60.8	-72.8	169.5	0	0	112.5	E339 Y469 L508	E339-E341 WeakPolarHBondContact OE1-CA 3.31Å; E339-E341 WeakPolarHBondContact OE1-CB 3.49Å; E339-E341 PolarHBondContact OE1-N 3.31Å; E341-Y469 VanDerWaalsContact OE1-CE2 3.29Å; E341-Y469 WeakPolarHBondContact OE1-CE2 3.29Å; E341-Y469 VanDerWaalsContact OE1-CZ 3.31Å; E341-Y469 PolarHBondContact OE1-OH 2.96Å; E341-L508 HydrophobicContact CB-CD2 4.08Å
342	D	70.8	Confident	86.7	Confident	70 Å²	70	18.6 Å²	18.6	37%	0.374	11%	0.113	S	C	.	.	S	Bend	trans	65.2	-165.4	179.6	-145.1	-35.8	0	0	0	114.8	M30 K282 V346 L508	M30-D342 HydrophobicContact CE-CB 4.28Å; M30-D342 WeakPolarHBondContact CE-OD2 3.24Å; K282-D342 PolarHBondContact NZ-O 2.95Å; D342-V346 HydrophobicContact CB-CB 4.18Å; D342-V346 HydrophobicContact CB-CG1 4.08Å; D342-L508 HydrophobicContact CB-CD2 4.32Å
343	G	65.8	Low	86.5	Confident	23 Å²	23	14.3 Å²	14.3	24%	0.237	8%	0.082	C	C	.	.	S	Bend	trans	-93.6	-177.4	-173.9	0	0	0	0	0	114.8	G345 V346 Y347	G343-G345 PolarHBondContact O-N 3.41Å; G343-V346 PolarHBondContact O-N 2.69Å; G343-Y347 PolarHBondContact O-N 3.4Å
344	A	59.3	Low	86.4	Confident	22 Å²	22	14.2 Å²	14.2	18%	0.182	8%	0.082	C	C	.	.	B	Isolated β-bridge	trans	-57.1	122.9	-179.2	0	0	0	0	0	112.4	H32 M35 K282	H32-A344 PolarHBondContact CE1-O 3.27Å; H32-A344 PolarHBondContact ND1-O 3.48Å; H32-A344 PolarHBondContact NE2-O 3.08Å; M35-A344 HydrophobicContact CE-CB 3.4Å; M35-A344 VanDerWaalsContact CE-CB 3.4Å; K282-A344 WeakPolarHBondContact O-CB 3.41Å
345	G	60.3	Low	86.4	Confident	3 Å²	3	11.3 Å²	11.3	3%	0.031	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.7	-5.5	-178.5	0	0	0	0	0	115.5	H33 N283 G343 T349 H350	H33-G345 PolarHBondContact N-O 3.09Å; H33-G345 WeakPolarHBondContact O-CA 2.98Å; N283-G345 PolarHBondContact OD1-N 3.4Å; G343-G345 PolarHBondContact O-N 3.41Å; G345-T349 PolarHBondContact O-OG1 3.18Å; G345-T349 VanDerWaalsContact O-OG1 3.1Å; G345-H350 PolarHBondContact O-CE1 3.13Å
346	V	72.3	Confident	86.2	Confident	1 Å²	1	11.2 Å²	11.2	1%	0.006	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-48.4	158.9	171.9	0	0	0	0	108.8	M30 C31 E339 D342 G343 L348 T349 H350 A363 L508	M30-V346 HydrophobicContact CE-CG1 4.23Å; M30-V346 HydrophobicContact CE-CG2 3.84Å; C31-V346 WeakPolarHBondContact O-CG2 3.33Å; E339-V346 HydrophobicContact CG-CG1 3.75Å; D342-V346 HydrophobicContact CB-CB 4.18Å; D342-V346 HydrophobicContact CB-CG1 4.08Å; G343-V346 PolarHBondContact O-N 2.69Å; V346-L348 PolarHBondContact O-N 3.14Å; V346-T349 PolarHBondContact O-N 3.12Å; V346-T349 PolarHBondContact O-OG1 3.4Å; V346-H350 PolarHBondContact O-ND1 3.16Å; V346-H350 VanDerWaalsContact O-ND1 3.09Å; V346-A363 HydrophobicContact CG1-CB 3.69Å; V346-L508 HydrophobicContact CG1-CD2 3.96Å
347	Y	81.3	Confident	86	Confident	26 Å²	26	11.8 Å²	11.8	10%	0.102	7%	0.068	C	C	.	.	B	Isolated β-bridge	trans	-52.7	125.3	176.9	-177.2	-101.7	0	0	0	112.3	Y279 K282 N283 H313 D340 G343 T349	Y279-Y347 HydrophobicContact CE1-CE1 4.49Å; Y279-Y347 PolarHBondContact OH-OH 2.82Å; K282-Y347 HydrophobicContact CB-CD1 4.13Å; K282-Y347 HydrophobicContact CB-CE1 4.45Å; K282-Y347 HydrophobicContact CD-CD2 4.48Å; K282-Y347 HydrophobicContact CD-CG 4.41Å; N283-Y347 PolarHBondContact ND2-O 3.15Å; N283-Y347 PolarHBondContact OD1-O 3.26Å; H313-Y347 AromaticContact NE2-CZ 3.78Å; H313-Y347 PolarHBondContact NE2-OH 3.26Å; D340-Y347 HydrophobicContact CB-CE2 4.41Å; D340-Y347 WeakPolarHBondContact O-CD2 3.08Å; G343-Y347 PolarHBondContact O-N 3.4Å; Y347-T349 PolarHBondContact O-N 3.43Å
348	L	89.5	Confident	85.7	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	-7.5	-179.8	-55.1	176.4	0	0	0	117.4	T250 F253 Y279 W289 H313 L338 E339 V346	T250-L348 HydrophobicContact CG2-CB 3.42Å; T250-L348 VanDerWaalsContact CG2-CB 3.42Å; T250-L348 WeakPolarHBondContact CG2-O 3.34Å; F253-L348 WeakPolarHBondContact CZ-O 3.43Å; Y279-L348 HydrophobicContact CE1-CD1 4.32Å; W289-L348 HydrophobicContact CH2-CD1 3.66Å; W289-L348 HydrophobicContact CZ2-CD1 3.89Å; H313-L348 HydrophobicContact CB-CD2 3.25Å; L338-L348 HydrophobicContact CB-CD2 4.08Å; L338-L348 HydrophobicContact CD1-CB 4.4Å; L338-L348 HydrophobicContact CD1-CD2 4.07Å; E339-L348 PolarHBondContact O-N 2.94Å; V346-L348 PolarHBondContact O-N 3.14Å
349	T	89.6	Confident	85.7	Confident	3 Å²	3	12.1 Å²	12.1	2%	0.018	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-12.1	-178.9	53.9	0	0	0	0	113.1	H244 F248 T250 G345 V346 Y347	H244-T349 PolarHBondContact CE1-O 3.13Å; F248-T349 WeakPolarHBondContact CD2-O 3.46Å; F248-T349 WeakPolarHBondContact CE2-O 3.34Å; T250-T349 HydrophobicContact CG2-CG2 3.6Å; T250-T349 WeakPolarHBondContact OG1-CG2 3.23Å; G345-T349 PolarHBondContact O-OG1 3.18Å; G345-T349 VanDerWaalsContact O-OG1 3.1Å; V346-T349 PolarHBondContact O-N 3.12Å; V346-T349 PolarHBondContact O-OG1 3.4Å; Y347-T349 PolarHBondContact O-N 3.43Å
350	H	94.8	Very high	85.8	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.071	C	C	.	.	S	Bend	trans	-130.6	164.8	-175.8	-55.6	103.5	0	0	0	110.4	H33 H240 H244 L338 E339 G345 V346 M361 A363	H33-H350 AromaticContact CE1-CE1 3.8Å; H33-H350 AromaticContact CE1-NE2 3.24Å; H33-H350 PolarHBondContact CE1-NE2 2.98Å; H33-H350 AromaticContact ND1-CE1 3.38Å; H33-H350 PolarHBondContact ND1-CE1 2.88Å; H33-H350 AromaticContact ND1-NE2 3.27Å; H33-H350 PolarHBondContact ND1-NE2 2.76Å; H240-H350 AromaticContact CE1-CD2 3.59Å; H240-H350 AromaticContact CE1-NE2 3.65Å; H240-H350 AromaticContact NE2-CD2 3.9Å; H240-H350 AromaticContact NE2-NE2 3.48Å; H240-H350 PolarHBondContact NE2-NE2 3.03Å; H244-H350 AromaticContact CE1-CD2 3.99Å; H244-H350 AromaticContact CE1-NE2 3.9Å; H244-H350 AromaticContact NE2-CD2 3.79Å; H244-H350 AromaticContact NE2-NE2 3.53Å; L338-H350 WeakPolarHBondContact CA-O 3.27Å; L338-H350 WeakPolarHBondContact CD2-O 3.25Å; E339-H350 HydrophobicContact CB-CB 4.23Å; E339-H350 PolarHBondContact N-O 3.32Å; G345-H350 PolarHBondContact O-CE1 3.13Å; V346-H350 PolarHBondContact O-ND1 3.16Å; V346-H350 VanDerWaalsContact O-ND1 3.09Å; H350-M361 WeakPolarHBondContact CA-O 3.15Å; H350-M361 VanDerWaalsContact CB-O 3.25Å; H350-M361 WeakPolarHBondContact CB-O 3.45Å; H350-A363 HydrophobicContact CB-CB 4.05Å; H350-A363 WeakPolarHBondContact ND1-CB 3.38Å
351	W	97.2	Very high	86.2	Confident	0 Å²	0	11 Å²	11	0%	0	6%	0.064	C	C	.	.	B	Isolated β-bridge	trans	-72.5	148.9	167.5	-65.2	127.5	0	0	0	112.2	F248 V315 V320 V336 L338 K353 L356 M361 I374 T375 M378	F248-W351 HydrophobicContact CE1-CD2 4.09Å; F248-W351 AromaticContact CE1-CE2 3.32Å; F248-W351 HydrophobicContact CE1-CH2 4.25Å; F248-W351 AromaticContact CE1-CZ2 3.43Å; F248-W351 HydrophobicContact CE1-CZ2 3.43Å; F248-W351 VanDerWaalsContact CE1-CZ2 3.43Å; F248-W351 AromaticContact CE1-NE1 3.36Å; F248-W351 AromaticContact CZ-CD2 3.77Å; F248-W351 HydrophobicContact CZ-CD2 3.77Å; F248-W351 AromaticContact CZ-CE2 3.48Å; F248-W351 VanDerWaalsContact CZ-CE2 3.48Å; F248-W351 HydrophobicContact CZ-CE3 4.24Å; F248-W351 HydrophobicContact CZ-CG 4.22Å; F248-W351 HydrophobicContact CZ-CH2 4.17Å; F248-W351 AromaticContact CZ-CZ2 3.71Å; F248-W351 HydrophobicContact CZ-CZ2 3.71Å; F248-W351 HydrophobicContact CZ-CZ3 4.42Å; F248-W351 AromaticContact CZ-NE1 3.79Å; V315-W351 HydrophobicContact CB-CH2 4.1Å; V315-W351 HydrophobicContact CB-CZ3 4.01Å; V315-W351 HydrophobicContact CG1-CH2 4.41Å; V315-W351 HydrophobicContact CG2-CH2 3.84Å; V315-W351 HydrophobicContact CG2-CZ3 3.58Å; V320-W351 HydrophobicContact CG1-CH2 4.35Å; V336-W351 HydrophobicContact CB-CE3 4.39Å; V336-W351 HydrophobicContact CB-CH2 4.44Å; V336-W351 HydrophobicContact CB-CZ3 3.9Å; V336-W351 HydrophobicContact CG1-CD2 4.46Å; V336-W351 HydrophobicContact CG1-CE3 3.76Å; V336-W351 HydrophobicContact CG1-CH2 4.47Å; V336-W351 HydrophobicContact CG1-CZ3 3.78Å; L338-W351 HydrophobicContact CD2-CE3 3.7Å; L338-W351 HydrophobicContact CD2-CZ3 3.72Å; L338-W351 HydrophobicContact CG-CZ3 4.47Å; W351-K353 PolarHBondContact O-N 3.24Å; W351-L356 HydrophobicContact CB-CB 4.24Å; W351-L356 HydrophobicContact CB-CD1 3.59Å; W351-L356 HydrophobicContact CB-CG 4.5Å; W351-L356 HydrophobicContact CD2-CD1 3.82Å; W351-L356 HydrophobicContact CG-CD1 3.37Å; W351-M361 PolarHBondContact N-O 2.05Å; W351-I374 HydrophobicContact CH2-CG2 4.08Å; W351-I374 HydrophobicContact CZ2-CG2 3.67Å; W351-T375 PolarHBondContact NE1-OG1 2.88Å; W351-M378 HydrophobicContact CH2-CB 4.32Å; W351-M378 HydrophobicContact CH2-CG 4.4Å; W351-M378 HydrophobicContact CH2-SD 4.29Å; W351-M378 HydrophobicContact CZ2-CB 3.84Å; W351-M378 HydrophobicContact CZ2-CG 4.15Å
352	E	96.1	Very high	86.9	Confident	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.054	C	C	.	.			trans	-56.6	116.7	169.4	165.6	55.3	-107.1	0	0	110.1	K310 E337 R354 L355 L356 N510	K310-E352 IonicContact NZ-OE2 2.73Å; E337-E352 HydrophobicContact CB-CB 3.82Å; E337-E352 HydrophobicContact CB-CG 4.29Å; E337-E352 WeakPolarHBondContact O-CB 3.27Å; E337-E352 PolarHBondContact O-N 3.42Å; E337-E352 VanDerWaalsContact O-N 3.08Å; E352-R354 VanDerWaalsContact C-N 3.25Å; E352-R354 HydrophobicContact CG-CB 4.08Å; E352-R354 PolarHBondContact O-N 3.28Å; E352-R354 WeakPolarHBondContact OE1-CB 3.04Å; E352-R354 PolarHBondContact OE1-N 2.96Å; E352-L355 HydrophobicContact CB-CD1 4.48Å; E352-L355 HydrophobicContact CG-CB 4.42Å; E352-L355 HydrophobicContact CG-CD1 4.3Å; E352-L355 HydrophobicContact CG-CG 4Å; E352-L355 PolarHBondContact O-N 2.74Å; E352-L355 VanDerWaalsContact O-N 3.09Å; E352-L356 PolarHBondContact O-N 3.18Å; E352-N510 PolarHBondContact OE1-OD1 2.97Å; E352-N510 PolarHBondContact OE2-ND2 2.85Å; E352-N510 PolarHBondContact OE2-OD1 2.69Å
353	K	94.6	Very high	87.7	Confident	2 Å²	2	5.4 Å²	5.4	1%	0.009	4%	0.036	C	C	.	.	H	α-helix	trans	-65.6	-29	-171.4	-173.9	174.4	173.3	66.8	0	112.1	W351 L355 L356 E357 T362 T364 T366 I506 L508 Y514	W351-K353 PolarHBondContact O-N 3.24Å; K353-L355 PolarHBondContact O-N 3.08Å; K353-L356 PolarHBondContact O-N 2.96Å; K353-E357 WeakPolarHBondContact CE-OE1 3.29Å; K353-E357 PolarHBondContact NZ-O 2.75Å; K353-E357 IonicContact NZ-OE1 2.91Å; K353-E357 PolarHBondContact NZ-OE1 3.48Å; K353-E357 WeakPolarHBondContact O-CA 3.19Å; K353-E357 PolarHBondContact O-N 2.88Å; K353-T362 HydrophobicContact CB-CG2 4.36Å; K353-T362 HydrophobicContact CG-CG2 4.28Å; K353-T364 VanDerWaalsContact CD-OG1 3.23Å; K353-T364 WeakPolarHBondContact CD-OG1 3.12Å; K353-T364 WeakPolarHBondContact CE-OG1 3.27Å; K353-T364 PolarHBondContact NZ-OG1 3.44Å; K353-T366 PolarHBondContact NZ-OG1 2.91Å; K353-T366 VanDerWaalsContact NZ-OG1 3.16Å; K353-I506 HydrophobicContact CD-CG2 3.9Å; K353-L508 HydrophobicContact CB-CB 4.2Å; K353-L508 WeakPolarHBondContact CB-O 3.34Å; K353-L508 HydrophobicContact CD-CB 4.36Å; K353-Y514 VanDerWaalsContact CE-OH 3.23Å; K353-Y514 WeakPolarHBondContact CE-OH 3.49Å
354	R	96.1	Very high	88.5	Confident	2 Å²	2	4.5 Å²	4.5	1%	0.008	3%	0.026	C	C	.	.	H	α-helix	trans	-57	-38.7	174.6	-177.6	-175.5	58.8	84.9	-1.5	112.1	E337 E352 W397 F405 G408 F427 A509 N510 C512	E337-R354 IonicContact OE2-NH2 3.65Å; E337-R354 PolarHBondContact OE2-NH2 2.96Å; E352-R354 VanDerWaalsContact C-N 3.25Å; E352-R354 HydrophobicContact CG-CB 4.08Å; E352-R354 PolarHBondContact O-N 3.28Å; E352-R354 WeakPolarHBondContact OE1-CB 3.04Å; E352-R354 PolarHBondContact OE1-N 2.96Å; R354-W397 PolarHBondContact O-NE1 3.21Å; R354-F405 PolarHBondContact NH1-O 3.27Å; R354-G408 PolarHBondContact NH1-O 3.09Å; R354-F427 HydrophobicContact CG-CE1 4.11Å; R354-F427 HydrophobicContact CG-CZ 3.85Å; R354-A509 HydrophobicContact CB-CB 4.48Å; R354-N510 VanDerWaalsContact CD-OD1 3.26Å; R354-N510 WeakPolarHBondContact CD-OD1 3.33Å; R354-N510 PolarHBondContact NE-OD1 3.5Å; R354-C512 HydrophobicContact CG-CB 4.33Å
355	L	97.3	Very high	89.5	Confident	3 Å²	3	5.1 Å²	5.1	2%	0.016	2%	0.024	C	C	.	.	H	α-helix	trans	-86.4	-24.5	-173.8	-68.1	-175.3	0	0	0	114	Y328 E337 E352 K353 F405	Y328-L355 PolarHBondContact OH-O 2.71Å; Y328-L355 VanDerWaalsContact OH-O 3.1Å; E337-L355 HydrophobicContact CB-CD1 3.81Å; E337-L355 HydrophobicContact CG-CD1 3.98Å; E352-L355 HydrophobicContact CB-CD1 4.48Å; E352-L355 HydrophobicContact CG-CB 4.42Å; E352-L355 HydrophobicContact CG-CD1 4.3Å; E352-L355 HydrophobicContact CG-CG 4Å; E352-L355 PolarHBondContact O-N 2.74Å; E352-L355 VanDerWaalsContact O-N 3.09Å; K353-L355 PolarHBondContact O-N 3.08Å; L355-F405 HydrophobicContact CD2-CD1 4.22Å; L355-F405 HydrophobicContact CD2-CE1 4.15Å; L355-F405 WeakPolarHBondContact CD2-O 3.23Å
356	L	96.1	Very high	90.3	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-135.6	7.6	-169.3	-78	173.9	0	0	0	114.5	V336 W351 E352 K353 N358 D359 T362 I374 F395	V336-L356 HydrophobicContact CG1-CD1 4.32Å; W351-L356 HydrophobicContact CB-CB 4.24Å; W351-L356 HydrophobicContact CB-CD1 3.59Å; W351-L356 HydrophobicContact CB-CG 4.5Å; W351-L356 HydrophobicContact CD2-CD1 3.82Å; W351-L356 HydrophobicContact CG-CD1 3.37Å; E352-L356 PolarHBondContact O-N 3.18Å; K353-L356 PolarHBondContact O-N 2.96Å; L356-N358 PolarHBondContact O-N 2.98Å; L356-D359 HydrophobicContact CB-CB 3.87Å; L356-D359 HydrophobicContact CD2-CB 4.49Å; L356-D359 WeakPolarHBondContact O-CA 3.48Å; L356-D359 WeakPolarHBondContact O-CB 3.33Å; L356-D359 PolarHBondContact O-N 2.71Å; L356-T362 HydrophobicContact CB-CG2 4.24Å; L356-I374 HydrophobicContact CD1-CG2 4.29Å; L356-I374 HydrophobicContact CD2-CD1 4.21Å; L356-F395 HydrophobicContact CD2-CE1 3.67Å; L356-F395 HydrophobicContact CD2-CZ 3.92Å
357	E	93.5	Very high	90.3	Very high	13 Å²	13	6.7 Å²	6.7	6%	0.061	3%	0.032	C	C	.	.	T	Hydrogen-bonded Turn	trans	9.4	-74.8	178.9	-152.6	-71.3	137.9	0	0	118.6	K353 D359 T362 T366 W397 Y514	K353-E357 WeakPolarHBondContact CE-OE1 3.29Å; K353-E357 PolarHBondContact NZ-O 2.75Å; K353-E357 IonicContact NZ-OE1 2.91Å; K353-E357 PolarHBondContact NZ-OE1 3.48Å; K353-E357 WeakPolarHBondContact O-CA 3.19Å; K353-E357 PolarHBondContact O-N 2.88Å; E357-D359 VanDerWaalsContact C-N 3.35Å; E357-T362 PolarHBondContact O-OG1 3.31Å; E357-T362 VanDerWaalsContact O-OG1 3.08Å; E357-T366 PolarHBondContact OE1-OG1 3.33Å; E357-W397 HydrophobicContact CB-CD2 3.38Å; E357-W397 HydrophobicContact CB-CE3 3.68Å; E357-W397 HydrophobicContact CB-CG 3.9Å; E357-W397 HydrophobicContact CB-CH2 3.75Å; E357-W397 HydrophobicContact CB-CZ2 3.51Å; E357-W397 HydrophobicContact CB-CZ3 3.85Å; E357-W397 HydrophobicContact CG-CD2 4.26Å; E357-W397 HydrophobicContact CG-CE3 4.14Å; E357-W397 HydrophobicContact CG-CH2 3.56Å; E357-W397 HydrophobicContact CG-CZ2 3.74Å; E357-W397 HydrophobicContact CG-CZ3 3.79Å; E357-Y514 HydrophobicContact CG-CD2 4.21Å; E357-Y514 HydrophobicContact CG-CE1 4.26Å; E357-Y514 HydrophobicContact CG-CE2 3.6Å; E357-Y514 WeakPolarHBondContact OE1-CE2 3.47Å; E357-Y514 PolarHBondContact OE1-OH 2.87Å
358	N	91.4	Very high	90	Very high	12 Å²	12	6 Å²	6	6%	0.064	3%	0.031	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	14.8	-176.8	72.1	-36.4	0	0	0	113.5	L356 T366 S368 F369 Q370 F395	L356-N358 PolarHBondContact O-N 2.98Å; N358-T366 HydrophobicContact CB-CG2 4.03Å; N358-S368 PolarHBondContact ND2-O 3.14Å; N358-S368 VanDerWaalsContact ND2-O 3.15Å; N358-F369 CarbonylContact O-C 3.55Å; N358-F369 VanDerWaalsContact O-CA 3.28Å; N358-F369 WeakPolarHBondContact O-CA 3.28Å; N358-Q370 PolarHBondContact ND2-NE2 3.47Å; N358-Q370 PolarHBondContact O-N 3.38Å; N358-F395 VanDerWaalsContact OD1-CE2 3.31Å; N358-F395 WeakPolarHBondContact OD1-CE2 3.31Å
359	D	95.4	Very high	89.9	Confident	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.04	C	C	.	.	B	Isolated β-bridge	trans	-67.8	137	170.4	-177.3	-88.8	0	0	0	109.5	L356 E357 M361 T362 Q370 S372 T375 F395	L356-D359 HydrophobicContact CB-CB 3.87Å; L356-D359 HydrophobicContact CD2-CB 4.49Å; L356-D359 WeakPolarHBondContact O-CA 3.48Å; L356-D359 WeakPolarHBondContact O-CB 3.33Å; L356-D359 PolarHBondContact O-N 2.71Å; E357-D359 VanDerWaalsContact C-N 3.35Å; D359-M361 PolarHBondContact O-N 2.78Å; D359-M361 WeakPolarHBondContact OD1-CA 3.18Å; D359-M361 WeakPolarHBondContact OD1-CB 3.25Å; D359-M361 PolarHBondContact OD1-N 3.02Å; D359-T362 HydrophobicContact CB-CG2 4.19Å; D359-T362 PolarHBondContact O-N 3Å; D359-T362 PolarHBondContact O-OG1 2.9Å; D359-Q370 CarbonylContact C-O 3.54Å; D359-Q370 VanDerWaalsContact CA-O 3.29Å; D359-Q370 WeakPolarHBondContact CA-O 3.35Å; D359-S372 WeakPolarHBondContact OD2-CA 3.44Å; D359-S372 WeakPolarHBondContact OD2-CB 3.48Å; D359-S372 PolarHBondContact OD2-N 2.68Å; D359-S372 PolarHBondContact OD2-OG 2.79Å; D359-T375 VanDerWaalsContact CG-OG1 3.23Å; D359-T375 PolarHBondContact OD1-OG1 3.03Å; D359-T375 PolarHBondContact OD2-OG1 3.44Å; D359-F395 HydrophobicContact CB-CE2 3.87Å; D359-F395 HydrophobicContact CB-CZ 3.83Å
360	L	95.1	Very high	89.9	Confident	2 Å²	2	9.2 Å²	9.2	1%	0.01	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-31.1	179.1	178.3	64.4	0	0	0	112.6	F92 W93 F236 T239 H240 F369 Q370	F92-L360 HydrophobicContact CE1-CD2 4.41Å; W93-L360 HydrophobicContact CH2-CD2 4.13Å; W93-L360 HydrophobicContact CZ2-CD2 3.55Å; F236-L360 HydrophobicContact CD2-CD1 3.81Å; F236-L360 HydrophobicContact CE2-CD1 4.06Å; T239-L360 HydrophobicContact CG2-CD1 4.43Å; T239-L360 HydrophobicContact CG2-CD2 3.64Å; H240-L360 HydrophobicContact CB-CD1 4Å; H240-L360 HydrophobicContact CB-CG 4.46Å; H240-L360 PolarHBondContact ND1-O 3.11Å; L360-F369 HydrophobicContact CD1-CD2 3.63Å; L360-F369 HydrophobicContact CD1-CE2 4.02Å; L360-F369 HydrophobicContact CD1-CG 4.43Å; L360-Q370 PolarHBondContact N-O 2.85Å
361	M	95.8	Very high	89.9	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	21.3	-177.4	-60.2	-55.7	-59	0	0	114.1	L243 H244 F248 H350 W351 D359 T375	L243-M361 HydrophobicContact CB-CE 4.34Å; L243-M361 HydrophobicContact CB-SD 3.78Å; L243-M361 HydrophobicContact CD2-CE 4.16Å; L243-M361 HydrophobicContact CD2-CG 3.46Å; L243-M361 VanDerWaalsContact CD2-CG 3.46Å; L243-M361 HydrophobicContact CD2-SD 3.38Å; L243-M361 WeakPolarHBondContact CD2-SD 3.16Å; L243-M361 HydrophobicContact CG-SD 4.09Å; H244-M361 WeakPolarHBondContact CE1-CE 3.17Å; H244-M361 WeakPolarHBondContact NE2-CE 3.21Å; F248-M361 HydrophobicContact CB-CE 3.95Å; F248-M361 HydrophobicContact CD1-CB 4.39Å; F248-M361 HydrophobicContact CD1-CE 4.26Å; F248-M361 HydrophobicContact CD1-CG 4.11Å; F248-M361 HydrophobicContact CD2-CE 4.1Å; F248-M361 HydrophobicContact CE1-CB 4.19Å; F248-M361 HydrophobicContact CE1-CG 4.37Å; F248-M361 HydrophobicContact CG-CE 3.84Å; H350-M361 WeakPolarHBondContact CA-O 3.15Å; H350-M361 VanDerWaalsContact CB-O 3.25Å; H350-M361 WeakPolarHBondContact CB-O 3.45Å; W351-M361 PolarHBondContact N-O 2.05Å; D359-M361 PolarHBondContact O-N 2.78Å; D359-M361 WeakPolarHBondContact OD1-CA 3.18Å; D359-M361 WeakPolarHBondContact OD1-CB 3.25Å; D359-M361 PolarHBondContact OD1-N 3.02Å; M361-T375 HydrophobicContact CB-CG2 4.47Å; M361-T375 HydrophobicContact CG-CG2 3.61Å
362	T	93.6	Very high	89.9	Confident	1 Å²	1	9.6 Å²	9.6	1%	0.006	5%	0.047	C	C	.	.	B	Isolated β-bridge	trans	-79.9	153.8	159.7	62.8	0	0	0	0	110.4	H240 K353 L356 E357 D359 T364	H240-T362 PolarHBondContact CE1-O 3.3Å; K353-T362 HydrophobicContact CB-CG2 4.36Å; K353-T362 HydrophobicContact CG-CG2 4.28Å; L356-T362 HydrophobicContact CB-CG2 4.24Å; E357-T362 PolarHBondContact O-OG1 3.31Å; E357-T362 VanDerWaalsContact O-OG1 3.08Å; D359-T362 HydrophobicContact CB-CG2 4.19Å; D359-T362 PolarHBondContact O-N 3Å; D359-T362 PolarHBondContact O-OG1 2.9Å; T362-T364 VanDerWaalsContact C-N 3.26Å; T362-T364 PolarHBondContact O-N 2.97Å
363	A	86.4	Confident	90	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.008	5%	0.051	C	C	.	.	S	Bend	trans	-74.9	-8.7	-169.7	0	0	0	0	0	115.2	M30 C31 V346 H350 L508	M30-A363 CarbonylContact C-O 3.52Å; M30-A363 WeakPolarHBondContact CA-O 3.43Å; C31-A363 PolarHBondContact N-O 3.27Å; V346-A363 HydrophobicContact CG1-CB 3.69Å; H350-A363 HydrophobicContact CB-CB 4.05Å; H350-A363 WeakPolarHBondContact ND1-CB 3.38Å; A363-L508 HydrophobicContact CB-CD1 4.11Å
364	T	82.1	Confident	90.2	Very high	4 Å²	4	10.1 Å²	10.1	3%	0.025	5%	0.051	C	C	.	.	B	Isolated β-bridge	trans	-119.2	143.5	179.8	52.4	0	0	0	0	111	T29 M30 K353 T362 T366 L508	T29-T364 WeakPolarHBondContact O-CA 3.47Å; M30-T364 HydrophobicContact CG-CG2 3.74Å; K353-T364 VanDerWaalsContact CD-OG1 3.23Å; K353-T364 WeakPolarHBondContact CD-OG1 3.12Å; K353-T364 WeakPolarHBondContact CE-OG1 3.27Å; K353-T364 PolarHBondContact NZ-OG1 3.44Å; T362-T364 VanDerWaalsContact C-N 3.26Å; T362-T364 PolarHBondContact O-N 2.97Å; T364-T366 PolarHBondContact O-N 3.41Å; T364-L508 HydrophobicContact CG2-CD1 3.43Å; T364-L508 VanDerWaalsContact CG2-CD1 3.43Å
365	Y	80.2	Confident	90.3	Very high	34 Å²	34	10 Å²	10	13%	0.133	5%	0.05	C	C	.	.			trans	-58.8	131.8	169.6	175.1	-126.3	0	0	0	112.1	T29 T232 R233 F236 N367 F369	T29-Y365 PolarHBondContact O-N 2.55Å; T232-Y365 WeakPolarHBondContact CG2-OH 3.12Å; R233-Y365 WeakPolarHBondContact CA-OH 3.32Å; R233-Y365 HydrophobicContact CB-CD1 4.42Å; R233-Y365 HydrophobicContact CB-CE1 3.76Å; R233-Y365 HydrophobicContact CB-CE2 4.16Å; R233-Y365 HydrophobicContact CG-CD1 4.02Å; R233-Y365 HydrophobicContact CG-CE1 3.84Å; R233-Y365 HydrophobicContact CG-CE2 4.45Å; R233-Y365 HydrophobicContact CG-CG 4.36Å; R233-Y365 PolarHBondContact N-OH 2.94Å; F236-Y365 HydrophobicContact CB-CD2 3.64Å; F236-Y365 HydrophobicContact CB-CE2 3.66Å; F236-Y365 AromaticContact CD1-CD2 3.42Å; F236-Y365 HydrophobicContact CD1-CD2 3.42Å; F236-Y365 VanDerWaalsContact CD1-CD2 3.42Å; F236-Y365 HydrophobicContact CD1-CE2 4.32Å; F236-Y365 HydrophobicContact CD1-CG 4.09Å; F236-Y365 HydrophobicContact CD2-CD2 4.06Å; F236-Y365 HydrophobicContact CE1-CD2 4.05Å; F236-Y365 HydrophobicContact CE1-CG 4.44Å; F236-Y365 AromaticContact CG-CD2 3.42Å; F236-Y365 HydrophobicContact CG-CD2 3.42Å; F236-Y365 VanDerWaalsContact CG-CD2 3.42Å; F236-Y365 AromaticContact CG-CE2 3.97Å; F236-Y365 HydrophobicContact CG-CE2 3.97Å; F236-Y365 HydrophobicContact CG-CG 4.48Å; Y365-N367 WeakPolarHBondContact CE1-OD1 3.36Å; Y365-N367 PolarHBondContact OH-OD1 2.85Å; Y365-F369 HydrophobicContact CE2-CD1 4.41Å
366	T	78.2	Confident	90.4	Very high	15 Å²	15	9.9 Å²	9.9	9%	0.092	5%	0.05	C	C	.	.			trans	-124.3	136.5	165.5	-61.5	0	0	0	0	108.1	K353 E357 N358 T364 S368 F369	K353-T366 PolarHBondContact NZ-OG1 2.91Å; K353-T366 VanDerWaalsContact NZ-OG1 3.16Å; E357-T366 PolarHBondContact OE1-OG1 3.33Å; N358-T366 HydrophobicContact CB-CG2 4.03Å; T364-T366 PolarHBondContact O-N 3.41Å; T366-S368 WeakPolarHBondContact CG2-OG 3.35Å; T366-S368 PolarHBondContact O-N 2.76Å; T366-F369 PolarHBondContact O-N 2.95Å
367	N	71.6	Confident	90.5	Very high	23 Å²	23	9.9 Å²	9.9	12%	0.123	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-32.8	-177.1	-69.4	-10.5	0	0	0	113.2	T232 Y365 E519	T232-N367 WeakPolarHBondContact CG2-O 3.37Å; Y365-N367 WeakPolarHBondContact CE1-OD1 3.36Å; Y365-N367 PolarHBondContact OH-OD1 2.85Å; N367-E519 WeakPolarHBondContact ND2-CB 3.45Å; N367-E519 PolarHBondContact ND2-OE2 2.71Å; N367-E519 PolarHBondContact OD1-OE2 3.4Å
368	S	75.8	Confident	90.7	Very high	12 Å²	12	9.2 Å²	9.2	8%	0.084	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	32.3	177.9	62	0	0	0	0	114.9	N358 T366 Q370 E517 H532	N358-S368 PolarHBondContact ND2-O 3.14Å; N358-S368 VanDerWaalsContact ND2-O 3.15Å; T366-S368 WeakPolarHBondContact CG2-OG 3.35Å; T366-S368 PolarHBondContact O-N 2.76Å; S368-Q370 PolarHBondContact O-N 3.29Å; S368-E517 WeakPolarHBondContact CB-OE1 3.22Å; S368-E517 WeakPolarHBondContact CB-OE2 3.32Å; S368-E517 PolarHBondContact N-OE2 3.33Å; S368-E517 PolarHBondContact OG-OE1 3.18Å; S368-E517 PolarHBondContact OG-OE2 3.39Å; S368-H532 WeakPolarHBondContact CB-CE1 3.43Å; S368-H532 WeakPolarHBondContact CB-NE2 3.48Å
369	F	86.9	Confident	91.1	Very high	43 Å²	43	8.7 Å²	8.7	19%	0.189	4%	0.044	C	C	.	.			trans	-55.6	135.9	-178.2	72.8	-88.9	0	0	0	111.4	T232 L235 F236 N358 L360 Y365 T366	T232-F369 HydrophobicContact CG2-CD1 4.48Å; T232-F369 HydrophobicContact CG2-CE1 3.99Å; L235-F369 HydrophobicContact CB-CZ 4.37Å; L235-F369 HydrophobicContact CD2-CZ 4.22Å; L235-F369 HydrophobicContact CG-CZ 4.04Å; F236-F369 HydrophobicContact CB-CD1 3.6Å; F236-F369 HydrophobicContact CB-CE1 3.55Å; F236-F369 HydrophobicContact CB-CG 4.15Å; F236-F369 HydrophobicContact CB-CZ 4.07Å; F236-F369 HydrophobicContact CD2-CB 3.5Å; F236-F369 VanDerWaalsContact CD2-CB 3.5Å; F236-F369 AromaticContact CD2-CD1 3.75Å; F236-F369 HydrophobicContact CD2-CD1 3.75Å; F236-F369 AromaticContact CD2-CD2 3.98Å; F236-F369 HydrophobicContact CD2-CD2 3.98Å; F236-F369 HydrophobicContact CD2-CE1 4.45Å; F236-F369 AromaticContact CD2-CG 3.47Å; F236-F369 HydrophobicContact CD2-CG 3.47Å; F236-F369 VanDerWaalsContact CD2-CG 3.47Å; F236-F369 HydrophobicContact CE2-CB 3.92Å; F236-F369 HydrophobicContact CE2-CG 4.35Å; F236-F369 HydrophobicContact CG-CD1 4.12Å; F236-F369 HydrophobicContact CG-CG 4.28Å; N358-F369 CarbonylContact O-C 3.55Å; N358-F369 VanDerWaalsContact O-CA 3.28Å; N358-F369 WeakPolarHBondContact O-CA 3.28Å; L360-F369 HydrophobicContact CD1-CD2 3.63Å; L360-F369 HydrophobicContact CD1-CE2 4.02Å; L360-F369 HydrophobicContact CD1-CG 4.43Å; Y365-F369 HydrophobicContact CE2-CD1 4.41Å; T366-F369 PolarHBondContact O-N 2.95Å
370	Q	90	Very high	91.1	Very high	26 Å²	26	9.8 Å²	9.8	12%	0.121	5%	0.049	C	C	.	.	B	Isolated β-bridge	trans	-134.1	162.1	178.5	-72	-175.3	56.2	0	0	108.7	N358 D359 L360 S368 S394 F395 E451	N358-Q370 PolarHBondContact ND2-NE2 3.47Å; N358-Q370 PolarHBondContact O-N 3.38Å; D359-Q370 CarbonylContact C-O 3.54Å; D359-Q370 VanDerWaalsContact CA-O 3.29Å; D359-Q370 WeakPolarHBondContact CA-O 3.35Å; L360-Q370 PolarHBondContact N-O 2.85Å; S368-Q370 PolarHBondContact O-N 3.29Å; Q370-S394 PolarHBondContact OE1-OG 3.16Å; Q370-F395 HydrophobicContact CB-CD2 3.65Å; Q370-F395 HydrophobicContact CB-CE2 4.18Å; Q370-E451 PolarHBondContact NE2-OE2 3.05Å
371	I	95	Very high	91.3	Very high	8 Å²	8	10.1 Å²	10.1	4%	0.041	5%	0.051	C	C	.	.			trans	-93.3	120.9	171.3	-167.6	163.1	0	0	0	109.7	F92 W93 T375 L376 L391 S392	F92-I371 HydrophobicContact CE1-CD1 3.99Å; F92-I371 HydrophobicContact CE2-CG2 4.46Å; F92-I371 HydrophobicContact CZ-CB 4.04Å; F92-I371 HydrophobicContact CZ-CD1 3.83Å; F92-I371 HydrophobicContact CZ-CG2 3.88Å; W93-I371 HydrophobicContact CH2-CD1 3.45Å; W93-I371 VanDerWaalsContact CH2-CD1 3.45Å; W93-I371 HydrophobicContact CZ2-CD1 4.47Å; W93-I371 HydrophobicContact CZ3-CD1 3.68Å; I371-T375 HydrophobicContact CD1-CG2 4.24Å; I371-T375 HydrophobicContact CG1-CG2 4.04Å; I371-L376 HydrophobicContact CD1-CD2 3.51Å; I371-L376 HydrophobicContact CD1-CG 3.81Å; I371-L376 HydrophobicContact CG1-CD2 4.27Å; I371-L376 HydrophobicContact CG1-CG 4.01Å; I371-L391 HydrophobicContact CG2-CB 4.15Å; I371-L391 WeakPolarHBondContact CG2-O 3.16Å; I371-S392 WeakPolarHBondContact O-CA 3.37Å; I371-S392 WeakPolarHBondContact O-CB 3.43Å
372	S	97.4	Very high	91.3	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.051	C	C	.	.			trans	-75	155.3	174.1	74	0	0	0	0	111.1	D359 I374 T375 L376	D359-S372 WeakPolarHBondContact OD2-CA 3.44Å; D359-S372 WeakPolarHBondContact OD2-CB 3.48Å; D359-S372 PolarHBondContact OD2-N 2.68Å; D359-S372 PolarHBondContact OD2-OG 2.79Å; S372-I374 PolarHBondContact O-N 3.44Å; S372-I374 PolarHBondContact OG-N 3.26Å; S372-T375 PolarHBondContact O-N 3.45Å; S372-T375 PolarHBondContact OG-N 3.33Å; S372-T375 PolarHBondContact OG-OG1 3.09Å; S372-L376 PolarHBondContact O-N 2.9Å
373	P	98.2	Very high	91.3	Very high	13 Å²	13	10.2 Å²	10.2	8%	0.084	5%	0.052	C	C	.	.	H	α-helix	trans	-61.9	-22.5	170.3	26.7	-35.9	0	0	0	111.8	I323 F327 A377 Y389 S392	I323-P373 HydrophobicContact CG2-CB 3.76Å; I323-P373 HydrophobicContact CG2-CG 4.3Å; F327-P373 HydrophobicContact CD2-CG 3.77Å; F327-P373 HydrophobicContact CE2-CG 4.27Å; F327-P373 HydrophobicContact CG-CG 4.23Å; P373-A377 WeakPolarHBondContact O-CB 3.28Å; P373-A377 PolarHBondContact O-N 3.03Å; P373-Y389 HydrophobicContact CB-CD1 4.2Å; P373-Y389 WeakPolarHBondContact O-CE1 3.35Å; P373-S392 WeakPolarHBondContact CA-OG 3.46Å; P373-S392 WeakPolarHBondContact CB-OG 3.41Å
374	I	98.7	Very high	91.7	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-73.2	-41.3	179.2	-67.7	170.4	0	0	0	110.9	V320 I323 A324 F327 Y328 V336 W351 L356 S372 L376 A377 M378	V320-I374 HydrophobicContact CG1-CG2 4.35Å; I323-I374 HydrophobicContact CG2-CG1 4.31Å; A324-I374 HydrophobicContact CB-CD1 3.89Å; A324-I374 HydrophobicContact CB-CG1 4.14Å; F327-I374 HydrophobicContact CD1-CD1 3.72Å; F327-I374 HydrophobicContact CE1-CD1 4.3Å; F327-I374 HydrophobicContact CG-CD1 4.39Å; Y328-I374 HydrophobicContact CD2-CD1 4.34Å; Y328-I374 HydrophobicContact CE2-CD1 3.49Å; Y328-I374 VanDerWaalsContact CE2-CD1 3.49Å; V336-I374 HydrophobicContact CB-CG2 4.42Å; V336-I374 HydrophobicContact CG1-CG2 4.12Å; V336-I374 HydrophobicContact CG2-CD1 4.38Å; V336-I374 HydrophobicContact CG2-CG2 4.05Å; W351-I374 HydrophobicContact CH2-CG2 4.08Å; W351-I374 HydrophobicContact CZ2-CG2 3.67Å; L356-I374 HydrophobicContact CD1-CG2 4.29Å; L356-I374 HydrophobicContact CD2-CD1 4.21Å; S372-I374 PolarHBondContact O-N 3.44Å; S372-I374 PolarHBondContact OG-N 3.26Å; I374-L376 VanDerWaalsContact C-N 3.35Å; I374-L376 PolarHBondContact O-N 3.19Å; I374-A377 WeakPolarHBondContact O-CB 3.39Å; I374-A377 PolarHBondContact O-N 2.87Å; I374-M378 PolarHBondContact O-N 3.46Å
375	T	98.5	Very high	92.3	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-60.8	-43.4	172.9	-69.4	0	0	0	0	111.6	L243 W351 D359 M361 I371 S372 A377 M378 M379	L243-T375 HydrophobicContact CD2-CG2 3.59Å; W351-T375 PolarHBondContact NE1-OG1 2.88Å; D359-T375 VanDerWaalsContact CG-OG1 3.23Å; D359-T375 PolarHBondContact OD1-OG1 3.03Å; D359-T375 PolarHBondContact OD2-OG1 3.44Å; M361-T375 HydrophobicContact CB-CG2 4.47Å; M361-T375 HydrophobicContact CG-CG2 3.61Å; I371-T375 HydrophobicContact CD1-CG2 4.24Å; I371-T375 HydrophobicContact CG1-CG2 4.04Å; S372-T375 PolarHBondContact O-N 3.45Å; S372-T375 PolarHBondContact OG-N 3.33Å; S372-T375 PolarHBondContact OG-OG1 3.09Å; T375-A377 VanDerWaalsContact C-N 3.34Å; T375-A377 PolarHBondContact O-N 2.79Å; T375-M378 WeakPolarHBondContact O-CB 3.42Å; T375-M378 PolarHBondContact O-N 2.93Å; T375-M379 PolarHBondContact O-N 2.97Å
376	L	98.7	Very high	92.9	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-63.9	-38	173.4	-70.9	176.3	0	0	0	112.6	A96 I371 S372 I374 M378 M379 E380 S387 N388 Y389	A96-L376 HydrophobicContact CB-CD2 4.4Å; I371-L376 HydrophobicContact CD1-CD2 3.51Å; I371-L376 HydrophobicContact CD1-CG 3.81Å; I371-L376 HydrophobicContact CG1-CD2 4.27Å; I371-L376 HydrophobicContact CG1-CG 4.01Å; S372-L376 PolarHBondContact O-N 2.9Å; I374-L376 VanDerWaalsContact C-N 3.35Å; I374-L376 PolarHBondContact O-N 3.19Å; L376-M378 VanDerWaalsContact C-N 3.34Å; L376-M379 PolarHBondContact O-N 3.46Å; L376-E380 PolarHBondContact O-N 3.39Å; L376-S387 WeakPolarHBondContact O-CB 3.15Å; L376-S387 PolarHBondContact O-OG 3.32Å; L376-N388 WeakPolarHBondContact CD1-O 3.32Å; L376-Y389 HydrophobicContact CB-CD1 4.05Å; L376-Y389 HydrophobicContact CB-CE1 3.88Å; L376-Y389 HydrophobicContact CD1-CD1 4.28Å
377	A	98.5	Very high	93.8	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-65.4	-36.7	175.9	0	0	0	0	0	112.7	T319 V320 I323 P373 I374 T375 M379 E380 D381 Y389	T319-A377 HydrophobicContact CG2-CB 3.91Å; V320-A377 HydrophobicContact CG2-CB 4.11Å; I323-A377 HydrophobicContact CB-CB 3.99Å; I323-A377 HydrophobicContact CG1-CB 3.93Å; I323-A377 HydrophobicContact CG2-CB 4.29Å; P373-A377 WeakPolarHBondContact O-CB 3.28Å; P373-A377 PolarHBondContact O-N 3.03Å; I374-A377 WeakPolarHBondContact O-CB 3.39Å; I374-A377 PolarHBondContact O-N 2.87Å; T375-A377 VanDerWaalsContact C-N 3.34Å; T375-A377 PolarHBondContact O-N 2.79Å; A377-M379 VanDerWaalsContact C-N 3.33Å; A377-E380 PolarHBondContact O-N 3.44Å; A377-D381 PolarHBondContact O-N 2.92Å; A377-Y389 WeakPolarHBondContact CA-OH 3.28Å; A377-Y389 HydrophobicContact CB-CE1 4.31Å
378	M	98.3	Very high	95	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-60.4	-44.9	173.5	-179	64.5	156.3	0	0	110.9	F248 F253 Y256 V315 L317 V320 W351 I374 T375 L376 E380 D381 T382	F248-M378 HydrophobicContact CD1-CB 4.29Å; F248-M378 HydrophobicContact CD1-CG 3.68Å; F248-M378 HydrophobicContact CE1-CB 4.22Å; F248-M378 HydrophobicContact CE1-CG 3.73Å; F248-M378 HydrophobicContact CE2-CE 4.39Å; F248-M378 HydrophobicContact CG-CG 4.36Å; F248-M378 HydrophobicContact CZ-CE 4.34Å; F248-M378 HydrophobicContact CZ-CG 4.43Å; F253-M378 HydrophobicContact CD1-CE 4.09Å; F253-M378 HydrophobicContact CE1-CE 3.38Å; F253-M378 HydrophobicContact CZ-CE 3.86Å; Y256-M378 HydrophobicContact CE2-CE 3.79Å; Y256-M378 HydrophobicContact CE2-SD 3.92Å; Y256-M378 WeakPolarHBondContact OH-CE 3.41Å; V315-M378 HydrophobicContact CG1-CE 4.44Å; V315-M378 HydrophobicContact CG1-SD 3.88Å; V315-M378 HydrophobicContact CG2-CE 4.06Å; V315-M378 HydrophobicContact CG2-SD 4.44Å; L317-M378 HydrophobicContact CD1-SD 3.53Å; L317-M378 VanDerWaalsContact CD1-SD 3.53Å; V320-M378 HydrophobicContact CG2-CB 4.03Å; V320-M378 HydrophobicContact CG2-SD 4.34Å; W351-M378 HydrophobicContact CH2-CB 4.32Å; W351-M378 HydrophobicContact CH2-CG 4.4Å; W351-M378 HydrophobicContact CH2-SD 4.29Å; W351-M378 HydrophobicContact CZ2-CB 3.84Å; W351-M378 HydrophobicContact CZ2-CG 4.15Å; I374-M378 PolarHBondContact O-N 3.46Å; T375-M378 WeakPolarHBondContact O-CB 3.42Å; T375-M378 PolarHBondContact O-N 2.93Å; L376-M378 VanDerWaalsContact C-N 3.34Å; M378-E380 PolarHBondContact O-N 2.99Å; M378-D381 PolarHBondContact O-N 3.28Å; M378-T382 PolarHBondContact O-N 3.37Å; M378-T382 VanDerWaalsContact O-N 3.11Å
379	M	98.1	Very high	96	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-64.8	-36.9	176.2	-62.7	-52.2	-63.9	0	0	112.7	L97 L243 L246 F248 T375 L376 A377 D381 T382 Y385	L97-M379 HydrophobicContact CD1-CE 4.07Å; L97-M379 HydrophobicContact CD2-CB 3.82Å; L97-M379 HydrophobicContact CD2-CG 4.39Å; L243-M379 HydrophobicContact CD1-CE 3.6Å; L243-M379 HydrophobicContact CD1-CG 3.76Å; L243-M379 HydrophobicContact CD1-SD 3.44Å; L243-M379 WeakPolarHBondContact CD1-SD 3.42Å; L243-M379 HydrophobicContact CD2-CG 4.42Å; L243-M379 HydrophobicContact CD2-SD 4.25Å; L243-M379 HydrophobicContact CG-CG 4.49Å; L243-M379 HydrophobicContact CG-SD 3.9Å; L246-M379 HydrophobicContact CB-CE 4.05Å; F248-M379 HydrophobicContact CB-SD 4.22Å; T375-M379 PolarHBondContact O-N 2.97Å; L376-M379 PolarHBondContact O-N 3.46Å; A377-M379 VanDerWaalsContact C-N 3.33Å; M379-D381 VanDerWaalsContact C-N 3.33Å; M379-T382 HydrophobicContact CE-CG2 4.43Å; M379-T382 WeakPolarHBondContact O-CB 3.49Å; M379-T382 WeakPolarHBondContact O-CG2 3.29Å; M379-T382 PolarHBondContact O-N 2.98Å; M379-T382 PolarHBondContact O-OG1 3.22Å; M379-T382 HydrophobicContact SD-CG2 4.41Å; M379-Y385 HydrophobicContact CB-CD2 4.49Å; M379-Y385 HydrophobicContact CE-CD2 3.61Å; M379-Y385 HydrophobicContact CE-CE2 3.45Å; M379-Y385 VanDerWaalsContact CE-CE2 3.45Å
380	E	96.9	Very high	96.3	Very high	23 Å²	23	15.4 Å²	15.4	11%	0.107	9%	0.086	C	C	.	.	H	α-helix	trans	-66.3	-34.9	174.6	-176.2	-179.6	150.1	0	0	112.6	R100 K259 T319 L376 A377 M378 T382 S387 Y389	R100-E380 PolarHBondContact NH1-O 3.37Å; R100-E380 PolarHBondContact NH2-O 3.31Å; R100-E380 IonicContact NH2-OE1 3.49Å; K259-E380 IonicContact NZ-OE1 2.89Å; K259-E380 PolarHBondContact NZ-OE1 3.04Å; T319-E380 HydrophobicContact CG2-CB 4.36Å; T319-E380 HydrophobicContact CG2-CG 4.32Å; L376-E380 PolarHBondContact O-N 3.39Å; A377-E380 PolarHBondContact O-N 3.44Å; M378-E380 PolarHBondContact O-N 2.99Å; E380-T382 VanDerWaalsContact C-N 3.34Å; E380-S387 PolarHBondContact N-OG 3.11Å; E380-Y389 VanDerWaalsContact OE2-CE2 3.24Å; E380-Y389 WeakPolarHBondContact OE2-CE2 3.47Å; E380-Y389 PolarHBondContact OE2-OH 3.46Å
381	D	97.7	Very high	96.5	Very high	9 Å²	9	17.3 Å²	17.3	5%	0.048	10%	0.097	C	C	.	.	H	α-helix	trans	-83.2	-4.9	178.9	-80.5	-22.1	0	0	0	114.3	L317 T319 V320 A377 M378 M379 G383	L317-D381 VanDerWaalsContact C-OD2 3.31Å; L317-D381 HydrophobicContact CB-CB 3.68Å; L317-D381 WeakPolarHBondContact CB-OD2 3.13Å; L317-D381 HydrophobicContact CD1-CB 3.77Å; L317-D381 HydrophobicContact CD2-CB 4.37Å; L317-D381 HydrophobicContact CG-CB 4.15Å; T319-D381 WeakPolarHBondContact CA-OD2 3.5Å; T319-D381 WeakPolarHBondContact CB-OD1 3.38Å; T319-D381 WeakPolarHBondContact CB-OD2 3.11Å; T319-D381 PolarHBondContact N-OD1 3.33Å; T319-D381 PolarHBondContact N-OD2 3.24Å; T319-D381 PolarHBondContact OG1-OD1 2.9Å; V320-D381 PolarHBondContact N-OD2 3.42Å; A377-D381 PolarHBondContact O-N 2.92Å; M378-D381 PolarHBondContact O-N 3.28Å; M379-D381 VanDerWaalsContact C-N 3.33Å; D381-G383 PolarHBondContact O-N 3.26Å
382	T	97.2	Very high	96.4	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.1	165.2	63.1	0	0	0	0	112	Y256 R257 M378 M379 E380 W384	Y256-T382 HydrophobicContact CD1-CG2 4.28Å; Y256-T382 HydrophobicContact CE1-CG2 3.76Å; Y256-T382 HydrophobicContact CE2-CG2 4.39Å; R257-T382 PolarHBondContact N-O 3.39Å; R257-T382 CarbonylContact O-C 3.59Å; M378-T382 PolarHBondContact O-N 3.37Å; M378-T382 VanDerWaalsContact O-N 3.11Å; M379-T382 HydrophobicContact CE-CG2 4.43Å; M379-T382 WeakPolarHBondContact O-CB 3.49Å; M379-T382 WeakPolarHBondContact O-CG2 3.29Å; M379-T382 PolarHBondContact O-N 2.98Å; M379-T382 PolarHBondContact O-OG1 3.22Å; M379-T382 HydrophobicContact SD-CG2 4.41Å; E380-T382 VanDerWaalsContact C-N 3.34Å; T382-W384 VanDerWaalsContact C-N 3.33Å; T382-W384 VanDerWaalsContact CB-CE3 3.46Å; T382-W384 HydrophobicContact CG2-CE3 3.91Å; T382-W384 HydrophobicContact CG2-CZ3 4.02Å; T382-W384 PolarHBondContact OG1-N 2.95Å; T382-W384 VanDerWaalsContact OG1-N 3.1Å
383	G	94.2	Very high	95.7	Very high	4 Å²	4	24.1 Å²	24.1	4%	0.041	13%	0.129	C	C	.	.	S	Bend	trans	93.9	-13.6	-171.4	0	0	0	0	0	113.4	R257 D381	R257-G383 WeakPolarHBondContact O-CA 3.33Å; R257-G383 PolarHBondContact O-N 3.48Å; D381-G383 PolarHBondContact O-N 3.26Å
384	W	93.5	Very high	95	Very high	1 Å²	1	26.4 Å²	26.4	0%	0.004	15%	0.145	C	C	.	.	S	Bend	trans	-97.1	-33.6	-168.7	-50.8	-35.6	0	0	0	113.6	R100 T209 D210 R211 P212 L252 F255 Y256 T382	R100-W384 PolarHBondContact N-O 3.32Å; T209-W384 PolarHBondContact O-NE1 2.96Å; D210-W384 VanDerWaalsContact O-CZ2 3.27Å; D210-W384 WeakPolarHBondContact O-CZ2 3.29Å; R211-W384 HydrophobicContact CB-CB 4.27Å; R211-W384 HydrophobicContact CB-CD2 3.96Å; R211-W384 HydrophobicContact CB-CG 3.7Å; R211-W384 HydrophobicContact CG-CB 3.78Å; R211-W384 HydrophobicContact CG-CD2 3.92Å; R211-W384 HydrophobicContact CG-CE3 4.29Å; R211-W384 HydrophobicContact CG-CG 3.65Å; P212-W384 HydrophobicContact CG-CE3 4.44Å; P212-W384 HydrophobicContact CG-CH2 4.18Å; P212-W384 HydrophobicContact CG-CZ3 3.86Å; L252-W384 HydrophobicContact CB-CH2 4.23Å; L252-W384 HydrophobicContact CD1-CH2 4.3Å; L252-W384 HydrophobicContact CD1-CZ3 4.3Å; L252-W384 HydrophobicContact CD2-CH2 4.09Å; L252-W384 HydrophobicContact CG-CH2 4.44Å; F255-W384 HydrophobicContact CB-CZ2 4.4Å; Y256-W384 AromaticContact CD1-CH2 3.98Å; Y256-W384 HydrophobicContact CD1-CH2 3.98Å; Y256-W384 HydrophobicContact CD1-CZ2 4.3Å; Y256-W384 HydrophobicContact CE1-CH2 4.08Å; Y256-W384 HydrophobicContact CE1-CZ3 4.32Å; T382-W384 VanDerWaalsContact C-N 3.33Å; T382-W384 VanDerWaalsContact CB-CE3 3.46Å; T382-W384 HydrophobicContact CG2-CE3 3.91Å; T382-W384 HydrophobicContact CG2-CZ3 4.02Å; T382-W384 PolarHBondContact OG1-N 2.95Å; T382-W384 VanDerWaalsContact OG1-N 3.1Å
385	Y	94.7	Very high	94.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	160.3	-170.5	-50.5	-72.4	0	0	0	113.2	L62 L97 L98 L99 L246 M379	L62-Y385 HydrophobicContact CD1-CE1 4.23Å; L97-Y385 HydrophobicContact CB-CD1 4.13Å; L97-Y385 HydrophobicContact CB-CG 4.37Å; L97-Y385 HydrophobicContact CD1-CD1 4.33Å; L97-Y385 HydrophobicContact CD1-CD2 4.39Å; L97-Y385 HydrophobicContact CD1-CG 4.23Å; L97-Y385 HydrophobicContact CD2-CG 4.4Å; L98-Y385 CarbonylContact O-C 3.57Å; L98-Y385 WeakPolarHBondContact O-CA 3.37Å; L99-Y385 HydrophobicContact CD2-CD1 3.94Å; L99-Y385 HydrophobicContact CD2-CE1 3.82Å; L246-Y385 WeakPolarHBondContact O-CE2 3.41Å; L246-Y385 PolarHBondContact O-OH 3.26Å; M379-Y385 HydrophobicContact CB-CD2 4.49Å; M379-Y385 HydrophobicContact CE-CD2 3.61Å; M379-Y385 HydrophobicContact CE-CE2 3.45Å; M379-Y385 VanDerWaalsContact CE-CE2 3.45Å
386	I	94	Very high	94.3	Very high	50 Å²	50	27.5 Å²	27.5	26%	0.256	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.7	161.4	-60.3	170.3	0	0	0	105.8	Q59 L97 L98 R100	Q59-I386 HydrophobicContact CG-CD1 4.43Å; L97-I386 WeakPolarHBondContact CA-O 3.14Å; L98-I386 HydrophobicContact CB-CB 4.27Å; L98-I386 PolarHBondContact N-O 2.85Å; L98-I386 PolarHBondContact O-N 2.83Å; R100-I386 HydrophobicContact CB-CG1 4.07Å; R100-I386 HydrophobicContact CG-CG1 4.44Å
387	S	96	Very high	94	Very high	10 Å²	10	27.9 Å²	27.9	7%	0.07	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	139.5	-172.3	-57.1	0	0	0	0	112.4	L376 E380 Y389	L376-S387 WeakPolarHBondContact O-CB 3.15Å; L376-S387 PolarHBondContact O-OG 3.32Å; E380-S387 PolarHBondContact N-OG 3.11Å; S387-Y389 WeakPolarHBondContact O-CD2 3.4Å; S387-Y389 PolarHBondContact O-N 2.85Å
388	N	96.5	Very high	93.9	Very high	69 Å²	69	27.9 Å²	27.9	37%	0.369	15%	0.154	S	C	.	.			trans	-87.8	91.8	173.5	-178.7	4.6	0	0	0	111	D95 A96 L376 A390 L391	D95-N388 PolarHBondContact O-ND2 2.87Å; A96-N388 PolarHBondContact O-N 3.12Å; L376-N388 WeakPolarHBondContact CD1-O 3.32Å; N388-A390 PolarHBondContact O-N 3.46Å; N388-A390 VanDerWaalsContact O-N 3.15Å; N388-A390 VanDerWaalsContact OD1-CB 3.29Å; N388-A390 WeakPolarHBondContact OD1-CB 3.26Å; N388-A390 PolarHBondContact OD1-N 3.33Å; N388-L391 PolarHBondContact O-N 3.1Å
389	Y	96.7	Very high	93.7	Very high	58 Å²	58	33.5 Å²	33.5	23%	0.227	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-66.5	-12.7	-178	-67.1	-86.8	0	0	0	114.9	T319 I323 P373 L376 A377 E380 S387 L391 S392	T319-Y389 VanDerWaalsContact CG2-OH 3.3Å; T319-Y389 WeakPolarHBondContact CG2-OH 3.36Å; I323-Y389 HydrophobicContact CD1-CE1 4.09Å; I323-Y389 HydrophobicContact CG1-CE1 4.18Å; P373-Y389 HydrophobicContact CB-CD1 4.2Å; P373-Y389 WeakPolarHBondContact O-CE1 3.35Å; L376-Y389 HydrophobicContact CB-CD1 4.05Å; L376-Y389 HydrophobicContact CB-CE1 3.88Å; L376-Y389 HydrophobicContact CD1-CD1 4.28Å; A377-Y389 WeakPolarHBondContact CA-OH 3.28Å; A377-Y389 HydrophobicContact CB-CE1 4.31Å; E380-Y389 VanDerWaalsContact OE2-CE2 3.24Å; E380-Y389 WeakPolarHBondContact OE2-CE2 3.47Å; E380-Y389 PolarHBondContact OE2-OH 3.46Å; S387-Y389 WeakPolarHBondContact O-CD2 3.4Å; S387-Y389 PolarHBondContact O-N 2.85Å; Y389-L391 PolarHBondContact O-N 2.62Å; Y389-S392 PolarHBondContact O-N 2.65Å; Y389-S392 VanDerWaalsContact O-N 3.09Å; Y389-S392 PolarHBondContact O-OG 3.5Å
390	A	94.7	Very high	93.6	Very high	53 Å²	53	35.6 Å²	35.6	44%	0.438	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-60.2	-29.8	177.5	0	0	0	0	0	112.4	N388 S392 Q393	N388-A390 PolarHBondContact O-N 3.46Å; N388-A390 VanDerWaalsContact O-N 3.15Å; N388-A390 VanDerWaalsContact OD1-CB 3.29Å; N388-A390 WeakPolarHBondContact OD1-CB 3.26Å; N388-A390 PolarHBondContact OD1-N 3.33Å; A390-S392 PolarHBondContact O-N 2.76Å; A390-Q393 WeakPolarHBondContact O-CG 3.12Å
391	L	92.5	Very high	93.5	Very high	65 Å²	65	36.7 Å²	36.7	34%	0.34	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-69.9	-9.7	178.5	-60.7	177.8	0	0	0	113.9	F92 A96 I371 N388 Y389	F92-L391 HydrophobicContact CE2-CD1 4.34Å; A96-L391 HydrophobicContact CB-CD1 3.57Å; I371-L391 HydrophobicContact CG2-CB 4.15Å; I371-L391 WeakPolarHBondContact CG2-O 3.16Å; N388-L391 PolarHBondContact O-N 3.1Å; Y389-L391 PolarHBondContact O-N 2.62Å
392	S	92.9	Very high	93.5	Very high	4 Å²	4	37 Å²	37	3%	0.028	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-112.2	8.8	-174.7	68.6	0	0	0	0	114.3	I371 P373 Y389 A390 S394 F395	I371-S392 WeakPolarHBondContact O-CA 3.37Å; I371-S392 WeakPolarHBondContact O-CB 3.43Å; P373-S392 WeakPolarHBondContact CA-OG 3.46Å; P373-S392 WeakPolarHBondContact CB-OG 3.41Å; Y389-S392 PolarHBondContact O-N 2.65Å; Y389-S392 VanDerWaalsContact O-N 3.09Å; Y389-S392 PolarHBondContact O-OG 3.5Å; A390-S392 PolarHBondContact O-N 2.76Å; S392-S394 VanDerWaalsContact C-N 3.35Å; S392-S394 PolarHBondContact O-N 2.91Å; S392-F395 WeakPolarHBondContact O-CB 3.45Å; S392-F395 PolarHBondContact O-N 3.19Å
393	Q	82.6	Confident	93.6	Very high	147 Å²	147	38.8 Å²	38.8	69%	0.687	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-36.2	-171.4	-72.9	-179.6	2.9	0	0	113.4	A390 F395 R399	A390-Q393 WeakPolarHBondContact O-CG 3.12Å; Q393-F395 VanDerWaalsContact C-N 3.3Å; Q393-F395 PolarHBondContact O-N 3.17Å; Q393-R399 PolarHBondContact O-NH2 3.41Å
394	S	83.6	Confident	93.8	Very high	61 Å²	61	39.7 Å²	39.7	43%	0.427	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-16	179.5	53.9	0	0	0	0	113.9	Q370 S392 S396	Q370-S394 PolarHBondContact OE1-OG 3.16Å; S392-S394 VanDerWaalsContact C-N 3.35Å; S392-S394 PolarHBondContact O-N 2.91Å; S394-S396 PolarHBondContact O-N 3.14Å; S394-S396 VanDerWaalsContact O-N 3.14Å
395	F	91.5	Very high	94	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.222	C	C	.	.			trans	-63.3	118.2	-175.3	-163.3	-88.9	0	0	0	111.4	F327 L356 N358 D359 Q370 S392 Q393 W397 R399	F327-F395 HydrophobicContact CE1-CD1 4.44Å; F327-F395 HydrophobicContact CE1-CE1 4.39Å; F327-F395 AromaticContact CE2-CD1 3.84Å; F327-F395 HydrophobicContact CE2-CD1 3.84Å; F327-F395 AromaticContact CZ-CD1 3.5Å; F327-F395 HydrophobicContact CZ-CD1 3.5Å; F327-F395 VanDerWaalsContact CZ-CD1 3.5Å; F327-F395 AromaticContact CZ-CE1 3.78Å; F327-F395 HydrophobicContact CZ-CE1 3.78Å; L356-F395 HydrophobicContact CD2-CE1 3.67Å; L356-F395 HydrophobicContact CD2-CZ 3.92Å; N358-F395 VanDerWaalsContact OD1-CE2 3.31Å; N358-F395 WeakPolarHBondContact OD1-CE2 3.31Å; D359-F395 HydrophobicContact CB-CE2 3.87Å; D359-F395 HydrophobicContact CB-CZ 3.83Å; Q370-F395 HydrophobicContact CB-CD2 3.65Å; Q370-F395 HydrophobicContact CB-CE2 4.18Å; S392-F395 WeakPolarHBondContact O-CB 3.45Å; S392-F395 PolarHBondContact O-N 3.19Å; Q393-F395 VanDerWaalsContact C-N 3.3Å; Q393-F395 PolarHBondContact O-N 3.17Å; F395-W397 HydrophobicContact CE1-CB 4.14Å; F395-W397 HydrophobicContact CZ-CB 4.23Å; F395-R399 PolarHBondContact O-NE 2.9Å; F395-R399 PolarHBondContact O-NH2 2.96Å
396	S	91	Very high	94.2	Very high	23 Å²	23	39.8 Å²	39.8	16%	0.161	22%	0.223	C	C	.	.			trans	-123.5	-19.7	-165.6	72.5	0	0	0	0	115.3	S394 G398 R399 P448 G449	S394-S396 PolarHBondContact O-N 3.14Å; S394-S396 VanDerWaalsContact O-N 3.14Å; S396-G398 VanDerWaalsContact C-N 3.34Å; S396-G398 PolarHBondContact O-N 3.42Å; S396-G398 VanDerWaalsContact O-N 3.11Å; S396-R399 WeakPolarHBondContact O-CB 3.15Å; S396-R399 PolarHBondContact O-N 2.73Å; S396-P448 VanDerWaalsContact OG-C 3.24Å; S396-P448 PolarHBondContact OG-O 2.82Å; S396-G449 PolarHBondContact OG-N 2.88Å
397	W	93	Very high	94.3	Very high	8 Å²	8	39.2 Å²	39.2	3%	0.03	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-49.8	-168.6	177.7	-98.9	0	0	0	114.6	R354 E357 F395 R401 F405 P426 P448 Y514	R354-W397 PolarHBondContact O-NE1 3.21Å; E357-W397 HydrophobicContact CB-CD2 3.38Å; E357-W397 HydrophobicContact CB-CE3 3.68Å; E357-W397 HydrophobicContact CB-CG 3.9Å; E357-W397 HydrophobicContact CB-CH2 3.75Å; E357-W397 HydrophobicContact CB-CZ2 3.51Å; E357-W397 HydrophobicContact CB-CZ3 3.85Å; E357-W397 HydrophobicContact CG-CD2 4.26Å; E357-W397 HydrophobicContact CG-CE3 4.14Å; E357-W397 HydrophobicContact CG-CH2 3.56Å; E357-W397 HydrophobicContact CG-CZ2 3.74Å; E357-W397 HydrophobicContact CG-CZ3 3.79Å; F395-W397 HydrophobicContact CE1-CB 4.14Å; F395-W397 HydrophobicContact CZ-CB 4.23Å; W397-R401 WeakPolarHBondContact O-CD 3.48Å; W397-R401 PolarHBondContact O-NE 2.93Å; W397-F405 AromaticContact NE1-CZ 3.74Å; W397-P426 HydrophobicContact CD2-CB 4.12Å; W397-P426 HydrophobicContact CD2-CG 4.24Å; W397-P426 HydrophobicContact CE3-CB 3.88Å; W397-P426 HydrophobicContact CE3-CG 4.49Å; W397-P426 HydrophobicContact CH2-CB 3.63Å; W397-P426 HydrophobicContact CH2-CG 4.07Å; W397-P426 HydrophobicContact CZ2-CB 3.84Å; W397-P426 HydrophobicContact CZ2-CG 3.75Å; W397-P426 HydrophobicContact CZ3-CB 3.64Å; W397-P426 HydrophobicContact CZ3-CG 4.43Å; W397-P448 HydrophobicContact CE3-CG 3.99Å; W397-P448 HydrophobicContact CZ3-CG 4.29Å; W397-Y514 HydrophobicContact CH2-CD1 4.24Å; W397-Y514 AromaticContact CH2-CD2 3.56Å; W397-Y514 HydrophobicContact CH2-CD2 3.56Å; W397-Y514 HydrophobicContact CH2-CE2 4.24Å; W397-Y514 AromaticContact CH2-CG 3.55Å; W397-Y514 HydrophobicContact CH2-CG 3.55Å; W397-Y514 HydrophobicContact CZ2-CG 4.33Å; W397-Y514 HydrophobicContact CZ3-CD2 4.07Å; W397-Y514 HydrophobicContact CZ3-CG 4.45Å
398	G	95.4	Very high	94.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	2.4	-179.5	0	0	0	0	0	115.5	Y328 S396 G400 R401	Y328-G398 WeakPolarHBondContact CD1-O 3.46Å; S396-G398 VanDerWaalsContact C-N 3.34Å; S396-G398 PolarHBondContact O-N 3.42Å; S396-G398 VanDerWaalsContact O-N 3.11Å; G398-G400 PolarHBondContact O-N 2.92Å; G398-R401 PolarHBondContact O-N 3.29Å
399	R	94.8	Very high	94.5	Very high	119 Å²	119	35.6 Å²	35.6	45%	0.449	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	123.8	-166.9	-174.4	176.5	-67	-90.4	2.2	111.7	F327 Q393 F395 S396 R401	F327-R399 HydrophobicContact CD2-CB 4.36Å; F327-R399 HydrophobicContact CE2-CB 3.79Å; F327-R399 HydrophobicContact CE2-CG 4.33Å; F327-R399 HydrophobicContact CZ-CB 4.16Å; F327-R399 CarbonylContact O-C 3.58Å; F327-R399 WeakPolarHBondContact O-CA 3.41Å; Q393-R399 PolarHBondContact O-NH2 3.41Å; F395-R399 PolarHBondContact O-NE 2.9Å; F395-R399 PolarHBondContact O-NH2 2.96Å; S396-R399 WeakPolarHBondContact O-CB 3.15Å; S396-R399 PolarHBondContact O-N 2.73Å; R399-R401 VanDerWaalsContact C-N 3.27Å; R399-R401 PolarHBondContact O-N 3.18Å
400	G	95.4	Very high	94.6	Very high	43 Å²	43	32.8 Å²	32.8	44%	0.443	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	69	15.2	174	0	0	0	0	0	115.8	F327 Y328 G398 G402	F327-G400 PolarHBondContact O-N 3.03Å; Y328-G400 CarbonylContact O-C 3.5Å; Y328-G400 VanDerWaalsContact O-C 3.25Å; Y328-G400 WeakPolarHBondContact O-CA 3.49Å; G398-G400 PolarHBondContact O-N 2.92Å; G400-G402 VanDerWaalsContact C-N 3.34Å; G400-G402 PolarHBondContact O-N 3.05Å
401	R	96.4	Very high	94.8	Very high	46 Å²	46	30.3 Å²	30.3	17%	0.174	17%	0.17	C	C	.	.			trans	-85.4	2.2	-172	-61.9	-168.8	-179	-78.4	4.4	116	Y328 W397 G398 R399 F405 Y413 A425 P426	Y328-R401 PolarHBondContact O-N 2.99Å; Y328-R401 VanDerWaalsContact O-N 3.09Å; W397-R401 WeakPolarHBondContact O-CD 3.48Å; W397-R401 PolarHBondContact O-NE 2.93Å; G398-R401 PolarHBondContact O-N 3.29Å; R399-R401 VanDerWaalsContact C-N 3.27Å; R399-R401 PolarHBondContact O-N 3.18Å; R401-F405 HydrophobicContact CB-CB 3.59Å; R401-F405 HydrophobicContact CB-CD1 3.99Å; R401-F405 HydrophobicContact CB-CD2 3.95Å; R401-F405 HydrophobicContact CB-CG 3.56Å; R401-F405 HydrophobicContact CG-CD2 4.43Å; R401-F405 HydrophobicContact CG-CG 4.4Å; R401-F405 WeakPolarHBondContact O-CB 3.44Å; R401-Y413 HydrophobicContact CB-CE2 4.1Å; R401-Y413 PolarHBondContact NH1-OH 3.45Å; R401-A425 PolarHBondContact NH1-O 3.41Å; R401-P426 VanDerWaalsContact CZ-CD 3.44Å
402	G	97.7	Very high	95	Very high	15 Å²	15	30.4 Å²	30.4	16%	0.155	17%	0.169	C	C	.	.	H	α-helix	trans	77.9	-178.6	173.7	0	0	0	0	0	114.5	Y328 G400 A406	Y328-G402 WeakPolarHBondContact O-CA 3.25Å; Y328-G402 PolarHBondContact O-N 2.62Å; G400-G402 VanDerWaalsContact C-N 3.34Å; G400-G402 PolarHBondContact O-N 3.05Å; G402-A406 PolarHBondContact O-N 3.38Å
403	C	98.4	Very high	95.3	Very high	39 Å²	39	30.3 Å²	30.3	26%	0.264	17%	0.168	S	C	.	.	H	α-helix	trans	-69.8	-39	-174.9	-63.3	0	0	0	0	113.1	C330 S332 F405 A406 T407	C330-C403 WeakPolarHBondContact CA-SG 3.41Å; C330-C403 HydrophobicContact CB-CB 3.96Å; C330-C403 WeakPolarHBondContact CB-SG 3.14Å; C330-C403 WeakPolarHBondContact SG-CA 3.35Å; C330-C403 WeakPolarHBondContact SG-CB 3.46Å; C330-C403 CovalentContact SG-SG 2.04Å; C330-C403 PolarHBondContact SG-SG 2.67Å; S332-C403 PolarHBondContact OG-SG 2.85Å; S332-C403 VanDerWaalsContact OG-SG 3.34Å; C403-F405 VanDerWaalsContact C-N 3.25Å; C403-F405 PolarHBondContact O-N 3.48Å; C403-A406 PolarHBondContact O-N 3.13Å; C403-T407 PolarHBondContact O-N 3.48Å; C403-T407 PolarHBondContact O-OG1 3.24Å
404	T	98.1	Very high	96.1	Very high	22 Å²	22	23.3 Å²	23.3	14%	0.135	14%	0.135	C	C	.	.	H	α-helix	trans	-58.8	-38.5	179.6	-51.4	0	0	0	0	111.6	G408 E412 E416	T404-G408 VanDerWaalsContact O-CA 3.27Å; T404-G408 WeakPolarHBondContact O-CA 3.1Å; T404-G408 PolarHBondContact O-N 3.1Å; T404-E412 HydrophobicContact CG2-CB 3.95Å; T404-E412 HydrophobicContact CG2-CG 3.67Å; T404-E416 WeakPolarHBondContact CB-OE2 3.38Å; T404-E416 PolarHBondContact OG1-OE2 3.18Å
405	F	98.3	Very high	96.7	Very high	1 Å²	1	21.2 Å²	21.2	0%	0.004	12%	0.12	C	C	.	.	H	α-helix	trans	-63.3	-47.5	171.7	-174.4	-90.8	0	0	0	112	Y328 R354 L355 W397 R401 C403 Y413 P426 F427	Y328-F405 AromaticContact CD1-CD1 3.97Å; Y328-F405 HydrophobicContact CD1-CD1 3.97Å; Y328-F405 HydrophobicContact CD1-CE1 4.33Å; Y328-F405 AromaticContact CE1-CD1 3.93Å; Y328-F405 HydrophobicContact CE1-CD1 3.93Å; Y328-F405 AromaticContact CE1-CE1 3.88Å; Y328-F405 HydrophobicContact CE1-CE1 3.88Å; R354-F405 PolarHBondContact NH1-O 3.27Å; L355-F405 HydrophobicContact CD2-CD1 4.22Å; L355-F405 HydrophobicContact CD2-CE1 4.15Å; L355-F405 WeakPolarHBondContact CD2-O 3.23Å; W397-F405 AromaticContact NE1-CZ 3.74Å; R401-F405 HydrophobicContact CB-CB 3.59Å; R401-F405 HydrophobicContact CB-CD1 3.99Å; R401-F405 HydrophobicContact CB-CD2 3.95Å; R401-F405 HydrophobicContact CB-CG 3.56Å; R401-F405 HydrophobicContact CG-CD2 4.43Å; R401-F405 HydrophobicContact CG-CG 4.4Å; R401-F405 WeakPolarHBondContact O-CB 3.44Å; C403-F405 VanDerWaalsContact C-N 3.25Å; C403-F405 PolarHBondContact O-N 3.48Å; F405-Y413 HydrophobicContact CB-CD2 3.69Å; F405-Y413 HydrophobicContact CB-CE2 3.93Å; F405-Y413 HydrophobicContact CB-CG 4.39Å; F405-Y413 HydrophobicContact CD2-CD1 4.2Å; F405-Y413 AromaticContact CD2-CD2 3.99Å; F405-Y413 HydrophobicContact CD2-CD2 3.99Å; F405-Y413 HydrophobicContact CD2-CE1 4.12Å; F405-Y413 AromaticContact CD2-CE2 3.95Å; F405-Y413 HydrophobicContact CD2-CE2 3.95Å; F405-Y413 HydrophobicContact CD2-CG 4.1Å; F405-Y413 AromaticContact CD2-CZ 3.99Å; F405-Y413 HydrophobicContact CG-CD2 4.36Å; F405-Y413 HydrophobicContact CG-CE2 4.39Å; F405-P426 HydrophobicContact CE2-CG 3.77Å; F405-P426 HydrophobicContact CZ-CG 4.21Å; F405-F427 AromaticContact CD2-CE2 3.9Å; F405-F427 HydrophobicContact CD2-CE2 3.9Å; F405-F427 HydrophobicContact CD2-CZ 4.45Å; F405-F427 HydrophobicContact CE2-CD2 4.5Å; F405-F427 AromaticContact CE2-CE2 3.58Å; F405-F427 HydrophobicContact CE2-CE2 3.58Å; F405-F427 AromaticContact CE2-CZ 3.81Å; F405-F427 HydrophobicContact CE2-CZ 3.81Å; F405-F427 HydrophobicContact CZ-CZ 4.47Å
406	A	98.1	Very high	97	Very high	2 Å²	2	25.1 Å²	25.1	2%	0.017	14%	0.138	C	C	.	.	H	α-helix	trans	-71.4	-28.3	-173.4	0	0	0	0	0	114.3	Y328 L333 G402 C403	Y328-A406 HydrophobicContact CD1-CB 4.41Å; Y328-A406 HydrophobicContact CD2-CB 4.22Å; Y328-A406 HydrophobicContact CG-CB 4.1Å; L333-A406 HydrophobicContact CD1-CB 3.83Å; L333-A406 HydrophobicContact CD2-CB 4.41Å; G402-A406 PolarHBondContact O-N 3.38Å; C403-A406 PolarHBondContact O-N 3.13Å
407	T	97.7	Very high	97.3	Very high	38 Å²	38	25.5 Å²	25.5	23%	0.233	14%	0.137	C	C	.	.	H	α-helix	trans	-128.4	-19.1	-171.8	64.7	0	0	0	0	115.4	L333 C403	L333-T407 HydrophobicContact CD1-CG2 3.62Å; C403-T407 PolarHBondContact O-N 3.48Å; C403-T407 PolarHBondContact O-OG1 3.24Å
408	G	97.7	Very high	97.5	Very high	3 Å²	3	28 Å²	28	3%	0.031	16%	0.155	C	C	.	.	S	Bend	trans	-98.1	178.8	-178.6	0	0	0	0	0	112.6	W301 R354 T404	W301-G408 WeakPolarHBondContact CZ3-O 3.34Å; R354-G408 PolarHBondContact NH1-O 3.09Å; T404-G408 VanDerWaalsContact O-CA 3.27Å; T404-G408 WeakPolarHBondContact O-CA 3.1Å; T404-G408 PolarHBondContact O-N 3.1Å
409	S	98.1	Very high	97.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.19	C	C	.	.			trans	-74	158.9	173.5	75.2	0	0	0	0	111.3	W301 L302 L411 E412 Y413	W301-S409 VanDerWaalsContact CE2-CB 3.47Å; L302-S409 VanDerWaalsContact O-CB 3.29Å; L302-S409 WeakPolarHBondContact O-CB 3.38Å; L302-S409 PolarHBondContact O-OG 3.15Å; S409-L411 PolarHBondContact O-N 3.19Å; S409-L411 PolarHBondContact OG-N 3.08Å; S409-E412 PolarHBondContact O-N 3.09Å; S409-E412 PolarHBondContact OG-N 3.1Å; S409-Y413 PolarHBondContact O-N 3.39Å; S409-Y413 VanDerWaalsContact O-N 3.14Å
410	C	98.2	Very high	97.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.3	-29	171.7	49.9	0	0	0	0	112.3	M414 F427 Y471 C512	C410-M414 HydrophobicContact CB-CE 4.34Å; C410-M414 WeakPolarHBondContact O-CB 3.38Å; C410-M414 WeakPolarHBondContact O-CE 3.19Å; C410-M414 WeakPolarHBondContact O-CG 3.32Å; C410-M414 PolarHBondContact O-N 2.83Å; C410-F427 HydrophobicContact CB-CD1 3.99Å; C410-F427 HydrophobicContact CB-CD2 3.67Å; C410-F427 HydrophobicContact CB-CE1 3.87Å; C410-F427 HydrophobicContact CB-CE2 3.52Å; C410-F427 HydrophobicContact CB-CG 3.9Å; C410-F427 HydrophobicContact CB-CZ 3.64Å; C410-Y471 WeakPolarHBondContact SG-CE2 3.28Å; C410-C512 HydrophobicContact CB-CB 3.58Å; C410-C512 WeakPolarHBondContact CB-SG 3.4Å; C410-C512 WeakPolarHBondContact SG-CA 3.19Å; C410-C512 WeakPolarHBondContact SG-CB 3.34Å; C410-C512 CovalentContact SG-SG 2.03Å; C410-C512 PolarHBondContact SG-SG 3.22Å
411	L	98.6	Very high	97.3	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.9	-48	173.7	177.3	60.2	0	0	0	111.6	L302 S409 Y413 M414 L415 Y471 L488 G489	L302-L411 HydrophobicContact CD2-CG 4.46Å; L302-L411 HydrophobicContact CG-CD2 4.16Å; S409-L411 PolarHBondContact O-N 3.19Å; S409-L411 PolarHBondContact OG-N 3.08Å; L411-Y413 VanDerWaalsContact C-N 3.33Å; L411-Y413 PolarHBondContact O-N 3.03Å; L411-M414 PolarHBondContact O-N 3.09Å; L411-L415 HydrophobicContact CD1-CD1 4.17Å; L411-L415 HydrophobicContact CD1-CG 4.15Å; L411-L415 HydrophobicContact CG-CD1 4.09Å; L411-L415 WeakPolarHBondContact O-CB 3.16Å; L411-L415 VanDerWaalsContact O-CG 3.31Å; L411-L415 WeakPolarHBondContact O-CG 3.46Å; L411-L415 PolarHBondContact O-N 3.33Å; L411-Y471 HydrophobicContact CB-CD1 3.65Å; L411-Y471 HydrophobicContact CB-CE1 4.45Å; L411-Y471 HydrophobicContact CB-CG 4.22Å; L411-Y471 WeakPolarHBondContact CD1-O 3.46Å; L411-Y471 HydrophobicContact CD2-CD1 4.5Å; L411-L488 HydrophobicContact CD1-CB 3.84Å; L411-L488 HydrophobicContact CD1-CD2 4.21Å; L411-G489 WeakPolarHBondContact CD1-O 3.25Å
412	E	98.4	Very high	97.1	Very high	68 Å²	68	38 Å²	38	32%	0.318	22%	0.22	S	C	.	.	H	α-helix	trans	-60.2	-45.8	179.5	-163.1	172.9	175.9	0	0	111.4	L302 T404 S409 L415 E416	L302-E412 HydrophobicContact CB-CB 4.08Å; L302-E412 HydrophobicContact CB-CG 4.47Å; L302-E412 HydrophobicContact CD2-CB 4.15Å; L302-E412 HydrophobicContact CD2-CG 4.21Å; T404-E412 HydrophobicContact CG2-CB 3.95Å; T404-E412 HydrophobicContact CG2-CG 3.67Å; S409-E412 PolarHBondContact O-N 3.09Å; S409-E412 PolarHBondContact OG-N 3.1Å; E412-L415 PolarHBondContact O-N 3.17Å; E412-E416 PolarHBondContact O-N 3.36Å
413	Y	98.5	Very high	96.7	Very high	1 Å²	1	42.2 Å²	42.2	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-59.9	-50	174.8	173	-98.4	0	0	0	112.2	R401 F405 S409 L411 L415 E416 Q417 A425 F427	R401-Y413 HydrophobicContact CB-CE2 4.1Å; R401-Y413 PolarHBondContact NH1-OH 3.45Å; F405-Y413 HydrophobicContact CB-CD2 3.69Å; F405-Y413 HydrophobicContact CB-CE2 3.93Å; F405-Y413 HydrophobicContact CB-CG 4.39Å; F405-Y413 HydrophobicContact CD2-CD1 4.2Å; F405-Y413 AromaticContact CD2-CD2 3.99Å; F405-Y413 HydrophobicContact CD2-CD2 3.99Å; F405-Y413 HydrophobicContact CD2-CE1 4.12Å; F405-Y413 AromaticContact CD2-CE2 3.95Å; F405-Y413 HydrophobicContact CD2-CE2 3.95Å; F405-Y413 HydrophobicContact CD2-CG 4.1Å; F405-Y413 AromaticContact CD2-CZ 3.99Å; F405-Y413 HydrophobicContact CG-CD2 4.36Å; F405-Y413 HydrophobicContact CG-CE2 4.39Å; S409-Y413 PolarHBondContact O-N 3.39Å; S409-Y413 VanDerWaalsContact O-N 3.14Å; L411-Y413 VanDerWaalsContact C-N 3.33Å; L411-Y413 PolarHBondContact O-N 3.03Å; Y413-L415 VanDerWaalsContact C-N 3.27Å; Y413-L415 PolarHBondContact O-N 3.3Å; Y413-E416 WeakPolarHBondContact O-CB 3.31Å; Y413-E416 PolarHBondContact O-N 2.93Å; Y413-E416 VanDerWaalsContact O-N 3.16Å; Y413-Q417 HydrophobicContact CD1-CG 4.24Å; Y413-Q417 HydrophobicContact CD2-CG 4.1Å; Y413-Q417 HydrophobicContact CE1-CG 3.85Å; Y413-Q417 HydrophobicContact CE2-CG 3.64Å; Y413-Q417 VanDerWaalsContact CE2-OE1 3.26Å; Y413-Q417 HydrophobicContact CG-CG 4.39Å; Y413-Q417 VanDerWaalsContact O-CG 3.31Å; Y413-Q417 WeakPolarHBondContact O-CG 3.47Å; Y413-Q417 PolarHBondContact O-N 3.37Å; Y413-Q417 PolarHBondContact OH-OE1 2.77Å; Y413-A425 PolarHBondContact OH-O 3.41Å; Y413-F427 AromaticContact CD1-CD2 3.58Å; Y413-F427 HydrophobicContact CD1-CD2 3.58Å; Y413-F427 AromaticContact CD1-CE2 3.82Å; Y413-F427 HydrophobicContact CD1-CE2 3.82Å; Y413-F427 AromaticContact CE1-CD2 3.97Å; Y413-F427 HydrophobicContact CE1-CD2 3.97Å; Y413-F427 HydrophobicContact CE1-CE2 4.32Å; Y413-F427 HydrophobicContact CG-CE2 4.45Å
414	M	98.3	Very high	96.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.8	-35.7	-179.5	-70.4	-172.3	-72.1	0	0	112	C410 L411 S418 I424 F427 F472 L488	C410-M414 HydrophobicContact CB-CE 4.34Å; C410-M414 WeakPolarHBondContact O-CB 3.38Å; C410-M414 WeakPolarHBondContact O-CE 3.19Å; C410-M414 WeakPolarHBondContact O-CG 3.32Å; C410-M414 PolarHBondContact O-N 2.83Å; L411-M414 PolarHBondContact O-N 3.09Å; M414-S418 VanDerWaalsContact O-CB 3.28Å; M414-S418 WeakPolarHBondContact O-CB 3.48Å; M414-S418 PolarHBondContact O-N 2.96Å; M414-S418 PolarHBondContact O-OG 3.42Å; M414-I424 HydrophobicContact CB-CB 4.29Å; M414-I424 HydrophobicContact CB-CG2 4.14Å; M414-I424 HydrophobicContact CG-CB 4.01Å; M414-I424 HydrophobicContact CG-CD1 4.46Å; M414-I424 HydrophobicContact CG-CG2 4.41Å; M414-I424 HydrophobicContact SD-CD1 4.04Å; M414-F427 HydrophobicContact CG-CB 3.96Å; M414-F427 HydrophobicContact CG-CD2 4.31Å; M414-F427 HydrophobicContact SD-CB 3.71Å; M414-F472 HydrophobicContact CE-CZ 4.32Å; M414-L488 HydrophobicContact CB-CD1 3.67Å; M414-L488 HydrophobicContact CB-CD2 4.28Å; M414-L488 HydrophobicContact CE-CD2 3.7Å; M414-L488 HydrophobicContact SD-CD2 3.95Å
415	L	98	Very high	96.3	Very high	18 Å²	18	42.2 Å²	42.2	9%	0.094	25%	0.245	C	C	.	.	H	α-helix	trans	-67.4	-44	173.8	-73	172	0	0	0	112.3	L302 L411 E412 Y413 S418 R419 L488 G489 T490	L302-L415 HydrophobicContact CD2-CD1 3.77Å; L411-L415 HydrophobicContact CD1-CD1 4.17Å; L411-L415 HydrophobicContact CD1-CG 4.15Å; L411-L415 HydrophobicContact CG-CD1 4.09Å; L411-L415 WeakPolarHBondContact O-CB 3.16Å; L411-L415 VanDerWaalsContact O-CG 3.31Å; L411-L415 WeakPolarHBondContact O-CG 3.46Å; L411-L415 PolarHBondContact O-N 3.33Å; E412-L415 PolarHBondContact O-N 3.17Å; Y413-L415 VanDerWaalsContact C-N 3.27Å; Y413-L415 PolarHBondContact O-N 3.3Å; L415-S418 PolarHBondContact O-N 2.95Å; L415-R419 WeakPolarHBondContact O-CB 3.18Å; L415-R419 VanDerWaalsContact O-CG 3.25Å; L415-R419 WeakPolarHBondContact O-CG 3.04Å; L415-R419 PolarHBondContact O-N 3.09Å; L415-L488 HydrophobicContact CD2-CB 4.02Å; L415-L488 HydrophobicContact CD2-CD1 4.17Å; L415-L488 HydrophobicContact CG-CD1 4.49Å; L415-G489 WeakPolarHBondContact CD1-O 3.44Å; L415-T490 HydrophobicContact CD2-CG2 4.16Å
416	E	97.7	Very high	96.1	Very high	82 Å²	82	42.2 Å²	42.2	38%	0.383	25%	0.245	S	C	.	.	H	α-helix	trans	-58.6	-47.5	176.1	-176	-175.8	94	0	0	111.1	T404 E412 Y413 R419 G420	T404-E416 WeakPolarHBondContact CB-OE2 3.38Å; T404-E416 PolarHBondContact OG1-OE2 3.18Å; E412-E416 PolarHBondContact O-N 3.36Å; Y413-E416 WeakPolarHBondContact O-CB 3.31Å; Y413-E416 PolarHBondContact O-N 2.93Å; Y413-E416 VanDerWaalsContact O-N 3.16Å; E416-R419 PolarHBondContact O-N 3.27Å; E416-G420 PolarHBondContact O-N 2.85Å; E416-G420 VanDerWaalsContact O-N 3.12Å
417	Q	97.5	Very high	96.1	Very high	31 Å²	31	42.1 Å²	42.1	15%	0.145	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-44.2	178.2	-59.3	-71	-134.2	0	0	112	Y413 R419 G420 G421 H422 I424	Y413-Q417 HydrophobicContact CD1-CG 4.24Å; Y413-Q417 HydrophobicContact CD2-CG 4.1Å; Y413-Q417 HydrophobicContact CE1-CG 3.85Å; Y413-Q417 HydrophobicContact CE2-CG 3.64Å; Y413-Q417 VanDerWaalsContact CE2-OE1 3.26Å; Y413-Q417 HydrophobicContact CG-CG 4.39Å; Y413-Q417 VanDerWaalsContact O-CG 3.31Å; Y413-Q417 WeakPolarHBondContact O-CG 3.47Å; Y413-Q417 PolarHBondContact O-N 3.37Å; Y413-Q417 PolarHBondContact OH-OE1 2.77Å; Q417-R419 VanDerWaalsContact C-N 3.34Å; Q417-R419 PolarHBondContact O-N 2.83Å; Q417-G420 CarbonylContact O-C 3.59Å; Q417-G420 PolarHBondContact O-N 3.48Å; Q417-G420 VanDerWaalsContact O-N 3.14Å; Q417-G421 PolarHBondContact O-N 3.21Å; Q417-G421 VanDerWaalsContact O-N 3.1Å; Q417-H422 CarbonylContact C-O 3.59Å; Q417-H422 HydrophobicContact CB-CB 4.27Å; Q417-H422 PolarHBondContact O-N 3.19Å; Q417-I424 HydrophobicContact CB-CG2 4.27Å
418	S	95.3	Very high	96	Very high	59 Å²	59	40.5 Å²	40.5	41%	0.413	24%	0.235	S	C	.	.	H	α-helix	trans	-60.6	-41.4	177.1	-61.4	0	0	0	0	112.5	M414 L415 G420 G421 I424	M414-S418 VanDerWaalsContact O-CB 3.28Å; M414-S418 WeakPolarHBondContact O-CB 3.48Å; M414-S418 PolarHBondContact O-N 2.96Å; M414-S418 PolarHBondContact O-OG 3.42Å; L415-S418 PolarHBondContact O-N 2.95Å; S418-G420 VanDerWaalsContact C-N 3.31Å; S418-G420 PolarHBondContact O-N 2.75Å; S418-G421 PolarHBondContact O-N 2.84Å; S418-I424 WeakPolarHBondContact OG-CG2 3.12Å
419	R	96.2	Very high	95.8	Very high	195 Å²	195	42.1 Å²	42.1	74%	0.736	24%	0.241	S	C	*	.	H	α-helix	trans	-64.7	-35.3	176.4	-73.8	169.9	-175.4	159.4	2.4	112.4	L415 E416 Q417 G421	L415-R419 WeakPolarHBondContact O-CB 3.18Å; L415-R419 VanDerWaalsContact O-CG 3.25Å; L415-R419 WeakPolarHBondContact O-CG 3.04Å; L415-R419 PolarHBondContact O-N 3.09Å; E416-R419 PolarHBondContact O-N 3.27Å; Q417-R419 VanDerWaalsContact C-N 3.34Å; Q417-R419 PolarHBondContact O-N 2.83Å; R419-G421 VanDerWaalsContact C-N 3.31Å
420	G	94.6	Very high	95.3	Very high	45 Å²	45	44 Å²	44	46%	0.464	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-4.2	176.7	0	0	0	0	0	114.9	E416 Q417 S418 H422	E416-G420 PolarHBondContact O-N 2.85Å; E416-G420 VanDerWaalsContact O-N 3.12Å; Q417-G420 CarbonylContact O-C 3.59Å; Q417-G420 PolarHBondContact O-N 3.48Å; Q417-G420 VanDerWaalsContact O-N 3.14Å; S418-G420 VanDerWaalsContact C-N 3.31Å; S418-G420 PolarHBondContact O-N 2.75Å; G420-H422 VanDerWaalsContact C-N 3.25Å; G420-H422 PolarHBondContact O-CE1 2.85Å; G420-H422 PolarHBondContact O-N 3.42Å; G420-H422 PolarHBondContact O-ND1 3.3Å
421	G	92.2	Very high	94.8	Very high	69 Å²	69	45 Å²	45	71%	0.711	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	19.9	-173.2	0	0	0	0	0	114	Q417 S418 R419	Q417-G421 PolarHBondContact O-N 3.21Å; Q417-G421 VanDerWaalsContact O-N 3.1Å; S418-G421 PolarHBondContact O-N 2.84Å; R419-G421 VanDerWaalsContact C-N 3.31Å
422	H	91.5	Very high	93.9	Very high	111 Å²	111	46.1 Å²	46.1	51%	0.514	26%	0.262	S	S	.	.			trans	-94.4	154.8	177.8	-59	101.5	0	0	0	111.1	Q417 G420	Q417-H422 CarbonylContact C-O 3.59Å; Q417-H422 HydrophobicContact CB-CB 4.27Å; Q417-H422 PolarHBondContact O-N 3.19Å; G420-H422 VanDerWaalsContact C-N 3.25Å; G420-H422 PolarHBondContact O-CE1 2.85Å; G420-H422 PolarHBondContact O-N 3.42Å; G420-H422 PolarHBondContact O-ND1 3.3Å
423	P	90.5	Very high	92.4	Very high	103 Å²	103	43.9 Å²	43.9	67%	0.669	25%	0.254	S	S	*	.			trans	-58.7	138.9	172	-22.7	33.7	0	0	0	112	A425	P423-A425 PolarHBondContact O-N 3.39Å
424	I	94.8	Very high	90.3	Very high	29 Å²	29	48.3 Å²	48.3	15%	0.149	29%	0.285	C	S	.	.			trans	-79	-6.3	175.4	63.9	165.3	0	0	0	113.6	M414 Q417 S418 F427 Q429	M414-I424 HydrophobicContact CB-CB 4.29Å; M414-I424 HydrophobicContact CB-CG2 4.14Å; M414-I424 HydrophobicContact CG-CB 4.01Å; M414-I424 HydrophobicContact CG-CD1 4.46Å; M414-I424 HydrophobicContact CG-CG2 4.41Å; M414-I424 HydrophobicContact SD-CD1 4.04Å; Q417-I424 HydrophobicContact CB-CG2 4.27Å; S418-I424 WeakPolarHBondContact OG-CG2 3.12Å; I424-F427 CarbonylContact C-O 3.47Å; I424-F427 PolarHBondContact O-N 3.04Å; I424-Q429 HydrophobicContact CD1-CB 4.2Å; I424-Q429 HydrophobicContact CD1-CG 3.85Å
425	A	92.5	Very high	87.9	Confident	32 Å²	32	57 Å²	57	26%	0.264	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	140.9	174.8	0	0	0	0	0	109.6	R401 Y413 P423 F427	R401-A425 PolarHBondContact NH1-O 3.41Å; Y413-A425 PolarHBondContact OH-O 3.41Å; P423-A425 PolarHBondContact O-N 3.39Å; A425-F427 WeakPolarHBondContact CA-O 3.45Å
426	P	94.2	Very high	85.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	cis	-83.9	-13.6	20.5	37.1	-33.6	0	0	0	113.2	W397 R401 F405 P448 Y514 H515	W397-P426 HydrophobicContact CD2-CB 4.12Å; W397-P426 HydrophobicContact CD2-CG 4.24Å; W397-P426 HydrophobicContact CE3-CB 3.88Å; W397-P426 HydrophobicContact CE3-CG 4.49Å; W397-P426 HydrophobicContact CH2-CB 3.63Å; W397-P426 HydrophobicContact CH2-CG 4.07Å; W397-P426 HydrophobicContact CZ2-CB 3.84Å; W397-P426 HydrophobicContact CZ2-CG 3.75Å; W397-P426 HydrophobicContact CZ3-CB 3.64Å; W397-P426 HydrophobicContact CZ3-CG 4.43Å; R401-P426 VanDerWaalsContact CZ-CD 3.44Å; F405-P426 HydrophobicContact CE2-CG 3.77Å; F405-P426 HydrophobicContact CZ-CG 4.21Å; P426-P448 HydrophobicContact CB-CG 3.54Å; P426-Y514 WeakPolarHBondContact O-CA 3.28Å; P426-Y514 WeakPolarHBondContact O-CB 3.5Å; P426-H515 PolarHBondContact O-N 2.82Å
427	F	97	Very high	82.8	Confident	1 Å²	1	64.3 Å²	64.3	0%	0.004	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-72.4	165	176.8	-55.1	-59.8	0	0	0	111.9	R354 F405 C410 Y413 M414 I424 A425 C512 P513	R354-F427 HydrophobicContact CG-CE1 4.11Å; R354-F427 HydrophobicContact CG-CZ 3.85Å; F405-F427 AromaticContact CD2-CE2 3.9Å; F405-F427 HydrophobicContact CD2-CE2 3.9Å; F405-F427 HydrophobicContact CD2-CZ 4.45Å; F405-F427 HydrophobicContact CE2-CD2 4.5Å; F405-F427 AromaticContact CE2-CE2 3.58Å; F405-F427 HydrophobicContact CE2-CE2 3.58Å; F405-F427 AromaticContact CE2-CZ 3.81Å; F405-F427 HydrophobicContact CE2-CZ 3.81Å; F405-F427 HydrophobicContact CZ-CZ 4.47Å; C410-F427 HydrophobicContact CB-CD1 3.99Å; C410-F427 HydrophobicContact CB-CD2 3.67Å; C410-F427 HydrophobicContact CB-CE1 3.87Å; C410-F427 HydrophobicContact CB-CE2 3.52Å; C410-F427 HydrophobicContact CB-CG 3.9Å; C410-F427 HydrophobicContact CB-CZ 3.64Å; Y413-F427 AromaticContact CD1-CD2 3.58Å; Y413-F427 HydrophobicContact CD1-CD2 3.58Å; Y413-F427 AromaticContact CD1-CE2 3.82Å; Y413-F427 HydrophobicContact CD1-CE2 3.82Å; Y413-F427 AromaticContact CE1-CD2 3.97Å; Y413-F427 HydrophobicContact CE1-CD2 3.97Å; Y413-F427 HydrophobicContact CE1-CE2 4.32Å; Y413-F427 HydrophobicContact CG-CE2 4.45Å; M414-F427 HydrophobicContact CG-CB 3.96Å; M414-F427 HydrophobicContact CG-CD2 4.31Å; M414-F427 HydrophobicContact SD-CB 3.71Å; I424-F427 CarbonylContact C-O 3.47Å; I424-F427 PolarHBondContact O-N 3.04Å; A425-F427 WeakPolarHBondContact CA-O 3.45Å; F427-C512 HydrophobicContact CD1-CB 3.81Å; F427-C512 HydrophobicContact CE1-CB 3.52Å; F427-C512 HydrophobicContact CZ-CB 4.32Å; F427-P513 CarbonylContact C-O 3.54Å; F427-P513 WeakPolarHBondContact CA-O 3.24Å; F427-P513 VanDerWaalsContact CB-O 3.28Å; F427-P513 WeakPolarHBondContact CB-O 3.45Å; F427-P513 WeakPolarHBondContact CD1-O 3.47Å
428	C	95.5	Very high	80.5	Confident	4 Å²	4	72.4 Å²	72.4	3%	0.027	39%	0.39	C	S	.	.			trans	-146	163.2	-175.2	66.5	0	0	0	0	111.2	C456 P513 Y514 H515	C428-C456 HydrophobicContact CB-CB 3.69Å; C428-C456 WeakPolarHBondContact CB-SG 3.41Å; C428-C456 WeakPolarHBondContact SG-CA 3.49Å; C428-C456 WeakPolarHBondContact SG-CB 3.44Å; C428-C456 CovalentContact SG-SG 2.02Å; C428-C456 PolarHBondContact SG-SG 2.87Å; C428-P513 PolarHBondContact N-O 3.16Å; C428-P513 WeakPolarHBondContact O-CG 3.36Å; C428-P513 VanDerWaalsContact SG-C 3.59Å; C428-Y514 WeakPolarHBondContact SG-CA 2.89Å; C428-Y514 PolarHBondContact SG-N 3.38Å; C428-Y514 VanDerWaalsContact SG-N 3.39Å; C428-Y514 PolarHBondContact SG-O 2.93Å; C428-H515 VanDerWaalsContact CB-CE1 3.45Å; C428-H515 WeakPolarHBondContact CB-CE1 3.38Å
429	Q	93.7	Very high	78.4	Confident	37 Å²	37	76 Å²	76	17%	0.173	41%	0.405	C	S	.	.			trans	-136.2	21.7	-175.7	67.4	-173.9	27.6	0	0	112.8	I424 F472 K485 I486 L488	I424-Q429 HydrophobicContact CD1-CB 4.2Å; I424-Q429 HydrophobicContact CD1-CG 3.85Å; Q429-F472 HydrophobicContact CB-CE1 3.68Å; Q429-F472 HydrophobicContact CB-CZ 4.41Å; Q429-K485 HydrophobicContact CG-CB 4.3Å; Q429-K485 HydrophobicContact CG-CG 4.42Å; Q429-I486 PolarHBondContact O-N 2.97Å; Q429-L488 HydrophobicContact CB-CD2 4.49Å
430	Q	89.2	Confident	76.8	Confident	40 Å²	40	70.5 Å²	70.5	19%	0.187	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-101.1	122.4	-178.8	-178.6	164.4	-14.1	0	0	110.1	T432 C456 N483	Q430-T432 PolarHBondContact O-N 3.35Å; Q430-C456 HydrophobicContact CB-CB 4.14Å; Q430-C456 WeakPolarHBondContact O-CB 3.36Å; Q430-C456 PolarHBondContact O-SG 2.8Å; Q430-N483 PolarHBondContact NE2-O 3.48Å
431	L	86.9	Confident	75.6	Confident	19 Å²	19	68.9 Å²	68.9	10%	0.099	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-69.7	118	178.3	-172.4	62.5	0	0	0	110.2	L458 V480 N483 I486 L502	L431-L458 HydrophobicContact CD1-CG 4.31Å; L431-V480 HydrophobicContact CD2-CG1 3.87Å; L431-N483 PolarHBondContact O-N 2.77Å; L431-I486 HydrophobicContact CB-CD1 3.78Å; L431-I486 HydrophobicContact CB-CG1 4.45Å; L431-I486 HydrophobicContact CD1-CD1 4.42Å; L431-L502 HydrophobicContact CD1-CD2 3.9Å
432	T	79.5	Confident	75	Confident	25 Å²	25	67 Å²	67	15%	0.153	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-82.5	127.2	174.7	-70.2	0	0	0	0	110.2	Q430 L442 F455 C456 L458	Q430-T432 PolarHBondContact O-N 3.35Å; T432-L442 HydrophobicContact CG2-CD1 3.73Å; T432-F455 HydrophobicContact CG2-CD2 3.85Å; T432-F455 HydrophobicContact CG2-CE2 4.38Å; T432-C456 WeakPolarHBondContact CB-O 3.48Å; T432-C456 PolarHBondContact OG1-O 2.89Å; T432-L458 PolarHBondContact N-O 3.39Å
433	S	68	Low	74.7	Confident	21 Å²	21	64.4 Å²	64.4	15%	0.147	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-70.7	144.5	176.3	66.4	0	0	0	0	112.3	Y435 L482	S433-Y435 PolarHBondContact O-N 3.38Å; S433-L482 VanDerWaalsContact CB-CD2 3.44Å
434	S	53	Low	74.7	Confident	94 Å²	94	59.6 Å²	59.6	66%	0.657	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-55.7	138.5	154.2	-178.3	0	0	0	0	108.6	Q436	S434-Q436 PolarHBondContact O-N 2.55Å
435	Y	48.4	Very low	74.6	Confident	182 Å²	182	59.4 Å²	59.4	71%	0.714	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	3.7	-175.4	-135.8	-96.5	0	0	0	116	S433	S433-Y435 PolarHBondContact O-N 3.38Å
436	Q	42.7	Very low	74.6	Confident	171 Å²	171	58.6 Å²	58.6	80%	0.799	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-25.4	-176.7	-69	-81.5	-28.9	0	0	113.7	S434 K438	S434-Q436 PolarHBondContact O-N 2.55Å; Q436-K438 PolarHBondContact O-N 2.79Å
437	N	46.8	Very low	74.4	Confident	83 Å²	83	59.3 Å²	59.3	44%	0.444	30%	0.302	S	S	.	.			trans	-95.2	86.3	-177.8	-150.7	-15	0	0	0	111.2	N439 N440 L482	N437-N439 PolarHBondContact O-N 3.18Å; N437-N440 PolarHBondContact O-N 3.3Å; N437-L482 HydrophobicContact CB-CD2 4.21Å
438	K	47.8	Very low	73.8	Confident	200 Å²	200	60.6 Å²	60.6	87%	0.87	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-14.3	-175.3	-68.3	-175.3	178	-177.6	0	115.3	Q436	Q436-K438 PolarHBondContact O-N 2.79Å
439	N	51.9	Low	73.2	Confident	136 Å²	136	62.5 Å²	62.5	73%	0.727	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-16.9	-174.2	-70.7	-0.5	0	0	0	114	N437	N437-N439 PolarHBondContact O-N 3.18Å
440	N	61.8	Low	73	Confident	79 Å²	79	63.5 Å²	63.5	42%	0.422	33%	0.334	S	S	.	.	S	Bend	trans	-118.5	122.7	179.8	-70.3	1.6	0	0	0	109.7	N437	N437-N440 PolarHBondContact O-N 3.3Å
441	G	69.6	Low	72.9	Confident	11 Å²	11	64.1 Å²	64.1	11%	0.113	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-58.5	154.6	169.9	0	0	0	0	0	111.7	Q443 P576	G441-Q443 PolarHBondContact O-N 3.05Å; G441-P576 WeakPolarHBondContact CA-O 3.23Å
442	L	80.3	Confident	73	Confident	30 Å²	30	63.3 Å²	63.3	16%	0.157	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	116.9	172.5	178.4	63.8	0	0	0	109.1	T432 V444 F455 I518 P576 V577 E578	T432-L442 HydrophobicContact CG2-CD1 3.73Å; L442-V444 HydrophobicContact CG-CG1 4.41Å; L442-F455 HydrophobicContact CD1-CB 3.86Å; L442-F455 HydrophobicContact CD1-CG 4.41Å; L442-F455 HydrophobicContact CD2-CB 4.15Å; L442-F455 HydrophobicContact CD2-CG 4.49Å; L442-F455 HydrophobicContact CG-CB 4.1Å; L442-I518 HydrophobicContact CD2-CD1 3.6Å; L442-I518 HydrophobicContact CD2-CG1 4.42Å; L442-P576 PolarHBondContact N-O 3.26Å; L442-V577 WeakPolarHBondContact O-CA 3.48Å; L442-E578 PolarHBondContact O-N 3.27Å
443	Q	85.4	Confident	73.6	Confident	56 Å²	56	62.5 Å²	62.5	26%	0.262	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	129.7	174.9	-171.9	70	22.8	0	0	110.5	G441 E578	G441-Q443 PolarHBondContact O-N 3.05Å; Q443-E578 CarbonylContact C-O 3.56Å; Q443-E578 WeakPolarHBondContact CA-O 3.25Å
444	V	89.8	Confident	74.7	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.006	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	161.4	174.8	-62.2	0	0	0	0	110.8	L442 Y453 G454 F455 I518 V577 E578 G579 A580	L442-V444 HydrophobicContact CG-CG1 4.41Å; V444-Y453 HydrophobicContact CB-CD2 4.05Å; V444-Y453 HydrophobicContact CG1-CD2 4.25Å; V444-Y453 HydrophobicContact CG2-CD2 3.74Å; V444-Y453 HydrophobicContact CG2-CE2 4.34Å; V444-Y453 HydrophobicContact CG2-CG 4.39Å; V444-G454 CarbonylContact C-O 3.52Å; V444-G454 VanDerWaalsContact CA-O 3.23Å; V444-G454 WeakPolarHBondContact CA-O 3.46Å; V444-G454 WeakPolarHBondContact CB-O 3.18Å; V444-F455 HydrophobicContact CG1-CB 4.27Å; V444-I518 HydrophobicContact CG1-CD1 3.68Å; V444-V577 HydrophobicContact CB-CG1 4.36Å; V444-V577 HydrophobicContact CG1-CG1 3.67Å; V444-V577 HydrophobicContact CG2-CG1 3.68Å; V444-E578 WeakPolarHBondContact CG2-O 3.44Å; V444-E578 PolarHBondContact N-O 3.33Å; V444-G579 CarbonylContact O-C 3.47Å; V444-G579 WeakPolarHBondContact O-CA 3.37Å; V444-A580 HydrophobicContact CG2-CB 4.06Å
445	S	92.6	Very high	76.5	Confident	26 Å²	26	58.5 Å²	58.5	18%	0.182	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	161.5	169.4	-67.7	0	0	0	0	109.6	T447 Y453 G454 E559	S445-T447 PolarHBondContact O-N 2.84Å; S445-Y453 CarbonylContact O-C 3.49Å; S445-Y453 VanDerWaalsContact O-CA 3.27Å; S445-Y453 WeakPolarHBondContact O-CA 3.49Å; S445-Y453 WeakPolarHBondContact O-CB 3.48Å; S445-G454 PolarHBondContact N-O 2.75Å; S445-G454 PolarHBondContact O-N 3.37Å; S445-E559 WeakPolarHBondContact CA-OE2 3.36Å; S445-E559 WeakPolarHBondContact CB-OE1 3.4Å
446	C	92.8	Very high	78.6	Confident	15 Å²	15	50 Å²	50	10%	0.101	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	135.8	175.7	-65.5	0	0	0	0	110.9	C557 V558 E559	C446-C557 WeakPolarHBondContact CA-SG 3.45Å; C446-C557 HydrophobicContact CB-CB 3.81Å; C446-C557 WeakPolarHBondContact CB-SG 3.36Å; C446-C557 WeakPolarHBondContact SG-CB 3.28Å; C446-C557 PolarHBondContact SG-O 2.91Å; C446-C557 CovalentContact SG-SG 2.04Å; C446-C557 PolarHBondContact SG-SG 2.97Å; C446-V558 PolarHBondContact SG-N 3.36Å; C446-E559 WeakPolarHBondContact CB-OE1 3.17Å; C446-E559 PolarHBondContact N-OE1 2.85Å
447	T	90.3	Very high	80.9	Confident	15 Å²	15	41.8 Å²	41.8	9%	0.092	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-71.3	160.9	173.1	59.7	0	0	0	0	110.2	S445 G449 K450 S452 E517	S445-T447 PolarHBondContact O-N 2.84Å; T447-G449 PolarHBondContact O-N 2.88Å; T447-K450 PolarHBondContact O-N 2.8Å; T447-S452 WeakPolarHBondContact CG2-OG 3.37Å; T447-S452 PolarHBondContact N-O 3.34Å; T447-S452 PolarHBondContact OG1-O 3.48Å; T447-S452 PolarHBondContact OG1-OG 2.91Å; T447-E517 HydrophobicContact CG2-CG 3.99Å
448	P	84.4	Confident	83.1	Confident	28 Å²	28	37.9 Å²	37.9	18%	0.182	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	135.1	169.7	-24.1	33.3	0	0	0	111.6	S396 W397 P426 K450	S396-P448 VanDerWaalsContact OG-C 3.24Å; S396-P448 PolarHBondContact OG-O 2.82Å; W397-P448 HydrophobicContact CE3-CG 3.99Å; W397-P448 HydrophobicContact CZ3-CG 4.29Å; P426-P448 HydrophobicContact CB-CG 3.54Å; P448-K450 VanDerWaalsContact C-N 3.28Å
449	G	82.5	Confident	85.1	Confident	44 Å²	44	30 Å²	30	45%	0.454	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	89	-17.5	-174.1	0	0	0	0	0	114.3	S396 T447 E451	S396-G449 PolarHBondContact OG-N 2.88Å; T447-G449 PolarHBondContact O-N 2.88Å; G449-E451 PolarHBondContact O-N 3.5Å
450	K	88.6	Confident	87	Confident	57 Å²	57	29.5 Å²	29.5	25%	0.248	16%	0.164	C	C	.	.	S	Bend	trans	60.3	26	178.5	-49.6	-173.8	179.9	-174.4	0	114.2	T447 P448 S452 V556 C557 P633	T447-K450 PolarHBondContact O-N 2.8Å; P448-K450 VanDerWaalsContact C-N 3.28Å; K450-S452 VanDerWaalsContact C-N 3.34Å; K450-V556 HydrophobicContact CB-CG2 3.6Å; K450-V556 HydrophobicContact CD-CG2 4.33Å; K450-V556 WeakPolarHBondContact O-CG2 3.49Å; K450-C557 HydrophobicContact CB-CB 4.23Å; K450-C557 VanDerWaalsContact O-CB 3.3Å; K450-C557 WeakPolarHBondContact O-CB 3.42Å; K450-C557 PolarHBondContact O-N 3.38Å; K450-P633 VanDerWaalsContact NZ-CB 3.26Å
451	E	87.2	Confident	88.4	Confident	54 Å²	54	27.4 Å²	27.4	25%	0.252	15%	0.15	S	C	.	.	S	Bend	trans	-86.2	-13.4	176	-61	-179.7	167.1	0	0	112	Q370 G449 C533	Q370-E451 PolarHBondContact NE2-OE2 3.05Å; G449-E451 PolarHBondContact O-N 3.5Å; E451-C533 PolarHBondContact O-N 3.08Å
452	S	90.5	Very high	89.5	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.007	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-155.4	175.9	-179.1	64.5	0	0	0	0	111.4	T447 K450 E517 T531 C557	T447-S452 WeakPolarHBondContact CG2-OG 3.37Å; T447-S452 PolarHBondContact N-O 3.34Å; T447-S452 PolarHBondContact OG1-O 3.48Å; T447-S452 PolarHBondContact OG1-OG 2.91Å; K450-S452 VanDerWaalsContact C-N 3.34Å; S452-E517 WeakPolarHBondContact CB-OE1 3.38Å; S452-E517 PolarHBondContact OG-OE1 3.26Å; S452-T531 VanDerWaalsContact CA-O 3.26Å; S452-T531 WeakPolarHBondContact CA-O 3.29Å; S452-T531 WeakPolarHBondContact CB-O 3.04Å; S452-C557 WeakPolarHBondContact O-CB 3.38Å; S452-C557 PolarHBondContact O-SG 3.19Å; S452-C557 VanDerWaalsContact O-SG 3.38Å
453	Y	91.8	Very high	90.1	Very high	8 Å²	8	36.8 Å²	36.8	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	158.3	168.7	53.8	-91.6	0	0	0	112	V444 S445 W520 T531 K547 V577 A580	V444-Y453 HydrophobicContact CB-CD2 4.05Å; V444-Y453 HydrophobicContact CG1-CD2 4.25Å; V444-Y453 HydrophobicContact CG2-CD2 3.74Å; V444-Y453 HydrophobicContact CG2-CE2 4.34Å; V444-Y453 HydrophobicContact CG2-CG 4.39Å; S445-Y453 CarbonylContact O-C 3.49Å; S445-Y453 VanDerWaalsContact O-CA 3.27Å; S445-Y453 WeakPolarHBondContact O-CA 3.49Å; S445-Y453 WeakPolarHBondContact O-CB 3.48Å; Y453-W520 HydrophobicContact CE2-CH2 4.44Å; Y453-T531 HydrophobicContact CD2-CG2 3.55Å; Y453-T531 HydrophobicContact CE1-CG2 4.43Å; Y453-T531 HydrophobicContact CE2-CG2 3.26Å; Y453-T531 HydrophobicContact CG-CG2 4.28Å; Y453-T531 PolarHBondContact N-O 3.29Å; Y453-T531 WeakPolarHBondContact O-CB 3.33Å; Y453-T531 PolarHBondContact O-OG1 3.23Å; Y453-K547 PolarHBondContact OH-NZ 3.15Å; Y453-V577 HydrophobicContact CE2-CG1 4.25Å; Y453-A580 HydrophobicContact CG-CB 4.23Å
454	G	90.8	Very high	90.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	159.4	-176.5	0	0	0	0	0	113.6	V444 S445 Q516	V444-G454 CarbonylContact C-O 3.52Å; V444-G454 VanDerWaalsContact CA-O 3.23Å; V444-G454 WeakPolarHBondContact CA-O 3.46Å; V444-G454 WeakPolarHBondContact CB-O 3.18Å; S445-G454 PolarHBondContact N-O 2.75Å; S445-G454 PolarHBondContact O-N 3.37Å; G454-Q516 CarbonylContact C-O 3.5Å; G454-Q516 WeakPolarHBondContact CA-O 3.42Å
455	F	90	Very high	91	Very high	31 Å²	31	38.9 Å²	38.9	14%	0.136	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	153.6	174.4	69.9	-80.3	0	0	0	110.3	T432 L442 V444 N457 H515 Q516 I518	T432-F455 HydrophobicContact CG2-CD2 3.85Å; T432-F455 HydrophobicContact CG2-CE2 4.38Å; L442-F455 HydrophobicContact CD1-CB 3.86Å; L442-F455 HydrophobicContact CD1-CG 4.41Å; L442-F455 HydrophobicContact CD2-CB 4.15Å; L442-F455 HydrophobicContact CD2-CG 4.49Å; L442-F455 HydrophobicContact CG-CB 4.1Å; V444-F455 HydrophobicContact CG1-CB 4.27Å; F455-N457 HydrophobicContact CE2-CB 3.97Å; F455-N457 HydrophobicContact CZ-CB 4.42Å; F455-N457 PolarHBondContact O-N 3.42Å; F455-N457 VanDerWaalsContact O-N 3.17Å; F455-H515 CarbonylContact O-C 3.41Å; F455-H515 VanDerWaalsContact O-CA 3.31Å; F455-H515 WeakPolarHBondContact O-CA 3.29Å; F455-Q516 VanDerWaalsContact CD1-O 3.23Å; F455-Q516 WeakPolarHBondContact CD1-O 3.32Å; F455-Q516 HydrophobicContact CE1-CB 4.18Å; F455-Q516 HydrophobicContact CE1-CG 4.34Å; F455-Q516 HydrophobicContact CZ-CB 4.28Å; F455-Q516 HydrophobicContact CZ-CG 4.48Å; F455-Q516 PolarHBondContact N-O 2.86Å; F455-Q516 PolarHBondContact O-N 3.38Å; F455-I518 HydrophobicContact CD1-CD1 4.29Å; F455-I518 HydrophobicContact CD1-CG1 3.6Å; F455-I518 HydrophobicContact CE1-CG1 4.16Å
456	C	92.7	Very high	91.1	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.02	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	112.9	174.2	-177.8	0	0	0	0	110.5	C428 Q430 T432 L458	C428-C456 HydrophobicContact CB-CB 3.69Å; C428-C456 WeakPolarHBondContact CB-SG 3.41Å; C428-C456 WeakPolarHBondContact SG-CA 3.49Å; C428-C456 WeakPolarHBondContact SG-CB 3.44Å; C428-C456 CovalentContact SG-SG 2.02Å; C428-C456 PolarHBondContact SG-SG 2.87Å; Q430-C456 HydrophobicContact CB-CB 4.14Å; Q430-C456 WeakPolarHBondContact O-CB 3.36Å; Q430-C456 PolarHBondContact O-SG 2.8Å; T432-C456 WeakPolarHBondContact CB-O 3.48Å; T432-C456 PolarHBondContact OG1-O 2.89Å; C456-L458 PolarHBondContact O-N 2.91Å
457	N	91.9	Very high	91.3	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.234	C	C	.	.			trans	-76.8	27.7	-177	71.9	-0.6	0	0	0	114.4	F455 K505 P513 Y514 Q516	F455-N457 HydrophobicContact CE2-CB 3.97Å; F455-N457 HydrophobicContact CZ-CB 4.42Å; F455-N457 PolarHBondContact O-N 3.42Å; F455-N457 VanDerWaalsContact O-N 3.17Å; N457-K505 HydrophobicContact CB-CB 4.11Å; N457-K505 WeakPolarHBondContact O-CB 3.42Å; N457-K505 PolarHBondContact O-N 3.18Å; N457-P513 VanDerWaalsContact OD1-CA 3.23Å; N457-P513 WeakPolarHBondContact OD1-CA 3.3Å; N457-Y514 PolarHBondContact N-O 2.95Å; N457-Y514 VanDerWaalsContact ND2-CE1 3.29Å; N457-Y514 WeakPolarHBondContact ND2-CE1 3.28Å; N457-Y514 PolarHBondContact OD1-N 2.66Å; N457-Y514 PolarHBondContact OD1-O 3.25Å; N457-Y514 VanDerWaalsContact OD1-O 3.09Å; N457-Q516 HydrophobicContact CB-CB 3.93Å; N457-Q516 PolarHBondContact ND2-OE1 2.99Å
458	L	93.5	Very high	91.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	122	171.7	-179.6	54.5	0	0	0	110.1	L431 T432 C456 F472 I486 L502 G503 P513	L431-L458 HydrophobicContact CD1-CG 4.31Å; T432-L458 PolarHBondContact N-O 3.39Å; C456-L458 PolarHBondContact O-N 2.91Å; L458-F472 HydrophobicContact CD1-CD2 4.05Å; L458-F472 HydrophobicContact CD1-CE2 3.66Å; L458-F472 HydrophobicContact CD1-CZ 4.31Å; L458-F472 HydrophobicContact CD2-CE1 4.33Å; L458-F472 HydrophobicContact CD2-CE2 4.12Å; L458-F472 HydrophobicContact CD2-CZ 4.01Å; L458-I486 HydrophobicContact CD2-CD1 3.57Å; L458-I486 HydrophobicContact CD2-CG1 4.47Å; L458-I486 HydrophobicContact CG-CD1 4.39Å; L458-L502 HydrophobicContact CD1-CB 4.35Å; L458-G503 WeakPolarHBondContact CD1-O 3.5Å; L458-P513 HydrophobicContact CB-CB 3.75Å; L458-P513 HydrophobicContact CB-CG 4.42Å; L458-P513 HydrophobicContact CD1-CB 4.19Å; L458-P513 HydrophobicContact CD1-CG 4.18Å; L458-P513 HydrophobicContact CG-CB 4.46Å
459	I	89.9	Confident	92.3	Very high	35 Å²	35	43.8 Å²	43.8	18%	0.179	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	166.7	-176.3	64.2	164.5	0	0	0	111.8	Y461 L502 G503 K505	I459-Y461 HydrophobicContact CD1-CD2 4.47Å; I459-Y461 HydrophobicContact CD1-CE1 4.43Å; I459-Y461 HydrophobicContact CD1-CE2 4.03Å; I459-Y461 HydrophobicContact CG1-CD2 4.19Å; I459-Y461 HydrophobicContact CG1-CE2 3.77Å; I459-L502 WeakPolarHBondContact O-CA 3.27Å; I459-G503 PolarHBondContact N-O 3.33Å; I459-G503 PolarHBondContact O-N 3.47Å; I459-K505 HydrophobicContact CD1-CB 4Å; I459-K505 HydrophobicContact CD1-CG 4.01Å; I459-K505 HydrophobicContact CG1-CB 4.19Å; I459-K505 HydrophobicContact CG2-CB 4.41Å
460	E	90.9	Very high	93	Very high	126 Å²	126	41.7 Å²	41.7	59%	0.589	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	122.4	168.3	-168.9	175.3	-178.6	0	0	111.3	K501 L502	E460-K501 WeakPolarHBondContact CA-O 3.11Å; E460-K501 HydrophobicContact CG-CB 3.98Å; E460-L502 HydrophobicContact CB-CD2 3.69Å; E460-L502 HydrophobicContact CG-CD2 4Å
461	Y	90.9	Very high	93.5	Very high	34 Å²	34	39 Å²	39	13%	0.133	21%	0.205	C	C	.	.			trans	-82.6	150.7	176.2	-74.7	-97.2	0	0	0	111.5	I459 K463 L465 K501 G504 K505 Y511	I459-Y461 HydrophobicContact CD1-CD2 4.47Å; I459-Y461 HydrophobicContact CD1-CE1 4.43Å; I459-Y461 HydrophobicContact CD1-CE2 4.03Å; I459-Y461 HydrophobicContact CG1-CD2 4.19Å; I459-Y461 HydrophobicContact CG1-CE2 3.77Å; Y461-K463 VanDerWaalsContact C-N 3.27Å; Y461-K463 VanDerWaalsContact CB-O 3.29Å; Y461-K463 WeakPolarHBondContact CB-O 2.97Å; Y461-K463 PolarHBondContact O-N 3.29Å; Y461-L465 HydrophobicContact CD1-CD2 4.31Å; Y461-L465 HydrophobicContact CD2-CD1 4.47Å; Y461-L465 HydrophobicContact CD2-CD2 3.83Å; Y461-L465 HydrophobicContact CD2-CG 4.42Å; Y461-L465 HydrophobicContact CE2-CD2 4.07Å; Y461-L465 HydrophobicContact CG-CD2 3.97Å; Y461-K501 PolarHBondContact N-O 3.27Å; Y461-K501 WeakPolarHBondContact O-CD 3.45Å; Y461-G504 PolarHBondContact OH-O 2.86Å; Y461-K505 VanDerWaalsContact OH-CA 3.3Å; Y461-K505 WeakPolarHBondContact OH-CA 3.03Å; Y461-K505 PolarHBondContact OH-O 3.41Å; Y461-Y511 HydrophobicContact CE1-CE1 4.13Å; Y461-Y511 HydrophobicContact CE2-CD1 4.14Å; Y461-Y511 AromaticContact CZ-CD1 3.83Å; Y461-Y511 AromaticContact CZ-CE1 3.89Å
462	S	92.3	Very high	93.9	Very high	78 Å²	78	36.4 Å²	36.4	55%	0.545	19%	0.193	S	C	.	.	S	Bend	trans	-67.3	-30.8	174.7	56.1	0	0	0	0	112.6
463	K	94.3	Very high	94.1	Very high	161 Å²	161	36.5 Å²	36.5	70%	0.7	19%	0.194	S	C	*	.	S	Bend	trans	-115.9	151.6	179	-64.5	-177.1	-179.3	-179.3	0	110.9	Y461	Y461-K463 VanDerWaalsContact C-N 3.27Å; Y461-K463 VanDerWaalsContact CB-O 3.29Å; Y461-K463 WeakPolarHBondContact CB-O 2.97Å; Y461-K463 PolarHBondContact O-N 3.29Å
464	P	96.3	Very high	94	Very high	85 Å²	85	37.5 Å²	37.5	55%	0.552	20%	0.2	S	C	*	.	P	Polyproline II helix	trans	-58.4	144.9	171.8	-22.1	33.8	0	0	0	112.1	V500	P464-V500 CarbonylContact C-O 3.43Å; P464-V500 WeakPolarHBondContact CA-O 3.44Å; P464-V500 HydrophobicContact CB-CB 4.25Å; P464-V500 HydrophobicContact CB-CG2 4.01Å; P464-V500 HydrophobicContact CG-CG2 4.33Å
465	L	96.2	Very high	93.7	Very high	16 Å²	16	40.6 Å²	40.6	8%	0.084	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-76.8	158.4	170.8	-59	179.7	0	0	0	110.8	Y461 V470 V500 L502 Y511	Y461-L465 HydrophobicContact CD1-CD2 4.31Å; Y461-L465 HydrophobicContact CD2-CD1 4.47Å; Y461-L465 HydrophobicContact CD2-CD2 3.83Å; Y461-L465 HydrophobicContact CD2-CG 4.42Å; Y461-L465 HydrophobicContact CE2-CD2 4.07Å; Y461-L465 HydrophobicContact CG-CD2 3.97Å; L465-V470 HydrophobicContact CB-CG2 4.22Å; L465-V500 PolarHBondContact N-O 3.06Å; L465-L502 WeakPolarHBondContact CD1-O 3.5Å; L465-Y511 HydrophobicContact CD1-CD1 4.29Å; L465-Y511 HydrophobicContact CD1-CG 4.35Å; L465-Y511 HydrophobicContact CD2-CD1 3.63Å; L465-Y511 HydrophobicContact CD2-CE1 3.57Å; L465-Y511 HydrophobicContact CD2-CG 4.25Å
466	P	95.9	Very high	93.1	Very high	53 Å²	53	43.8 Å²	43.8	34%	0.344	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-53.3	142.7	165	-23.7	34.7	0	0	0	111.5	E468 Y469	P466-E468 VanDerWaalsContact C-N 3.25Å; P466-E468 VanDerWaalsContact CB-CD 3.47Å; P466-E468 HydrophobicContact CB-CG 4.21Å; P466-E468 WeakPolarHBondContact CB-OE2 3.03Å; P466-E468 PolarHBondContact O-N 2.96Å; P466-Y469 HydrophobicContact CB-CD2 3.93Å; P466-Y469 HydrophobicContact CG-CD2 3.96Å; P466-Y469 PolarHBondContact O-N 2.99Å
467	S	97.3	Very high	91.7	Very high	53 Å²	53	52 Å²	52	37%	0.371	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-57.7	-37.1	-172	-61.6	0	0	0	0	113.1	S303 Y469 V470	S303-S467 WeakPolarHBondContact CB-O 3.48Å; S303-S467 PolarHBondContact OG-O 2.81Å; S467-Y469 PolarHBondContact O-N 3.4Å; S467-V470 PolarHBondContact O-N 2.89Å
468	E	96.5	Very high	90.3	Very high	68 Å²	68	55.2 Å²	55.2	32%	0.318	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-63.3	-19.9	176.9	59.9	-90.4	-144.7	0	0	113.7	W301 F308 P466	W301-E468 PolarHBondContact NE1-O 3.03Å; W301-E468 VanDerWaalsContact NE1-O 3.1Å; F308-E468 HydrophobicContact CB-CB 4.21Å; F308-E468 HydrophobicContact CD1-CB 4.09Å; F308-E468 HydrophobicContact CD2-CB 4.27Å; F308-E468 HydrophobicContact CG-CB 3.92Å; P466-E468 VanDerWaalsContact C-N 3.25Å; P466-E468 VanDerWaalsContact CB-CD 3.47Å; P466-E468 HydrophobicContact CB-CG 4.21Å; P466-E468 WeakPolarHBondContact CB-OE2 3.03Å; P466-E468 PolarHBondContact O-N 2.96Å
469	Y	97.3	Very high	88.9	Confident	13 Å²	13	61.3 Å²	61.3	5%	0.051	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-110	11.5	-178.3	-57.8	-40	0	0	0	113.6	W301 K310 E341 P466 S467 Y471 N510 Y511	W301-Y469 HydrophobicContact CZ2-CE1 4.22Å; W301-Y469 AromaticContact NE1-CD1 3.82Å; W301-Y469 AromaticContact NE1-CE1 3.9Å; K310-Y469 WeakPolarHBondContact CE-OH 2.99Å; E341-Y469 VanDerWaalsContact OE1-CE2 3.29Å; E341-Y469 WeakPolarHBondContact OE1-CE2 3.29Å; E341-Y469 VanDerWaalsContact OE1-CZ 3.31Å; E341-Y469 PolarHBondContact OE1-OH 2.96Å; P466-Y469 HydrophobicContact CB-CD2 3.93Å; P466-Y469 HydrophobicContact CG-CD2 3.96Å; P466-Y469 PolarHBondContact O-N 2.99Å; S467-Y469 PolarHBondContact O-N 3.4Å; Y469-Y471 WeakPolarHBondContact CD1-OH 3.49Å; Y469-Y471 WeakPolarHBondContact O-CD2 3.42Å; Y469-Y471 WeakPolarHBondContact O-CE2 3.38Å; Y469-N510 HydrophobicContact CD1-CB 4.18Å; Y469-N510 HydrophobicContact CE1-CB 3.81Å; Y469-Y511 AromaticContact CD2-CD2 3.54Å; Y469-Y511 HydrophobicContact CD2-CD2 3.54Å; Y469-Y511 AromaticContact CD2-CE2 3.69Å; Y469-Y511 HydrophobicContact CD2-CE2 3.69Å; Y469-Y511 HydrophobicContact CE2-CD2 4.24Å; Y469-Y511 HydrophobicContact CE2-CE2 4.17Å; Y469-Y511 AromaticContact CG-CD2 3.79Å; Y469-Y511 HydrophobicContact CG-CD2 3.79Å; Y469-Y511 HydrophobicContact CG-CE2 4.4Å
470	V	98	Very high	87.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.339	C	S	.	.			trans	-88.7	110.9	172.6	-179.2	0	0	0	0	109.3	A304 F305 L465 S467 P498 V500	A304-V470 HydrophobicContact CB-CG1 4.02Å; A304-V470 VanDerWaalsContact CB-O 3.28Å; A304-V470 WeakPolarHBondContact CB-O 3.04Å; A304-V470 PolarHBondContact N-O 2.99Å; F305-V470 HydrophobicContact CD2-CB 4.1Å; F305-V470 HydrophobicContact CD2-CG2 4.41Å; F305-V470 HydrophobicContact CE2-CB 3.91Å; F305-V470 HydrophobicContact CE2-CG1 4.08Å; F305-V470 HydrophobicContact CE2-CG2 3.9Å; L465-V470 HydrophobicContact CB-CG2 4.22Å; S467-V470 PolarHBondContact O-N 2.89Å; V470-P498 HydrophobicContact CG1-CB 4.21Å; V470-V500 HydrophobicContact CG2-CB 4.39Å; V470-V500 HydrophobicContact CG2-CG1 4.48Å
471	Y	98.2	Very high	86.1	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.34	C	S	.	.			trans	-106.8	-17.9	-174.2	-52.8	-52.9	0	0	0	114.7	C410 L411 Y469 G489 N510 Y511	C410-Y471 WeakPolarHBondContact SG-CE2 3.28Å; L411-Y471 HydrophobicContact CB-CD1 3.65Å; L411-Y471 HydrophobicContact CB-CE1 4.45Å; L411-Y471 HydrophobicContact CB-CG 4.22Å; L411-Y471 WeakPolarHBondContact CD1-O 3.46Å; L411-Y471 HydrophobicContact CD2-CD1 4.5Å; Y469-Y471 WeakPolarHBondContact CD1-OH 3.49Å; Y469-Y471 WeakPolarHBondContact O-CD2 3.42Å; Y469-Y471 WeakPolarHBondContact O-CE2 3.38Å; Y471-G489 PolarHBondContact O-N 3.07Å; Y471-N510 WeakPolarHBondContact CE2-O 3.43Å; Y471-N510 PolarHBondContact OH-O 3.26Å; Y471-Y511 WeakPolarHBondContact CE2-O 3.32Å
472	F	96.5	Very high	84.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	151	-169.9	-60	-77.4	0	0	0	112.4	M414 Q429 L458 I486 N487 L488 L499 L502 P513	M414-F472 HydrophobicContact CE-CZ 4.32Å; Q429-F472 HydrophobicContact CB-CE1 3.68Å; Q429-F472 HydrophobicContact CB-CZ 4.41Å; L458-F472 HydrophobicContact CD1-CD2 4.05Å; L458-F472 HydrophobicContact CD1-CE2 3.66Å; L458-F472 HydrophobicContact CD1-CZ 4.31Å; L458-F472 HydrophobicContact CD2-CE1 4.33Å; L458-F472 HydrophobicContact CD2-CE2 4.12Å; L458-F472 HydrophobicContact CD2-CZ 4.01Å; F472-I486 HydrophobicContact CB-CG2 3.86Å; F472-I486 HydrophobicContact CD1-CB 4.1Å; F472-I486 HydrophobicContact CD1-CG2 4.03Å; F472-I486 HydrophobicContact CG-CG2 4.23Å; F472-N487 WeakPolarHBondContact CA-O 3.44Å; F472-L488 HydrophobicContact CD1-CD2 4.12Å; F472-L488 HydrophobicContact CE1-CD2 3.69Å; F472-L499 HydrophobicContact CB-CB 4.34Å; F472-L499 HydrophobicContact CB-CD1 4.23Å; F472-L499 PolarHBondContact O-N 3.35Å; F472-L502 HydrophobicContact CD2-CB 4.5Å; F472-P513 HydrophobicContact CE2-CG 3.73Å; F472-P513 HydrophobicContact CZ-CG 3.54Å
473	I	95	Very high	83	Confident	3 Å²	3	60.3 Å²	60.3	2%	0.015	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	167.2	179.5	61.8	164.5	0	0	0	111.1	A304 T475 N487 L488 L493 R496 Y497	A304-I473 HydrophobicContact CB-CG2 3.88Å; I473-T475 HydrophobicContact CD1-CG2 4.49Å; I473-N487 HydrophobicContact CG1-CB 3.97Å; I473-N487 PolarHBondContact N-O 3.43Å; I473-L488 WeakPolarHBondContact CD1-O 3.34Å; I473-L488 WeakPolarHBondContact CG1-O 3.19Å; I473-L493 HydrophobicContact CG2-CD2 4.22Å; I473-R496 HydrophobicContact CD1-CB 3.92Å; I473-R496 HydrophobicContact CD1-CG 3.7Å; I473-Y497 CarbonylContact C-O 3.58Å; I473-Y497 VanDerWaalsContact CA-O 3.27Å; I473-Y497 WeakPolarHBondContact CA-O 3.36Å
474	N	90.3	Very high	81.9	Confident	29 Å²	29	54.5 Å²	54.5	16%	0.155	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	142.9	161.3	-157.8	-8.4	0	0	0	110.5	N476 S478 R496 Y497 L499	N474-N476 PolarHBondContact ND2-O 3.32Å; N474-N476 PolarHBondContact OD1-N 3.01Å; N474-N476 PolarHBondContact OD1-O 2.89Å; N474-S478 PolarHBondContact ND2-O 2.04Å; N474-R496 WeakPolarHBondContact O-CA 3.47Å; N474-Y497 PolarHBondContact N-O 3.12Å; N474-Y497 PolarHBondContact O-N 2.92Å; N474-L499 HydrophobicContact CB-CD2 4.3Å
475	T	83.4	Confident	81.1	Confident	64 Å²	64	58 Å²	58	39%	0.393	32%	0.319	S	S	.	.	S	Bend	trans	-94.6	-20.9	177	54.2	0	0	0	0	112.4	I473	I473-T475 HydrophobicContact CD1-CG2 4.49Å
476	N	78.1	Confident	80.8	Confident	99 Å²	99	57.6 Å²	57.6	53%	0.529	32%	0.317	S	S	.	.	S	Bend	trans	-123.1	166.9	177.4	-66.1	-18.5	0	0	0	109.8	N474 S478	N474-N476 PolarHBondContact ND2-O 3.32Å; N474-N476 PolarHBondContact OD1-N 3.01Å; N474-N476 PolarHBondContact OD1-O 2.89Å; N476-S478 WeakPolarHBondContact CB-OG 3.49Å; N476-S478 PolarHBondContact O-N 2.81Å
477	F	63.8	Low	80.7	Confident	174 Å²	174	58.5 Å²	58.5	76%	0.763	32%	0.319	S	S	*	.	S	Bend	trans	-72.8	-0.4	169.4	-78.9	-77.6	0	0	0	113.5	Y497	F477-Y497 HydrophobicContact CD1-CE2 4.48Å; F477-Y497 HydrophobicContact CD2-CE2 4.28Å; F477-Y497 HydrophobicContact CE1-CD1 4.46Å; F477-Y497 AromaticContact CE1-CE1 3.83Å; F477-Y497 HydrophobicContact CE1-CE1 3.83Å; F477-Y497 HydrophobicContact CE1-CE2 4.29Å; F477-Y497 AromaticContact CE1-CZ 3.74Å; F477-Y497 HydrophobicContact CE2-CE1 4.43Å; F477-Y497 HydrophobicContact CE2-CE2 4.09Å; F477-Y497 AromaticContact CE2-CZ 3.62Å; F477-Y497 WeakPolarHBondContact CE2-OH 3.25Å; F477-Y497 HydrophobicContact CG-CE2 4.49Å; F477-Y497 AromaticContact CZ-CE1 3.7Å; F477-Y497 HydrophobicContact CZ-CE1 3.7Å; F477-Y497 HydrophobicContact CZ-CE2 4.1Å; F477-Y497 AromaticContact CZ-CZ 3.33Å; F477-Y497 WeakPolarHBondContact CZ-OH 3.16Å
478	S	62.3	Low	80.6	Confident	69 Å²	69	56.9 Å²	56.9	48%	0.483	31%	0.306	S	S	.	.	S	Bend	trans	-61.2	140.3	179.2	-41.7	0	0	0	0	111.4	N474 N476	N474-S478 PolarHBondContact ND2-O 2.04Å; N476-S478 WeakPolarHBondContact CB-OG 3.49Å; N476-S478 PolarHBondContact O-N 2.81Å
479	T	63.2	Low	80.5	Confident	127 Å²	127	53.7 Å²	53.7	78%	0.779	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-60.7	141.9	172.9	49.6	0	0	0	0	111.2	T481	T479-T481 PolarHBondContact O-N 3.34Å
480	V	60.7	Low	80.4	Confident	52 Å²	52	55.4 Å²	55.4	32%	0.315	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-60	121.7	172.6	177.9	0	0	0	0	108.9	L431 I486 L499	L431-V480 HydrophobicContact CD2-CG1 3.87Å; V480-I486 HydrophobicContact CG1-CD1 4.19Å; V480-I486 HydrophobicContact CG1-CG1 4.13Å; V480-L499 HydrophobicContact CG2-CD1 3.98Å; V480-L499 HydrophobicContact CG2-CD2 4.33Å
481	T	61.6	Low	80.4	Confident	98 Å²	98	56.5 Å²	56.5	60%	0.601	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-81.5	140.2	177.2	-30.8	0	0	0	0	110.2	T479 S484	T479-T481 PolarHBondContact O-N 3.34Å; T481-S484 VanDerWaalsContact O-CB 3.27Å; T481-S484 WeakPolarHBondContact O-CB 3.32Å; T481-S484 PolarHBondContact O-N 2.72Å; T481-S484 PolarHBondContact O-OG 2.84Å
482	L	58.9	Low	80.2	Confident	62 Å²	62	60.8 Å²	60.8	33%	0.325	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	145.2	177.5	-145.7	78.6	0	0	0	111.7	S433 N437 S484	S433-L482 VanDerWaalsContact CB-CD2 3.44Å; N437-L482 HydrophobicContact CB-CD2 4.21Å; L482-S484 PolarHBondContact O-N 3.28Å
483	N	59.7	Low	80.1	Confident	41 Å²	41	63.3 Å²	63.3	22%	0.219	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	56	11.4	-177.7	-65.5	-16.2	0	0	0	115.1	Q430 L431	Q430-N483 PolarHBondContact NE2-O 3.48Å; L431-N483 PolarHBondContact O-N 2.77Å
484	S	70.2	Confident	79.9	Confident	38 Å²	38	67.7 Å²	67.7	27%	0.266	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-84.1	150.5	175.1	72.2	0	0	0	0	111.6	T481 L482 I486	T481-S484 VanDerWaalsContact O-CB 3.27Å; T481-S484 WeakPolarHBondContact O-CB 3.32Å; T481-S484 PolarHBondContact O-N 2.72Å; T481-S484 PolarHBondContact O-OG 2.84Å; L482-S484 PolarHBondContact O-N 3.28Å; S484-I486 PolarHBondContact O-N 2.88Å
485	K	80.3	Confident	79.8	Confident	159 Å²	159	72.8 Å²	72.8	69%	0.691	41%	0.405	S	S	*	.	B	Isolated β-bridge	trans	-69.8	116.4	168.5	-72.2	-177.6	-179.6	-178.2	0	108.5	Q429	Q429-K485 HydrophobicContact CG-CB 4.3Å; Q429-K485 HydrophobicContact CG-CG 4.42Å
486	I	89.7	Confident	80.2	Confident	7 Å²	7	73.6 Å²	73.6	4%	0.036	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-80	143.8	178.1	-52.3	174.7	0	0	0	109.3	Q429 L431 L458 F472 V480 S484 L499 L502	Q429-I486 PolarHBondContact O-N 2.97Å; L431-I486 HydrophobicContact CB-CD1 3.78Å; L431-I486 HydrophobicContact CB-CG1 4.45Å; L431-I486 HydrophobicContact CD1-CD1 4.42Å; L458-I486 HydrophobicContact CD2-CD1 3.57Å; L458-I486 HydrophobicContact CD2-CG1 4.47Å; L458-I486 HydrophobicContact CG-CD1 4.39Å; F472-I486 HydrophobicContact CB-CG2 3.86Å; F472-I486 HydrophobicContact CD1-CB 4.1Å; F472-I486 HydrophobicContact CD1-CG2 4.03Å; F472-I486 HydrophobicContact CG-CG2 4.23Å; V480-I486 HydrophobicContact CG1-CD1 4.19Å; V480-I486 HydrophobicContact CG1-CG1 4.13Å; S484-I486 PolarHBondContact O-N 2.88Å; I486-L499 HydrophobicContact CG2-CD1 3.59Å; I486-L502 HydrophobicContact CD1-CD1 3.57Å
487	N	93	Very high	80.9	Confident	73 Å²	73	73.5 Å²	73.5	39%	0.39	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	134.3	178.8	-68	-43.8	0	0	0	111.4	F472 I473	F472-N487 WeakPolarHBondContact CA-O 3.44Å; I473-N487 HydrophobicContact CG1-CB 3.97Å; I473-N487 PolarHBondContact N-O 3.43Å
488	L	95.6	Very high	82.4	Confident	19 Å²	19	67 Å²	67	10%	0.099	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	140	172.3	-60.9	177.4	0	0	0	110.6	L411 M414 L415 Q429 F472 I473	L411-L488 HydrophobicContact CD1-CB 3.84Å; L411-L488 HydrophobicContact CD1-CD2 4.21Å; M414-L488 HydrophobicContact CB-CD1 3.67Å; M414-L488 HydrophobicContact CB-CD2 4.28Å; M414-L488 HydrophobicContact CE-CD2 3.7Å; M414-L488 HydrophobicContact SD-CD2 3.95Å; L415-L488 HydrophobicContact CD2-CB 4.02Å; L415-L488 HydrophobicContact CD2-CD1 4.17Å; L415-L488 HydrophobicContact CG-CD1 4.49Å; Q429-L488 HydrophobicContact CB-CD2 4.49Å; F472-L488 HydrophobicContact CD1-CD2 4.12Å; F472-L488 HydrophobicContact CE1-CD2 3.69Å; I473-L488 WeakPolarHBondContact CD1-O 3.34Å; I473-L488 WeakPolarHBondContact CG1-O 3.19Å
489	G	95.7	Very high	83.9	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-62.2	169.8	166.6	0	0	0	0	0	111.8	L411 L415 Y471	L411-G489 WeakPolarHBondContact CD1-O 3.25Å; L415-G489 WeakPolarHBondContact CD1-O 3.44Å; Y471-G489 PolarHBondContact O-N 3.07Å
490	T	95.3	Very high	85.5	Confident	50 Å²	50	61.4 Å²	61.4	31%	0.307	33%	0.33	S	S	.	.			trans	-137.5	16.5	175.3	64.7	0	0	0	0	113.1	L415 N492 R496	L415-T490 HydrophobicContact CD2-CG2 4.16Å; T490-N492 PolarHBondContact O-N 3.49Å; T490-R496 PolarHBondContact OG1-NH1 3.45Å
491	G	96.4	Very high	87.1	Confident	23 Å²	23	62.8 Å²	62.8	24%	0.237	33%	0.332	C	S	.	.	S	Bend	trans	69.9	12.1	-170.6	0	0	0	0	0	115.1	S303	S303-G491 WeakPolarHBondContact O-CA 3.23Å; S303-G491 PolarHBondContact O-N 2.91Å; S303-G491 VanDerWaalsContact O-N 3.12Å
492	N	94.7	Very high	88.6	Confident	89 Å²	89	58.5 Å²	58.5	48%	0.476	31%	0.305	S	S	.	.			trans	-141.5	128.5	176.9	-173.5	-23.3	0	0	0	109.3	T490 T494 R496	T490-N492 PolarHBondContact O-N 3.49Å; N492-T494 PolarHBondContact OD1-N 3.18Å; N492-T494 PolarHBondContact OD1-OG1 3.36Å; N492-R496 VanDerWaalsContact O-CD 3.31Å; N492-R496 WeakPolarHBondContact O-CD 3.08Å
493	L	93.5	Very high	90.4	Very high	53 Å²	53	55.6 Å²	55.6	28%	0.277	29%	0.29	S	S	.	.			trans	-100.4	9.1	-175.4	-62.7	-178.4	0	0	0	114.4	A304 F305 I473 N495 R496 P498	A304-L493 HydrophobicContact CB-CD2 4.44Å; A304-L493 VanDerWaalsContact O-CD2 3.29Å; A304-L493 WeakPolarHBondContact O-CD2 3.37Å; F305-L493 HydrophobicContact CD1-CD1 3.53Å; F305-L493 HydrophobicContact CE1-CD1 3.75Å; F305-L493 HydrophobicContact CG-CD1 4.43Å; I473-L493 HydrophobicContact CG2-CD2 4.22Å; L493-N495 PolarHBondContact O-N 2.87Å; L493-R496 PolarHBondContact O-N 2.87Å; L493-R496 VanDerWaalsContact O-O 3.07Å; L493-P498 HydrophobicContact CD1-CB 4.42Å; L493-P498 HydrophobicContact CD1-CG 3.87Å; L493-P498 HydrophobicContact CD2-CB 4.06Å; L493-P498 HydrophobicContact CD2-CG 4.2Å
494	T	92.2	Very high	92	Very high	95 Å²	95	53.6 Å²	53.6	58%	0.583	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	116.9	174.9	-59.1	0	0	0	0	110.4	N492 R496	N492-T494 PolarHBondContact OD1-N 3.18Å; N492-T494 PolarHBondContact OD1-OG1 3.36Å; T494-R496 WeakPolarHBondContact O-CG 3.02Å; T494-R496 PolarHBondContact O-N 2.04Å
495	N	88.3	Confident	93	Very high	136 Å²	136	55 Å²	55	73%	0.727	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	30.4	-176.3	-56.6	-31.5	0	0	0	114.1	L493	L493-N495 PolarHBondContact O-N 2.87Å
496	R	91	Very high	93.5	Very high	81 Å²	81	48.1 Å²	48.1	31%	0.306	25%	0.251	S	S	.	.			trans	-137.1	140.8	-176.9	-65	162	178.8	-147.2	13.8	110	I473 N474 T490 N492 L493 T494	I473-R496 HydrophobicContact CD1-CB 3.92Å; I473-R496 HydrophobicContact CD1-CG 3.7Å; N474-R496 WeakPolarHBondContact O-CA 3.47Å; T490-R496 PolarHBondContact OG1-NH1 3.45Å; N492-R496 VanDerWaalsContact O-CD 3.31Å; N492-R496 WeakPolarHBondContact O-CD 3.08Å; L493-R496 PolarHBondContact O-N 2.87Å; L493-R496 VanDerWaalsContact O-O 3.07Å; T494-R496 WeakPolarHBondContact O-CG 3.02Å; T494-R496 PolarHBondContact O-N 2.04Å
497	Y	92.6	Very high	93.5	Very high	98 Å²	98	49.4 Å²	49.4	38%	0.384	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	115.9	-176.6	-56.4	-81.2	0	0	0	109.4	I473 N474 F477	I473-Y497 CarbonylContact C-O 3.58Å; I473-Y497 VanDerWaalsContact CA-O 3.27Å; I473-Y497 WeakPolarHBondContact CA-O 3.36Å; N474-Y497 PolarHBondContact N-O 3.12Å; N474-Y497 PolarHBondContact O-N 2.92Å; F477-Y497 HydrophobicContact CD1-CE2 4.48Å; F477-Y497 HydrophobicContact CD2-CE2 4.28Å; F477-Y497 HydrophobicContact CE1-CD1 4.46Å; F477-Y497 AromaticContact CE1-CE1 3.83Å; F477-Y497 HydrophobicContact CE1-CE1 3.83Å; F477-Y497 HydrophobicContact CE1-CE2 4.29Å; F477-Y497 AromaticContact CE1-CZ 3.74Å; F477-Y497 HydrophobicContact CE2-CE1 4.43Å; F477-Y497 HydrophobicContact CE2-CE2 4.09Å; F477-Y497 AromaticContact CE2-CZ 3.62Å; F477-Y497 WeakPolarHBondContact CE2-OH 3.25Å; F477-Y497 HydrophobicContact CG-CE2 4.49Å; F477-Y497 AromaticContact CZ-CE1 3.7Å; F477-Y497 HydrophobicContact CZ-CE1 3.7Å; F477-Y497 HydrophobicContact CZ-CE2 4.1Å; F477-Y497 AromaticContact CZ-CZ 3.33Å; F477-Y497 WeakPolarHBondContact CZ-OH 3.16Å
498	P	94.6	Very high	93.4	Very high	36 Å²	36	46.3 Å²	46.3	23%	0.234	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	133.6	-179.7	28.3	-32.8	0	0	0	111.1	A304 F305 V470 L493 V500	A304-P498 HydrophobicContact CB-CB 4.41Å; F305-P498 HydrophobicContact CE1-CB 4.16Å; F305-P498 HydrophobicContact CE1-CG 3.69Å; F305-P498 HydrophobicContact CE2-CB 4.12Å; F305-P498 HydrophobicContact CE2-CG 4.43Å; F305-P498 HydrophobicContact CZ-CB 3.75Å; F305-P498 HydrophobicContact CZ-CG 3.58Å; V470-P498 HydrophobicContact CG1-CB 4.21Å; L493-P498 HydrophobicContact CD1-CB 4.42Å; L493-P498 HydrophobicContact CD1-CG 3.87Å; L493-P498 HydrophobicContact CD2-CB 4.06Å; L493-P498 HydrophobicContact CD2-CG 4.2Å; P498-V500 VanDerWaalsContact C-N 3.33Å; P498-V500 HydrophobicContact CB-CG1 4.22Å; P498-V500 HydrophobicContact CG-CG1 4.29Å; P498-V500 PolarHBondContact O-N 2.99Å; P498-V500 VanDerWaalsContact O-N 3.14Å
499	L	94.4	Very high	93.4	Very high	33 Å²	33	45.5 Å²	45.5	17%	0.173	24%	0.242	C	C	.	.			trans	-89.7	73.3	178.9	-62.6	174.5	0	0	0	109.5	F472 N474 V480 I486 K501 L502	F472-L499 HydrophobicContact CB-CB 4.34Å; F472-L499 HydrophobicContact CB-CD1 4.23Å; F472-L499 PolarHBondContact O-N 3.35Å; N474-L499 HydrophobicContact CB-CD2 4.3Å; V480-L499 HydrophobicContact CG2-CD1 3.98Å; V480-L499 HydrophobicContact CG2-CD2 4.33Å; I486-L499 HydrophobicContact CG2-CD1 3.59Å; L499-K501 PolarHBondContact O-N 3.12Å; L499-L502 HydrophobicContact CB-CB 4.14Å; L499-L502 HydrophobicContact CB-CD1 3.85Å; L499-L502 HydrophobicContact CB-CG 4Å; L499-L502 HydrophobicContact CD1-CD1 3.58Å; L499-L502 HydrophobicContact CG-CD1 4.25Å; L499-L502 PolarHBondContact O-N 3.2Å
500	V	96.3	Very high	93.4	Very high	47 Å²	47	45.5 Å²	45.5	29%	0.285	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-13.6	-169.2	-57.4	0	0	0	0	115.4	F305 P464 L465 V470 P498	F305-V500 HydrophobicContact CE2-CG1 3.96Å; F305-V500 HydrophobicContact CZ-CG1 3.67Å; P464-V500 CarbonylContact C-O 3.43Å; P464-V500 WeakPolarHBondContact CA-O 3.44Å; P464-V500 HydrophobicContact CB-CB 4.25Å; P464-V500 HydrophobicContact CB-CG2 4.01Å; P464-V500 HydrophobicContact CG-CG2 4.33Å; L465-V500 PolarHBondContact N-O 3.06Å; V470-V500 HydrophobicContact CG2-CB 4.39Å; V470-V500 HydrophobicContact CG2-CG1 4.48Å; P498-V500 VanDerWaalsContact C-N 3.33Å; P498-V500 HydrophobicContact CB-CG1 4.22Å; P498-V500 HydrophobicContact CG-CG1 4.29Å; P498-V500 PolarHBondContact O-N 2.99Å; P498-V500 VanDerWaalsContact O-N 3.14Å
501	K	94.6	Very high	93.4	Very high	81 Å²	81	45 Å²	45	35%	0.352	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-3.5	177.4	-67	-175.9	177.2	-170	0	113.3	E460 Y461 L499	E460-K501 WeakPolarHBondContact CA-O 3.11Å; E460-K501 HydrophobicContact CG-CB 3.98Å; Y461-K501 PolarHBondContact N-O 3.27Å; Y461-K501 WeakPolarHBondContact O-CD 3.45Å; L499-K501 PolarHBondContact O-N 3.12Å
502	L	94	Very high	93.5	Very high	8 Å²	8	43.9 Å²	43.9	4%	0.042	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.9	-178.8	-66.6	-171.1	0	0	0	111.3	L431 L458 I459 E460 L465 F472 I486 L499	L431-L502 HydrophobicContact CD1-CD2 3.9Å; L458-L502 HydrophobicContact CD1-CB 4.35Å; I459-L502 WeakPolarHBondContact O-CA 3.27Å; E460-L502 HydrophobicContact CB-CD2 3.69Å; E460-L502 HydrophobicContact CG-CD2 4Å; L465-L502 WeakPolarHBondContact CD1-O 3.5Å; F472-L502 HydrophobicContact CD2-CB 4.5Å; I486-L502 HydrophobicContact CD1-CD1 3.57Å; L499-L502 HydrophobicContact CB-CB 4.14Å; L499-L502 HydrophobicContact CB-CD1 3.85Å; L499-L502 HydrophobicContact CB-CG 4Å; L499-L502 HydrophobicContact CD1-CD1 3.58Å; L499-L502 HydrophobicContact CG-CD1 4.25Å; L499-L502 PolarHBondContact O-N 3.2Å
503	G	95.6	Very high	93.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	169.4	173.6	0	0	0	0	0	111.9	L458 I459	L458-G503 WeakPolarHBondContact CD1-O 3.5Å; I459-G503 PolarHBondContact N-O 3.33Å; I459-G503 PolarHBondContact O-N 3.47Å
504	G	95	Very high	93.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	137.1	170.8	0	0	0	0	0	110.7	Y461 I506 Y511	Y461-G504 PolarHBondContact OH-O 2.86Å; G504-I506 PolarHBondContact O-N 3.3Å; G504-I506 VanDerWaalsContact O-N 3.08Å; G504-Y511 WeakPolarHBondContact CA-O 3.44Å; G504-Y511 PolarHBondContact N-O 3.29Å
505	K	90.8	Very high	93.6	Very high	66 Å²	66	34.1 Å²	34.1	29%	0.287	17%	0.167	S	C	.	.	S	Bend	trans	-53.5	-30	-175.6	-179.6	179.3	177.4	-173.3	0	113.9	N457 I459 Y461	N457-K505 HydrophobicContact CB-CB 4.11Å; N457-K505 WeakPolarHBondContact O-CB 3.42Å; N457-K505 PolarHBondContact O-N 3.18Å; I459-K505 HydrophobicContact CD1-CB 4Å; I459-K505 HydrophobicContact CD1-CG 4.01Å; I459-K505 HydrophobicContact CG1-CB 4.19Å; I459-K505 HydrophobicContact CG2-CB 4.41Å; Y461-K505 VanDerWaalsContact OH-CA 3.3Å; Y461-K505 WeakPolarHBondContact OH-CA 3.03Å; Y461-K505 PolarHBondContact OH-O 3.41Å
506	I	89.7	Confident	93.6	Very high	15 Å²	15	30 Å²	30	8%	0.077	14%	0.143	C	C	.	.			trans	-97.2	106.4	-174.3	-52.1	-58.4	0	0	0	110	K353 G504 L508 A509 Y514	K353-I506 HydrophobicContact CD-CG2 3.9Å; G504-I506 PolarHBondContact O-N 3.3Å; G504-I506 VanDerWaalsContact O-N 3.08Å; I506-L508 VanDerWaalsContact C-N 3.3Å; I506-L508 HydrophobicContact CG2-CB 4.11Å; I506-L508 PolarHBondContact O-N 2.94Å; I506-A509 HydrophobicContact CB-CB 4.37Å; I506-A509 HydrophobicContact CG2-CB 4.39Å; I506-A509 PolarHBondContact O-N 2.92Å; I506-Y514 HydrophobicContact CB-CE1 4.48Å; I506-Y514 HydrophobicContact CG1-CE1 4.36Å
507	A	90.9	Very high	93.4	Very high	35 Å²	35	27.3 Å²	27.3	29%	0.289	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-59.8	-38.1	179.1	0	0	0	0	0	112.7	A509 N510 Y511	A507-A509 PolarHBondContact O-N 3.49Å; A507-A509 VanDerWaalsContact O-N 3.12Å; A507-N510 VanDerWaalsContact O-CA 3.29Å; A507-N510 WeakPolarHBondContact O-CA 3.44Å; A507-N510 PolarHBondContact O-N 3.47Å; A507-Y511 HydrophobicContact CB-CD1 4.4Å; A507-Y511 HydrophobicContact CB-CE1 3.74Å; A507-Y511 HydrophobicContact CB-CE2 4.1Å; A507-Y511 PolarHBondContact O-N 3.17Å
508	L	91.1	Very high	93	Very high	8 Å²	8	23.4 Å²	23.4	4%	0.042	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-62	-15.7	175.7	-63	171.7	0	0	0	113.9	M30 E339 E341 D342 V346 K353 A363 T364 I506 N510	M30-L508 HydrophobicContact CE-CD1 3.71Å; M30-L508 HydrophobicContact CE-CD2 4.12Å; M30-L508 HydrophobicContact CE-CG 4.26Å; M30-L508 HydrophobicContact SD-CD1 4.45Å; E339-L508 HydrophobicContact CG-CD2 4.04Å; E341-L508 HydrophobicContact CB-CD2 4.08Å; D342-L508 HydrophobicContact CB-CD2 4.32Å; V346-L508 HydrophobicContact CG1-CD2 3.96Å; K353-L508 HydrophobicContact CB-CB 4.2Å; K353-L508 WeakPolarHBondContact CB-O 3.34Å; K353-L508 HydrophobicContact CD-CB 4.36Å; A363-L508 HydrophobicContact CB-CD1 4.11Å; T364-L508 HydrophobicContact CG2-CD1 3.43Å; T364-L508 VanDerWaalsContact CG2-CD1 3.43Å; I506-L508 VanDerWaalsContact C-N 3.3Å; I506-L508 HydrophobicContact CG2-CB 4.11Å; I506-L508 PolarHBondContact O-N 2.94Å; L508-N510 PolarHBondContact O-N 2.79Å
509	A	94.5	Very high	92.2	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.008	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-92.1	27	171.1	0	0	0	0	0	111	R354 I506 A507 Y511 C512 Y514	R354-A509 HydrophobicContact CB-CB 4.48Å; I506-A509 HydrophobicContact CB-CB 4.37Å; I506-A509 HydrophobicContact CG2-CB 4.39Å; I506-A509 PolarHBondContact O-N 2.92Å; A507-A509 PolarHBondContact O-N 3.49Å; A507-A509 VanDerWaalsContact O-N 3.12Å; A509-Y511 PolarHBondContact O-N 3.01Å; A509-C512 WeakPolarHBondContact O-CB 3.4Å; A509-C512 PolarHBondContact O-N 2.62Å; A509-C512 PolarHBondContact O-SG 2.83Å; A509-Y514 HydrophobicContact CB-CE1 4.09Å
510	N	95.4	Very high	91.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	40.5	-168.9	-40.4	127.8	0	0	0	113.1	W301 K310 E352 R354 Y469 Y471 A507 L508 C512	W301-N510 HydrophobicContact CH2-CB 4.35Å; W301-N510 WeakPolarHBondContact CH2-OD1 3.31Å; W301-N510 HydrophobicContact CZ2-CB 3.93Å; K310-N510 PolarHBondContact NZ-ND2 3.34Å; E352-N510 PolarHBondContact OE1-OD1 2.97Å; E352-N510 PolarHBondContact OE2-ND2 2.85Å; E352-N510 PolarHBondContact OE2-OD1 2.69Å; R354-N510 VanDerWaalsContact CD-OD1 3.26Å; R354-N510 WeakPolarHBondContact CD-OD1 3.33Å; R354-N510 PolarHBondContact NE-OD1 3.5Å; Y469-N510 HydrophobicContact CD1-CB 4.18Å; Y469-N510 HydrophobicContact CE1-CB 3.81Å; Y471-N510 WeakPolarHBondContact CE2-O 3.43Å; Y471-N510 PolarHBondContact OH-O 3.26Å; A507-N510 VanDerWaalsContact O-CA 3.29Å; A507-N510 WeakPolarHBondContact O-CA 3.44Å; A507-N510 PolarHBondContact O-N 3.47Å; L508-N510 PolarHBondContact O-N 2.79Å; N510-C512 PolarHBondContact O-N 2.91Å; N510-C512 VanDerWaalsContact O-N 3.08Å
511	Y	95.8	Very high	89.8	Confident	39 Å²	39	29 Å²	29	15%	0.153	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	22.1	-174.5	-54.8	-90.1	0	0	0	114.5	Y461 L465 Y469 Y471 G504 A507 A509 P513	Y461-Y511 HydrophobicContact CE1-CE1 4.13Å; Y461-Y511 HydrophobicContact CE2-CD1 4.14Å; Y461-Y511 AromaticContact CZ-CD1 3.83Å; Y461-Y511 AromaticContact CZ-CE1 3.89Å; L465-Y511 HydrophobicContact CD1-CD1 4.29Å; L465-Y511 HydrophobicContact CD1-CG 4.35Å; L465-Y511 HydrophobicContact CD2-CD1 3.63Å; L465-Y511 HydrophobicContact CD2-CE1 3.57Å; L465-Y511 HydrophobicContact CD2-CG 4.25Å; Y469-Y511 AromaticContact CD2-CD2 3.54Å; Y469-Y511 HydrophobicContact CD2-CD2 3.54Å; Y469-Y511 AromaticContact CD2-CE2 3.69Å; Y469-Y511 HydrophobicContact CD2-CE2 3.69Å; Y469-Y511 HydrophobicContact CE2-CD2 4.24Å; Y469-Y511 HydrophobicContact CE2-CE2 4.17Å; Y469-Y511 AromaticContact CG-CD2 3.79Å; Y469-Y511 HydrophobicContact CG-CD2 3.79Å; Y469-Y511 HydrophobicContact CG-CE2 4.4Å; Y471-Y511 WeakPolarHBondContact CE2-O 3.32Å; G504-Y511 WeakPolarHBondContact CA-O 3.44Å; G504-Y511 PolarHBondContact N-O 3.29Å; A507-Y511 HydrophobicContact CB-CD1 4.4Å; A507-Y511 HydrophobicContact CB-CE1 3.74Å; A507-Y511 HydrophobicContact CB-CE2 4.1Å; A507-Y511 PolarHBondContact O-N 3.17Å; A509-Y511 PolarHBondContact O-N 3.01Å; Y511-P513 VanDerWaalsContact O-CD 3.32Å; Y511-P513 WeakPolarHBondContact O-CD 3.48Å
512	C	97.6	Very high	88.4	Confident	0 Å²	0	28 Å²	28	0%	0	13%	0.134	C	C	.	.			trans	-77.5	118.3	174.3	-68.8	0	0	0	0	109.9	R354 C410 F427 A509 N510 Y514	R354-C512 HydrophobicContact CG-CB 4.33Å; C410-C512 HydrophobicContact CB-CB 3.58Å; C410-C512 WeakPolarHBondContact CB-SG 3.4Å; C410-C512 WeakPolarHBondContact SG-CA 3.19Å; C410-C512 WeakPolarHBondContact SG-CB 3.34Å; C410-C512 CovalentContact SG-SG 2.03Å; C410-C512 PolarHBondContact SG-SG 3.22Å; F427-C512 HydrophobicContact CD1-CB 3.81Å; F427-C512 HydrophobicContact CE1-CB 3.52Å; F427-C512 HydrophobicContact CZ-CB 4.32Å; A509-C512 WeakPolarHBondContact O-CB 3.4Å; A509-C512 PolarHBondContact O-N 2.62Å; A509-C512 PolarHBondContact O-SG 2.83Å; N510-C512 PolarHBondContact O-N 2.91Å; N510-C512 VanDerWaalsContact O-N 3.08Å; C512-Y514 WeakPolarHBondContact O-CD1 3.37Å
513	P	96.3	Very high	86.8	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.178	C	C	.	.			trans	-75.7	141.5	179.3	30	-35.9	0	0	0	112	F427 C428 N457 L458 F472 Y511	F427-P513 CarbonylContact C-O 3.54Å; F427-P513 WeakPolarHBondContact CA-O 3.24Å; F427-P513 VanDerWaalsContact CB-O 3.28Å; F427-P513 WeakPolarHBondContact CB-O 3.45Å; F427-P513 WeakPolarHBondContact CD1-O 3.47Å; C428-P513 PolarHBondContact N-O 3.16Å; C428-P513 WeakPolarHBondContact O-CG 3.36Å; C428-P513 VanDerWaalsContact SG-C 3.59Å; N457-P513 VanDerWaalsContact OD1-CA 3.23Å; N457-P513 WeakPolarHBondContact OD1-CA 3.3Å; L458-P513 HydrophobicContact CB-CB 3.75Å; L458-P513 HydrophobicContact CB-CG 4.42Å; L458-P513 HydrophobicContact CD1-CB 4.19Å; L458-P513 HydrophobicContact CD1-CG 4.18Å; L458-P513 HydrophobicContact CG-CB 4.46Å; F472-P513 HydrophobicContact CE2-CG 3.73Å; F472-P513 HydrophobicContact CZ-CG 3.54Å; Y511-P513 VanDerWaalsContact O-CD 3.32Å; Y511-P513 WeakPolarHBondContact O-CD 3.48Å
514	Y	94.8	Very high	85	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.016	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-146.4	168.9	179.2	61.2	-91.5	0	0	0	112.2	K353 E357 W397 P426 C428 N457 I506 A509 C512 Q516	K353-Y514 VanDerWaalsContact CE-OH 3.23Å; K353-Y514 WeakPolarHBondContact CE-OH 3.49Å; E357-Y514 HydrophobicContact CG-CD2 4.21Å; E357-Y514 HydrophobicContact CG-CE1 4.26Å; E357-Y514 HydrophobicContact CG-CE2 3.6Å; E357-Y514 WeakPolarHBondContact OE1-CE2 3.47Å; E357-Y514 PolarHBondContact OE1-OH 2.87Å; W397-Y514 HydrophobicContact CH2-CD1 4.24Å; W397-Y514 AromaticContact CH2-CD2 3.56Å; W397-Y514 HydrophobicContact CH2-CD2 3.56Å; W397-Y514 HydrophobicContact CH2-CE2 4.24Å; W397-Y514 AromaticContact CH2-CG 3.55Å; W397-Y514 HydrophobicContact CH2-CG 3.55Å; W397-Y514 HydrophobicContact CZ2-CG 4.33Å; W397-Y514 HydrophobicContact CZ3-CD2 4.07Å; W397-Y514 HydrophobicContact CZ3-CG 4.45Å; P426-Y514 WeakPolarHBondContact O-CA 3.28Å; P426-Y514 WeakPolarHBondContact O-CB 3.5Å; C428-Y514 WeakPolarHBondContact SG-CA 2.89Å; C428-Y514 PolarHBondContact SG-N 3.38Å; C428-Y514 VanDerWaalsContact SG-N 3.39Å; C428-Y514 PolarHBondContact SG-O 2.93Å; N457-Y514 PolarHBondContact N-O 2.95Å; N457-Y514 VanDerWaalsContact ND2-CE1 3.29Å; N457-Y514 WeakPolarHBondContact ND2-CE1 3.28Å; N457-Y514 PolarHBondContact OD1-N 2.66Å; N457-Y514 PolarHBondContact OD1-O 3.25Å; N457-Y514 VanDerWaalsContact OD1-O 3.09Å; I506-Y514 HydrophobicContact CB-CE1 4.48Å; I506-Y514 HydrophobicContact CG1-CE1 4.36Å; A509-Y514 HydrophobicContact CB-CE1 4.09Å; C512-Y514 WeakPolarHBondContact O-CD1 3.37Å; Y514-Q516 HydrophobicContact CD2-CB 4.4Å; Y514-Q516 HydrophobicContact CE2-CB 4.12Å; Y514-Q516 PolarHBondContact O-N 2.85Å; Y514-Q516 VanDerWaalsContact O-N 3.13Å
515	H	92.1	Very high	83.2	Confident	28 Å²	28	44.3 Å²	44.3	13%	0.13	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	103.1	175.2	-61.8	95	0	0	0	110	P426 C428 F455	P426-H515 PolarHBondContact O-N 2.82Å; C428-H515 VanDerWaalsContact CB-CE1 3.45Å; C428-H515 WeakPolarHBondContact CB-CE1 3.38Å; F455-H515 CarbonylContact O-C 3.41Å; F455-H515 VanDerWaalsContact O-CA 3.31Å; F455-H515 WeakPolarHBondContact O-CA 3.29Å
516	Q	89	Confident	81.6	Confident	49 Å²	49	44.4 Å²	44.4	23%	0.229	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.9	179.8	-178.1	173.7	-12.9	0	0	110	G454 F455 N457 Y514	G454-Q516 CarbonylContact C-O 3.5Å; G454-Q516 WeakPolarHBondContact CA-O 3.42Å; F455-Q516 VanDerWaalsContact CD1-O 3.23Å; F455-Q516 WeakPolarHBondContact CD1-O 3.32Å; F455-Q516 HydrophobicContact CE1-CB 4.18Å; F455-Q516 HydrophobicContact CE1-CG 4.34Å; F455-Q516 HydrophobicContact CZ-CB 4.28Å; F455-Q516 HydrophobicContact CZ-CG 4.48Å; F455-Q516 PolarHBondContact N-O 2.86Å; F455-Q516 PolarHBondContact O-N 3.38Å; N457-Q516 HydrophobicContact CB-CB 3.93Å; N457-Q516 PolarHBondContact ND2-OE1 2.99Å; Y514-Q516 HydrophobicContact CD2-CB 4.4Å; Y514-Q516 HydrophobicContact CE2-CB 4.12Å; Y514-Q516 PolarHBondContact O-N 2.85Å; Y514-Q516 VanDerWaalsContact O-N 3.13Å
517	E	87.4	Confident	80.5	Confident	25 Å²	25	44 Å²	44	12%	0.117	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	151.2	175.9	-65.9	170.3	161.5	0	0	111.8	S368 T447 S452 H532	S368-E517 WeakPolarHBondContact CB-OE1 3.22Å; S368-E517 WeakPolarHBondContact CB-OE2 3.32Å; S368-E517 PolarHBondContact N-OE2 3.33Å; S368-E517 PolarHBondContact OG-OE1 3.18Å; S368-E517 PolarHBondContact OG-OE2 3.39Å; T447-E517 HydrophobicContact CG2-CG 3.99Å; S452-E517 WeakPolarHBondContact CB-OE1 3.38Å; S452-E517 PolarHBondContact OG-OE1 3.26Å; E517-H532 IonicContact OE1-CE1 2.96Å; E517-H532 PolarHBondContact OE1-CE1 2.85Å; E517-H532 IonicContact OE1-NE2 3.42Å; E517-H532 IonicContact OE2-NE2 3.87Å
518	I	83.1	Confident	79.4	Confident	16 Å²	16	44.9 Å²	44.9	8%	0.082	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-101.2	135.2	179.5	-54.7	162	0	0	0	108.5	L442 V444 F455 W520 N530 T531	L442-I518 HydrophobicContact CD2-CD1 3.6Å; L442-I518 HydrophobicContact CD2-CG1 4.42Å; V444-I518 HydrophobicContact CG1-CD1 3.68Å; F455-I518 HydrophobicContact CD1-CD1 4.29Å; F455-I518 HydrophobicContact CD1-CG1 3.6Å; F455-I518 HydrophobicContact CE1-CG1 4.16Å; I518-W520 HydrophobicContact CB-CH2 4.24Å; I518-W520 HydrophobicContact CB-CZ2 4.15Å; I518-W520 HydrophobicContact CD1-CZ2 4.31Å; I518-W520 HydrophobicContact CG2-CD2 3.95Å; I518-W520 HydrophobicContact CG2-CE3 4.38Å; I518-W520 HydrophobicContact CG2-CG 4.48Å; I518-W520 HydrophobicContact CG2-CH2 4.23Å; I518-W520 HydrophobicContact CG2-CZ2 3.72Å; I518-N530 WeakPolarHBondContact O-CA 3.35Å; I518-T531 HydrophobicContact CB-CG2 3.64Å; I518-T531 HydrophobicContact CD1-CG2 4.26Å; I518-T531 HydrophobicContact CG1-CG2 4.18Å; I518-T531 PolarHBondContact N-OG1 2.83Å; I518-T531 PolarHBondContact O-N 3.47Å
519	E	77	Confident	78.6	Confident	61 Å²	61	45.3 Å²	45.3	29%	0.285	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	127.6	166.2	-169.9	161.2	-151.6	0	0	108	N367 S527	N367-E519 WeakPolarHBondContact ND2-CB 3.45Å; N367-E519 PolarHBondContact ND2-OE2 2.71Å; N367-E519 PolarHBondContact OD1-OE2 3.4Å; E519-S527 VanDerWaalsContact CG-OG 3.3Å; E519-S527 WeakPolarHBondContact CG-OG 3.36Å; E519-S527 WeakPolarHBondContact OE1-CB 3.35Å; E519-S527 PolarHBondContact OE1-OG 2.97Å
520	W	74.7	Confident	78	Confident	75 Å²	75	46.3 Å²	46.3	28%	0.284	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.3	173.1	-65	-84.1	0	0	0	108.2	Y453 I518 S527 I528 A529 N530 T531 V577	Y453-W520 HydrophobicContact CE2-CH2 4.44Å; I518-W520 HydrophobicContact CB-CH2 4.24Å; I518-W520 HydrophobicContact CB-CZ2 4.15Å; I518-W520 HydrophobicContact CD1-CZ2 4.31Å; I518-W520 HydrophobicContact CG2-CD2 3.95Å; I518-W520 HydrophobicContact CG2-CE3 4.38Å; I518-W520 HydrophobicContact CG2-CG 4.48Å; I518-W520 HydrophobicContact CG2-CH2 4.23Å; I518-W520 HydrophobicContact CG2-CZ2 3.72Å; W520-S527 CarbonylContact O-C 3.48Å; W520-S527 WeakPolarHBondContact O-CA 3.33Å; W520-I528 HydrophobicContact CB-CD1 4.19Å; W520-I528 HydrophobicContact CB-CG1 3.86Å; W520-I528 WeakPolarHBondContact O-CG1 3.37Å; W520-I528 PolarHBondContact O-N 2.87Å; W520-A529 HydrophobicContact CE3-CB 3.85Å; W520-A529 HydrophobicContact CZ3-CB 4.49Å; W520-A529 PolarHBondContact N-O 2.87Å; W520-N530 WeakPolarHBondContact CZ3-O 3.44Å; W520-T531 HydrophobicContact CH2-CG2 3.54Å; W520-T531 HydrophobicContact CZ3-CG2 3.79Å; W520-V577 HydrophobicContact CZ2-CG2 4.26Å
521	E	67.2	Low	77.5	Confident	97 Å²	97	46.3 Å²	46.3	45%	0.453	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	154.1	176.4	-66	173.6	-178.1	0	0	110.3	K526	E521-K526 CarbonylContact C-O 3.25Å; E521-K526 WeakPolarHBondContact CA-O 3.49Å
522	D	64	Low	77.1	Confident	60 Å²	60	45.5 Å²	45.5	32%	0.321	24%	0.24	S	C	.	.			trans	-78.8	179.2	167.1	68.5	19.9	0	0	0	111.9	V524 G525 K526 I528	D522-V524 PolarHBondContact O-N 3.49Å; D522-V524 WeakPolarHBondContact OD1-CA 3.39Å; D522-V524 WeakPolarHBondContact OD1-CB 3.3Å; D522-V524 PolarHBondContact OD1-N 2.86Å; D522-G525 PolarHBondContact O-N 3.5Å; D522-G525 PolarHBondContact OD1-N 2.85Å; D522-K526 PolarHBondContact N-O 3.05Å; D522-K526 WeakPolarHBondContact OD1-CB 3.42Å; D522-K526 PolarHBondContact OD1-N 2.78Å; D522-I528 HydrophobicContact CB-CG2 3.89Å
523	D	61.1	Low	76.8	Confident	179 Å²	179	45.5 Å²	45.5	96%	0.957	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-14.1	-178.8	-64.4	-32.5	0	0	0	114
524	V	57.7	Low	76.3	Confident	135 Å²	135	48.4 Å²	48.4	82%	0.818	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-0.6	177.7	-162.8	0	0	0	0	111	D522 K526	D522-V524 PolarHBondContact O-N 3.49Å; D522-V524 WeakPolarHBondContact OD1-CA 3.39Å; D522-V524 WeakPolarHBondContact OD1-CB 3.3Å; D522-V524 PolarHBondContact OD1-N 2.86Å; V524-K526 VanDerWaalsContact C-N 3.33Å
525	G	57.5	Low	75.7	Confident	37 Å²	37	50 Å²	50	38%	0.381	26%	0.264	S	S	.	.	S	Bend	trans	80.3	13.4	-176.3	0	0	0	0	0	113.3	D522	D522-G525 PolarHBondContact O-N 3.5Å; D522-G525 PolarHBondContact OD1-N 2.85Å
526	K	57.9	Low	75	Confident	68 Å²	68	52.4 Å²	52.4	30%	0.296	28%	0.284	S	S	.	.			trans	-84.6	127.1	177.9	175.1	-177	175.6	167.9	0	108.5	E227 E521 D522 V524	E227-K526 WeakPolarHBondContact OE2-CD 3.19Å; E227-K526 WeakPolarHBondContact OE2-CE 3.11Å; E227-K526 IonicContact OE2-NZ 3.55Å; E227-K526 PolarHBondContact OE2-NZ 3.28Å; E521-K526 CarbonylContact C-O 3.25Å; E521-K526 WeakPolarHBondContact CA-O 3.49Å; D522-K526 PolarHBondContact N-O 3.05Å; D522-K526 WeakPolarHBondContact OD1-CB 3.42Å; D522-K526 PolarHBondContact OD1-N 2.78Å; V524-K526 VanDerWaalsContact C-N 3.33Å
527	S	65.8	Low	74.4	Confident	6 Å²	6	52.9 Å²	52.9	4%	0.042	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	143.9	174.9	170.2	0	0	0	0	110.3	N229 E519 W520	N229-S527 VanDerWaalsContact CB-C 3.48Å; N229-S527 VanDerWaalsContact CB-CB 3.49Å; N229-S527 WeakPolarHBondContact CB-O 3.1Å; N229-S527 VanDerWaalsContact CG-C 3.48Å; N229-S527 PolarHBondContact ND2-O 3.19Å; E519-S527 VanDerWaalsContact CG-OG 3.3Å; E519-S527 WeakPolarHBondContact CG-OG 3.36Å; E519-S527 WeakPolarHBondContact OE1-CB 3.35Å; E519-S527 PolarHBondContact OE1-OG 2.97Å; W520-S527 CarbonylContact O-C 3.48Å; W520-S527 WeakPolarHBondContact O-CA 3.33Å
528	I	67.4	Low	74	Confident	55 Å²	55	52.7 Å²	52.7	28%	0.282	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	-23	-175.1	53.2	159.8	0	0	0	113.5	W520 D522 K540	W520-I528 HydrophobicContact CB-CD1 4.19Å; W520-I528 HydrophobicContact CB-CG1 3.86Å; W520-I528 WeakPolarHBondContact O-CG1 3.37Å; W520-I528 PolarHBondContact O-N 2.87Å; D522-I528 HydrophobicContact CB-CG2 3.89Å; I528-K540 WeakPolarHBondContact O-CE 3.28Å; I528-K540 PolarHBondContact O-NZ 3.34Å
529	A	74.5	Confident	73.5	Confident	16 Å²	16	54.8 Å²	54.8	13%	0.132	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	160.6	177.7	0	0	0	0	0	109.2	W520	W520-A529 HydrophobicContact CE3-CB 3.85Å; W520-A529 HydrophobicContact CZ3-CB 4.49Å; W520-A529 PolarHBondContact N-O 2.87Å
530	N	80.9	Confident	72.9	Confident	23 Å²	23	58.3 Å²	58.3	12%	0.123	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	-177.3	172.1	60.6	50.2	0	0	0	110.9	I518 W520 H532 N538	I518-N530 WeakPolarHBondContact O-CA 3.35Å; W520-N530 WeakPolarHBondContact CZ3-O 3.44Å; N530-H532 VanDerWaalsContact OD1-CB 3.3Å; N530-H532 WeakPolarHBondContact OD1-CB 3.47Å; N530-H532 PolarHBondContact OD1-CD2 2.81Å; N530-H532 PolarHBondContact OD1-N 2.95Å; N530-H532 VanDerWaalsContact OD1-N 3.09Å; N530-N538 PolarHBondContact N-OD1 2.72Å; N530-N538 PolarHBondContact O-ND2 2.92Å; N530-N538 PolarHBondContact O-OD1 2.91Å; N530-N538 PolarHBondContact OD1-ND2 2.85Å
531	T	86.9	Confident	72.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.316	C	S	.	.	S	Bend	trans	-94.3	12.9	-174.7	54.4	0	0	0	0	114.5	S452 Y453 I518 W520	S452-T531 VanDerWaalsContact CA-O 3.26Å; S452-T531 WeakPolarHBondContact CA-O 3.29Å; S452-T531 WeakPolarHBondContact CB-O 3.04Å; Y453-T531 HydrophobicContact CD2-CG2 3.55Å; Y453-T531 HydrophobicContact CE1-CG2 4.43Å; Y453-T531 HydrophobicContact CE2-CG2 3.26Å; Y453-T531 HydrophobicContact CG-CG2 4.28Å; Y453-T531 PolarHBondContact N-O 3.29Å; Y453-T531 WeakPolarHBondContact O-CB 3.33Å; Y453-T531 PolarHBondContact O-OG1 3.23Å; I518-T531 HydrophobicContact CB-CG2 3.64Å; I518-T531 HydrophobicContact CD1-CG2 4.26Å; I518-T531 HydrophobicContact CG1-CG2 4.18Å; I518-T531 PolarHBondContact N-OG1 2.83Å; I518-T531 PolarHBondContact O-N 3.47Å; W520-T531 HydrophobicContact CH2-CG2 3.54Å; W520-T531 HydrophobicContact CZ3-CG2 3.79Å
532	H	86.3	Confident	72.7	Confident	21 Å²	21	55.2 Å²	55.2	10%	0.097	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-75.3	133.7	179.2	-76.9	-78.9	0	0	0	112.7	S368 E517 N530 V535 N538 F551	S368-H532 WeakPolarHBondContact CB-CE1 3.43Å; S368-H532 WeakPolarHBondContact CB-NE2 3.48Å; E517-H532 IonicContact OE1-CE1 2.96Å; E517-H532 PolarHBondContact OE1-CE1 2.85Å; E517-H532 IonicContact OE1-NE2 3.42Å; E517-H532 IonicContact OE2-NE2 3.87Å; N530-H532 VanDerWaalsContact OD1-CB 3.3Å; N530-H532 WeakPolarHBondContact OD1-CB 3.47Å; N530-H532 PolarHBondContact OD1-CD2 2.81Å; N530-H532 PolarHBondContact OD1-N 2.95Å; N530-H532 VanDerWaalsContact OD1-N 3.09Å; H532-V535 HydrophobicContact CB-CB 4.21Å; H532-V535 HydrophobicContact CB-CG2 3.67Å; H532-N538 PolarHBondContact O-ND2 3.14Å; H532-F551 WeakPolarHBondContact O-CD1 3.14Å; H532-F551 WeakPolarHBondContact O-CE1 3.24Å
533	C	91	Very high	72.8	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-27.7	178.8	-58.6	0	0	0	0	112.7	E451 V535 F551 G552 S555 V556 C557 C582	E451-C533 PolarHBondContact O-N 3.08Å; C533-V535 VanDerWaalsContact C-N 3.34Å; C533-V535 PolarHBondContact O-N 3.46Å; C533-F551 CarbonylContact O-C 3.58Å; C533-F551 VanDerWaalsContact O-CA 3.26Å; C533-F551 WeakPolarHBondContact O-CA 3.2Å; C533-G552 PolarHBondContact O-N 3.06Å; C533-S555 WeakPolarHBondContact CB-O 3.45Å; C533-S555 VanDerWaalsContact O-CB 3.31Å; C533-S555 WeakPolarHBondContact O-CB 3.43Å; C533-V556 VanDerWaalsContact SG-C 3.54Å; C533-C557 PolarHBondContact SG-N 3.3Å; C533-C557 VanDerWaalsContact SG-N 3.37Å; C533-C582 WeakPolarHBondContact CA-SG 3.46Å; C533-C582 HydrophobicContact CB-CB 3.55Å; C533-C582 WeakPolarHBondContact CB-SG 3.27Å; C533-C582 VanDerWaalsContact SG-CA 3.56Å; C533-C582 WeakPolarHBondContact SG-CB 3.48Å; C533-C582 CovalentContact SG-SG 2.05Å; C533-C582 PolarHBondContact SG-SG 2.82Å
534	H	87	Confident	73.3	Confident	62 Å²	62	52.9 Å²	52.9	29%	0.287	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-10.5	-178.6	-53.3	-60	0	0	0	114.9	S536 G552 M553 S555	H534-S536 PolarHBondContact O-N 3.22Å; H534-G552 WeakPolarHBondContact CA-O 3.37Å; H534-G552 PolarHBondContact ND1-O 2.9Å; H534-M553 HydrophobicContact CB-SD 4.48Å; H534-M553 PolarHBondContact CE1-O 3.33Å; H534-M553 VanDerWaalsContact CE1-O 3.22Å; H534-M553 PolarHBondContact ND1-O 2.93Å; H534-S555 PolarHBondContact CE1-O 2.91Å; H534-S555 PolarHBondContact ND1-O 3.24Å
535	V	80.4	Confident	74.4	Confident	37 Å²	37	46.8 Å²	46.8	22%	0.224	25%	0.254	C	S	.	.			trans	-89	96	-178.2	177.1	0	0	0	0	109.3	H532 C533 T537 N538	H532-V535 HydrophobicContact CB-CB 4.21Å; H532-V535 HydrophobicContact CB-CG2 3.67Å; C533-V535 VanDerWaalsContact C-N 3.34Å; C533-V535 PolarHBondContact O-N 3.46Å; V535-T537 VanDerWaalsContact CG1-OG1 3.23Å; V535-T537 WeakPolarHBondContact CG1-OG1 3.18Å; V535-T537 PolarHBondContact O-N 3.15Å; V535-T537 VanDerWaalsContact O-N 3.07Å; V535-N538 WeakPolarHBondContact O-CB 3.32Å; V535-N538 PolarHBondContact O-N 2.92Å
536	S	78.5	Confident	75.5	Confident	79 Å²	79	47.4 Å²	47.4	55%	0.552	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-57.7	-24.3	-176.7	56.2	0	0	0	0	114.3	H534 N538	H534-S536 PolarHBondContact O-N 3.22Å; S536-N538 VanDerWaalsContact C-N 3.3Å; S536-N538 PolarHBondContact O-N 3.21Å
537	T	76.2	Confident	76.9	Confident	58 Å²	58	45 Å²	45	36%	0.356	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-78.1	-8.5	179.2	58.6	0	0	0	0	114.4	Y228 V535 L539	Y228-T537 HydrophobicContact CE1-CG2 4.07Å; Y228-T537 VanDerWaalsContact CE1-OG1 3.26Å; Y228-T537 WeakPolarHBondContact CE1-OG1 3.4Å; Y228-T537 HydrophobicContact CE2-CG2 4.4Å; Y228-T537 VanDerWaalsContact OH-CG2 3.29Å; Y228-T537 WeakPolarHBondContact OH-CG2 3.4Å; Y228-T537 PolarHBondContact OH-OG1 3.4Å; V535-T537 VanDerWaalsContact CG1-OG1 3.23Å; V535-T537 WeakPolarHBondContact CG1-OG1 3.18Å; V535-T537 PolarHBondContact O-N 3.15Å; V535-T537 VanDerWaalsContact O-N 3.07Å; T537-L539 PolarHBondContact O-N 3.46Å
538	N	79.4	Confident	77.9	Confident	22 Å²	22	44.8 Å²	44.8	12%	0.118	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-65.3	-26.9	176.1	-77.8	-22.2	0	0	0	111.7	N530 H532 V535 S536 K540 F551	N530-N538 PolarHBondContact N-OD1 2.72Å; N530-N538 PolarHBondContact O-ND2 2.92Å; N530-N538 PolarHBondContact O-OD1 2.91Å; N530-N538 PolarHBondContact OD1-ND2 2.85Å; H532-N538 PolarHBondContact O-ND2 3.14Å; V535-N538 WeakPolarHBondContact O-CB 3.32Å; V535-N538 PolarHBondContact O-N 2.92Å; S536-N538 VanDerWaalsContact C-N 3.3Å; S536-N538 PolarHBondContact O-N 3.21Å; N538-K540 PolarHBondContact O-N 3.18Å; N538-F551 HydrophobicContact CB-CD1 3.72Å; N538-F551 HydrophobicContact CB-CD2 4.5Å; N538-F551 HydrophobicContact CB-CE1 3.63Å; N538-F551 HydrophobicContact CB-CE2 4.4Å; N538-F551 HydrophobicContact CB-CG 4.16Å; N538-F551 HydrophobicContact CB-CZ 3.98Å
539	L	72.4	Confident	79.1	Confident	60 Å²	60	43 Å²	43	31%	0.314	23%	0.225	S	C	.	.			trans	-85.7	90.8	170.2	-172.6	67	0	0	0	110.7	T537 N545 F551	T537-L539 PolarHBondContact O-N 3.46Å; L539-N545 HydrophobicContact CD1-CB 3.85Å; L539-F551 HydrophobicContact CB-CD2 3.77Å; L539-F551 HydrophobicContact CB-CE2 4.25Å
540	K	64.3	Low	79.9	Confident	135 Å²	135	45.8 Å²	45.8	59%	0.587	23%	0.232	S	C	*	.			trans	-79.7	-41.4	178.8	-67.5	-172.4	-180	-178.4	0	113.9	I528 N538	I528-K540 WeakPolarHBondContact O-CE 3.28Å; I528-K540 PolarHBondContact O-NZ 3.34Å; N538-K540 PolarHBondContact O-N 3.18Å
541	D	68.3	Low	80.3	Confident	55 Å²	55	46.1 Å²	46.1	29%	0.294	23%	0.232	S	C	.	.			trans	-135.5	110.8	-174.5	-175.7	4	0	0	0	110.8	H543 H544	D541-H543 PolarHBondContact O-N 2.78Å; D541-H543 VanDerWaalsContact O-N 3.09Å; D541-H543 VanDerWaalsContact OD1-CB 3.26Å; D541-H543 WeakPolarHBondContact OD1-CB 3.49Å; D541-H543 IonicContact OD1-CD2 3.13Å; D541-H543 PolarHBondContact OD1-CD2 3.1Å; D541-H543 IonicContact OD1-CG 2.99Å; D541-H543 PolarHBondContact OD1-N 3.26Å; D541-H544 PolarHBondContact O-N 3.25Å; D541-H544 IonicContact OD2-CE1 3.37Å; D541-H544 PolarHBondContact OD2-CE1 2.86Å; D541-H544 IonicContact OD2-CG 3.94Å; D541-H544 IonicContact OD2-ND1 2.73Å; D541-H544 PolarHBondContact OD2-ND1 3.02Å
542	P	69	Low	80.2	Confident	52 Å²	52	47 Å²	47	34%	0.338	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-54.9	-24.3	172.9	-24.6	34.3	0	0	0	113.7	H544 N545 L702 Y703	P542-H544 VanDerWaalsContact C-N 3.28Å; P542-H544 PolarHBondContact O-N 3.38Å; P542-N545 WeakPolarHBondContact O-CB 3.28Å; P542-N545 PolarHBondContact O-N 3.45Å; P542-L702 HydrophobicContact CB-CD1 3.72Å; P542-L702 HydrophobicContact CB-CD2 4.37Å; P542-L702 HydrophobicContact CG-CD1 4.49Å; P542-Y703 PolarHBondContact O-OH 3.41Å
543	H	66.4	Low	80.2	Confident	65 Å²	65	53 Å²	53	30%	0.301	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-71.6	-19.1	178.1	-61.4	-59.1	0	0	0	114.2	D541 K621 Q622 L702	D541-H543 PolarHBondContact O-N 2.78Å; D541-H543 VanDerWaalsContact O-N 3.09Å; D541-H543 VanDerWaalsContact OD1-CB 3.26Å; D541-H543 WeakPolarHBondContact OD1-CB 3.49Å; D541-H543 IonicContact OD1-CD2 3.13Å; D541-H543 PolarHBondContact OD1-CD2 3.1Å; D541-H543 IonicContact OD1-CG 2.99Å; D541-H543 PolarHBondContact OD1-N 3.26Å; H543-K621 VanDerWaalsContact CE1-CD 3.41Å; H543-K621 WeakPolarHBondContact CE1-CD 3.47Å; H543-Q622 VanDerWaalsContact CA-NE2 3.29Å; H543-Q622 PolarHBondContact O-NE2 2.81Å; H543-L702 WeakPolarHBondContact CE1-CD2 3.42Å
544	H	71.6	Confident	80.2	Confident	125 Å²	125	58.6 Å²	58.6	58%	0.579	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-110.1	15.2	178.2	-65.6	92.9	0	0	0	112.3	D541 P542 F546	D541-H544 PolarHBondContact O-N 3.25Å; D541-H544 IonicContact OD2-CE1 3.37Å; D541-H544 PolarHBondContact OD2-CE1 2.86Å; D541-H544 IonicContact OD2-CG 3.94Å; D541-H544 IonicContact OD2-ND1 2.73Å; D541-H544 PolarHBondContact OD2-ND1 3.02Å; P542-H544 VanDerWaalsContact C-N 3.28Å; P542-H544 PolarHBondContact O-N 3.38Å; H544-F546 HydrophobicContact CB-CE2 4.24Å; H544-F546 HydrophobicContact CB-CZ 4.4Å; H544-F546 AromaticContact CD2-CZ 3.81Å; H544-F546 WeakPolarHBondContact O-CD2 3.44Å; H544-F546 PolarHBondContact O-N 3.36Å
545	N	81	Confident	80.5	Confident	6 Å²	6	55.7 Å²	55.7	3%	0.032	29%	0.287	C	S	.	.			trans	-80.8	60.8	178.7	-167	6.8	0	0	0	112.2	L539 P542 K547 L548 E549 A599	L539-N545 HydrophobicContact CD1-CB 3.85Å; P542-N545 WeakPolarHBondContact O-CB 3.28Å; P542-N545 PolarHBondContact O-N 3.45Å; N545-K547 PolarHBondContact O-N 2.83Å; N545-L548 PolarHBondContact O-N 2.97Å; N545-L548 PolarHBondContact OD1-N 3.26Å; N545-E549 PolarHBondContact ND2-N 2.93Å; N545-E549 PolarHBondContact ND2-O 3.11Å; N545-E549 PolarHBondContact OD1-N 3.23Å; N545-A599 WeakPolarHBondContact ND2-CB 3.3Å
546	F	80.2	Confident	81.2	Confident	51 Å²	51	54.2 Å²	54.2	22%	0.224	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-20.7	-174.9	-60.2	-50.2	0	0	0	114.2	H544 W564 L566 L619 L624	H544-F546 HydrophobicContact CB-CE2 4.24Å; H544-F546 HydrophobicContact CB-CZ 4.4Å; H544-F546 AromaticContact CD2-CZ 3.81Å; H544-F546 WeakPolarHBondContact O-CD2 3.44Å; H544-F546 PolarHBondContact O-N 3.36Å; F546-W564 PolarHBondContact O-NE1 3.47Å; F546-L566 HydrophobicContact CB-CD1 3.85Å; F546-L566 HydrophobicContact CB-CD2 3.89Å; F546-L566 HydrophobicContact CB-CG 4.26Å; F546-L566 HydrophobicContact CD1-CD1 3.56Å; F546-L566 HydrophobicContact CD1-CD2 3.63Å; F546-L566 HydrophobicContact CD1-CG 4.23Å; F546-L566 HydrophobicContact CD2-CD1 3.94Å; F546-L566 HydrophobicContact CE1-CD1 4.07Å; F546-L566 HydrophobicContact CE2-CD1 4.39Å; F546-L566 HydrophobicContact CG-CD1 3.5Å; F546-L566 VanDerWaalsContact CG-CD1 3.5Å; F546-L566 HydrophobicContact CG-CD2 4.01Å; F546-L566 HydrophobicContact CG-CG 4.31Å; F546-L566 HydrophobicContact CZ-CD1 4.45Å; F546-L619 HydrophobicContact CD1-CD1 3.95Å; F546-L619 HydrophobicContact CE1-CD1 4.33Å; F546-L624 HydrophobicContact CE1-CD1 4Å
547	K	86.6	Confident	81.9	Confident	18 Å²	18	50.5 Å²	50.5	8%	0.078	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-2.6	174.5	-74.5	-171.2	-76.2	152.3	0	113.5	Y453 N545 E549 W564 A580 Y583	Y453-K547 PolarHBondContact OH-NZ 3.15Å; N545-K547 PolarHBondContact O-N 2.83Å; K547-E549 HydrophobicContact CB-CG 3.59Å; K547-E549 VanDerWaalsContact CE-CD 3.5Å; K547-E549 WeakPolarHBondContact CE-OE2 3.46Å; K547-E549 IonicContact NZ-OE1 3.84Å; K547-E549 PolarHBondContact NZ-OE1 3.4Å; K547-E549 IonicContact NZ-OE2 3.67Å; K547-E549 PolarHBondContact NZ-OE2 3.47Å; K547-E549 VanDerWaalsContact NZ-OE2 3.11Å; K547-E549 PolarHBondContact O-N 2.72Å; K547-W564 HydrophobicContact CB-CZ2 4.23Å; K547-W564 HydrophobicContact CG-CZ2 4.47Å; K547-W564 WeakPolarHBondContact O-CH2 3.09Å; K547-W564 WeakPolarHBondContact O-CZ2 3.36Å; K547-A580 PolarHBondContact NZ-O 3.45Å; K547-Y583 WeakPolarHBondContact O-CE1 3.45Å; K547-Y583 PolarHBondContact O-OH 3.42Å; K547-Y583 VanDerWaalsContact O-OH 3.1Å
548	L	88.4	Confident	82.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.236	C	C	.	.			trans	54.9	34.8	-174.1	-50.5	176.4	0	0	0	112.8	N545 L598 A599 I615 A617 L619 Y703	N545-L548 PolarHBondContact O-N 2.97Å; N545-L548 PolarHBondContact OD1-N 3.26Å; L548-L598 HydrophobicContact CB-CB 4.11Å; L548-L598 HydrophobicContact CB-CD2 4.12Å; L548-L598 HydrophobicContact CB-CG 4.49Å; L548-L598 HydrophobicContact CD1-CD2 4.21Å; L548-A599 HydrophobicContact CB-CB 4.21Å; L548-A599 PolarHBondContact O-N 3.27Å; L548-I615 HydrophobicContact CD1-CG2 3.81Å; L548-A617 HydrophobicContact CD1-CB 3.73Å; L548-L619 HydrophobicContact CD2-CD2 4.08Å; L548-Y703 HydrophobicContact CD2-CD1 3.54Å; L548-Y703 HydrophobicContact CD2-CE1 3.39Å
549	E	91.2	Very high	83.5	Confident	17 Å²	17	49.8 Å²	49.8	8%	0.079	24%	0.244	C	C	.	.			trans	-69.2	151.6	-175.8	-69.6	176	114.5	0	0	111.6	N545 K547 F551 G581 C582 Y583	N545-E549 PolarHBondContact ND2-N 2.93Å; N545-E549 PolarHBondContact ND2-O 3.11Å; N545-E549 PolarHBondContact OD1-N 3.23Å; K547-E549 HydrophobicContact CB-CG 3.59Å; K547-E549 VanDerWaalsContact CE-CD 3.5Å; K547-E549 WeakPolarHBondContact CE-OE2 3.46Å; K547-E549 IonicContact NZ-OE1 3.84Å; K547-E549 PolarHBondContact NZ-OE1 3.4Å; K547-E549 IonicContact NZ-OE2 3.67Å; K547-E549 PolarHBondContact NZ-OE2 3.47Å; K547-E549 VanDerWaalsContact NZ-OE2 3.11Å; K547-E549 PolarHBondContact O-N 2.72Å; E549-F551 HydrophobicContact CB-CD2 4.25Å; E549-F551 HydrophobicContact CB-CE2 3.63Å; E549-F551 HydrophobicContact CB-CZ 4.25Å; E549-F551 HydrophobicContact CG-CE2 4.48Å; E549-G581 WeakPolarHBondContact OE1-CA 3.32Å; E549-C582 CarbonylContact C-O 3.47Å; E549-C582 WeakPolarHBondContact CA-O 3.36Å; E549-C582 VanDerWaalsContact CB-O 3.25Å; E549-C582 WeakPolarHBondContact CB-O 3.47Å; E549-C582 PolarHBondContact OE1-N 2.86Å; E549-Y583 HydrophobicContact CG-CE1 4.4Å
550	R	91.7	Very high	84.4	Confident	75 Å²	75	47.5 Å²	47.5	28%	0.283	23%	0.232	S	C	.	.			trans	-126.5	133.2	166.3	-70.9	-174.6	166.4	-172.7	-4.4	108.4	S555 C582 Y583 T584 E597 L598	R550-S555 WeakPolarHBondContact O-CB 3.28Å; R550-S555 PolarHBondContact O-OG 3.1Å; R550-S555 VanDerWaalsContact O-OG 3.13Å; R550-C582 PolarHBondContact N-O 3.33Å; R550-C582 CarbonylContact O-C 3.58Å; R550-C582 VanDerWaalsContact O-C 3.32Å; R550-Y583 PolarHBondContact O-N 3.02Å; R550-T584 HydrophobicContact CB-CG2 3.86Å; R550-T584 VanDerWaalsContact CD-OG1 3.26Å; R550-T584 WeakPolarHBondContact CD-OG1 3.47Å; R550-E597 IonicContact NH1-OE2 3.77Å; R550-L598 PolarHBondContact NE-O 3.36Å; R550-L598 VanDerWaalsContact NE-O 3.07Å; R550-L598 PolarHBondContact NH2-O 2.84Å
551	F	89.2	Confident	85.3	Confident	31 Å²	31	42.4 Å²	42.4	14%	0.136	21%	0.213	C	C	.	.			trans	-116.4	139.9	178.9	-65.6	-95.8	0	0	0	109.4	H532 C533 N538 L539 E549 S555 C582	H532-F551 WeakPolarHBondContact O-CD1 3.14Å; H532-F551 WeakPolarHBondContact O-CE1 3.24Å; C533-F551 CarbonylContact O-C 3.58Å; C533-F551 VanDerWaalsContact O-CA 3.26Å; C533-F551 WeakPolarHBondContact O-CA 3.2Å; N538-F551 HydrophobicContact CB-CD1 3.72Å; N538-F551 HydrophobicContact CB-CD2 4.5Å; N538-F551 HydrophobicContact CB-CE1 3.63Å; N538-F551 HydrophobicContact CB-CE2 4.4Å; N538-F551 HydrophobicContact CB-CG 4.16Å; N538-F551 HydrophobicContact CB-CZ 3.98Å; L539-F551 HydrophobicContact CB-CD2 3.77Å; L539-F551 HydrophobicContact CB-CE2 4.25Å; E549-F551 HydrophobicContact CB-CD2 4.25Å; E549-F551 HydrophobicContact CB-CE2 3.63Å; E549-F551 HydrophobicContact CB-CZ 4.25Å; E549-F551 HydrophobicContact CG-CE2 4.48Å; F551-S555 WeakPolarHBondContact CA-OG 3.14Å; F551-C582 HydrophobicContact CD1-CB 4Å; F551-C582 HydrophobicContact CE1-CB 3.74Å; F551-C582 HydrophobicContact CZ-CB 4.08Å
552	G	86.4	Confident	85.5	Confident	17 Å²	17	44 Å²	44	18%	0.175	23%	0.227	C	C	.	.	S	Bend	trans	159.4	171.4	-175.6	0	0	0	0	0	112	C533 H534 D554 S555	C533-G552 PolarHBondContact O-N 3.06Å; H534-G552 WeakPolarHBondContact CA-O 3.37Å; H534-G552 PolarHBondContact ND1-O 2.9Å; G552-D554 PolarHBondContact O-N 2.73Å; G552-S555 PolarHBondContact N-OG 3.5Å; G552-S555 WeakPolarHBondContact O-CB 3.36Å; G552-S555 PolarHBondContact O-N 2.84Å; G552-S555 PolarHBondContact O-OG 2.62Å; G552-S555 VanDerWaalsContact O-OG 3.09Å
553	M	86	Confident	85.7	Confident	149 Å²	149	46.7 Å²	46.7	73%	0.734	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-30.9	-173.5	-65.8	-57.2	-62.5	0	0	113.7	H534	H534-M553 HydrophobicContact CB-SD 4.48Å; H534-M553 PolarHBondContact CE1-O 3.33Å; H534-M553 VanDerWaalsContact CE1-O 3.22Å; H534-M553 PolarHBondContact ND1-O 2.93Å
554	D	89.4	Confident	86.4	Confident	116 Å²	116	43.7 Å²	43.7	62%	0.62	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	21.2	178.8	-50.5	-45.4	0	0	0	113.1	G552 T584 F585	G552-D554 PolarHBondContact O-N 2.73Å; D554-T584 WeakPolarHBondContact O-CA 3.22Å; D554-F585 WeakPolarHBondContact O-CD1 3.47Å; D554-F585 VanDerWaalsContact O-CE1 3.3Å; D554-F585 WeakPolarHBondContact O-CE1 3.38Å; D554-F585 PolarHBondContact O-N 2.93Å
555	S	94.1	Very high	87	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.007	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	140.8	-179.8	-54.2	0	0	0	0	112.4	C533 H534 R550 F551 G552 Y583 T584	C533-S555 WeakPolarHBondContact CB-O 3.45Å; C533-S555 VanDerWaalsContact O-CB 3.31Å; C533-S555 WeakPolarHBondContact O-CB 3.43Å; H534-S555 PolarHBondContact CE1-O 2.91Å; H534-S555 PolarHBondContact ND1-O 3.24Å; R550-S555 WeakPolarHBondContact O-CB 3.28Å; R550-S555 PolarHBondContact O-OG 3.1Å; R550-S555 VanDerWaalsContact O-OG 3.13Å; F551-S555 WeakPolarHBondContact CA-OG 3.14Å; G552-S555 PolarHBondContact N-OG 3.5Å; G552-S555 WeakPolarHBondContact O-CB 3.36Å; G552-S555 PolarHBondContact O-N 2.84Å; G552-S555 PolarHBondContact O-OG 2.62Å; G552-S555 VanDerWaalsContact O-OG 3.09Å; S555-Y583 CarbonylContact C-O 3.55Å; S555-Y583 VanDerWaalsContact CA-O 3.22Å; S555-Y583 WeakPolarHBondContact CA-O 3.26Å; S555-T584 WeakPolarHBondContact OG-CG2 3.18Å
556	V	94.1	Very high	86.9	Confident	6 Å²	6	39.7 Å²	39.7	4%	0.036	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.6	-179.7	68.3	0	0	0	0	110.5	K450 C533 V558 C582 Y583 F585 L638	K450-V556 HydrophobicContact CB-CG2 3.6Å; K450-V556 HydrophobicContact CD-CG2 4.33Å; K450-V556 WeakPolarHBondContact O-CG2 3.49Å; C533-V556 VanDerWaalsContact SG-C 3.54Å; V556-V558 HydrophobicContact CG1-CG2 4.03Å; V556-C582 WeakPolarHBondContact O-CA 3.5Å; V556-Y583 PolarHBondContact N-O 3.32Å; V556-Y583 PolarHBondContact O-N 3.19Å; V556-F585 HydrophobicContact CB-CD1 4.15Å; V556-F585 HydrophobicContact CB-CE1 4.19Å; V556-F585 HydrophobicContact CG1-CD1 3.81Å; V556-F585 HydrophobicContact CG1-CE1 4.33Å; V556-L638 HydrophobicContact CB-CD1 4.4Å; V556-L638 HydrophobicContact CB-CD2 4.39Å; V556-L638 HydrophobicContact CG1-CD1 3.89Å; V556-L638 HydrophobicContact CG2-CD1 4.16Å; V556-L638 HydrophobicContact CG2-CD2 3.73Å
557	C	94.8	Very high	86.9	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.007	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	130.5	169.2	-176.1	0	0	0	0	111	C446 K450 S452 C533 G581	C446-C557 WeakPolarHBondContact CA-SG 3.45Å; C446-C557 HydrophobicContact CB-CB 3.81Å; C446-C557 WeakPolarHBondContact CB-SG 3.36Å; C446-C557 WeakPolarHBondContact SG-CB 3.28Å; C446-C557 PolarHBondContact SG-O 2.91Å; C446-C557 CovalentContact SG-SG 2.04Å; C446-C557 PolarHBondContact SG-SG 2.97Å; K450-C557 HydrophobicContact CB-CB 4.23Å; K450-C557 VanDerWaalsContact O-CB 3.3Å; K450-C557 WeakPolarHBondContact O-CB 3.42Å; K450-C557 PolarHBondContact O-N 3.38Å; S452-C557 WeakPolarHBondContact O-CB 3.38Å; S452-C557 PolarHBondContact O-SG 3.19Å; S452-C557 VanDerWaalsContact O-SG 3.38Å; C533-C557 PolarHBondContact SG-N 3.3Å; C533-C557 VanDerWaalsContact SG-N 3.37Å; C557-G581 CarbonylContact C-O 3.55Å; C557-G581 WeakPolarHBondContact CA-O 3.13Å
558	V	95.5	Very high	86.6	Confident	3 Å²	3	42 Å²	42	2%	0.018	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131.5	175.2	-176.8	0	0	0	0	109.3	C446 V556 H560 A580 G581 Y583 L596 L630 V631	C446-V558 PolarHBondContact SG-N 3.36Å; V556-V558 HydrophobicContact CG1-CG2 4.03Å; V558-H560 PolarHBondContact O-CD2 3.14Å; V558-A580 VanDerWaalsContact O-CA 3.32Å; V558-A580 WeakPolarHBondContact O-CA 3.35Å; V558-G581 PolarHBondContact N-O 2.87Å; V558-G581 PolarHBondContact O-N 3.24Å; V558-Y583 HydrophobicContact CB-CD2 3.64Å; V558-Y583 HydrophobicContact CB-CE2 3.9Å; V558-Y583 HydrophobicContact CG2-CD2 3.68Å; V558-Y583 HydrophobicContact CG2-CE2 4.45Å; V558-L596 HydrophobicContact CG1-CD1 3.98Å; V558-L596 HydrophobicContact CG2-CD1 3.95Å; V558-L596 HydrophobicContact CG2-CD2 4Å; V558-L630 HydrophobicContact CG1-CB 4.12Å; V558-L630 HydrophobicContact CG1-CD2 4.29Å; V558-V631 WeakPolarHBondContact CG1-O 3.42Å
559	E	94	Very high	85.9	Confident	62 Å²	62	44.9 Å²	44.9	29%	0.29	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	141.5	175.5	-61.6	-71.3	177.8	0	0	110.2	S445 C446 G579 V631	S445-E559 WeakPolarHBondContact CA-OE2 3.36Å; S445-E559 WeakPolarHBondContact CB-OE1 3.4Å; C446-E559 WeakPolarHBondContact CB-OE1 3.17Å; C446-E559 PolarHBondContact N-OE1 2.85Å; E559-G579 CarbonylContact C-O 3.52Å; E559-G579 WeakPolarHBondContact CA-O 3.29Å; E559-G579 VanDerWaalsContact OE2-O 3.1Å; E559-V631 HydrophobicContact CB-CB 4.19Å; E559-V631 HydrophobicContact CB-CG2 4.43Å; E559-V631 PolarHBondContact O-N 3.4Å
560	H	91.3	Very high	85.2	Confident	12 Å²	12	52.4 Å²	52.4	6%	0.056	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-98.2	141.3	173	-60.7	-175.1	0	0	0	108.8	V558 W564 G579 G581 Y583 K629 L630	V558-H560 PolarHBondContact O-CD2 3.14Å; H560-W564 HydrophobicContact CB-CE3 4.43Å; H560-W564 AromaticContact CE1-CE3 3.59Å; H560-W564 AromaticContact CE1-CZ3 3.52Å; H560-W564 AromaticContact CG-CE3 3.87Å; H560-W564 AromaticContact ND1-CD2 3.93Å; H560-W564 AromaticContact ND1-CE3 3.27Å; H560-W564 VanDerWaalsContact ND1-CE3 3.27Å; H560-W564 AromaticContact ND1-CZ3 3.65Å; H560-W564 AromaticContact NE2-CZ3 3.92Å; H560-G579 PolarHBondContact N-O 3.34Å; H560-G581 PolarHBondContact NE2-N 2.93Å; H560-Y583 PolarHBondContact CE1-OH 3.46Å; H560-Y583 AromaticContact NE2-CE2 3.56Å; H560-Y583 AromaticContact NE2-CZ 3.55Å; H560-Y583 PolarHBondContact NE2-OH 3.28Å; H560-K629 CarbonylContact C-O 3.54Å; H560-K629 VanDerWaalsContact CA-O 3.28Å; H560-K629 WeakPolarHBondContact CA-O 3.24Å; H560-L630 WeakPolarHBondContact CD2-CD2 3.39Å; H560-L630 WeakPolarHBondContact NE2-CD2 3.01Å
561	S	82	Confident	84.4	Confident	28 Å²	28	52 Å²	52	20%	0.196	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-66.8	156.7	161.4	-148.7	0	0	0	0	108.9	K629	S561-K629 VanDerWaalsContact CB-CB 3.42Å; S561-K629 PolarHBondContact N-O 2.9Å
562	P	73.5	Confident	83.7	Confident	89 Å²	89	55.2 Å²	55.2	58%	0.578	32%	0.318	S	S	*	.	S	Bend	trans	-52.5	156.8	172.2	-24.6	34.4	0	0	0	111.9
563	N	73.3	Confident	83.1	Confident	108 Å²	108	58.8 Å²	58.8	58%	0.578	33%	0.329	S	S	*	.			trans	78.1	55.8	175.8	-47.7	-47.3	0	0	0	114.7	H565	N563-H565 VanDerWaalsContact CB-NE2 3.32Å; N563-H565 WeakPolarHBondContact CB-NE2 2.85Å
564	W	81.4	Confident	82.4	Confident	3 Å²	3	54.8 Å²	54.8	1%	0.011	31%	0.313	C	S	.	.			trans	-85	112.8	164.7	-166.4	-73.8	0	0	0	109.4	F546 K547 H560 P575 I615 V626 L630	F546-W564 PolarHBondContact O-NE1 3.47Å; K547-W564 HydrophobicContact CB-CZ2 4.23Å; K547-W564 HydrophobicContact CG-CZ2 4.47Å; K547-W564 WeakPolarHBondContact O-CH2 3.09Å; K547-W564 WeakPolarHBondContact O-CZ2 3.36Å; H560-W564 HydrophobicContact CB-CE3 4.43Å; H560-W564 AromaticContact CE1-CE3 3.59Å; H560-W564 AromaticContact CE1-CZ3 3.52Å; H560-W564 AromaticContact CG-CE3 3.87Å; H560-W564 AromaticContact ND1-CD2 3.93Å; H560-W564 AromaticContact ND1-CE3 3.27Å; H560-W564 VanDerWaalsContact ND1-CE3 3.27Å; H560-W564 AromaticContact ND1-CZ3 3.65Å; H560-W564 AromaticContact NE2-CZ3 3.92Å; W564-P575 WeakPolarHBondContact O-CD 3.44Å; W564-I615 HydrophobicContact CH2-CD1 3.35Å; W564-I615 HydrophobicContact CZ2-CD1 4.39Å; W564-I615 HydrophobicContact CZ3-CD1 3.62Å; W564-V626 HydrophobicContact CZ2-CG1 3.59Å; W564-L630 HydrophobicContact CZ3-CD2 3.86Å
565	H	82.7	Confident	81.5	Confident	38 Å²	38	49.7 Å²	49.7	18%	0.176	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	142.8	-169.5	-64	-40.5	0	0	0	112.7	N563 L572 V626 K627	N563-H565 VanDerWaalsContact CB-NE2 3.32Å; N563-H565 WeakPolarHBondContact CB-NE2 2.85Å; H565-L572 HydrophobicContact CB-CD1 3.55Å; H565-L572 HydrophobicContact CB-CG 4.42Å; H565-V626 WeakPolarHBondContact O-CA 3.38Å; H565-K627 PolarHBondContact N-O 2.93Å; H565-K627 PolarHBondContact O-N 2.87Å
566	L	79.2	Confident	80.4	Confident	8 Å²	8	53.9 Å²	53.9	4%	0.042	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.2	165.6	-62.7	165	0	0	0	108.1	F546 F573 L619 T625 V626	F546-L566 HydrophobicContact CB-CD1 3.85Å; F546-L566 HydrophobicContact CB-CD2 3.89Å; F546-L566 HydrophobicContact CB-CG 4.26Å; F546-L566 HydrophobicContact CD1-CD1 3.56Å; F546-L566 HydrophobicContact CD1-CD2 3.63Å; F546-L566 HydrophobicContact CD1-CG 4.23Å; F546-L566 HydrophobicContact CD2-CD1 3.94Å; F546-L566 HydrophobicContact CE1-CD1 4.07Å; F546-L566 HydrophobicContact CE2-CD1 4.39Å; F546-L566 HydrophobicContact CG-CD1 3.5Å; F546-L566 VanDerWaalsContact CG-CD1 3.5Å; F546-L566 HydrophobicContact CG-CD2 4.01Å; F546-L566 HydrophobicContact CG-CG 4.31Å; F546-L566 HydrophobicContact CZ-CD1 4.45Å; L566-F573 HydrophobicContact CB-CB 4.08Å; L566-F573 PolarHBondContact N-O 2.9Å; L566-F573 PolarHBondContact O-N 2.84Å; L566-L619 HydrophobicContact CD2-CD1 4.48Å; L566-T625 CarbonylContact C-O 3.6Å; L566-T625 WeakPolarHBondContact CA-O 3.01Å; L566-V626 HydrophobicContact CD2-CG2 3.7Å
567	I	81	Confident	79.7	Confident	40 Å²	40	54.3 Å²	54.3	21%	0.205	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	124.2	-177.3	-57.6	171.6	0	0	0	108.7	G569 S571 L572 L624 T625 K627	I567-G569 VanDerWaalsContact CG2-O 3.31Å; I567-G569 WeakPolarHBondContact CG2-O 3.43Å; I567-S571 WeakPolarHBondContact CA-O 3.46Å; I567-L572 HydrophobicContact CG1-CD1 3.98Å; I567-L624 WeakPolarHBondContact O-CA 3.13Å; I567-T625 PolarHBondContact N-O 3.12Å; I567-T625 PolarHBondContact O-N 2.93Å; I567-K627 HydrophobicContact CD1-CD 3.64Å; I567-K627 HydrophobicContact CD1-CG 3.89Å
568	N	78.6	Confident	79.2	Confident	77 Å²	77	55.7 Å²	55.7	41%	0.412	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	100.9	167.7	-168.3	-2.7	0	0	0	109.5	D570 S571 F573 L624	N568-D570 PolarHBondContact O-N 2.76Å; N568-D570 VanDerWaalsContact O-N 3.08Å; N568-S571 PolarHBondContact N-O 3.33Å; N568-S571 WeakPolarHBondContact O-CB 3.31Å; N568-S571 PolarHBondContact O-N 3.09Å; N568-F573 HydrophobicContact CB-CE2 3.93Å; N568-L624 HydrophobicContact CB-CD2 3.63Å
569	G	75.7	Confident	78.9	Confident	62 Å²	62	55.8 Å²	55.8	64%	0.639	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	-116.5	-171.1	0	0	0	0	0	110.8	I567	I567-G569 VanDerWaalsContact CG2-O 3.31Å; I567-G569 WeakPolarHBondContact CG2-O 3.43Å
570	D	74.7	Confident	78.9	Confident	175 Å²	175	52.9 Å²	52.9	94%	0.936	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-6.8	177.5	-60.3	-36.7	0	0	0	113.9	N568	N568-D570 PolarHBondContact O-N 2.76Å; N568-D570 VanDerWaalsContact O-N 3.08Å
571	S	76	Confident	79	Confident	65 Å²	65	52.3 Å²	52.3	46%	0.455	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	124.5	-178.2	-60.9	0	0	0	0	111.2	I567 N568	I567-S571 WeakPolarHBondContact CA-O 3.46Å; N568-S571 PolarHBondContact N-O 3.33Å; N568-S571 WeakPolarHBondContact O-CB 3.31Å; N568-S571 PolarHBondContact O-N 3.09Å
572	L	73.3	Confident	79.6	Confident	99 Å²	99	51 Å²	51	52%	0.518	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	124.3	174.2	-169.6	76.5	0	0	0	109.7	H565 I567	H565-L572 HydrophobicContact CB-CD1 3.55Å; H565-L572 HydrophobicContact CB-CG 4.42Å; I567-L572 HydrophobicContact CG1-CD1 3.98Å
573	F	74.6	Confident	80.6	Confident	92 Å²	92	46.7 Å²	46.7	40%	0.404	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	135.8	172.9	-50.6	-97.9	0	0	0	110.4	L566 N568	L566-F573 HydrophobicContact CB-CB 4.08Å; L566-F573 PolarHBondContact N-O 2.9Å; L566-F573 PolarHBondContact O-N 2.84Å; N568-F573 HydrophobicContact CB-CE2 3.93Å
574	V	70.7	Confident	81.6	Confident	66 Å²	66	42.7 Å²	42.7	40%	0.4	25%	0.25	S	S	.	.			trans	-102.3	126.1	176.9	178.7	0	0	0	0	106.9	E578	V574-E578 VanDerWaalsContact CG1-CD 3.46Å; V574-E578 HydrophobicContact CG1-CG 4.36Å; V574-E578 WeakPolarHBondContact CG1-OE1 3.27Å
575	P	71.4	Confident	82.3	Confident	9 Å²	9	44.7 Å²	44.7	6%	0.058	26%	0.259	C	S	.	.			trans	-63.5	151.3	176.6	27.4	-33.6	0	0	0	110.6	W564 V577 E578	W564-P575 WeakPolarHBondContact O-CD 3.44Å; P575-V577 PolarHBondContact O-N 3.16Å; P575-V577 VanDerWaalsContact O-N 3.13Å; P575-E578 WeakPolarHBondContact CD-OE1 3.39Å; P575-E578 HydrophobicContact CG-CG 3.72Å
576	P	71.5	Confident	82.8	Confident	89 Å²	89	46.7 Å²	46.7	58%	0.578	27%	0.265	S	S	*	.	S	Bend	trans	-65.2	-18	-178	26.4	-35.3	0	0	0	113.5	G441 L442	G441-P576 WeakPolarHBondContact CA-O 3.23Å; L442-P576 PolarHBondContact N-O 3.26Å
577	V	79.7	Confident	83.6	Confident	14 Å²	14	47.8 Å²	47.8	9%	0.085	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	127	178.3	-178.8	0	0	0	0	108.9	L442 V444 Y453 W520 P575	L442-V577 WeakPolarHBondContact O-CA 3.48Å; V444-V577 HydrophobicContact CB-CG1 4.36Å; V444-V577 HydrophobicContact CG1-CG1 3.67Å; V444-V577 HydrophobicContact CG2-CG1 3.68Å; Y453-V577 HydrophobicContact CE2-CG1 4.25Å; W520-V577 HydrophobicContact CZ2-CG2 4.26Å; P575-V577 PolarHBondContact O-N 3.16Å; P575-V577 VanDerWaalsContact O-N 3.13Å
578	E	83.4	Confident	84.1	Confident	31 Å²	31	47 Å²	47	15%	0.145	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	152.4	-173.5	-73.2	-166.7	143.9	0	0	112.5	L442 Q443 V444 V574 P575	L442-E578 PolarHBondContact O-N 3.27Å; Q443-E578 CarbonylContact C-O 3.56Å; Q443-E578 WeakPolarHBondContact CA-O 3.25Å; V444-E578 WeakPolarHBondContact CG2-O 3.44Å; V444-E578 PolarHBondContact N-O 3.33Å; V574-E578 VanDerWaalsContact CG1-CD 3.46Å; V574-E578 HydrophobicContact CG1-CG 4.36Å; V574-E578 WeakPolarHBondContact CG1-OE1 3.27Å; P575-E578 WeakPolarHBondContact CD-OE1 3.39Å; P575-E578 HydrophobicContact CG-CG 3.72Å
579	G	89	Confident	84.7	Confident	5 Å²	5	47.9 Å²	47.9	5%	0.052	27%	0.274	C	S	.	.	S	Bend	trans	110.4	-19.8	171.4	0	0	0	0	0	115.1	V444 E559 H560	V444-G579 CarbonylContact O-C 3.47Å; V444-G579 WeakPolarHBondContact O-CA 3.37Å; E559-G579 CarbonylContact C-O 3.52Å; E559-G579 WeakPolarHBondContact CA-O 3.29Å; E559-G579 VanDerWaalsContact OE2-O 3.1Å; H560-G579 PolarHBondContact N-O 3.34Å
580	A	93.6	Very high	85.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	161.6	173.6	0	0	0	0	0	112.9	V444 Y453 K547 V558	V444-A580 HydrophobicContact CG2-CB 4.06Å; Y453-A580 HydrophobicContact CG-CB 4.23Å; K547-A580 PolarHBondContact NZ-O 3.45Å; V558-A580 VanDerWaalsContact O-CA 3.32Å; V558-A580 WeakPolarHBondContact O-CA 3.35Å
581	G	93.1	Very high	85.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	170	175.5	0	0	0	0	0	113.4	E549 C557 V558 H560 Y583	E549-G581 WeakPolarHBondContact OE1-CA 3.32Å; C557-G581 CarbonylContact C-O 3.55Å; C557-G581 WeakPolarHBondContact CA-O 3.13Å; V558-G581 PolarHBondContact N-O 2.87Å; V558-G581 PolarHBondContact O-N 3.24Å; H560-G581 PolarHBondContact NE2-N 2.93Å; G581-Y583 VanDerWaalsContact C-CE2 3.46Å; G581-Y583 WeakPolarHBondContact O-CD2 3.03Å; G581-Y583 WeakPolarHBondContact O-CE2 2.99Å
582	C	94.7	Very high	86.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.5	-176.9	-67.2	0	0	0	0	112.9	C533 E549 R550 F551 V556	C533-C582 WeakPolarHBondContact CA-SG 3.46Å; C533-C582 HydrophobicContact CB-CB 3.55Å; C533-C582 WeakPolarHBondContact CB-SG 3.27Å; C533-C582 VanDerWaalsContact SG-CA 3.56Å; C533-C582 WeakPolarHBondContact SG-CB 3.48Å; C533-C582 CovalentContact SG-SG 2.05Å; C533-C582 PolarHBondContact SG-SG 2.82Å; E549-C582 CarbonylContact C-O 3.47Å; E549-C582 WeakPolarHBondContact CA-O 3.36Å; E549-C582 VanDerWaalsContact CB-O 3.25Å; E549-C582 WeakPolarHBondContact CB-O 3.47Å; E549-C582 PolarHBondContact OE1-N 2.86Å; R550-C582 PolarHBondContact N-O 3.33Å; R550-C582 CarbonylContact O-C 3.58Å; R550-C582 VanDerWaalsContact O-C 3.32Å; F551-C582 HydrophobicContact CD1-CB 4Å; F551-C582 HydrophobicContact CE1-CB 3.74Å; F551-C582 HydrophobicContact CZ-CB 4.08Å; V556-C582 WeakPolarHBondContact O-CA 3.5Å
583	Y	95.3	Very high	87.3	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	140.9	-176.3	-54.6	-77	0	0	0	111.4	K547 E549 R550 S555 V556 V558 H560 G581 L598 L630	K547-Y583 WeakPolarHBondContact O-CE1 3.45Å; K547-Y583 PolarHBondContact O-OH 3.42Å; K547-Y583 VanDerWaalsContact O-OH 3.1Å; E549-Y583 HydrophobicContact CG-CE1 4.4Å; R550-Y583 PolarHBondContact O-N 3.02Å; S555-Y583 CarbonylContact C-O 3.55Å; S555-Y583 VanDerWaalsContact CA-O 3.22Å; S555-Y583 WeakPolarHBondContact CA-O 3.26Å; V556-Y583 PolarHBondContact N-O 3.32Å; V556-Y583 PolarHBondContact O-N 3.19Å; V558-Y583 HydrophobicContact CB-CD2 3.64Å; V558-Y583 HydrophobicContact CB-CE2 3.9Å; V558-Y583 HydrophobicContact CG2-CD2 3.68Å; V558-Y583 HydrophobicContact CG2-CE2 4.45Å; H560-Y583 PolarHBondContact CE1-OH 3.46Å; H560-Y583 AromaticContact NE2-CE2 3.56Å; H560-Y583 AromaticContact NE2-CZ 3.55Å; H560-Y583 PolarHBondContact NE2-OH 3.28Å; G581-Y583 VanDerWaalsContact C-CE2 3.46Å; G581-Y583 WeakPolarHBondContact O-CD2 3.03Å; G581-Y583 WeakPolarHBondContact O-CE2 2.99Å; Y583-L598 HydrophobicContact CD1-CD1 4.11Å; Y583-L598 HydrophobicContact CD1-CD2 4.4Å; Y583-L598 HydrophobicContact CD1-CG 3.62Å; Y583-L598 HydrophobicContact CE1-CD2 4.05Å; Y583-L598 HydrophobicContact CE1-CG 3.76Å; Y583-L630 HydrophobicContact CD2-CD1 4.46Å; Y583-L630 HydrophobicContact CE1-CD1 4.48Å; Y583-L630 HydrophobicContact CE2-CD1 4.19Å; Y583-L630 HydrophobicContact CE2-CD2 3.72Å
584	T	94.8	Very high	88.3	Confident	23 Å²	23	34.1 Å²	34.1	14%	0.141	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	157.7	169	55.5	0	0	0	0	109.8	R550 D554 S555 E597	R550-T584 HydrophobicContact CB-CG2 3.86Å; R550-T584 VanDerWaalsContact CD-OG1 3.26Å; R550-T584 WeakPolarHBondContact CD-OG1 3.47Å; D554-T584 WeakPolarHBondContact O-CA 3.22Å; S555-T584 WeakPolarHBondContact OG-CG2 3.18Å; T584-E597 PolarHBondContact N-O 3.19Å; T584-E597 PolarHBondContact O-N 3.39Å; T584-E597 VanDerWaalsContact OG1-CB 3.31Å; T584-E597 WeakPolarHBondContact OG1-CB 3.37Å; T584-E597 PolarHBondContact OG1-OE2 3.05Å
585	F	94.5	Very high	89.4	Confident	45 Å²	45	31.2 Å²	31.2	20%	0.197	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	156.2	175.2	68.1	-84.8	0	0	0	111.5	D554 V556 L594 I595 L596 L638	D554-F585 WeakPolarHBondContact O-CD1 3.47Å; D554-F585 VanDerWaalsContact O-CE1 3.3Å; D554-F585 WeakPolarHBondContact O-CE1 3.38Å; D554-F585 PolarHBondContact O-N 2.93Å; V556-F585 HydrophobicContact CB-CD1 4.15Å; V556-F585 HydrophobicContact CB-CE1 4.19Å; V556-F585 HydrophobicContact CG1-CD1 3.81Å; V556-F585 HydrophobicContact CG1-CE1 4.33Å; F585-L594 HydrophobicContact CB-CD1 3.74Å; F585-L594 HydrophobicContact CD2-CD1 3.64Å; F585-L594 HydrophobicContact CG-CD1 3.94Å; F585-I595 CarbonylContact C-O 3.51Å; F585-I595 WeakPolarHBondContact CA-O 3.11Å; F585-I595 WeakPolarHBondContact CB-O 3.14Å; F585-L596 HydrophobicContact CB-CD2 4.17Å; F585-L638 HydrophobicContact CD1-CD1 4.46Å; F585-L638 HydrophobicContact CD2-CB 4.21Å; F585-L638 HydrophobicContact CE2-CB 3.74Å; F585-L638 HydrophobicContact CG-CD1 4.49Å; F585-L638 HydrophobicContact CZ-CB 3.96Å; F585-L638 HydrophobicContact CZ-CD2 4.48Å
586	R	94.6	Very high	90.5	Very high	81 Å²	81	30.8 Å²	30.8	31%	0.306	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	152.6	166.3	64.9	178.7	-175	-94.2	-3.3	109.8	E591 I595 E597 S603	R586-E591 IonicContact CZ-OE1 3.11Å; R586-E591 IonicContact CZ-OE2 2.57Å; R586-E591 IonicContact NE-OE1 3.75Å; R586-E591 PolarHBondContact NE-OE1 3.13Å; R586-E591 IonicContact NE-OE2 3.78Å; R586-E591 IonicContact NH2-OE1 3.72Å; R586-E591 IonicContact NH2-OE2 2.65Å; R586-E591 PolarHBondContact NH2-OE2 3.08Å; R586-I595 HydrophobicContact CG-CB 3.89Å; R586-I595 HydrophobicContact CG-CG1 4.31Å; R586-I595 PolarHBondContact N-O 3.34Å; R586-I595 PolarHBondContact O-N 2.97Å; R586-E597 IonicContact CZ-OE1 2.66Å; R586-E597 IonicContact NH1-OE1 2.91Å; R586-E597 PolarHBondContact NH1-OE1 3.27Å; R586-S603 PolarHBondContact NH1-OG 3.16Å
587	C	94.5	Very high	91.6	Very high	31 Å²	31	28.3 Å²	28.3	21%	0.209	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.8	178.9	-58	0	0	0	0	108	G593 C639 E643	C587-G593 CarbonylContact C-O 3.54Å; C587-G593 WeakPolarHBondContact CA-O 3.42Å; C587-C639 HydrophobicContact CB-CB 3.65Å; C587-C639 WeakPolarHBondContact CB-SG 3.33Å; C587-C639 WeakPolarHBondContact SG-CA 3.25Å; C587-C639 WeakPolarHBondContact SG-CB 3.4Å; C587-C639 CovalentContact SG-SG 2.02Å; C587-C639 PolarHBondContact SG-SG 2.72Å; C587-E643 HydrophobicContact CB-CB 4.15Å; C587-E643 WeakPolarHBondContact CB-OE2 3.41Å
588	S	93.4	Very high	92.2	Very high	22 Å²	22	27.7 Å²	27.7	15%	0.154	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	110.4	-176.4	176.7	0	0	0	0	110.9	S590 E591 G592 G593	S588-S590 PolarHBondContact O-N 2.78Å; S588-S590 PolarHBondContact OG-OG 2.98Å; S588-E591 PolarHBondContact O-N 3.2Å; S588-G592 PolarHBondContact O-N 3.25Å; S588-G593 PolarHBondContact N-O 3.37Å; S588-G593 WeakPolarHBondContact O-CA 3.41Å; S588-G593 PolarHBondContact O-N 3.37Å
589	M	89.4	Confident	92.4	Very high	96 Å²	96	26.6 Å²	26.6	47%	0.473	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-55	-36.5	175.1	-78.7	-53.2	-62.3	0	0	112.9	E591 G592 S642 E643 C644	M589-E591 PolarHBondContact O-N 3.07Å; M589-G592 PolarHBondContact O-N 3.18Å; M589-S642 VanDerWaalsContact CG-O 3.23Å; M589-S642 WeakPolarHBondContact CG-O 3.28Å; M589-E643 WeakPolarHBondContact SD-CA 3.1Å; M589-C644 VanDerWaalsContact SD-C 3.57Å; M589-C644 PolarHBondContact SD-N 2.96Å; M589-C644 VanDerWaalsContact SD-N 3.44Å
590	S	88.8	Confident	92.1	Very high	114 Å²	114	27.1 Å²	27.1	80%	0.797	15%	0.154	S	C	*	.	G	3₁₀ helix	trans	-73.1	-17.7	-178.2	55.6	0	0	0	0	113	S588	S588-S590 PolarHBondContact O-N 2.78Å; S588-S590 PolarHBondContact OG-OG 2.98Å
591	E	88.6	Confident	91.6	Very high	72 Å²	72	29.6 Å²	29.6	34%	0.336	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-100.5	1.7	175.9	-61.3	-173.7	-106.6	0	0	113.4	R586 S588 M589 I595	R586-E591 IonicContact CZ-OE1 3.11Å; R586-E591 IonicContact CZ-OE2 2.57Å; R586-E591 IonicContact NE-OE1 3.75Å; R586-E591 PolarHBondContact NE-OE1 3.13Å; R586-E591 IonicContact NE-OE2 3.78Å; R586-E591 IonicContact NH2-OE1 3.72Å; R586-E591 IonicContact NH2-OE2 2.65Å; R586-E591 PolarHBondContact NH2-OE2 3.08Å; S588-E591 PolarHBondContact O-N 3.2Å; M589-E591 PolarHBondContact O-N 3.07Å; E591-I595 HydrophobicContact CB-CD1 3.58Å; E591-I595 HydrophobicContact CB-CG1 3.79Å; E591-I595 WeakPolarHBondContact O-CD1 3.44Å
592	G	85.3	Confident	91.4	Very high	19 Å²	19	30 Å²	30	20%	0.196	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.7	7.3	-178.8	0	0	0	0	0	114.7	S588 M589	S588-G592 PolarHBondContact O-N 3.25Å; M589-G592 PolarHBondContact O-N 3.18Å
593	G	92.5	Very high	91.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	105.9	-108.9	177.8	0	0	0	0	0	111.8	C587 S588 E643	C587-G593 CarbonylContact C-O 3.54Å; C587-G593 WeakPolarHBondContact CA-O 3.42Å; S588-G593 PolarHBondContact N-O 3.37Å; S588-G593 WeakPolarHBondContact O-CA 3.41Å; S588-G593 PolarHBondContact O-N 3.37Å; G593-E643 VanDerWaalsContact CA-O 3.23Å; G593-E643 WeakPolarHBondContact CA-O 3.19Å
594	L	94.9	Very high	91	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	126.3	-178	176.3	67.8	0	0	0	111.2	F585 L596 C606 P633 C635 L638	F585-L594 HydrophobicContact CB-CD1 3.74Å; F585-L594 HydrophobicContact CD2-CD1 3.64Å; F585-L594 HydrophobicContact CG-CD1 3.94Å; L594-L596 HydrophobicContact CD2-CD2 4.39Å; L594-C606 HydrophobicContact CB-CB 4.3Å; L594-C606 HydrophobicContact CD2-CB 4.05Å; L594-C606 HydrophobicContact CG-CB 4.23Å; L594-C606 PolarHBondContact O-N 3.17Å; L594-P633 HydrophobicContact CD2-CG 3.55Å; L594-C635 HydrophobicContact CB-CB 3.9Å; L594-L638 HydrophobicContact CD1-CB 4.37Å; L594-L638 HydrophobicContact CD1-CD1 4.08Å; L594-L638 HydrophobicContact CD2-CD1 3.92Å
595	I	95	Very high	90.8	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	119.5	173.5	-46.7	-59	0	0	0	109.1	F585 R586 E591 P605	F585-I595 CarbonylContact C-O 3.51Å; F585-I595 WeakPolarHBondContact CA-O 3.11Å; F585-I595 WeakPolarHBondContact CB-O 3.14Å; R586-I595 HydrophobicContact CG-CB 3.89Å; R586-I595 HydrophobicContact CG-CG1 4.31Å; R586-I595 PolarHBondContact N-O 3.34Å; R586-I595 PolarHBondContact O-N 2.97Å; E591-I595 HydrophobicContact CB-CD1 3.58Å; E591-I595 HydrophobicContact CB-CG1 3.79Å; E591-I595 WeakPolarHBondContact O-CD1 3.44Å; I595-P605 HydrophobicContact CD1-CB 3.76Å
596	L	94.6	Very high	90.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	135.4	171.4	-60.7	179.3	0	0	0	109.7	V558 F585 L594 L598 S603 I604 L630	V558-L596 HydrophobicContact CG1-CD1 3.98Å; V558-L596 HydrophobicContact CG2-CD1 3.95Å; V558-L596 HydrophobicContact CG2-CD2 4Å; F585-L596 HydrophobicContact CB-CD2 4.17Å; L594-L596 HydrophobicContact CD2-CD2 4.39Å; L596-L598 HydrophobicContact CB-CD1 4.28Å; L596-S603 CarbonylContact O-C 3.5Å; L596-S603 VanDerWaalsContact O-CA 3.23Å; L596-S603 WeakPolarHBondContact O-CA 3.5Å; L596-I604 HydrophobicContact CB-CB 4.49Å; L596-I604 PolarHBondContact N-O 2.97Å; L596-I604 PolarHBondContact O-N 3.17Å; L596-L630 HydrophobicContact CD1-CD1 4.06Å
597	E	93.4	Very high	90.4	Very high	38 Å²	38	32.3 Å²	32.3	18%	0.178	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	124.4	-179.1	-62.5	-179.3	145.5	0	0	110.5	R550 T584 R586	R550-E597 IonicContact NH1-OE2 3.77Å; T584-E597 PolarHBondContact N-O 3.19Å; T584-E597 PolarHBondContact O-N 3.39Å; T584-E597 VanDerWaalsContact OG1-CB 3.31Å; T584-E597 WeakPolarHBondContact OG1-CB 3.37Å; T584-E597 PolarHBondContact OG1-OE2 3.05Å; R586-E597 IonicContact CZ-OE1 2.66Å; R586-E597 IonicContact NH1-OE1 2.91Å; R586-E597 PolarHBondContact NH1-OE1 3.27Å
598	L	92.3	Very high	90	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	22%	0.217	C	C	.	.			trans	-109	161.1	-176.5	-74.8	73.7	0	0	0	110.2	L548 R550 Y583 L596 G601 M602 I604 I615 L630	L548-L598 HydrophobicContact CB-CB 4.11Å; L548-L598 HydrophobicContact CB-CD2 4.12Å; L548-L598 HydrophobicContact CB-CG 4.49Å; L548-L598 HydrophobicContact CD1-CD2 4.21Å; R550-L598 PolarHBondContact NE-O 3.36Å; R550-L598 VanDerWaalsContact NE-O 3.07Å; R550-L598 PolarHBondContact NH2-O 2.84Å; Y583-L598 HydrophobicContact CD1-CD1 4.11Å; Y583-L598 HydrophobicContact CD1-CD2 4.4Å; Y583-L598 HydrophobicContact CD1-CG 3.62Å; Y583-L598 HydrophobicContact CE1-CD2 4.05Å; Y583-L598 HydrophobicContact CE1-CG 3.76Å; L596-L598 HydrophobicContact CB-CD1 4.28Å; L598-G601 PolarHBondContact O-N 2.93Å; L598-M602 HydrophobicContact CB-CB 4.04Å; L598-M602 HydrophobicContact CD2-SD 3.9Å; L598-M602 PolarHBondContact N-O 2.63Å; L598-I604 HydrophobicContact CD1-CD1 4.12Å; L598-I604 HydrophobicContact CD1-CG1 4.15Å; L598-I604 HydrophobicContact CD2-CD1 4.28Å; L598-I615 HydrophobicContact CD2-CD1 3.41Å; L598-I615 VanDerWaalsContact CD2-CD1 3.41Å; L598-I615 HydrophobicContact CD2-CG1 4.06Å; L598-L630 HydrophobicContact CD1-CD1 4.08Å; L598-L630 HydrophobicContact CD2-CD1 4.22Å
599	A	87.6	Confident	89.8	Confident	9 Å²	9	36 Å²	36	7%	0.074	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-54.8	145.4	170.3	0	0	0	0	0	111	N545 L548 Y703	N545-A599 WeakPolarHBondContact ND2-CB 3.3Å; L548-A599 HydrophobicContact CB-CB 4.21Å; L548-A599 PolarHBondContact O-N 3.27Å; A599-Y703 HydrophobicContact CB-CE1 4.34Å; A599-Y703 HydrophobicContact CB-CE2 4.07Å
600	G	82.6	Confident	89.7	Confident	15 Å²	15	33.7 Å²	33.7	16%	0.155	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	82.1	9.6	-175.3	0	0	0	0	0	115.9	M602	G600-M602 VanDerWaalsContact C-N 3.28Å; G600-M602 PolarHBondContact O-N 3.21Å
601	G	84.5	Confident	89.8	Confident	53 Å²	53	30.8 Å²	30.8	55%	0.546	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	78.9	10.4	176.2	0	0	0	0	0	113.8	L598	L598-G601 PolarHBondContact O-N 2.93Å
602	M	88.2	Confident	89.9	Confident	9 Å²	9	31 Å²	31	4%	0.044	20%	0.202	C	C	.	.			trans	-69	134.1	171.6	-179.1	-176.4	-76.3	0	0	109.5	L598 G600 I604 I615 A617 V705	L598-M602 HydrophobicContact CB-CB 4.04Å; L598-M602 HydrophobicContact CD2-SD 3.9Å; L598-M602 PolarHBondContact N-O 2.63Å; G600-M602 VanDerWaalsContact C-N 3.28Å; G600-M602 PolarHBondContact O-N 3.21Å; M602-I604 HydrophobicContact CG-CG1 4.39Å; M602-I604 HydrophobicContact SD-CD1 4.34Å; M602-I604 HydrophobicContact SD-CG1 4.45Å; M602-I615 HydrophobicContact CE-CG2 4.03Å; M602-I615 HydrophobicContact SD-CB 4.46Å; M602-I615 HydrophobicContact SD-CG1 4.09Å; M602-I615 HydrophobicContact SD-CG2 4.02Å; M602-A617 HydrophobicContact CE-CB 3.98Å; M602-V705 HydrophobicContact CB-CB 4.34Å; M602-V705 HydrophobicContact CB-CG1 3.65Å; M602-V705 HydrophobicContact CB-CG2 3.79Å; M602-V705 HydrophobicContact CE-CB 4.16Å; M602-V705 HydrophobicContact CE-CG1 3.44Å; M602-V705 VanDerWaalsContact CE-CG1 3.44Å; M602-V705 HydrophobicContact CE-CG2 4.1Å; M602-V705 HydrophobicContact CG-CG1 3.75Å; M602-V705 HydrophobicContact SD-CG1 4.41Å
603	S	91.2	Very high	90	Very high	37 Å²	37	30.6 Å²	30.6	26%	0.259	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.9	172.3	-63	0	0	0	0	109.9	R586 L596	R586-S603 PolarHBondContact NH1-OG 3.16Å; L596-S603 CarbonylContact O-C 3.5Å; L596-S603 VanDerWaalsContact O-CA 3.23Å; L596-S603 WeakPolarHBondContact O-CA 3.5Å
604	I	90.9	Very high	89.8	Confident	15 Å²	15	35.1 Å²	35.1	8%	0.077	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	114.5	178.8	-58.4	-176.5	0	0	0	108.4	L596 L598 M602 I615 L630	L596-I604 HydrophobicContact CB-CB 4.49Å; L596-I604 PolarHBondContact N-O 2.97Å; L596-I604 PolarHBondContact O-N 3.17Å; L598-I604 HydrophobicContact CD1-CD1 4.12Å; L598-I604 HydrophobicContact CD1-CG1 4.15Å; L598-I604 HydrophobicContact CD2-CD1 4.28Å; M602-I604 HydrophobicContact CG-CG1 4.39Å; M602-I604 HydrophobicContact SD-CD1 4.34Å; M602-I604 HydrophobicContact SD-CG1 4.45Å; I604-I615 HydrophobicContact CD1-CD1 4.06Å; I604-I615 HydrophobicContact CD1-CG1 3.59Å; I604-L630 HydrophobicContact CD1-CD1 3.95Å; I604-L630 HydrophobicContact CD1-CG 4.48Å
605	P	91.3	Very high	89.3	Confident	40 Å²	40	35.2 Å²	35.2	26%	0.26	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	133.2	173.6	29.8	-32.7	0	0	0	110.5	I595	I595-P605 HydrophobicContact CD1-CB 3.76Å
606	C	91.5	Very high	88.8	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.014	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	76.8	177.6	-76.4	0	0	0	0	110.3	L594 C632	L594-C606 HydrophobicContact CB-CB 4.3Å; L594-C606 HydrophobicContact CD2-CB 4.05Å; L594-C606 HydrophobicContact CG-CB 4.23Å; L594-C606 PolarHBondContact O-N 3.17Å; C606-C632 WeakPolarHBondContact CA-SG 3.47Å; C606-C632 HydrophobicContact CB-CB 3.52Å; C606-C632 WeakPolarHBondContact CB-SG 3.48Å; C606-C632 WeakPolarHBondContact SG-CA 3.5Å; C606-C632 WeakPolarHBondContact SG-CB 3.23Å; C606-C632 CovalentContact SG-SG 2.05Å; C606-C632 PolarHBondContact SG-SG 2.89Å
607	E	87.4	Confident	88.3	Confident	103 Å²	103	37.4 Å²	37.4	48%	0.481	23%	0.231	S	C	.	.			trans	-76.2	-38.8	-179.4	-63.3	179.5	-167.3	0	0	111.9
608	V	88	Confident	87.6	Confident	82 Å²	82	35.9 Å²	35.9	50%	0.497	22%	0.224	S	C	.	.	S	Bend	trans	-116.5	126.5	-176.7	-176.6	0	0	0	0	110.9	G610 E611	V608-G610 PolarHBondContact O-N 2.83Å; V608-E611 HydrophobicContact CB-CB 4.21Å; V608-E611 VanDerWaalsContact O-CB 3.26Å; V608-E611 WeakPolarHBondContact O-CB 3.48Å; V608-E611 PolarHBondContact O-N 3.27Å; V608-E611 VanDerWaalsContact O-N 3.13Å
609	P	87.8	Confident	86.8	Confident	49 Å²	49	36 Å²	36	32%	0.318	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	130.7	174.9	-19.2	28.8	0	0	0	111.6	E611 D634 I647	P609-E611 VanDerWaalsContact C-N 3.3Å; P609-D634 HydrophobicContact CB-CB 3.95Å; P609-D634 HydrophobicContact CG-CB 3.89Å; P609-I647 HydrophobicContact CG-CD1 3.71Å
610	G	88.2	Confident	85.9	Confident	46 Å²	46	37.6 Å²	37.6	47%	0.474	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	83	-2.8	-179	0	0	0	0	0	115	V608 C632	V608-G610 PolarHBondContact O-N 2.83Å; G610-C632 PolarHBondContact N-O 2.77Å
611	E	90.3	Very high	85.1	Confident	53 Å²	53	43.1 Å²	43.1	25%	0.248	25%	0.253	C	S	.	.			trans	-60.1	146.6	170.6	-177.3	175	-173.8	0	0	110.9	V608 P609 C632 K709	V608-E611 HydrophobicContact CB-CB 4.21Å; V608-E611 VanDerWaalsContact O-CB 3.26Å; V608-E611 WeakPolarHBondContact O-CB 3.48Å; V608-E611 PolarHBondContact O-N 3.27Å; V608-E611 VanDerWaalsContact O-N 3.13Å; P609-E611 VanDerWaalsContact C-N 3.3Å; E611-C632 HydrophobicContact CB-CB 4.31Å; E611-C632 WeakPolarHBondContact O-CB 3.13Å; E611-C632 PolarHBondContact O-N 3.25Å; E611-K709 IonicContact OE1-NZ 3.45Å; E611-K709 PolarHBondContact OE1-NZ 2.99Å
612	I	90	Very high	84.4	Confident	78 Å²	78	43 Å²	43	40%	0.4	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	113.1	179.6	-60.2	177.1	0	0	0	109.5	K629 L630	I612-K629 HydrophobicContact CG2-CB 3.74Å; I612-K629 HydrophobicContact CG2-CD 3.81Å; I612-K629 HydrophobicContact CG2-CG 3.73Å; I612-L630 CarbonylContact C-O 3.58Å; I612-L630 WeakPolarHBondContact CA-O 3.49Å
613	G	87.3	Confident	83.7	Confident	9 Å²	9	44.7 Å²	44.7	9%	0.093	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	114.7	169.5	0	0	0	0	0	110.9	K629 L630	G613-K629 CarbonylContact O-C 3.56Å; G613-K629 VanDerWaalsContact O-CA 3.31Å; G613-K629 WeakPolarHBondContact O-CA 3.01Å; G613-L630 PolarHBondContact N-O 2.85Å; G613-L630 PolarHBondContact O-N 2.93Å
614	E	88.8	Confident	83.1	Confident	96 Å²	96	44 Å²	44	45%	0.449	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	131.3	178.3	-63.3	-163.4	154	0	0	112.1	K629	E614-K629 HydrophobicContact CG-CG 4.45Å; E614-K629 IonicContact OE1-NZ 3.09Å
615	I	85.6	Confident	82.8	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	124	177.7	-64.7	170.8	0	0	0	108.5	L548 W564 L598 M602 I604 V626 K627 G628 L630	L548-I615 HydrophobicContact CD1-CG2 3.81Å; W564-I615 HydrophobicContact CH2-CD1 3.35Å; W564-I615 HydrophobicContact CZ2-CD1 4.39Å; W564-I615 HydrophobicContact CZ3-CD1 3.62Å; L598-I615 HydrophobicContact CD2-CD1 3.41Å; L598-I615 VanDerWaalsContact CD2-CD1 3.41Å; L598-I615 HydrophobicContact CD2-CG1 4.06Å; M602-I615 HydrophobicContact CE-CG2 4.03Å; M602-I615 HydrophobicContact SD-CB 4.46Å; M602-I615 HydrophobicContact SD-CG1 4.09Å; M602-I615 HydrophobicContact SD-CG2 4.02Å; I604-I615 HydrophobicContact CD1-CD1 4.06Å; I604-I615 HydrophobicContact CD1-CG1 3.59Å; I615-V626 HydrophobicContact CG2-CG1 4.25Å; I615-K627 WeakPolarHBondContact O-CA 3.41Å; I615-G628 PolarHBondContact N-O 3.41Å; I615-G628 PolarHBondContact O-N 2.71Å; I615-L630 HydrophobicContact CD1-CD1 3.92Å; I615-L630 HydrophobicContact CD1-CD2 4.14Å; I615-L630 HydrophobicContact CD1-CG 3.63Å
616	N	83.4	Confident	82.5	Confident	48 Å²	48	42 Å²	42	26%	0.257	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	103.7	166.1	-68.5	-77.8	0	0	0	108	V626 K627 K706	N616-V626 WeakPolarHBondContact CA-O 3.36Å; N616-K627 WeakPolarHBondContact OD1-CG 3.29Å; N616-K706 PolarHBondContact O-N 2.75Å
617	A	83.9	Confident	82.2	Confident	2 Å²	2	46.2 Å²	46.2	2%	0.017	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	142.2	179.5	0	0	0	0	0	110.9	L548 M602 T625 V626	L548-A617 HydrophobicContact CD1-CB 3.73Å; M602-A617 HydrophobicContact CE-CB 3.98Å; A617-T625 CarbonylContact O-C 3.56Å; A617-T625 WeakPolarHBondContact O-CA 3.02Å; A617-V626 HydrophobicContact CB-CB 4.41Å; A617-V626 PolarHBondContact N-O 2.8Å; A617-V626 PolarHBondContact O-N 2.92Å
618	C	79.7	Confident	82.3	Confident	6 Å²	6	41.6 Å²	41.6	4%	0.041	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124.4	171.9	159.4	0	0	0	0	109.4	T620 I704 C725	C618-T620 PolarHBondContact O-N 3.09Å; C618-I704 HydrophobicContact CB-CB 4.18Å; C618-I704 PolarHBondContact N-O 2.89Å; C618-I704 PolarHBondContact O-N 2.86Å; C618-C725 HydrophobicContact CB-CB 3.65Å; C618-C725 WeakPolarHBondContact CB-SG 3.44Å; C618-C725 WeakPolarHBondContact SG-CB 3.18Å; C618-C725 CovalentContact SG-SG 2.03Å; C618-C725 PolarHBondContact SG-SG 3.29Å
619	L	75.5	Confident	82.4	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.016	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	96.1	168.6	-53.5	-178	0	0	0	107.8	F546 L548 L566 K621 Q622 S623 L624 V626 Y703	F546-L619 HydrophobicContact CD1-CD1 3.95Å; F546-L619 HydrophobicContact CE1-CD1 4.33Å; L548-L619 HydrophobicContact CD2-CD2 4.08Å; L566-L619 HydrophobicContact CD2-CD1 4.48Å; L619-K621 PolarHBondContact O-N 3.06Å; L619-Q622 HydrophobicContact CB-CB 4.41Å; L619-Q622 PolarHBondContact O-N 3.44Å; L619-S623 PolarHBondContact O-N 2.61Å; L619-L624 HydrophobicContact CB-CB 4.26Å; L619-L624 HydrophobicContact CD1-CB 4.17Å; L619-L624 HydrophobicContact CG-CB 4.46Å; L619-L624 PolarHBondContact N-O 2.88Å; L619-L624 PolarHBondContact O-N 3.32Å; L619-V626 HydrophobicContact CD1-CG2 3.92Å; L619-V626 HydrophobicContact CD2-CG2 4.22Å; L619-V626 HydrophobicContact CG-CG2 3.93Å; L619-Y703 HydrophobicContact CD2-CD1 3.38Å; L619-Y703 HydrophobicContact CD2-CE1 3.48Å; L619-Y703 VanDerWaalsContact CD2-CE1 3.48Å
620	T	67.6	Low	82.7	Confident	43 Å²	43	39 Å²	39	26%	0.264	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-40.2	-169.6	47.1	0	0	0	0	113.3	C618 Q622 I704	C618-T620 PolarHBondContact O-N 3.09Å; T620-Q622 VanDerWaalsContact C-N 3.33Å; T620-Q622 PolarHBondContact O-N 2.76Å; T620-I704 HydrophobicContact CG2-CB 4.31Å; T620-I704 HydrophobicContact CG2-CD1 3.29Å; T620-I704 HydrophobicContact CG2-CG1 3.48Å; T620-I704 VanDerWaalsContact CG2-CG1 3.48Å
621	K	66.7	Low	82.9	Confident	130 Å²	130	39 Å²	39	57%	0.565	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-30.9	-179.2	-75	-176.6	174.8	-175.2	0	113.3	H543 L619 L702	H543-K621 VanDerWaalsContact CE1-CD 3.41Å; H543-K621 WeakPolarHBondContact CE1-CD 3.47Å; L619-K621 PolarHBondContact O-N 3.06Å; K621-L702 HydrophobicContact CD-CD2 4.29Å
622	Q	68.4	Low	83	Confident	51 Å²	51	36.6 Å²	36.6	24%	0.238	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-8.3	-176.8	-59.4	84.6	-19.7	0	0	112.5	H543 L619 T620 L624	H543-Q622 VanDerWaalsContact CA-NE2 3.29Å; H543-Q622 PolarHBondContact O-NE2 2.81Å; L619-Q622 HydrophobicContact CB-CB 4.41Å; L619-Q622 PolarHBondContact O-N 3.44Å; T620-Q622 VanDerWaalsContact C-N 3.33Å; T620-Q622 PolarHBondContact O-N 2.76Å; Q622-L624 HydrophobicContact CB-CB 4.27Å; Q622-L624 HydrophobicContact CB-CD1 3.76Å; Q622-L624 HydrophobicContact CB-CG 3.9Å; Q622-L624 HydrophobicContact CG-CD1 4.47Å; Q622-L624 PolarHBondContact O-N 2.89Å
623	S	73.6	Confident	83.2	Confident	44 Å²	44	33.3 Å²	33.3	31%	0.308	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	34.4	-170.6	-58.4	0	0	0	0	113	L619	L619-S623 PolarHBondContact O-N 2.61Å
624	L	79.8	Confident	83.3	Confident	22 Å²	22	34.3 Å²	34.3	12%	0.115	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	136.8	-179.5	-71.7	171.1	0	0	0	110.9	F546 I567 N568 L619 Q622	F546-L624 HydrophobicContact CE1-CD1 4Å; I567-L624 WeakPolarHBondContact O-CA 3.13Å; N568-L624 HydrophobicContact CB-CD2 3.63Å; L619-L624 HydrophobicContact CB-CB 4.26Å; L619-L624 HydrophobicContact CD1-CB 4.17Å; L619-L624 HydrophobicContact CG-CB 4.46Å; L619-L624 PolarHBondContact N-O 2.88Å; L619-L624 PolarHBondContact O-N 3.32Å; Q622-L624 HydrophobicContact CB-CB 4.27Å; Q622-L624 HydrophobicContact CB-CD1 3.76Å; Q622-L624 HydrophobicContact CB-CG 3.9Å; Q622-L624 HydrophobicContact CG-CD1 4.47Å; Q622-L624 PolarHBondContact O-N 2.89Å
625	T	83.8	Confident	83.5	Confident	14 Å²	14	30 Å²	30	9%	0.086	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	119.2	168.6	-58.3	0	0	0	0	110	L566 I567 A617 K627	L566-T625 CarbonylContact C-O 3.6Å; L566-T625 WeakPolarHBondContact CA-O 3.01Å; I567-T625 PolarHBondContact N-O 3.12Å; I567-T625 PolarHBondContact O-N 2.93Å; A617-T625 CarbonylContact O-C 3.56Å; A617-T625 WeakPolarHBondContact O-CA 3.02Å; T625-K627 HydrophobicContact CG2-CG 4.22Å
626	V	84.4	Confident	83.7	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	120.4	169.6	-179	0	0	0	0	108.2	W564 H565 L566 I615 N616 A617 L619	W564-V626 HydrophobicContact CZ2-CG1 3.59Å; H565-V626 WeakPolarHBondContact O-CA 3.38Å; L566-V626 HydrophobicContact CD2-CG2 3.7Å; I615-V626 HydrophobicContact CG2-CG1 4.25Å; N616-V626 WeakPolarHBondContact CA-O 3.36Å; A617-V626 HydrophobicContact CB-CB 4.41Å; A617-V626 PolarHBondContact N-O 2.8Å; A617-V626 PolarHBondContact O-N 2.92Å; L619-V626 HydrophobicContact CD1-CG2 3.92Å; L619-V626 HydrophobicContact CD2-CG2 4.22Å; L619-V626 HydrophobicContact CG-CG2 3.93Å
627	K	86.2	Confident	83.9	Confident	91 Å²	91	39.2 Å²	39.2	40%	0.396	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	120.2	166.2	-67.8	-162.1	180	174.1	0	109.1	H565 I567 I615 N616 T625	H565-K627 PolarHBondContact N-O 2.93Å; H565-K627 PolarHBondContact O-N 2.87Å; I567-K627 HydrophobicContact CD1-CD 3.64Å; I567-K627 HydrophobicContact CD1-CG 3.89Å; I615-K627 WeakPolarHBondContact O-CA 3.41Å; N616-K627 WeakPolarHBondContact OD1-CG 3.29Å; T625-K627 HydrophobicContact CG2-CG 4.22Å
628	G	88.3	Confident	84.1	Confident	5 Å²	5	41.1 Å²	41.1	5%	0.052	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	172.2	-176.6	0	0	0	0	0	111.7	I615	I615-G628 PolarHBondContact N-O 3.41Å; I615-G628 PolarHBondContact O-N 2.71Å
629	K	91.2	Very high	84.7	Confident	76 Å²	76	41.3 Å²	41.3	33%	0.33	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	122.4	-179.7	-78.1	178.9	175.5	-169	0	108.8	H560 S561 I612 G613 E614	H560-K629 CarbonylContact C-O 3.54Å; H560-K629 VanDerWaalsContact CA-O 3.28Å; H560-K629 WeakPolarHBondContact CA-O 3.24Å; S561-K629 VanDerWaalsContact CB-CB 3.42Å; S561-K629 PolarHBondContact N-O 2.9Å; I612-K629 HydrophobicContact CG2-CB 3.74Å; I612-K629 HydrophobicContact CG2-CD 3.81Å; I612-K629 HydrophobicContact CG2-CG 3.73Å; G613-K629 CarbonylContact O-C 3.56Å; G613-K629 VanDerWaalsContact O-CA 3.31Å; G613-K629 WeakPolarHBondContact O-CA 3.01Å; E614-K629 HydrophobicContact CG-CG 4.45Å; E614-K629 IonicContact OE1-NZ 3.09Å
630	L	92.8	Very high	85.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	142.2	171.7	-61.5	-175.8	0	0	0	110.2	V558 H560 W564 Y583 L596 L598 I604 I612 G613 I615	V558-L630 HydrophobicContact CG1-CB 4.12Å; V558-L630 HydrophobicContact CG1-CD2 4.29Å; H560-L630 WeakPolarHBondContact CD2-CD2 3.39Å; H560-L630 WeakPolarHBondContact NE2-CD2 3.01Å; W564-L630 HydrophobicContact CZ3-CD2 3.86Å; Y583-L630 HydrophobicContact CD2-CD1 4.46Å; Y583-L630 HydrophobicContact CE1-CD1 4.48Å; Y583-L630 HydrophobicContact CE2-CD1 4.19Å; Y583-L630 HydrophobicContact CE2-CD2 3.72Å; L596-L630 HydrophobicContact CD1-CD1 4.06Å; L598-L630 HydrophobicContact CD1-CD1 4.08Å; L598-L630 HydrophobicContact CD2-CD1 4.22Å; I604-L630 HydrophobicContact CD1-CD1 3.95Å; I604-L630 HydrophobicContact CD1-CG 4.48Å; I612-L630 CarbonylContact C-O 3.58Å; I612-L630 WeakPolarHBondContact CA-O 3.49Å; G613-L630 PolarHBondContact N-O 2.85Å; G613-L630 PolarHBondContact O-N 2.93Å; I615-L630 HydrophobicContact CD1-CD1 3.92Å; I615-L630 HydrophobicContact CD1-CD2 4.14Å; I615-L630 HydrophobicContact CD1-CG 3.63Å
631	V	93.5	Very high	86.5	Confident	46 Å²	46	49 Å²	49	28%	0.279	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	111.1	170.8	-176.1	0	0	0	0	107.8	V558 E559	V558-V631 WeakPolarHBondContact CG1-O 3.42Å; E559-V631 HydrophobicContact CB-CB 4.19Å; E559-V631 HydrophobicContact CB-CG2 4.43Å; E559-V631 PolarHBondContact O-N 3.4Å
632	C	93.2	Very high	87.7	Confident	4 Å²	4	47.3 Å²	47.3	3%	0.027	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-60.5	124.4	-175.9	-85.8	0	0	0	0	111.5	C606 G610 E611	C606-C632 WeakPolarHBondContact CA-SG 3.47Å; C606-C632 HydrophobicContact CB-CB 3.52Å; C606-C632 WeakPolarHBondContact CB-SG 3.48Å; C606-C632 WeakPolarHBondContact SG-CA 3.5Å; C606-C632 WeakPolarHBondContact SG-CB 3.23Å; C606-C632 CovalentContact SG-SG 2.05Å; C606-C632 PolarHBondContact SG-SG 2.89Å; G610-C632 PolarHBondContact N-O 2.77Å; E611-C632 HydrophobicContact CB-CB 4.31Å; E611-C632 WeakPolarHBondContact O-CB 3.13Å; E611-C632 PolarHBondContact O-N 3.25Å
633	P	92.4	Very high	88.8	Confident	8 Å²	8	47.9 Å²	47.9	5%	0.052	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-74.1	162.6	174.6	32.3	-33.9	0	0	0	110.4	K450 L594 C635 L638	K450-P633 VanDerWaalsContact NZ-CB 3.26Å; L594-P633 HydrophobicContact CD2-CG 3.55Å; P633-C635 PolarHBondContact O-N 3.07Å; P633-L638 HydrophobicContact CG-CD1 4.09Å
634	D	91.1	Very high	89.7	Confident	30 Å²	30	46.3 Å²	46.3	16%	0.16	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-67.8	122.3	172.2	-175.3	-18.8	0	0	0	110.5	P609 R636 L637	P609-D634 HydrophobicContact CB-CB 3.95Å; P609-D634 HydrophobicContact CG-CB 3.89Å; D634-R636 PolarHBondContact O-N 2.99Å; D634-R636 VanDerWaalsContact O-N 3.13Å; D634-R636 WeakPolarHBondContact OD1-CB 3.3Å; D634-R636 WeakPolarHBondContact OD1-CG 3.43Å; D634-R636 IonicContact OD1-CZ 3.87Å; D634-R636 PolarHBondContact OD1-N 3.28Å; D634-R636 IonicContact OD1-NE 3.27Å; D634-R636 PolarHBondContact OD1-NE 2.7Å; D634-R636 IonicContact OD1-NH2 2.72Å; D634-R636 IonicContact OD2-CZ 3.4Å; D634-R636 VanDerWaalsContact OD2-CZ 3.3Å; D634-R636 IonicContact OD2-NE 2.71Å; D634-R636 PolarHBondContact OD2-NE 3.03Å; D634-R636 VanDerWaalsContact OD2-NE 3.16Å; D634-R636 IonicContact OD2-NH2 3.8Å; D634-R636 PolarHBondContact OD2-NH2 3.28Å; D634-L637 HydrophobicContact CB-CD1 3.86Å; D634-L637 HydrophobicContact CB-CG 3.97Å; D634-L637 WeakPolarHBondContact O-CB 3.5Å; D634-L637 PolarHBondContact O-N 2.96Å
635	C	93.1	Very high	90	Very high	7 Å²	7	47.2 Å²	47.2	5%	0.047	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-48.7	-39.8	177.8	176	0	0	0	0	112.4	L594 P633 L637 L638 C639 C644	L594-C635 HydrophobicContact CB-CB 3.9Å; P633-C635 PolarHBondContact O-N 3.07Å; C635-L637 PolarHBondContact O-N 2.83Å; C635-L637 VanDerWaalsContact O-N 3.08Å; C635-L638 PolarHBondContact O-N 3.17Å; C635-C639 WeakPolarHBondContact O-CB 3.3Å; C635-C639 PolarHBondContact O-N 3.37Å; C635-C644 HydrophobicContact CB-CB 3.9Å; C635-C644 WeakPolarHBondContact CB-SG 3.4Å; C635-C644 PolarHBondContact O-SG 3.4Å; C635-C644 VanDerWaalsContact O-SG 3.42Å; C635-C644 WeakPolarHBondContact SG-CA 3.49Å; C635-C644 WeakPolarHBondContact SG-CB 3.34Å; C635-C644 CovalentContact SG-SG 2.05Å; C635-C644 PolarHBondContact SG-SG 3.5Å
636	R	89.7	Confident	89.9	Confident	130 Å²	130	55.2 Å²	55.2	49%	0.491	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-69	-11.3	-174.7	-57.7	169.7	-67.4	-178.1	2.2	113.4	D634 L641 C644	D634-R636 PolarHBondContact O-N 2.99Å; D634-R636 VanDerWaalsContact O-N 3.13Å; D634-R636 WeakPolarHBondContact OD1-CB 3.3Å; D634-R636 WeakPolarHBondContact OD1-CG 3.43Å; D634-R636 IonicContact OD1-CZ 3.87Å; D634-R636 PolarHBondContact OD1-N 3.28Å; D634-R636 IonicContact OD1-NE 3.27Å; D634-R636 PolarHBondContact OD1-NE 2.7Å; D634-R636 IonicContact OD1-NH2 2.72Å; D634-R636 IonicContact OD2-CZ 3.4Å; D634-R636 VanDerWaalsContact OD2-CZ 3.3Å; D634-R636 IonicContact OD2-NE 2.71Å; D634-R636 PolarHBondContact OD2-NE 3.03Å; D634-R636 VanDerWaalsContact OD2-NE 3.16Å; D634-R636 IonicContact OD2-NH2 3.8Å; D634-R636 PolarHBondContact OD2-NH2 3.28Å; R636-L641 HydrophobicContact CB-CD2 4.13Å; R636-L641 HydrophobicContact CG-CD2 3.94Å; R636-C644 HydrophobicContact CG-CB 4.1Å; R636-C644 PolarHBondContact N-SG 2.02Å
637	L	86.6	Confident	89.2	Confident	112 Å²	112	59.3 Å²	59.3	59%	0.586	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-81.3	-22.7	174.5	-62.1	173.4	0	0	0	112.5	D634 C635	D634-L637 HydrophobicContact CB-CD1 3.86Å; D634-L637 HydrophobicContact CB-CG 3.97Å; D634-L637 WeakPolarHBondContact O-CB 3.5Å; D634-L637 PolarHBondContact O-N 2.96Å; C635-L637 PolarHBondContact O-N 2.83Å; C635-L637 VanDerWaalsContact O-N 3.08Å
638	L	89.2	Confident	87.8	Confident	42 Å²	42	64.4 Å²	64.4	22%	0.22	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-28.7	-170.7	-57.8	178.2	0	0	0	112.8	V556 F585 L594 P633 C635	V556-L638 HydrophobicContact CB-CD1 4.4Å; V556-L638 HydrophobicContact CB-CD2 4.39Å; V556-L638 HydrophobicContact CG1-CD1 3.89Å; V556-L638 HydrophobicContact CG2-CD1 4.16Å; V556-L638 HydrophobicContact CG2-CD2 3.73Å; F585-L638 HydrophobicContact CD1-CD1 4.46Å; F585-L638 HydrophobicContact CD2-CB 4.21Å; F585-L638 HydrophobicContact CE2-CB 3.74Å; F585-L638 HydrophobicContact CG-CD1 4.49Å; F585-L638 HydrophobicContact CZ-CB 3.96Å; F585-L638 HydrophobicContact CZ-CD2 4.48Å; L594-L638 HydrophobicContact CD1-CB 4.37Å; L594-L638 HydrophobicContact CD1-CD1 4.08Å; L594-L638 HydrophobicContact CD2-CD1 3.92Å; P633-L638 HydrophobicContact CG-CD1 4.09Å; C635-L638 PolarHBondContact O-N 3.17Å
639	C	92.3	Very high	85.7	Confident	9 Å²	9	69.5 Å²	69.5	6%	0.061	36%	0.358	C	S	.	.	S	Bend	trans	-111.2	151.2	-173.9	-59.9	0	0	0	0	111.9	C587 C635 E643	C587-C639 HydrophobicContact CB-CB 3.65Å; C587-C639 WeakPolarHBondContact CB-SG 3.33Å; C587-C639 WeakPolarHBondContact SG-CA 3.25Å; C587-C639 WeakPolarHBondContact SG-CB 3.4Å; C587-C639 CovalentContact SG-SG 2.02Å; C587-C639 PolarHBondContact SG-SG 2.72Å; C635-C639 WeakPolarHBondContact O-CB 3.3Å; C635-C639 PolarHBondContact O-N 3.37Å; C639-E643 HydrophobicContact CB-CB 4.47Å
640	P	91.7	Very high	83	Confident	69 Å²	69	72.1 Å²	72.1	45%	0.448	37%	0.374	S	S	.	.			trans	-53.3	144	166.2	-23.6	33.9	0	0	0	111.4	S642 E643	P640-S642 PolarHBondContact O-N 3.23Å; P640-S642 VanDerWaalsContact O-N 3.07Å; P640-E643 WeakPolarHBondContact O-CA 3.22Å; P640-E643 PolarHBondContact O-N 2.65Å
641	L	88.4	Confident	80	Confident	138 Å²	138	77 Å²	77	72%	0.723	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-59.7	-24.1	-179.7	-69	176.9	0	0	0	113.6	R636 E643	R636-L641 HydrophobicContact CB-CD2 4.13Å; R636-L641 HydrophobicContact CG-CD2 3.94Å; L641-E643 PolarHBondContact O-N 3.43Å
642	S	91.6	Very high	77.2	Confident	95 Å²	95	83.5 Å²	83.5	66%	0.664	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-69.3	-16.3	173.5	49.6	0	0	0	0	113.7	M589 P640	M589-S642 VanDerWaalsContact CG-O 3.23Å; M589-S642 WeakPolarHBondContact CG-O 3.28Å; P640-S642 PolarHBondContact O-N 3.23Å; P640-S642 VanDerWaalsContact O-N 3.07Å
643	E	92.7	Very high	74.3	Confident	63 Å²	63	90.7 Å²	90.7	29%	0.294	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-109	2.7	-176.3	-66.7	-177.2	-141.6	0	0	114	C587 M589 G593 C639 P640 L641	C587-E643 HydrophobicContact CB-CB 4.15Å; C587-E643 WeakPolarHBondContact CB-OE2 3.41Å; M589-E643 WeakPolarHBondContact SD-CA 3.1Å; G593-E643 VanDerWaalsContact CA-O 3.23Å; G593-E643 WeakPolarHBondContact CA-O 3.19Å; C639-E643 HydrophobicContact CB-CB 4.47Å; P640-E643 WeakPolarHBondContact O-CA 3.22Å; P640-E643 PolarHBondContact O-N 2.65Å; L641-E643 PolarHBondContact O-N 3.43Å
644	C	91.6	Very high	71.1	Confident	12 Å²	12	97 Å²	97	8%	0.081	51%	0.505	C	S	.	.	S	Bend	trans	-107.2	141	175.3	-65	0	0	0	0	112.4	M589 C635 R636	M589-C644 VanDerWaalsContact SD-C 3.57Å; M589-C644 PolarHBondContact SD-N 2.96Å; M589-C644 VanDerWaalsContact SD-N 3.44Å; C635-C644 HydrophobicContact CB-CB 3.9Å; C635-C644 WeakPolarHBondContact CB-SG 3.4Å; C635-C644 PolarHBondContact O-SG 3.4Å; C635-C644 VanDerWaalsContact O-SG 3.42Å; C635-C644 WeakPolarHBondContact SG-CA 3.49Å; C635-C644 WeakPolarHBondContact SG-CB 3.34Å; C635-C644 CovalentContact SG-SG 2.05Å; C635-C644 PolarHBondContact SG-SG 3.5Å; R636-C644 HydrophobicContact CG-CB 4.1Å; R636-C644 PolarHBondContact N-SG 2.02Å
645	P	87.3	Confident	68.1	Low	41 Å²	41	99.5 Å²	99.5	27%	0.266	52%	0.521	S	S	.	.			trans	-62.1	145.6	171.6	27.1	-33.9	0	0	0	110.9	I647	P645-I647 PolarHBondContact O-N 2.85Å
646	K	81	Confident	64.8	Low	181 Å²	181	105.3 Å²	105.3	79%	0.787	56%	0.556	S	S	*	*			trans	-70.1	116.7	171.6	-70.7	-175.9	180	178.4	0	109	Y648	K646-Y648 PolarHBondContact O-N 3.18Å
647	I	69.7	Low	61.8	Low	86 Å²	86	108.8 Å²	108.8	44%	0.441	57%	0.571	S	S	.	*			trans	-81.3	110.6	172.6	-54.7	173.9	0	0	0	107.8	P609 P645 S649	P609-I647 HydrophobicContact CG-CD1 3.71Å; P645-I647 PolarHBondContact O-N 2.85Å; I647-S649 PolarHBondContact O-N 2.69Å
648	Y	57.3	Low	58.8	Low	199 Å²	199	111.7 Å²	111.7	78%	0.78	59%	0.586	S	S	*	*			trans	-74	122.2	166.7	-65.6	-85.6	0	0	0	108.2	K646 I650	K646-Y648 PolarHBondContact O-N 3.18Å; Y648-I650 PolarHBondContact O-N 2.67Å; Y648-I650 VanDerWaalsContact O-N 3.07Å
649	S	42.4	Very low	55.6	Low	111 Å²	111	120.6 Å²	120.6	78%	0.776	62%	0.617	S	S	*	*			trans	-62	110.3	172.5	33.6	0	0	0	0	109.4	I647	I647-S649 PolarHBondContact O-N 2.69Å
650	I	35.6	Very low	52.4	Low	132 Å²	132	124.8 Å²	124.8	68%	0.677	65%	0.646	S	S	*	*			trans	-64.9	127.1	165.5	-57.4	173.8	0	0	0	106.3	Y648 Q652	Y648-I650 PolarHBondContact O-N 2.67Å; Y648-I650 VanDerWaalsContact O-N 3.07Å; I650-Q652 PolarHBondContact O-N 3Å
651	P	28.9	Very low	49.1	Very low	103 Å²	103	128.5 Å²	128.5	67%	0.669	66%	0.662	S	S	*	*			trans	-52.8	129.3	176	-23.3	31.5	0	0	0	110.1	N653	P651-N653 PolarHBondContact O-N 2.8Å
652	Q	35.8	Very low	46	Very low	181 Å²	181	131.9 Å²	131.9	85%	0.846	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-58.2	-3.2	-169.9	-76.6	-174.4	-34.4	0	0	115.8	I650 N654	I650-Q652 PolarHBondContact O-N 3Å; Q652-N654 VanDerWaalsContact C-N 3.28Å; Q652-N654 PolarHBondContact O-N 3.39Å
653	N	31.1	Very low	42.9	Very low	156 Å²	156	132 Å²	132	83%	0.834	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-75.1	-8.6	-179.7	-74.9	-0.1	0	0	0	114.8	P651	P651-N653 PolarHBondContact O-N 2.8Å
654	N	25.8	Very low	39.6	Very low	140 Å²	140	135.4 Å²	135.4	75%	0.749	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-121	24.1	-178.5	-79.1	1.2	0	0	0	115	Q652 T656	Q652-N654 VanDerWaalsContact C-N 3.28Å; Q652-N654 PolarHBondContact O-N 3.39Å; N654-T656 PolarHBondContact O-N 2.03Å
655	V	27.8	Very low	36.5	Very low	83 Å²	83	142 Å²	142	50%	0.503	72%	0.722	S	S	.	*			trans	-94.8	92.4	171.4	-174.3	0	0	0	0	109.7	Y657	V655-Y657 HydrophobicContact CG1-CD2 4.24Å; V655-Y657 HydrophobicContact CG1-CE2 4Å; V655-Y657 PolarHBondContact O-N 3.39Å
656	T	24	Very low	33.5	Very low	128 Å²	128	148.5 Å²	148.5	79%	0.785	75%	0.749	S	S	*	*			trans	-80.6	103.3	166.1	-35.1	0	0	0	0	108	N654 L658	N654-T656 PolarHBondContact O-N 2.03Å; T656-L658 PolarHBondContact O-N 3.29Å; T656-L658 VanDerWaalsContact O-N 3.08Å
657	Y	26.2	Very low	30.9	Very low	204 Å²	204	145 Å²	145	80%	0.8	75%	0.747	S	S	*	*			trans	-62.3	111.5	170.3	-71.5	-88.5	0	0	0	108.7	V655 R659	V655-Y657 HydrophobicContact CG1-CD2 4.24Å; V655-Y657 HydrophobicContact CG1-CE2 4Å; V655-Y657 PolarHBondContact O-N 3.39Å; Y657-R659 PolarHBondContact O-N 3.39Å
658	L	23.9	Very low	28.7	Very low	173 Å²	173	145.2 Å²	145.2	91%	0.906	76%	0.756	S	S	*	*			trans	-64.4	101.8	169.1	-74.4	167	0	0	0	107.9	T656 S660	T656-L658 PolarHBondContact O-N 3.29Å; T656-L658 VanDerWaalsContact O-N 3.08Å; L658-S660 PolarHBondContact O-N 2.96Å
659	R	21.8	Very low	27	Very low	229 Å²	229	140.9 Å²	140.9	86%	0.864	76%	0.755	S	S	*	*			trans	-58.7	115.7	167.5	-120.9	-179.8	-161.5	177	5.5	107.5	Y657 N661	Y657-R659 PolarHBondContact O-N 3.39Å; R659-N661 PolarHBondContact O-N 3.34Å
660	S	25.4	Very low	26.2	Very low	96 Å²	96	144.2 Å²	144.2	67%	0.671	76%	0.756	S	S	*	*			trans	-64.9	101.9	165.8	61.1	0	0	0	0	108	L658 Y662	L658-S660 PolarHBondContact O-N 2.96Å; S660-Y662 PolarHBondContact O-N 2.86Å; S660-Y662 VanDerWaalsContact O-N 3.09Å
661	N	23	Very low	25.5	Very low	148 Å²	148	146 Å²	146	79%	0.791	77%	0.766	S	S	*	*			trans	-67.2	106	167.4	-81.3	-18.5	0	0	0	107.6	R659 S663	R659-N661 PolarHBondContact O-N 3.34Å; N661-S663 PolarHBondContact O-N 2.86Å; N661-S663 VanDerWaalsContact O-N 3.14Å
662	Y	22.8	Very low	25.2	Very low	208 Å²	208	151 Å²	151	82%	0.816	77%	0.773	S	S	*	*			trans	-62.2	107.2	160.9	-93.7	-96.5	0	0	0	107.5	S660	S660-Y662 PolarHBondContact O-N 2.86Å; S660-Y662 VanDerWaalsContact O-N 3.09Å
663	S	26.2	Very low	24.5	Very low	98 Å²	98	151.2 Å²	151.2	69%	0.685	77%	0.774	S	S	*	*			trans	-96.8	116.2	163.2	-153.4	0	0	0	0	107.3	N661 D665	N661-S663 PolarHBondContact O-N 2.86Å; N661-S663 VanDerWaalsContact O-N 3.14Å; S663-D665 PolarHBondContact O-N 2.89Å; S663-D665 VanDerWaalsContact O-N 3.14Å
664	N	23.6	Very low	24.1	Very low	135 Å²	135	149.7 Å²	149.7	72%	0.722	77%	0.771	S	S	*	*			trans	-72	93.6	171	-79.3	-23.5	0	0	0	108.5
665	D	27.1	Very low	24	Very low	150 Å²	150	149.8 Å²	149.8	80%	0.802	77%	0.771	S	S	*	*			trans	-99.4	101	162.4	-84.7	-25.7	0	0	0	109.6	S663	S663-D665 PolarHBondContact O-N 2.89Å; S663-D665 VanDerWaalsContact O-N 3.14Å
666	H	24.8	Very low	23.8	Very low	177 Å²	177	154.2 Å²	154.2	82%	0.819	79%	0.789	S	S	*	*			trans	-65.5	126.6	161.2	-73.4	-79	0	0	0	109.5
667	S	26	Very low	23.6	Very low	108 Å²	108	157 Å²	157	76%	0.755	79%	0.79	S	S	*	*			trans	-166.4	130	139.7	47.1	0	0	0	0	114.4
668	S	24	Very low	23.4	Very low	90 Å²	90	154.3 Å²	154.3	63%	0.629	79%	0.788	S	S	*	*			trans	57.9	94.2	149.1	57	0	0	0	0	120.2
669	S	21.8	Very low	23.4	Very low	109 Å²	109	151.4 Å²	151.4	76%	0.762	78%	0.779	S	S	*	*			trans	-15.1	119.7	131.8	46.4	0	0	0	0	116.9
670	F	24.1	Very low	23.3	Very low	181 Å²	181	150 Å²	150	79%	0.794	78%	0.779	S	S	*	*			trans	-135.5	120.7	143.5	-85.1	-80.1	0	0	0	109.4
671	L	21.3	Very low	23.1	Very low	170 Å²	170	150.7 Å²	150.7	89%	0.89	79%	0.785	S	S	*	*			trans	-77.1	121.2	174.9	-74.1	149.4	0	0	0	108.6
672	Y	23.1	Very low	23	Very low	206 Å²	206	152.4 Å²	152.4	81%	0.808	79%	0.787	S	S	*	*			trans	-131.2	120.8	158.3	-81.3	-77.4	0	0	0	110.1	T674	Y672-T674 PolarHBondContact O-N 2.84Å
673	E	20	Very low	22.9	Very low	186 Å²	186	148.8 Å²	148.8	87%	0.869	79%	0.787	S	S	*	*			trans	-65.7	121.3	167.7	-68	177.2	150.7	0	0	109.2
674	T	24.4	Very low	22.7	Very low	125 Å²	125	151 Å²	151	77%	0.767	79%	0.79	S	S	*	*			trans	-114	104.6	165	42.8	0	0	0	0	109.2	Y672 M676	Y672-T674 PolarHBondContact O-N 2.84Å; T674-M676 PolarHBondContact O-N 2.69Å
675	N	22.2	Very low	22.5	Very low	142 Å²	142	153.6 Å²	153.6	76%	0.759	80%	0.798	S	S	*	*			trans	-69.6	125.8	166.7	-79.1	-42.2	0	0	0	109.2	F677	N675-F677 PolarHBondContact O-N 3.35Å; N675-F677 VanDerWaalsContact O-N 3.1Å
676	M	23.4	Very low	22.3	Very low	176 Å²	176	157.3 Å²	157.3	87%	0.867	80%	0.802	S	S	*	*			trans	-58.5	103.2	175.9	-173.7	173.8	168.6	0	0	110	T674	T674-M676 PolarHBondContact O-N 2.69Å
677	F	21.4	Very low	22.2	Very low	187 Å²	187	153.8 Å²	153.8	82%	0.82	80%	0.797	S	S	*	*			trans	-79.3	123.6	174.4	-110.5	-90.5	0	0	0	109.8	N675 P679	N675-F677 PolarHBondContact O-N 3.35Å; N675-F677 VanDerWaalsContact O-N 3.1Å; F677-P679 WeakPolarHBondContact O-CD 3.21Å
678	I	21.5	Very low	22.2	Very low	147 Å²	147	157.5 Å²	157.5	75%	0.754	80%	0.803	S	S	*	*			trans	-98.6	105.1	169.3	-58.2	169.9	0	0	0	107
679	P	23	Very low	22.4	Very low	111 Å²	111	161.4 Å²	161.4	72%	0.721	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-95	137	179.5	4.9	15.7	0	0	0	111.9	F677	F677-P679 WeakPolarHBondContact O-CD 3.21Å
680	K	20.4	Very low	22.6	Very low	199 Å²	199	164.4 Å²	164.4	87%	0.865	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-74.8	141.3	171.3	-70.5	177.7	176.9	177.8	0	110.7
681	S	20.6	Very low	22.6	Very low	112 Å²	112	161.5 Å²	161.5	78%	0.783	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-59	133.1	179.6	54.2	0	0	0	0	113.5
682	H	21.6	Very low	22.6	Very low	183 Å²	183	160.9 Å²	160.9	85%	0.847	82%	0.816	S	S	*	*			trans	-123	127.6	159.2	-92.8	-71.4	0	0	0	110.6
683	T	20	Very low	22.7	Very low	133 Å²	133	159.5 Å²	159.5	82%	0.816	82%	0.817	S	S	*	*			trans	-81	128.8	177.4	-46.2	0	0	0	0	109.6
684	I	22.8	Very low	22.9	Very low	145 Å²	145	157 Å²	157	74%	0.744	82%	0.815	S	S	*	*			trans	-115.9	126.4	172	-60.6	177	0	0	0	108.3
685	Q	20.1	Very low	22.8	Very low	188 Å²	188	159.6 Å²	159.6	88%	0.879	82%	0.818	S	S	*	*			trans	-81.2	136.4	177.2	-74.7	-168	-42.5	0	0	111.1
686	Y	22.3	Very low	22.8	Very low	229 Å²	229	158.9 Å²	158.9	90%	0.898	82%	0.824	S	S	*	*			trans	-92.2	129.6	172	-82.3	-94.7	0	0	0	110.2
687	S	22.9	Very low	22.7	Very low	102 Å²	102	156.7 Å²	156.7	71%	0.713	82%	0.815	S	S	*	*			trans	-132.9	122.9	167.2	60.8	0	0	0	0	110.8
688	Q	26	Very low	22.8	Very low	186 Å²	186	155.2 Å²	155.2	87%	0.869	82%	0.815	S	S	*	*			trans	73.9	108.5	154.9	-58.9	179.9	-12.9	0	0	117.9
689	L	27.9	Very low	22.9	Very low	173 Å²	173	155.6 Å²	155.6	91%	0.906	81%	0.814	S	S	*	*			trans	-150.9	128.7	135	-96.6	162.2	0	0	0	108.6
690	I	26	Very low	23.2	Very low	171 Å²	171	153.5 Å²	153.5	88%	0.877	80%	0.797	S	S	*	*			trans	-82.4	132.2	-174.9	-68.7	167.1	0	0	0	108.9
691	V	23.3	Very low	23.6	Very low	121 Å²	121	148.5 Å²	148.5	73%	0.733	78%	0.784	S	S	*	*			trans	-87.1	133.4	-174.2	-177.7	0	0	0	0	110.2
692	N	21.9	Very low	24	Very low	157 Å²	157	144.5 Å²	144.5	84%	0.84	75%	0.754	S	S	*	*			trans	-131	119	153	-95.2	-6.4	0	0	0	109
693	E	25	Very low	24.5	Very low	177 Å²	177	137 Å²	137	83%	0.827	72%	0.718	S	S	*	*			trans	60.9	90.5	160.7	-64.7	-177.3	168.8	0	0	119.7	E695	E693-E695 PolarHBondContact O-N 2.69Å
694	T	23.6	Very low	25.4	Very low	134 Å²	134	134.8 Å²	134.8	82%	0.822	70%	0.701	S	S	*	*				26.6	80.2	127.6	55.8	0	0	0	0	119.4
695	E	23	Very low	25.9	Very low	178 Å²	178	129 Å²	129	83%	0.832	67%	0.672	S	S	*	*				-127.7	125.3	128.7	-86.1	-173.5	159.6	0	0	107.1	E693 I697	E693-E695 PolarHBondContact O-N 2.69Å; E695-I697 VanDerWaalsContact C-N 3.25Å; E695-I697 PolarHBondContact O-N 3.09Å
696	S	21.4	Very low	26.8	Very low	127 Å²	127	125.4 Å²	125.4	89%	0.888	65%	0.653	S	S	*	*			trans	-74	82.4	-179.1	48.6	0	0	0	0	109.6	D698	S696-D698 PolarHBondContact O-N 2.86Å
697	I	22.8	Very low	27.3	Very low	131 Å²	131	119 Å²	119	67%	0.672	64%	0.635	S	S	*	*			trans	-72.9	104.6	159.7	-56.5	175.3	0	0	0	105	E695 E699	E695-I697 VanDerWaalsContact C-N 3.25Å; E695-I697 PolarHBondContact O-N 3.09Å; I697-E699 HydrophobicContact CB-CG 4.48Å; I697-E699 HydrophobicContact CG2-CG 3.7Å; I697-E699 PolarHBondContact O-N 2.98Å
698	D	22.7	Very low	27.9	Very low	156 Å²	156	117.8 Å²	117.8	83%	0.834	63%	0.627	S	S	*	*			trans	-71.7	75.4	169.3	-158.8	13.9	0	0	0	107.5	S696 N700	S696-D698 PolarHBondContact O-N 2.86Å; D698-N700 PolarHBondContact O-N 3.13Å
699	E	24.3	Very low	28.1	Very low	155 Å²	155	115.1 Å²	115.1	72%	0.724	61%	0.612	S	S	*	*			trans	-62.1	103.9	170.7	-74.4	-169.5	164.6	0	0	107.4	I697 P701	I697-E699 HydrophobicContact CB-CG 4.48Å; I697-E699 HydrophobicContact CG2-CG 3.7Å; I697-E699 PolarHBondContact O-N 2.98Å; E699-P701 WeakPolarHBondContact O-CD 3.33Å
700	N	28.1	Very low	28.2	Very low	67 Å²	67	114.3 Å²	114.3	36%	0.358	60%	0.601	S	S	.	*			trans	-90.5	99.6	166.8	-164.6	-31.2	0	0	0	108.1	D698 L702	D698-N700 PolarHBondContact O-N 3.13Å; N700-L702 PolarHBondContact O-N 2.98Å
701	P	28.4	Very low	28.2	Very low	93 Å²	93	113.2 Å²	113.2	60%	0.604	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	12.6	-170.9	30.4	-38.2	0	0	0	114.4	E699	E699-P701 WeakPolarHBondContact O-CD 3.33Å
702	L	30.5	Very low	28.2	Very low	28 Å²	28	116.9 Å²	116.9	15%	0.147	61%	0.609	C	S	.	*	T	Hydrogen-bonded Turn	trans	-98.2	-22.3	-176.4	-73.4	158.9	0	0	0	113.7	P542 H543 K621 N700	P542-L702 HydrophobicContact CB-CD1 3.72Å; P542-L702 HydrophobicContact CB-CD2 4.37Å; P542-L702 HydrophobicContact CG-CD1 4.49Å; H543-L702 WeakPolarHBondContact CE1-CD2 3.42Å; K621-L702 HydrophobicContact CD-CD2 4.29Å; N700-L702 PolarHBondContact O-N 2.98Å
703	Y	31.5	Very low	28.2	Very low	25 Å²	25	112.1 Å²	112.1	10%	0.098	60%	0.597	C	S	.	*			trans	-143.5	138.8	-167.4	-51.1	-88.5	0	0	0	113.2	P542 L548 A599 L619	P542-Y703 PolarHBondContact O-OH 3.41Å; L548-Y703 HydrophobicContact CD2-CD1 3.54Å; L548-Y703 HydrophobicContact CD2-CE1 3.39Å; A599-Y703 HydrophobicContact CB-CE1 4.34Å; A599-Y703 HydrophobicContact CB-CE2 4.07Å; L619-Y703 HydrophobicContact CD2-CD1 3.38Å; L619-Y703 HydrophobicContact CD2-CE1 3.48Å; L619-Y703 VanDerWaalsContact CD2-CE1 3.48Å
704	I	38.7	Very low	28.1	Very low	88 Å²	88	111 Å²	111	45%	0.451	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.3	121.3	162.2	-65.3	172.5	0	0	0	108.4	C618 T620	C618-I704 HydrophobicContact CB-CB 4.18Å; C618-I704 PolarHBondContact N-O 2.89Å; C618-I704 PolarHBondContact O-N 2.86Å; T620-I704 HydrophobicContact CG2-CB 4.31Å; T620-I704 HydrophobicContact CG2-CD1 3.29Å; T620-I704 HydrophobicContact CG2-CG1 3.48Å; T620-I704 VanDerWaalsContact CG2-CG1 3.48Å
705	V	33.8	Very low	28	Very low	24 Å²	24	110.7 Å²	110.7	15%	0.145	59%	0.592	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.7	134.5	-173.3	165.1	0	0	0	0	110.5	M602	M602-V705 HydrophobicContact CB-CB 4.34Å; M602-V705 HydrophobicContact CB-CG1 3.65Å; M602-V705 HydrophobicContact CB-CG2 3.79Å; M602-V705 HydrophobicContact CE-CB 4.16Å; M602-V705 HydrophobicContact CE-CG1 3.44Å; M602-V705 VanDerWaalsContact CE-CG1 3.44Å; M602-V705 HydrophobicContact CE-CG2 4.1Å; M602-V705 HydrophobicContact CG-CG1 3.75Å; M602-V705 HydrophobicContact SD-CG1 4.41Å
706	K	38.5	Very low	28.1	Very low	111 Å²	111	108 Å²	108	48%	0.483	58%	0.583	S	S	.	*			trans	-106.1	115.2	167.1	-169.8	177.2	-179.4	-179.6	0	110	N616 V727	N616-K706 PolarHBondContact O-N 2.75Å; K706-V727 HydrophobicContact CD-CG1 4.29Å
707	N	32.1	Very low	28.1	Very low	95 Å²	95	110.1 Å²	110.1	51%	0.508	58%	0.578	S	S	.	*			trans	-79.8	126	175.2	-169.8	-19.7	0	0	0	110.3	K709	N707-K709 PolarHBondContact OD1-N 3.28Å; N707-K709 VanDerWaalsContact OD1-N 3.08Å
708	S	36.4	Very low	28.1	Very low	77 Å²	77	111.6 Å²	111.6	54%	0.538	58%	0.582	S	S	.	*	S	Bend	trans	-92.8	-5.5	-178.1	69.6	0	0	0	0	114.8
709	K	30.3	Very low	28.2	Very low	129 Å²	129	109 Å²	109	56%	0.561	58%	0.582	S	S	*	*	S	Bend	trans	-136.7	80.6	176.6	-72.6	-171	-179.5	-175.8	0	112.3	E611 N707	E611-K709 IonicContact OE1-NZ 3.45Å; E611-K709 PolarHBondContact OE1-NZ 2.99Å; N707-K709 PolarHBondContact OD1-N 3.28Å; N707-K709 VanDerWaalsContact OD1-N 3.08Å
710	K	29.8	Very low	28.1	Very low	156 Å²	156	107.8 Å²	107.8	68%	0.678	58%	0.58	S	S	*	*			trans	-163.4	86.5	147.3	-105.1	173.7	-169.4	-179.4	0	108.3	K712	K710-K712 PolarHBondContact O-N 3.49Å
711	T	25.3	Very low	28.1	Very low	148 Å²	148	112.4 Å²	112.4	91%	0.908	60%	0.604	S	S	*	*	S	Bend	trans	-67	75.5	151.8	41.5	0	0	0	0	108.2
712	K	24	Very low	28.2	Very low	198 Å²	198	114 Å²	114	86%	0.861	61%	0.614	S	S	*	*	S	Bend	trans	167.3	82.4	153.9	-93.8	175.4	-175.8	-175.2	0	107.8	K710	K710-K712 PolarHBondContact O-N 3.49Å
713	G	22	Very low	28.2	Very low	57 Å²	57	114.3 Å²	114.3	59%	0.588	62%	0.624	S	S	*	*			trans	80.4	103.4	161.1	0	0	0	0	0	116.9
714	I	22.6	Very low	28.5	Very low	153 Å²	153	117.8 Å²	117.8	79%	0.785	66%	0.658	S	S	*	*				-155.7	128.4	114.8	-85.5	149.7	0	0	0	106.4	I716	I714-I716 HydrophobicContact CG2-CG1 4.42Å
715	V	22.2	Very low	28.5	Very low	128 Å²	128	115 Å²	115	78%	0.776	65%	0.646	S	S	*	*			trans	-98.6	123.4	172.8	173	0	0	0	0	106.6
716	I	24.2	Very low	28.6	Very low	123 Å²	123	120.5 Å²	120.5	63%	0.631	67%	0.674	S	S	*	*			trans	-91.8	110.3	167.2	-60.5	176.2	0	0	0	106.5	I714	I714-I716 HydrophobicContact CG2-CG1 4.42Å
717	Q	23	Very low	28.5	Very low	170 Å²	170	118 Å²	118	79%	0.794	67%	0.668	S	S	*	*			trans	-81.6	151	177.9	-120.6	173.1	-21.3	0	0	111.2
718	Q	21.2	Very low	28.4	Very low	162 Å²	162	119.7 Å²	119.7	76%	0.757	68%	0.677	S	S	*	*			trans	-43.7	124.8	-168.7	-76.3	163.1	-49.3	0	0	116.6	I720	Q718-I720 HydrophobicContact CB-CG1 4.27Å; Q718-I720 HydrophobicContact CG-CG1 4.47Å
719	A	25.2	Very low	28	Very low	101 Å²	101	120.3 Å²	120.3	84%	0.835	67%	0.673	S	S	*	*			trans	-108.2	105.6	142.6	0	0	0	0	0	108.1
720	I	23	Very low	27.7	Very low	131 Å²	131	118.6 Å²	118.6	67%	0.672	68%	0.683	S	S	*	*			trans	-85.2	116.4	171.4	-64.3	167	0	0	0	106.7	Q718	Q718-I720 HydrophobicContact CB-CG1 4.27Å; Q718-I720 HydrophobicContact CG-CG1 4.47Å
721	L	28.5	Very low	27.6	Very low	164 Å²	164	120 Å²	120	86%	0.859	69%	0.685	S	S	*	*	S	Bend	trans	168.2	157.6	151	-89.8	155.1	0	0	0	109.8
722	P	29	Very low	27.7	Very low	125 Å²	125	117.4 Å²	117.4	81%	0.812	67%	0.673	S	S	*	*	S	Bend		-89.4	142.9	-123.9	34.4	-35.4	0	0	0	115.6
723	G	32	Very low	28	Very low	36 Å²	36	113.4 Å²	113.4	37%	0.371	67%	0.67	S	S	.	*			trans	143.5	67.5	-179.8	0	0	0	0	0	109.1	C725	G723-C725 PolarHBondContact O-N 2.87Å
724	A	36.7	Very low	28.6	Very low	97 Å²	97	114 Å²	114	80%	0.802	67%	0.67	S	S	*	*			trans	-69	99.5	-168.5	0	0	0	0	0	111.7	L726	A724-L726 PolarHBondContact O-N 3.05Å; A724-L726 VanDerWaalsContact O-N 3.08Å
725	C	37.9	Very low	29.5	Very low	31 Å²	31	110 Å²	110	21%	0.209	66%	0.655	C	S	.	*			trans	-64	105.4	158.4	-76.4	0	0	0	0	108.3	C618 G723 V727	C618-C725 HydrophobicContact CB-CB 3.65Å; C618-C725 WeakPolarHBondContact CB-SG 3.44Å; C618-C725 WeakPolarHBondContact SG-CB 3.18Å; C618-C725 CovalentContact SG-SG 2.03Å; C618-C725 PolarHBondContact SG-SG 3.29Å; G723-C725 PolarHBondContact O-N 2.87Å; C725-V727 PolarHBondContact O-N 3.04Å
726	L	37.6	Very low	30.2	Very low	138 Å²	138	110.2 Å²	110.2	72%	0.723	65%	0.651	S	S	*	*			trans	-70	85.4	161.5	-76.9	163.2	0	0	0	107.3	A724 N728	A724-L726 PolarHBondContact O-N 3.05Å; A724-L726 VanDerWaalsContact O-N 3.08Å; L726-N728 PolarHBondContact O-N 3.44Å
727	V	36	Very low	31	Very low	60 Å²	60	109.1 Å²	109.1	36%	0.364	65%	0.651	S	S	.	*			trans	-65	92.2	156.6	-178.7	0	0	0	0	104.3	K706 C725 I729	K706-V727 HydrophobicContact CD-CG1 4.29Å; C725-V727 PolarHBondContact O-N 3.04Å; V727-I729 PolarHBondContact O-N 3.5Å
728	N	29.8	Very low	31.9	Very low	129 Å²	129	107.6 Å²	107.6	69%	0.69	64%	0.641	S	S	*	*			trans	-57.3	95	171.4	-90.6	-25.3	0	0	0	106.5	L726 A730	L726-N728 PolarHBondContact O-N 3.44Å; N728-A730 PolarHBondContact O-N 3.31Å
729	I	27.5	Very low	32.8	Very low	90 Å²	90	104.6 Å²	104.6	46%	0.462	63%	0.63	S	S	.	*			trans	-63.1	97.1	156.5	-56.6	173.5	0	0	0	101.8	V727 Y731	V727-I729 PolarHBondContact O-N 3.5Å; I729-Y731 HydrophobicContact CB-CD2 4.01Å; I729-Y731 HydrophobicContact CB-CE2 3.94Å; I729-Y731 HydrophobicContact CD1-CE2 4.35Å; I729-Y731 HydrophobicContact CG2-CD2 3.61Å; I729-Y731 HydrophobicContact CG2-CE2 3.57Å; I729-Y731 HydrophobicContact CG2-CG 4.14Å; I729-Y731 PolarHBondContact O-N 2.86Å
730	A	24.9	Very low	33.9	Very low	93 Å²	93	104.6 Å²	104.6	77%	0.769	62%	0.615	S	S	*	*			trans	-59.8	83.4	157.5	0	0	0	0	0	105.2	N728 S732	N728-A730 PolarHBondContact O-N 3.31Å; A730-S732 VanDerWaalsContact C-N 3.34Å; A730-S732 PolarHBondContact O-N 2.83Å
731	Y	26.5	Very low	35.1	Very low	186 Å²	186	101.1 Å²	101.1	73%	0.729	60%	0.602	S	S	*	*			trans	-55.1	114.1	152.6	-79.6	-84.2	0	0	0	103	I729 S733	I729-Y731 HydrophobicContact CB-CD2 4.01Å; I729-Y731 HydrophobicContact CB-CE2 3.94Å; I729-Y731 HydrophobicContact CD1-CE2 4.35Å; I729-Y731 HydrophobicContact CG2-CD2 3.61Å; I729-Y731 HydrophobicContact CG2-CE2 3.57Å; I729-Y731 HydrophobicContact CG2-CG 4.14Å; I729-Y731 PolarHBondContact O-N 2.86Å; Y731-S733 PolarHBondContact O-N 2.86Å
732	S	27.8	Very low	36.2	Very low	93 Å²	93	97.5 Å²	97.5	65%	0.65	58%	0.583	S	S	*	*			trans	-50.4	114.7	163.4	63.8	0	0	0	0	105	A730 A734	A730-S732 VanDerWaalsContact C-N 3.34Å; A730-S732 PolarHBondContact O-N 2.83Å; S732-A734 PolarHBondContact O-N 2.88Å
733	S	30.9	Very low	37	Very low	115 Å²	115	99.8 Å²	99.8	80%	0.804	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	39.2	-179.9	54.4	0	0	0	0	110.5	Y731	Y731-S733 PolarHBondContact O-N 2.86Å
734	A	34.2	Very low	37.8	Very low	69 Å²	69	104.9 Å²	104.9	57%	0.57	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	2.4	179.7	0	0	0	0	0	112.9	S732	S732-A734 PolarHBondContact O-N 2.88Å
735	S	42.4	Very low	38.7	Very low	69 Å²	69	104.6 Å²	104.6	48%	0.483	58%	0.577	S	S	.	*	S	Bend	trans	-121.9	-17.3	179.5	-167.2	0	0	0	0	116.2	F738 L739	S735-F738 PolarHBondContact O-N 3.04Å; S735-L739 PolarHBondContact O-N 2.78Å
736	L	35.8	Very low	39.5	Very low	132 Å²	132	106.8 Å²	106.8	69%	0.691	59%	0.589	S	S	*	*	H	α-helix	trans	-76.7	-33.2	176.6	-149.2	76.6	0	0	0	112.6	F738 I740	L736-F738 VanDerWaalsContact C-N 3.32Å; L736-I740 WeakPolarHBondContact O-CD1 3.44Å; L736-I740 VanDerWaalsContact O-CG1 3.29Å; L736-I740 WeakPolarHBondContact O-CG1 3.48Å; L736-I740 PolarHBondContact O-N 2.92Å
737	T	40.6	Very low	40	Very low	101 Å²	101	106.7 Å²	106.7	62%	0.62	58%	0.583	S	S	*	*	H	α-helix	trans	-70.5	-28.8	173	46.1	0	0	0	0	112.3	S741	T737-S741 PolarHBondContact O-N 2.95Å; T737-S741 PolarHBondContact O-OG 3.45Å
738	F	41.4	Very low	40.6	Very low	137 Å²	137	110.7 Å²	110.7	60%	0.601	60%	0.596	S	S	*	*	H	α-helix	trans	-76.4	-33.9	179.1	-137.8	-90.8	0	0	0	112.7	S735 L736 S741 I742	S735-F738 PolarHBondContact O-N 3.04Å; L736-F738 VanDerWaalsContact C-N 3.32Å; F738-S741 WeakPolarHBondContact CA-OG 3.43Å; F738-S741 PolarHBondContact O-OG 2.93Å; F738-I742 HydrophobicContact CD1-CD1 3.97Å; F738-I742 HydrophobicContact CE1-CD1 4.27Å; F738-I742 WeakPolarHBondContact O-CG1 3.45Å; F738-I742 PolarHBondContact O-N 2.83Å
739	L	41.9	Very low	41.5	Very low	100 Å²	100	111.1 Å²	111.1	52%	0.524	59%	0.594	S	S	.	*	H	α-helix	trans	-75	-35.2	175.9	-76.5	162.3	0	0	0	112.8	S735 Y743	S735-L739 PolarHBondContact O-N 2.78Å; L739-Y743 PolarHBondContact O-N 2.9Å
740	I	47.8	Very low	42.7	Very low	101 Å²	101	113 Å²	113	52%	0.518	60%	0.604	S	S	.	*	H	α-helix	trans	-69.7	-35.2	176.8	-64.1	167.3	0	0	0	111.1	L736 F744	L736-I740 WeakPolarHBondContact O-CD1 3.44Å; L736-I740 VanDerWaalsContact O-CG1 3.29Å; L736-I740 WeakPolarHBondContact O-CG1 3.48Å; L736-I740 PolarHBondContact O-N 2.92Å; I740-F744 HydrophobicContact CG2-CD2 4.48Å; I740-F744 PolarHBondContact O-N 2.98Å; I740-F744 VanDerWaalsContact O-N 3.15Å
741	S	48.4	Very low	44	Very low	57 Å²	57	116.6 Å²	116.6	40%	0.399	60%	0.602	S	S	.	*	H	α-helix	trans	-72.7	-34.6	177.7	37.3	0	0	0	0	112.8	T737 F738 F744 V745	T737-S741 PolarHBondContact O-N 2.95Å; T737-S741 PolarHBondContact O-OG 3.45Å; F738-S741 WeakPolarHBondContact CA-OG 3.43Å; F738-S741 PolarHBondContact O-OG 2.93Å; S741-F744 PolarHBondContact O-N 3.2Å; S741-V745 VanDerWaalsContact O-CG2 3.31Å; S741-V745 WeakPolarHBondContact O-CG2 3.42Å; S741-V745 PolarHBondContact O-N 2.9Å; S741-V745 VanDerWaalsContact O-N 3.12Å
742	I	49.9	Very low	45	Very low	89 Å²	89	113 Å²	113	46%	0.456	60%	0.603	S	S	.	*	H	α-helix	trans	-67.2	-41.6	173.2	-66.8	169.1	0	0	0	111.1	F738 F744 V745 V746	F738-I742 HydrophobicContact CD1-CD1 3.97Å; F738-I742 HydrophobicContact CE1-CD1 4.27Å; F738-I742 WeakPolarHBondContact O-CG1 3.45Å; F738-I742 PolarHBondContact O-N 2.83Å; I742-F744 VanDerWaalsContact C-N 3.32Å; I742-F744 PolarHBondContact O-N 3.22Å; I742-V745 PolarHBondContact O-N 3.42Å; I742-V746 HydrophobicContact CG2-CG2 4.27Å; I742-V746 WeakPolarHBondContact O-CG2 3.49Å; I742-V746 PolarHBondContact O-N 2.77Å
743	Y	46.3	Very low	45.9	Very low	172 Å²	172	118.5 Å²	118.5	68%	0.675	63%	0.625	S	S	*	*	H	α-helix	trans	-63	-37.4	177.1	-106.7	-85.5	0	0	0	112.5	L739 F747	L739-Y743 PolarHBondContact O-N 2.9Å; Y743-F747 WeakPolarHBondContact O-CB 3.37Å; Y743-F747 PolarHBondContact O-N 2.91Å; Y743-F747 VanDerWaalsContact O-N 3.09Å
744	F	49.4	Very low	46.6	Very low	144 Å²	144	118.7 Å²	118.7	63%	0.632	62%	0.616	S	S	*	*	H	α-helix	trans	-68.4	-38.3	176.2	-109.2	-86	0	0	0	113.1	I740 S741 I742 F748	I740-F744 HydrophobicContact CG2-CD2 4.48Å; I740-F744 PolarHBondContact O-N 2.98Å; I740-F744 VanDerWaalsContact O-N 3.15Å; S741-F744 PolarHBondContact O-N 3.2Å; I742-F744 VanDerWaalsContact C-N 3.32Å; I742-F744 PolarHBondContact O-N 3.22Å; F744-F748 PolarHBondContact O-N 3.25Å; F744-F748 VanDerWaalsContact O-N 3.13Å
745	V	55.3	Low	47.3	Very low	91 Å²	91	121.3 Å²	121.3	55%	0.552	62%	0.618	S	S	*	*	H	α-helix	trans	-70.5	-38.8	179	174.6	0	0	0	0	111.4	S741 I742 F748 Q749	S741-V745 VanDerWaalsContact O-CG2 3.31Å; S741-V745 WeakPolarHBondContact O-CG2 3.42Å; S741-V745 PolarHBondContact O-N 2.9Å; S741-V745 VanDerWaalsContact O-N 3.12Å; I742-V745 PolarHBondContact O-N 3.42Å; V745-F748 PolarHBondContact O-N 2.84Å; V745-Q749 PolarHBondContact O-N 3.28Å
746	V	54.4	Low	47.5	Very low	76 Å²	76	124.2 Å²	124.2	46%	0.461	63%	0.626	S	S	.	*	H	α-helix	trans	-69.5	-38.4	177.8	176.9	0	0	0	0	111.3	I742 L750	I742-V746 HydrophobicContact CG2-CG2 4.27Å; I742-V746 WeakPolarHBondContact O-CG2 3.49Å; I742-V746 PolarHBondContact O-N 2.77Å; V746-L750 HydrophobicContact CG1-CD1 4.12Å; V746-L750 PolarHBondContact O-N 3.13Å
747	F	48.1	Very low	48.2	Very low	136 Å²	136	123.8 Å²	123.8	60%	0.596	62%	0.622	S	S	*	*	H	α-helix	trans	-69.1	-34.5	177.3	-118.9	-89.7	0	0	0	113.1	Y743 F751	Y743-F747 WeakPolarHBondContact O-CB 3.37Å; Y743-F747 PolarHBondContact O-N 2.91Å; Y743-F747 VanDerWaalsContact O-N 3.09Å; F747-F751 PolarHBondContact O-N 2.94Å
748	F	49.9	Very low	48.7	Very low	145 Å²	145	125.2 Å²	125.2	64%	0.636	62%	0.622	S	S	*	*	H	α-helix	trans	-72.1	-32.6	178	-118.9	-87.8	0	0	0	112.9	F744 V745	F744-F748 PolarHBondContact O-N 3.25Å; F744-F748 VanDerWaalsContact O-N 3.13Å; V745-F748 PolarHBondContact O-N 2.84Å
749	Q	48.3	Very low	49.2	Very low	138 Å²	138	124.4 Å²	124.4	65%	0.645	62%	0.623	S	S	*	*	H	α-helix	trans	-74.3	-29.2	176.8	-75.1	-166.3	-25.9	0	0	113.3	V745 F751	V745-Q749 PolarHBondContact O-N 3.28Å; Q749-F751 VanDerWaalsContact C-N 3.35Å
750	L	51.9	Low	49.7	Very low	128 Å²	128	126.1 Å²	126.1	67%	0.67	63%	0.63	S	S	*	*	H	α-helix	trans	-77.8	-15.4	176.7	-100.5	134.8	0	0	0	114.3	V746	V746-L750 HydrophobicContact CG1-CD1 4.12Å; V746-L750 PolarHBondContact O-N 3.13Å
751	F	52.9	Low	49.8	Very low	169 Å²	169	128.1 Å²	128.1	74%	0.741	64%	0.639	S	S	*	*	S	Bend	trans	-95.6	-9	175.8	-111.8	-83.8	0	0	0	114	F747 Q749	F747-F751 PolarHBondContact O-N 2.94Å; Q749-F751 VanDerWaalsContact C-N 3.35Å
752	C	46.9	Very low	50	Low	111 Å²	111	134 Å²	134	75%	0.75	66%	0.659	S	S	*	*			trans	-105.9	-1.4	176.3	-81.4	0	0	0	0	114.3
753	L	46.1	Very low	50	Low	209 Å²	209	138.1 Å²	138.1	100%	1.094	68%	0.677	S	S	*	*			trans	-101.1	0	165	-88.7	153.4	0	0	0	108.5

Retrieved 753 of 753 residues in 326.9 ms (Link to these results)

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