A0A3Q0KKS1_SCHMA Loading...

Large ribosomal subunit protein uL4m

AlphaFold DB , UniProt , Accession A0A3Q0KKS1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 455 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	24.7	Very low	29	Very low	220 Å²	220	92.7 Å²	92.7	100%	1.084	46%	0.456	S	S	*	.				0	82.1	0	-85.5	177.4	172.2	0	0	110.7
2	V	23.8	Very low	29.7	Very low	62 Å²	62	88 Å²	88	38%	0.376	43%	0.434	S	S	.	.			trans	-153	64.7	-177.2	-173.1	0	0	0	0	106.8	Y130 R131	V2-Y130 HydrophobicContact CG2-CE2 4.4Å; V2-Y130 VanDerWaalsContact CG2-OH 3.24Å; V2-Y130 WeakPolarHBondContact CG2-OH 2.89Å; V2-R131 HydrophobicContact CG2-CG 4.23Å
3	F	24.8	Very low	30.5	Very low	150 Å²	150	85.6 Å²	85.6	66%	0.658	43%	0.427	S	S	*	.			trans	-144.3	57	-168.9	-76.4	-76.2	0	0	0	109.5
4	H	27.5	Very low	31.1	Very low	66 Å²	66	85.8 Å²	85.8	31%	0.306	42%	0.424	S	S	.	.	S	Bend	trans	-152.6	77.8	171.4	-77.8	-57.3	0	0	0	111.2	E7 P365 H367 S368	H4-E7 IonicContact CE1-OE2 2.88Å; H4-E7 PolarHBondContact CE1-OE2 2.95Å; H4-E7 IonicContact ND1-OE2 2.9Å; H4-E7 PolarHBondContact ND1-OE2 3.36Å; H4-P365 HydrophobicContact CB-CG 4.42Å; H4-H367 AromaticContact CD2-CE1 3.51Å; H4-H367 AromaticContact CD2-ND1 3.84Å; H4-H367 AromaticContact CE1-CE1 3.82Å; H4-H367 AromaticContact NE2-CE1 3.29Å; H4-H367 PolarHBondContact NE2-CE1 3.01Å; H4-H367 VanDerWaalsContact NE2-CE1 3.29Å; H4-H367 AromaticContact NE2-ND1 3.85Å; H4-S368 WeakPolarHBondContact CB-OG 3.34Å; H4-S368 PolarHBondContact CD2-OG 2.9Å
5	I	31.6	Very low	31.6	Very low	102 Å²	102	81.2 Å²	81.2	52%	0.523	40%	0.4	S	S	.	.	S	Bend	trans	-152.4	-22	146.3	-57.7	-170.1	0	0	0	108.3	E7	I5-E7 VanDerWaalsContact C-N 3.28Å; I5-E7 PolarHBondContact O-N 3.15Å
6	R	29.8	Very low	31.5	Very low	178 Å²	178	77.9 Å²	77.9	67%	0.672	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-19	177	-87.7	-177.6	165.9	164	-3.6	116	T9	R6-T9 PolarHBondContact O-OG1 2.91Å
7	E	30	Very low	31.3	Very low	77 Å²	77	76.5 Å²	76.5	36%	0.36	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-20.5	-165.2	-69.7	174.5	166.4	0	0	114.7	H4 I5 T9 S10 A293	H4-E7 IonicContact CE1-OE2 2.88Å; H4-E7 PolarHBondContact CE1-OE2 2.95Å; H4-E7 IonicContact ND1-OE2 2.9Å; H4-E7 PolarHBondContact ND1-OE2 3.36Å; I5-E7 VanDerWaalsContact C-N 3.28Å; I5-E7 PolarHBondContact O-N 3.15Å; E7-T9 PolarHBondContact O-N 3.24Å; E7-S10 PolarHBondContact O-N 2.68Å; E7-S10 PolarHBondContact O-OG 2.83Å; E7-A293 HydrophobicContact CB-CB 3.66Å; E7-A293 HydrophobicContact CG-CB 4.49Å; E7-A293 WeakPolarHBondContact OE2-CB 3.42Å
8	T	30.3	Very low	31.3	Very low	41 Å²	41	78.1 Å²	78.1	25%	0.252	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-74.4	-17.8	169.5	50.1	0	0	0	0	112.3	S10 P292 L296	T8-S10 VanDerWaalsContact C-N 3.35Å; T8-P292 HydrophobicContact CG2-CB 3.54Å; T8-P292 HydrophobicContact CG2-CG 3.53Å; T8-L296 HydrophobicContact CG2-CD1 4.12Å
9	T	32.5	Very low	31.1	Very low	27 Å²	27	83.9 Å²	83.9	17%	0.166	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-85.1	-8	178.5	67	0	0	0	0	113.4	R6 E7 L11 L12 E331 K335	R6-T9 PolarHBondContact O-OG1 2.91Å; E7-T9 PolarHBondContact O-N 3.24Å; T9-L11 VanDerWaalsContact C-N 3.33Å; T9-L11 PolarHBondContact O-N 2.7Å; T9-L12 PolarHBondContact O-N 3.42Å; T9-E331 VanDerWaalsContact CG2-OE1 3.31Å; T9-E331 WeakPolarHBondContact CG2-OE1 3.49Å; T9-K335 VanDerWaalsContact CB-NZ 3.33Å
10	S	31.4	Very low	30.9	Very low	67 Å²	67	88.3 Å²	88.3	47%	0.469	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-73.3	-21.5	179.9	69.1	0	0	0	0	113.5	E7 T8 L12 V13	E7-S10 PolarHBondContact O-N 2.68Å; E7-S10 PolarHBondContact O-OG 2.83Å; T8-S10 VanDerWaalsContact C-N 3.35Å; S10-L12 VanDerWaalsContact C-N 3.32Å; S10-V13 WeakPolarHBondContact O-CB 3.37Å; S10-V13 VanDerWaalsContact O-CG2 3.26Å; S10-V13 WeakPolarHBondContact O-CG2 3.32Å
11	L	33.3	Very low	30.7	Very low	30 Å²	30	90.1 Å²	90.1	16%	0.157	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-76	-19.6	170.4	-85.1	-175.4	0	0	0	113.8	T9 V13 L296 V298	T9-L11 VanDerWaalsContact C-N 3.33Å; T9-L11 PolarHBondContact O-N 2.7Å; L11-V13 VanDerWaalsContact C-N 3.29Å; L11-L296 HydrophobicContact CD1-CB 3.33Å; L11-L296 HydrophobicContact CD1-CD1 4.06Å; L11-L296 HydrophobicContact CD1-CD2 3.22Å; L11-L296 HydrophobicContact CD1-CG 3.62Å; L11-L296 VanDerWaalsContact CD2-O 3.31Å; L11-L296 WeakPolarHBondContact CD2-O 3.44Å; L11-L296 HydrophobicContact CG-CB 3.84Å; L11-L296 WeakPolarHBondContact CG-O 3.31Å; L11-V298 HydrophobicContact CD2-CG2 3.48Å; L11-V298 VanDerWaalsContact CD2-CG2 3.48Å
12	L	36.5	Very low	30.7	Very low	36 Å²	36	88 Å²	88	19%	0.188	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-83.2	-5.2	177.4	-93.1	153.4	0	0	0	113.3	T9 S10 K14 Y15 L260	T9-L12 PolarHBondContact O-N 3.42Å; S10-L12 VanDerWaalsContact C-N 3.32Å; L12-K14 PolarHBondContact O-N 3.37Å; L12-K14 VanDerWaalsContact O-N 3.12Å; L12-Y15 HydrophobicContact CD2-CD2 3.82Å; L12-Y15 HydrophobicContact CD2-CG 4.35Å; L12-Y15 PolarHBondContact O-N 2.9Å; L12-L260 HydrophobicContact CD2-CD1 3.73Å; L12-L260 HydrophobicContact CD2-CD2 4.42Å; L12-L260 HydrophobicContact CG-CD1 4.26Å
13	V	41	Very low	30.9	Very low	57 Å²	57	92.4 Å²	92.4	35%	0.345	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-57.5	-26.2	174.8	169.6	0	0	0	0	111.9	S10 L11 D18	S10-V13 WeakPolarHBondContact O-CB 3.37Å; S10-V13 VanDerWaalsContact O-CG2 3.26Å; S10-V13 WeakPolarHBondContact O-CG2 3.32Å; L11-V13 VanDerWaalsContact C-N 3.29Å; V13-D18 HydrophobicContact CG1-CB 4.48Å; V13-D18 WeakPolarHBondContact CG1-OD2 3.38Å; V13-D18 WeakPolarHBondContact CG2-OD2 3.46Å
14	K	39	Very low	31	Very low	88 Å²	88	92.3 Å²	92.3	38%	0.383	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-88	-1	-179.5	-57.1	-159.4	176.4	-152.3	0	114.6	L12 S239	L12-K14 PolarHBondContact O-N 3.37Å; L12-K14 VanDerWaalsContact O-N 3.12Å; K14-S239 WeakPolarHBondContact CE-OG 3.28Å; K14-S239 VanDerWaalsContact NZ-CB 3.33Å; K14-S239 PolarHBondContact NZ-O 2.88Å; K14-S239 PolarHBondContact NZ-OG 3.2Å
15	Y	37.7	Very low	31.1	Very low	17 Å²	17	97.6 Å²	97.6	7%	0.067	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-99.1	14	174.5	-73.8	-60.5	0	0	0	114.1	L12 R256 L260	L12-Y15 HydrophobicContact CD2-CD2 3.82Å; L12-Y15 HydrophobicContact CD2-CG 4.35Å; L12-Y15 PolarHBondContact O-N 2.9Å; Y15-R256 HydrophobicContact CD1-CB 4.04Å; Y15-R256 HydrophobicContact CE1-CB 3.15Å; Y15-R256 HydrophobicContact CE1-CG 3.98Å; Y15-L260 HydrophobicContact CD2-CD1 3.96Å; Y15-L260 HydrophobicContact CE2-CD1 3.74Å
16	G	29.6	Very low	30.8	Very low	29 Å²	29	100.5 Å²	100.5	30%	0.299	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.4	4.6	167.1	0	0	0	0	0	116.7
17	C	28.7	Very low	30.7	Very low	53 Å²	53	98.6 Å²	98.6	36%	0.358	50%	0.495	S	S	.	.			trans	-113.1	78.7	-179.4	-102.1	0	0	0	0	111.5	S339 E341	C17-S339 WeakPolarHBondContact SG-CB 3.32Å; C17-E341 PolarHBondContact SG-OE1 2.89Å
18	D	30.6	Very low	30.6	Very low	105 Å²	105	101.9 Å²	101.9	56%	0.561	51%	0.513	S	S	*	.			trans	-137.8	96.2	172.6	-116.8	14.5	0	0	0	110.2	V13	V13-D18 HydrophobicContact CG1-CB 4.48Å; V13-D18 WeakPolarHBondContact CG1-OD2 3.38Å; V13-D18 WeakPolarHBondContact CG2-OD2 3.46Å
19	F	28.4	Very low	30.4	Very low	189 Å²	189	107.6 Å²	107.6	83%	0.829	54%	0.542	S	S	*	.			trans	-155.6	119.2	160.4	-127.4	-104.9	0	0	0	111.7
20	F	27.5	Very low	30.1	Very low	171 Å²	171	112.3 Å²	112.3	75%	0.75	57%	0.57	S	S	*	*			trans	84.5	108	147.9	-91.9	-114.4	0	0	0	122.8
21	L	26.5	Very low	29.8	Very low	128 Å²	128	121.2 Å²	121.2	67%	0.67	59%	0.594	S	S	*	*			trans	-17.7	140.5	141.8	-71.7	160.2	0	0	0	117.7
22	K	25	Very low	29.6	Very low	176 Å²	176	125.1 Å²	125.1	77%	0.765	62%	0.623	S	S	*	*			trans	57.2	99.1	150.1	-70.3	178.4	175.8	176.9	0	115.8
23	H	27.9	Very low	29.3	Very low	154 Å²	154	128 Å²	128	71%	0.713	65%	0.653	S	S	*	*			trans	-155.5	125.9	130.6	-94.6	-69.6	0	0	0	111.7	Y25	H23-Y25 HydrophobicContact CB-CD2 3.67Å; H23-Y25 HydrophobicContact CB-CE2 3.23Å; H23-Y25 AromaticContact CG-CE2 3.7Å; H23-Y25 AromaticContact CG-CZ 3.97Å; H23-Y25 PolarHBondContact O-N 2.88Å
24	N	26.3	Very low	28.8	Very low	147 Å²	147	129.8 Å²	129.8	79%	0.786	67%	0.668	S	S	*	*			trans	-57.8	117.9	158.1	-71.6	-31.8	0	0	0	108.4
25	Y	29.3	Very low	28.5	Very low	177 Å²	177	131.4 Å²	131.4	69%	0.694	69%	0.69	S	S	*	*			trans	-132.8	117.9	162.2	-73.1	-65.3	0	0	0	110.7	H23 I27	H23-Y25 HydrophobicContact CB-CD2 3.67Å; H23-Y25 HydrophobicContact CB-CE2 3.23Å; H23-Y25 AromaticContact CG-CE2 3.7Å; H23-Y25 AromaticContact CG-CZ 3.97Å; H23-Y25 PolarHBondContact O-N 2.88Å; Y25-I27 PolarHBondContact O-N 3.34Å
26	N	24.8	Very low	28.2	Very low	163 Å²	163	140.9 Å²	140.9	87%	0.872	73%	0.726	S	S	*	*			trans	-48.8	123.8	154.7	-73.1	-40.5	0	0	0	109
27	I	28.6	Very low	28.3	Very low	139 Å²	139	145 Å²	145	71%	0.713	75%	0.75	S	S	*	*			trans	-105.7	105.8	162.8	-64.4	175.9	0	0	0	107.1	Y25 L29	Y25-I27 PolarHBondContact O-N 3.34Å; I27-L29 PolarHBondContact O-N 3.05Å
28	I	27.3	Very low	28.6	Very low	145 Å²	145	147.8 Å²	147.8	74%	0.744	76%	0.756	S	S	*	*			trans	-61.7	116.7	164.2	-66.6	168.3	0	0	0	106.9	T30	I28-T30 PolarHBondContact O-N 2.85Å; I28-T30 VanDerWaalsContact O-N 3.11Å
29	L	26.3	Very low	29.3	Very low	161 Å²	161	151.6 Å²	151.6	84%	0.843	77%	0.768	S	S	*	*			trans	-70	98.8	171.9	-72.4	168.4	0	0	0	109.5	I27 R31	I27-L29 PolarHBondContact O-N 3.05Å; L29-R31 PolarHBondContact O-N 2.75Å
30	T	27.5	Very low	30.2	Very low	126 Å²	126	145.5 Å²	145.5	77%	0.773	74%	0.743	S	S	*	*			trans	-83.5	105.6	158.6	50.7	0	0	0	0	108.8	I28 S32	I28-T30 PolarHBondContact O-N 2.85Å; I28-T30 VanDerWaalsContact O-N 3.11Å; T30-S32 PolarHBondContact O-N 3.49Å
31	R	24.9	Very low	31.3	Very low	255 Å²	255	141 Å²	141	96%	0.962	73%	0.731	S	S	*	*			trans	-58.7	111	167.7	-84.8	177.9	167.4	179	-3.9	109.5	L29	L29-R31 PolarHBondContact O-N 2.75Å
32	S	28.2	Very low	32.3	Very low	111 Å²	111	143 Å²	143	78%	0.776	74%	0.737	S	S	*	*			trans	-126.7	92.4	157.2	161.8	0	0	0	0	106.5	T30 S34	T30-S32 PolarHBondContact O-N 3.49Å; S32-S34 PolarHBondContact O-N 2.75Å
33	A	29.7	Very low	33.4	Very low	98 Å²	98	137.7 Å²	137.7	81%	0.81	72%	0.716	S	S	*	*			trans	-71.3	103	172.4	0	0	0	0	0	108.5	S35	A33-S35 PolarHBondContact O-N 3.37Å
34	S	32.1	Very low	34.1	Very low	93 Å²	93	137 Å²	137	65%	0.65	72%	0.718	S	S	*	*			trans	-80.1	101.5	157.9	161.1	0	0	0	0	107.2	S32 R36	S32-S34 PolarHBondContact O-N 2.75Å; S34-R36 PolarHBondContact O-N 3.45Å
35	S	31.4	Very low	35.1	Very low	122 Å²	122	133.9 Å²	133.9	85%	0.853	70%	0.701	S	S	*	*			trans	-70.1	77.8	169.7	55.5	0	0	0	0	110.2	A33	A33-S35 PolarHBondContact O-N 3.37Å
36	R	31.9	Very low	35.6	Very low	216 Å²	216	133.4 Å²	133.4	82%	0.815	70%	0.702	S	S	*	*			trans	-111.2	121.4	155.3	-88.8	-173.9	174.8	-168.6	-0.9	107.4	S34 F38	S34-R36 PolarHBondContact O-N 3.45Å; R36-F38 PolarHBondContact O-N 2.99Å
37	S	31	Very low	36.1	Very low	117 Å²	117	130.4 Å²	130.4	82%	0.818	69%	0.692	S	S	*	*			trans	-66.8	87.7	167.5	54.2	0	0	0	0	108.2	K39	S37-K39 PolarHBondContact O-N 3.45Å; S37-K39 VanDerWaalsContact O-N 3.15Å
38	F	36.2	Very low	36.7	Very low	111 Å²	111	127 Å²	127	49%	0.487	68%	0.676	S	S	.	*			trans	-74.1	99.8	167	-170.8	-95.5	0	0	0	106.3	R36 I40	R36-F38 PolarHBondContact O-N 2.99Å; F38-I40 PolarHBondContact O-N 3.48Å
39	K	43.7	Very low	37.3	Very low	184 Å²	184	128.8 Å²	128.8	80%	0.8	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-69.1	119.9	165.4	-72.6	-173.5	176.6	-173.2	0	106	S37	S37-K39 PolarHBondContact O-N 3.45Å; S37-K39 VanDerWaalsContact O-N 3.15Å
40	I	47.7	Very low	38	Very low	61 Å²	61	128 Å²	128	31%	0.313	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-55.9	124.5	169	-60.3	169.4	0	0	0	105.2	F38 E42 I269 R272	F38-I40 PolarHBondContact O-N 3.48Å; I40-E42 PolarHBondContact O-N 2.89Å; I40-I269 HydrophobicContact CG2-CG1 4.21Å; I40-I269 HydrophobicContact CG2-CG2 3.84Å; I40-R272 HydrophobicContact CD1-CG 4.35Å
41	P	50.6	Low	38.8	Very low	76 Å²	76	128.6 Å²	128.6	49%	0.494	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-57.1	120.1	174.6	22.6	-30.3	0	0	0	107.1	I43	P41-I43 VanDerWaalsContact C-N 3.33Å; P41-I43 PolarHBondContact O-N 3.38Å
42	E	48.2	Very low	39.7	Very low	172 Å²	172	122.2 Å²	122.2	80%	0.804	66%	0.662	S	S	*	*			trans	-61.5	104	168.9	-74.4	172.1	-165.9	0	0	105.6	I40 D44	I40-E42 PolarHBondContact O-N 2.89Å; E42-D44 VanDerWaalsContact C-N 3.32Å; E42-D44 PolarHBondContact O-N 3.14Å
43	I	47.9	Very low	40.6	Very low	63 Å²	63	121.7 Å²	121.7	32%	0.323	65%	0.648	S	S	.	*			trans	-64.3	107	163.3	-61.8	174.4	0	0	0	103.3	P41 I45 E266 I269	P41-I43 VanDerWaalsContact C-N 3.33Å; P41-I43 PolarHBondContact O-N 3.38Å; I43-I45 VanDerWaalsContact C-N 3.27Å; I43-I45 PolarHBondContact O-N 3.45Å; I43-E266 HydrophobicContact CD1-CB 4.43Å; I43-E266 HydrophobicContact CD1-CG 4.4Å; I43-I269 HydrophobicContact CD1-CB 3.78Å; I43-I269 HydrophobicContact CD1-CD1 4.1Å; I43-I269 HydrophobicContact CD1-CG2 3.54Å; I43-I269 HydrophobicContact CG1-CG2 3.9Å
44	D	42.8	Very low	41.6	Very low	141 Å²	141	122.6 Å²	122.6	75%	0.754	65%	0.645	S	S	*	*			trans	-51.4	106.4	159.4	-79.8	-26.5	0	0	0	104.3	E42 K46	E42-D44 VanDerWaalsContact C-N 3.32Å; E42-D44 PolarHBondContact O-N 3.14Å; D44-K46 PolarHBondContact O-N 3.21Å
45	I	46.8	Very low	42.3	Very low	81 Å²	81	125.1 Å²	125.1	42%	0.415	65%	0.651	S	S	.	*			trans	-57.8	96.7	173	-60.2	169.7	0	0	0	103.3	I43 C47 Y270	I43-I45 VanDerWaalsContact C-N 3.27Å; I43-I45 PolarHBondContact O-N 3.45Å; I45-C47 VanDerWaalsContact C-N 3.32Å; I45-C47 PolarHBondContact O-N 2.98Å; I45-Y270 HydrophobicContact CD1-CE2 4.45Å
46	K	40	Very low	43.5	Very low	167 Å²	167	124.4 Å²	124.4	73%	0.726	64%	0.637	S	S	*	*			trans	-53.1	112.2	170.1	-77.2	-177.1	178.8	176.8	0	103	D44 D48	D44-K46 PolarHBondContact O-N 3.21Å; K46-D48 PolarHBondContact O-N 3.06Å
47	C	36.2	Very low	45	Very low	99 Å²	99	120.9 Å²	120.9	67%	0.669	63%	0.63	S	S	*	*			trans	-68	80.7	175.7	-70.6	0	0	0	0	105.2	I45 E49	I45-C47 VanDerWaalsContact C-N 3.32Å; I45-C47 PolarHBondContact O-N 2.98Å; C47-E49 PolarHBondContact O-N 2.75Å
48	D	40.5	Very low	46.7	Very low	68 Å²	68	119.6 Å²	119.6	36%	0.364	62%	0.619	S	S	.	*			trans	-60	134.5	173.7	-66.1	-38.7	0	0	0	106.8	K46 L50 T223	K46-D48 PolarHBondContact O-N 3.06Å; D48-L50 PolarHBondContact O-N 2.67Å; D48-T223 HydrophobicContact CB-CG2 4.46Å; D48-T223 VanDerWaalsContact CG-CG2 3.43Å; D48-T223 VanDerWaalsContact OD2-CB 3.32Å; D48-T223 WeakPolarHBondContact OD2-CB 3.18Å; D48-T223 WeakPolarHBondContact OD2-CG2 3.33Å; D48-T223 PolarHBondContact OD2-OG1 3.32Å
49	E	40.3	Very low	48.2	Very low	182 Å²	182	117.8 Å²	117.8	85%	0.85	61%	0.614	S	S	*	*			trans	-31.4	121.4	-161.8	-70.3	170.6	146	0	0	114.8	C47 Q51	C47-E49 PolarHBondContact O-N 2.75Å; E49-Q51 PolarHBondContact O-N 2.96Å
50	L	40.5	Very low	49.3	Very low	146 Å²	146	115.3 Å²	115.3	76%	0.764	61%	0.608	S	S	*	*			trans	-42.1	102.9	171.8	-68.8	167	0	0	0	110.4	D48	D48-L50 PolarHBondContact O-N 2.67Å
51	Q	43.6	Very low	50	Low	137 Å²	137	114.4 Å²	114.4	64%	0.64	61%	0.605	S	S	*	*			trans	-77.7	139.6	162.2	-72	-140.4	-26.9	0	0	109.2	E49 E53	E49-Q51 PolarHBondContact O-N 2.96Å; Q51-E53 PolarHBondContact O-N 3.34Å; Q51-E53 VanDerWaalsContact O-N 3.14Å
52	P	44.6	Very low	50.8	Low	121 Å²	121	115.6 Å²	115.6	79%	0.786	62%	0.615	S	S	*	*			trans	-57.8	124.2	-178.5	23.3	-31.6	0	0	0	108.9
53	E	47.6	Very low	52.1	Low	101 Å²	101	109.1 Å²	109.1	47%	0.472	58%	0.584	S	S	.	*			trans	-42.2	121.9	175.2	-64	-98	138.8	0	0	110.1	Q51 L55 N56	Q51-E53 PolarHBondContact O-N 3.34Å; Q51-E53 VanDerWaalsContact O-N 3.14Å; E53-L55 PolarHBondContact O-N 3.22Å; E53-N56 PolarHBondContact OE2-ND2 2.89Å
54	P	49.4	Very low	53.6	Low	116 Å²	116	116.3 Å²	116.3	75%	0.753	61%	0.612	S	S	*	*			trans	-60.6	138.2	160.2	27.6	-30.3	0	0	0	107.3	N56	P54-N56 PolarHBondContact O-N 3.01Å
55	L	47	Very low	55.4	Low	146 Å²	146	111.9 Å²	111.9	76%	0.764	59%	0.589	S	S	*	*			trans	-29.9	121.8	-176.4	-87.1	117	0	0	0	113.1	E53 Q57	E53-L55 PolarHBondContact O-N 3.22Å; L55-Q57 PolarHBondContact O-N 3.4Å
56	N	57.1	Low	56.9	Low	107 Å²	107	111.8 Å²	111.8	57%	0.572	59%	0.586	S	S	*	*			trans	-61.6	57.9	176.2	-88.2	-86.9	0	0	0	112.4	E53 P54 K93	E53-N56 PolarHBondContact OE2-ND2 2.89Å; P54-N56 PolarHBondContact O-N 3.01Å; N56-K93 PolarHBondContact OD1-NZ 3.17Å
57	Q	63.7	Low	58.8	Low	143 Å²	143	108.8 Å²	108.8	67%	0.668	58%	0.584	S	S	*	*			trans	-107.7	125.5	170.7	-68	-177	-4.2	0	0	107.4	L55 I59	L55-Q57 PolarHBondContact O-N 3.4Å; Q57-I59 PolarHBondContact O-N 3.27Å
58	P	65.7	Low	60.8	Low	90 Å²	90	107.3 Å²	107.3	58%	0.584	57%	0.573	S	S	*	*			trans	-58.3	130.2	175.4	25.4	-32.8	0	0	0	108.5	I60 L101	P58-I60 VanDerWaalsContact C-N 3.29Å; P58-I60 HydrophobicContact CB-CG1 4.45Å; P58-I60 HydrophobicContact CG-CD1 4.49Å; P58-I60 HydrophobicContact CG-CG1 4.49Å; P58-I60 PolarHBondContact O-N 3.39Å; P58-L101 WeakPolarHBondContact CA-O 3.44Å
59	I	68.9	Low	62.6	Low	72 Å²	72	105.5 Å²	105.5	37%	0.369	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.4	91.2	175.6	-59.9	178.1	0	0	0	106.8	Q57 T61 L83 L101 G102 M103	Q57-I59 PolarHBondContact O-N 3.27Å; I59-T61 HydrophobicContact CG2-CG2 3.38Å; I59-T61 PolarHBondContact O-N 3.41Å; I59-L83 HydrophobicContact CB-CD2 4.49Å; I59-L83 HydrophobicContact CG2-CD2 4.27Å; I59-L101 HydrophobicContact CD1-CB 4.28Å; I59-L101 HydrophobicContact CD1-CD1 4.41Å; I59-L101 PolarHBondContact N-O 2.82Å; I59-G102 WeakPolarHBondContact O-CA 3.18Å; I59-M103 PolarHBondContact O-N 2.91Å
60	I	66.4	Low	64.1	Low	133 Å²	133	101.5 Å²	101.5	68%	0.682	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	86.1	168.8	-56.6	174.3	0	0	0	105.9	P58 S62	P58-I60 VanDerWaalsContact C-N 3.29Å; P58-I60 HydrophobicContact CB-CG1 4.45Å; P58-I60 HydrophobicContact CG-CD1 4.49Å; P58-I60 HydrophobicContact CG-CG1 4.49Å; P58-I60 PolarHBondContact O-N 3.39Å; I60-S62 PolarHBondContact O-N 3.47Å
61	T	63.1	Low	65	Low	42 Å²	42	100.6 Å²	100.6	26%	0.258	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	95.3	173.1	54.8	0	0	0	0	108.7	I59 R63 I104	I59-T61 HydrophobicContact CG2-CG2 3.38Å; I59-T61 PolarHBondContact O-N 3.41Å; T61-R63 PolarHBondContact O-N 3.05Å; T61-R63 VanDerWaalsContact O-N 3.11Å; T61-I104 WeakPolarHBondContact OG1-CG1 3.49Å
62	S	66.7	Low	65.7	Low	100 Å²	100	96.2 Å²	96.2	70%	0.699	53%	0.531	S	S	*	.			trans	-71.7	99.9	160.2	51.2	0	0	0	0	107.8	I60	I60-S62 PolarHBondContact O-N 3.47Å
63	R	75.8	Confident	65.9	Low	37 Å²	37	96 Å²	96	14%	0.14	54%	0.54	C	S	.	.			trans	-79.8	142.8	179.7	-63.5	-173	-171.2	-168.6	5.6	109.6	T61 L65 E388	T61-R63 PolarHBondContact O-N 3.05Å; T61-R63 VanDerWaalsContact O-N 3.11Å; R63-L65 VanDerWaalsContact C-N 3.28Å; R63-L65 HydrophobicContact CB-CD2 4.31Å; R63-L65 PolarHBondContact O-N 2.94Å; R63-E388 IonicContact CZ-OE1 3.5Å; R63-E388 IonicContact NH1-OE1 3.43Å; R63-E388 PolarHBondContact NH1-OE1 3.33Å
64	K	79.4	Confident	66.3	Low	214 Å²	214	96.2 Å²	96.2	93%	0.93	55%	0.548	S	S	*	.			trans	-75.2	88.4	165.1	-70.9	-176	-178.7	177.9	0	107.9
65	L	79.4	Confident	66.9	Low	48 Å²	48	96.1 Å²	96.1	25%	0.251	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-65.5	144.2	173.4	-63.2	178.2	0	0	0	109.9	R63 D105	R63-L65 VanDerWaalsContact C-N 3.28Å; R63-L65 HydrophobicContact CB-CD2 4.31Å; R63-L65 PolarHBondContact O-N 2.94Å; L65-D105 HydrophobicContact CD1-CB 4.14Å
66	Q	79.8	Confident	68.2	Low	78 Å²	78	94.7 Å²	94.7	36%	0.364	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-60.2	151.1	168.5	-69.9	-175.7	-7.5	0	0	109.6	H107 I395	Q66-H107 PolarHBondContact O-CD2 3.36Å; Q66-H107 PolarHBondContact O-NE2 3.1Å; Q66-H107 VanDerWaalsContact O-NE2 3.15Å; Q66-I395 HydrophobicContact CB-CD1 3.76Å; Q66-I395 HydrophobicContact CB-CG2 4.39Å; Q66-I395 HydrophobicContact CG-CD1 4.45Å
67	P	79.9	Confident	69.3	Low	105 Å²	105	92 Å²	92	68%	0.682	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-63.7	144.8	177.5	27.2	-34.1	0	0	0	110.3
68	P	78.5	Confident	70.5	Confident	67 Å²	67	87.7 Å²	87.7	44%	0.435	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-60.6	140.9	177.1	26.4	-34.2	0	0	0	110.4	D109	P68-D109 WeakPolarHBondContact CA-OD2 3.39Å; P68-D109 WeakPolarHBondContact CB-OD2 3.11Å
69	V	76.9	Confident	71.7	Confident	30 Å²	30	89.4 Å²	89.4	18%	0.182	51%	0.512	C	S	.	.	S	Bend	trans	-70.7	-40.4	179.7	-178.8	0	0	0	0	109.7	D109 I395 Q398 T399 V402	V69-D109 PolarHBondContact N-OD2 3.49Å; V69-I395 HydrophobicContact CG2-CG2 3.78Å; V69-Q398 HydrophobicContact CB-CB 4.34Å; V69-Q398 HydrophobicContact CG1-CB 4.34Å; V69-Q398 HydrophobicContact CG2-CB 3.91Å; V69-T399 HydrophobicContact CB-CG2 4.44Å; V69-T399 HydrophobicContact CG1-CG2 3.96Å; V69-T399 HydrophobicContact CG2-CG2 3.66Å; V69-V402 HydrophobicContact CG1-CB 4.26Å; V69-V402 HydrophobicContact CG1-CG2 3.88Å
70	Y	72.9	Confident	72.8	Confident	98 Å²	98	90.7 Å²	90.7	38%	0.384	52%	0.519	S	S	.	.	S	Bend	trans	-92.3	111.7	177.4	-59.9	-79.7	0	0	0	109.4	S72 V402	Y70-S72 PolarHBondContact O-N 3.39Å; Y70-V402 HydrophobicContact CD1-CG2 4.25Å; Y70-V402 HydrophobicContact CE1-CG2 3.37Å; Y70-V402 HydrophobicContact CE2-CG2 4.31Å; Y70-V402 VanDerWaalsContact CZ-CG2 3.41Å; Y70-V402 VanDerWaalsContact OH-CG2 3.3Å; Y70-V402 WeakPolarHBondContact OH-CG2 3.45Å
71	C	58.5	Low	74	Confident	127 Å²	127	85 Å²	85	86%	0.858	49%	0.491	S	S	*	.			trans	-71.3	69.1	165.4	-63.9	0	0	0	0	109.6	A73	C71-A73 PolarHBondContact O-N 3.19Å
72	S	58.9	Low	75.5	Confident	46 Å²	46	89.7 Å²	89.7	32%	0.322	50%	0.504	S	S	.	.			trans	-65.6	137.1	170.6	55.6	0	0	0	0	109.3	Y70 T74	Y70-S72 PolarHBondContact O-N 3.39Å; S72-T74 CarbonylContact O-C 3.28Å; S72-T74 VanDerWaalsContact O-C 3.28Å; S72-T74 PolarHBondContact O-N 3.46Å; S72-T74 PolarHBondContact OG-O 3.06Å
73	A	49	Very low	76.7	Confident	116 Å²	116	85 Å²	85	96%	0.959	47%	0.471	S	S	*	.	S	Bend	trans	-53.5	-24.9	177.4	0	0	0	0	0	112.8	C71	C71-A73 PolarHBondContact O-N 3.19Å
74	T	55.7	Low	77.4	Confident	106 Å²	106	84 Å²	84	65%	0.65	47%	0.467	S	S	*	.	S	Bend	trans	-90.6	110.7	165.8	-41	0	0	0	0	108.9	S72 R76	S72-T74 CarbonylContact O-C 3.28Å; S72-T74 VanDerWaalsContact O-C 3.28Å; S72-T74 PolarHBondContact O-N 3.46Å; S72-T74 PolarHBondContact OG-O 3.06Å; T74-R76 PolarHBondContact O-N 2.63Å
75	S	62.3	Low	77.9	Confident	113 Å²	113	74.1 Å²	74.1	79%	0.79	43%	0.425	S	S	*	.			trans	-56.6	105.5	165.9	175.9	0	0	0	0	108.3	G77	S75-G77 PolarHBondContact O-N 3.4Å
76	R	74	Confident	78.3	Confident	117 Å²	117	72 Å²	72	44%	0.442	41%	0.414	S	S	.	.			trans	-74.5	112.8	173.2	-68.5	-176.9	-179.5	168.4	3.1	106.6	T74 P108	T74-R76 PolarHBondContact O-N 2.63Å; R76-P108 HydrophobicContact CB-CB 3.77Å; R76-P108 HydrophobicContact CB-CG 4.36Å; R76-P108 WeakPolarHBondContact O-CG 3.28Å
77	G	80.5	Confident	78.5	Confident	50 Å²	50	72.3 Å²	72.3	52%	0.515	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-61	150.9	172.4	0	0	0	0	0	111.2	S75	S75-G77 PolarHBondContact O-N 3.4Å
78	S	87.5	Confident	78.2	Confident	53 Å²	53	70.4 Å²	70.4	37%	0.371	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-55.1	149.4	171.3	48.6	0	0	0	0	110.9	L106	S78-L106 WeakPolarHBondContact CA-O 3.29Å; S78-L106 WeakPolarHBondContact CB-O 3.18Å
79	R	90.8	Very high	77.4	Confident	126 Å²	126	69.7 Å²	69.7	48%	0.475	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	148.6	171.4	-64.4	-59.6	-172	-179.7	-1.5	109	D105 L106 A112	R79-D105 CarbonylContact O-C 3.55Å; R79-D105 WeakPolarHBondContact O-CA 3.44Å; R79-L106 HydrophobicContact CB-CB 4.1Å; R79-L106 PolarHBondContact N-O 3.48Å; R79-L106 WeakPolarHBondContact O-CB 3.33Å; R79-L106 PolarHBondContact O-N 3.17Å; R79-A112 HydrophobicContact CG-CB 3.85Å
80	L	92.4	Very high	76.4	Confident	98 Å²	98	69.2 Å²	69.2	51%	0.513	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	141.3	178.3	-64.8	176.8	0	0	0	109.8	M103 I104 D105	L80-M103 HydrophobicContact CB-CE 3.76Å; L80-M103 HydrophobicContact CD1-CE 4.37Å; L80-I104 WeakPolarHBondContact CA-O 3.35Å; L80-D105 WeakPolarHBondContact CD2-OD1 3.42Å
81	T	93	Very high	75.2	Confident	13 Å²	13	70.5 Å²	70.5	8%	0.08	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	153.5	175.6	41	0	0	0	0	110.8	M103 I104 L106 H207 I214	T81-M103 CarbonylContact O-C 3.54Å; T81-M103 WeakPolarHBondContact O-CA 3.46Å; T81-I104 PolarHBondContact N-O 3.22Å; T81-I104 PolarHBondContact O-N 3.32Å; T81-I104 PolarHBondContact OG1-O 2.79Å; T81-L106 HydrophobicContact CG2-CD1 3.4Å; T81-L106 VanDerWaalsContact CG2-CD1 3.4Å; T81-L106 HydrophobicContact CG2-CG 4.16Å; T81-L106 WeakPolarHBondContact OG1-CG 3.29Å; T81-H207 WeakPolarHBondContact CG2-CD2 3.29Å; T81-H207 VanDerWaalsContact CG2-NE2 3.26Å; T81-H207 WeakPolarHBondContact CG2-NE2 2.97Å; T81-I214 HydrophobicContact CG2-CD1 4.31Å; T81-I214 WeakPolarHBondContact OG1-CD1 3.37Å
82	W	92.9	Very high	74.5	Confident	142 Å²	142	69 Å²	69	54%	0.538	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	138.1	176.1	-66	104.4	0	0	0	111	L100 M103	W82-L100 HydrophobicContact CB-CD2 3.77Å; W82-L100 HydrophobicContact CD2-CD1 4.4Å; W82-L100 HydrophobicContact CD2-CD2 4.14Å; W82-L100 HydrophobicContact CE3-CB 4.38Å; W82-L100 HydrophobicContact CE3-CD1 4.19Å; W82-L100 HydrophobicContact CE3-CD2 4.2Å; W82-L100 HydrophobicContact CG-CD2 3.97Å; W82-L100 HydrophobicContact CZ3-CD1 4.5Å; W82-M103 HydrophobicContact CB-SD 4.46Å; W82-M103 HydrophobicContact CD2-SD 3.31Å; W82-M103 HydrophobicContact CE3-CG 3.98Å; W82-M103 HydrophobicContact CE3-SD 3.22Å; W82-M103 HydrophobicContact CG-SD 3.9Å; W82-M103 HydrophobicContact CH2-CG 4.41Å; W82-M103 HydrophobicContact CH2-SD 3.89Å; W82-M103 HydrophobicContact CZ2-CE 4.47Å; W82-M103 HydrophobicContact CZ2-SD 3.98Å; W82-M103 HydrophobicContact CZ3-CG 3.87Å; W82-M103 HydrophobicContact CZ3-SD 3.53Å; W82-M103 VanDerWaalsContact CZ3-SD 3.53Å
83	L	92.4	Very high	73.6	Confident	1 Å²	1	72.2 Å²	72.2	1%	0.005	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	119.6	167	-179.5	52.8	0	0	0	109.1	I59 L101 G102 I104 I214 D216 L384	I59-L83 HydrophobicContact CB-CD2 4.49Å; I59-L83 HydrophobicContact CG2-CD2 4.27Å; L83-L101 HydrophobicContact CB-CB 4.44Å; L83-L101 HydrophobicContact CD2-CB 4.18Å; L83-L101 HydrophobicContact CD2-CD1 4.27Å; L83-L101 HydrophobicContact CG-CB 4.08Å; L83-L101 HydrophobicContact CG-CD1 4.17Å; L83-L101 PolarHBondContact O-N 3.44Å; L83-G102 PolarHBondContact N-O 2.79Å; L83-I104 HydrophobicContact CB-CD1 3.6Å; L83-I104 HydrophobicContact CB-CG1 4.06Å; L83-I104 HydrophobicContact CD1-CD1 3.52Å; L83-I104 HydrophobicContact CD2-CD1 3.95Å; L83-I104 HydrophobicContact CD2-CG1 4.42Å; L83-I104 HydrophobicContact CG-CD1 3.84Å; L83-I214 HydrophobicContact CD1-CG2 4.22Å; L83-D216 HydrophobicContact CD1-CB 3.98Å; L83-L384 HydrophobicContact CD2-CD1 4.48Å
84	E	91.2	Very high	73.4	Confident	15 Å²	15	71.1 Å²	71.1	7%	0.07	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	160.9	179.1	-64.7	-178	-154.5	0	0	112.3	S99 L100 H213 I214 V215 D216 R278 W280	E84-S99 CarbonylContact C-O 3.58Å; E84-S99 VanDerWaalsContact CA-O 3.25Å; E84-S99 WeakPolarHBondContact CA-O 3.35Å; E84-L100 HydrophobicContact CG-CD2 3.99Å; E84-H213 IonicContact OE1-CE1 2.72Å; E84-H213 IonicContact OE1-CG 3.11Å; E84-H213 IonicContact OE1-ND1 2.64Å; E84-H213 PolarHBondContact OE1-ND1 2.93Å; E84-I214 PolarHBondContact N-O 2.85Å; E84-V215 HydrophobicContact CB-CG2 4.31Å; E84-V215 CarbonylContact O-C 3.57Å; E84-V215 VanDerWaalsContact O-CA 3.29Å; E84-V215 WeakPolarHBondContact O-CA 2.86Å; E84-D216 PolarHBondContact O-N 3.36Å; E84-R278 WeakPolarHBondContact OE2-CD 3.39Å; E84-R278 IonicContact OE2-CZ 3.5Å; E84-R278 IonicContact OE2-NE 2.82Å; E84-R278 IonicContact OE2-NH1 3.57Å; E84-R278 PolarHBondContact OE2-NH1 2.92Å; E84-W280 VanDerWaalsContact OE2-CZ2 3.32Å; E84-W280 WeakPolarHBondContact OE2-CZ2 3.07Å
85	T	89.6	Confident	73.2	Confident	7 Å²	7	71.1 Å²	71.1	4%	0.043	40%	0.404	C	S	.	.			trans	-119.6	145.3	169.4	-170.1	0	0	0	0	111	K87 V89 S99 L101 R278	T85-K87 PolarHBondContact OG1-N 3.38Å; T85-V89 HydrophobicContact CG2-CG2 3.84Å; T85-S99 PolarHBondContact N-O 3.31Å; T85-L101 HydrophobicContact CG2-CD2 4.31Å; T85-L101 HydrophobicContact CG2-CG 4.35Å; T85-R278 PolarHBondContact O-NH1 3.01Å; T85-R278 PolarHBondContact O-NH2 3.14Å
86	L	88.1	Confident	72.8	Confident	3 Å²	3	71.4 Å²	71.4	2%	0.016	40%	0.397	C	S	.	.			trans	-92.5	-8.5	171.3	-67.5	-177.5	0	0	0	113.5	V215 F218 L220 Y270 L274 W280 I323	L86-V215 HydrophobicContact CD1-CG1 4.28Å; L86-V215 HydrophobicContact CG-CG1 3.83Å; L86-V215 HydrophobicContact CG-CG2 4.38Å; L86-F218 HydrophobicContact CD1-CD1 3.76Å; L86-L220 HydrophobicContact CB-CD2 4.2Å; L86-L220 HydrophobicContact CD1-CD2 4.05Å; L86-Y270 PolarHBondContact O-OH 3.27Å; L86-L274 HydrophobicContact CB-CD1 4.38Å; L86-L274 HydrophobicContact CD2-CD1 3.6Å; L86-L274 HydrophobicContact CD2-CD2 3.68Å; L86-L274 HydrophobicContact CD2-CG 4.32Å; L86-W280 HydrophobicContact CD2-CH2 3.72Å; L86-W280 HydrophobicContact CD2-CZ3 4.17Å; L86-I323 HydrophobicContact CD1-CD1 4.17Å
87	K	83.6	Confident	71.8	Confident	85 Å²	85	68.7 Å²	68.7	37%	0.37	40%	0.396	S	S	.	.	S	Bend	trans	-66.3	143.3	179.8	-64.7	171.5	-174.6	161.7	0	109.7	T85 V89 D217 M219	T85-K87 PolarHBondContact OG1-N 3.38Å; K87-V89 PolarHBondContact O-N 3.4Å; K87-V89 VanDerWaalsContact O-N 3.1Å; K87-D217 IonicContact NZ-OD2 3.07Å; K87-M219 HydrophobicContact CG-CB 4.26Å
88	P	73.3	Confident	70.8	Confident	66 Å²	66	68.2 Å²	68.2	43%	0.429	38%	0.38	S	S	.	.			trans	-65.7	113.5	173.2	27.3	-32.4	0	0	0	108.6	L220 Y270	P88-L220 VanDerWaalsContact CD-O 3.31Å; P88-L220 WeakPolarHBondContact CD-O 3.02Å; P88-Y270 WeakPolarHBondContact CD-OH 3.47Å
89	V	62.3	Low	70.1	Confident	51 Å²	51	66.9 Å²	66.9	31%	0.309	37%	0.37	S	S	.	.			trans	-87.3	125.9	173.4	179.4	0	0	0	0	107.8	T85 K87 V91 Q98	T85-V89 HydrophobicContact CG2-CG2 3.84Å; K87-V89 PolarHBondContact O-N 3.4Å; K87-V89 VanDerWaalsContact O-N 3.1Å; V89-V91 PolarHBondContact O-N 2.89Å; V89-Q98 HydrophobicContact CB-CB 4.04Å; V89-Q98 HydrophobicContact CG1-CB 3.87Å; V89-Q98 HydrophobicContact CG1-CG 4.35Å; V89-Q98 WeakPolarHBondContact CG2-O 3.32Å
90	G	54.9	Low	69.7	Low	20 Å²	20	64 Å²	64	21%	0.206	36%	0.364	C	S	.	.			trans	-54.7	137.3	-173.6	0	0	0	0	0	112.6	S92 Q98	G90-S92 VanDerWaalsContact C-N 3.28Å; G90-S92 PolarHBondContact O-N 2.9Å; G90-Q98 PolarHBondContact O-NE2 3.36Å
91	V	48.8	Very low	69.4	Low	126 Å²	126	61.6 Å²	61.6	76%	0.764	35%	0.352	S	S	*	.	S	Bend	trans	-64.4	69.9	-170.6	-171.6	0	0	0	0	113.2	V89	V89-V91 PolarHBondContact O-N 2.89Å
92	S	43.4	Very low	69.1	Low	95 Å²	95	61.3 Å²	61.3	66%	0.664	35%	0.351	S	S	*	.			trans	-128.6	-6.6	-176.4	-49.7	0	0	0	0	114.8	G90	G90-S92 VanDerWaalsContact C-N 3.28Å; G90-S92 PolarHBondContact O-N 2.9Å
93	K	40.4	Very low	69	Low	114 Å²	114	57.1 Å²	57.1	50%	0.496	34%	0.338	S	S	.	.	S	Bend	trans	-142.1	150.1	178.8	-61.9	177.1	-174	165.2	0	110.2	N56 Q98	N56-K93 PolarHBondContact OD1-NZ 3.17Å; K93-Q98 HydrophobicContact CB-CG 3.93Å; K93-Q98 WeakPolarHBondContact O-CG 3.25Å; K93-Q98 PolarHBondContact O-NE2 3.4Å; K93-Q98 PolarHBondContact O-OE1 3Å
94	S	45.1	Very low	69	Low	93 Å²	93	57.1 Å²	57.1	65%	0.65	34%	0.338	S	S	*	.			trans	-44.2	138.4	-175.5	51.1	0	0	0	0	113.9	N96 S97	S94-N96 PolarHBondContact O-N 3.46Å; S94-S97 PolarHBondContact O-N 3.14Å; S94-S97 PolarHBondContact O-OG 3.5Å
95	S	50.8	Low	69.1	Low	106 Å²	106	58.2 Å²	58.2	74%	0.741	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.8	-17.9	-160.5	58.9	0	0	0	0	119.1
96	N	53.1	Low	69.3	Low	119 Å²	119	57.9 Å²	57.9	64%	0.636	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-16.7	-176.9	-68.2	7.6	0	0	0	113.8	S94	S94-N96 PolarHBondContact O-N 3.46Å
97	S	54.1	Low	69.5	Low	60 Å²	60	57.9 Å²	57.9	42%	0.42	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-18.1	-175.6	61.2	0	0	0	0	113.4	S94	S94-S97 PolarHBondContact O-N 3.14Å; S94-S97 PolarHBondContact O-OG 3.5Å
98	Q	59.5	Low	69.9	Low	40 Å²	40	54.3 Å²	54.3	19%	0.187	33%	0.328	C	S	.	.	S	Bend	trans	-82.7	-21.6	-169.9	-62.3	-167.5	-51.7	0	0	113.9	V89 G90 K93	V89-Q98 HydrophobicContact CB-CB 4.04Å; V89-Q98 HydrophobicContact CG1-CB 3.87Å; V89-Q98 HydrophobicContact CG1-CG 4.35Å; V89-Q98 WeakPolarHBondContact CG2-O 3.32Å; G90-Q98 PolarHBondContact O-NE2 3.36Å; K93-Q98 HydrophobicContact CB-CG 3.93Å; K93-Q98 WeakPolarHBondContact O-CG 3.25Å; K93-Q98 PolarHBondContact O-NE2 3.4Å; K93-Q98 PolarHBondContact O-OE1 3Å
99	S	72.9	Confident	70.8	Confident	24 Å²	24	51.3 Å²	51.3	17%	0.168	31%	0.308	C	S	.	.	S	Bend	trans	-82.1	-17.8	-177.1	56	0	0	0	0	113.9	E84 T85	E84-S99 CarbonylContact C-O 3.58Å; E84-S99 VanDerWaalsContact CA-O 3.25Å; E84-S99 WeakPolarHBondContact CA-O 3.35Å; T85-S99 PolarHBondContact N-O 3.31Å
100	L	82.7	Confident	72.3	Confident	65 Å²	65	48.9 Å²	48.9	34%	0.34	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	113.1	-172.4	-57.4	170.1	0	0	0	109.7	W82 E84	W82-L100 HydrophobicContact CB-CD2 3.77Å; W82-L100 HydrophobicContact CD2-CD1 4.4Å; W82-L100 HydrophobicContact CD2-CD2 4.14Å; W82-L100 HydrophobicContact CE3-CB 4.38Å; W82-L100 HydrophobicContact CE3-CD1 4.19Å; W82-L100 HydrophobicContact CE3-CD2 4.2Å; W82-L100 HydrophobicContact CG-CD2 3.97Å; W82-L100 HydrophobicContact CZ3-CD1 4.5Å; E84-L100 HydrophobicContact CG-CD2 3.99Å
101	L	85.2	Confident	74.2	Confident	49 Å²	49	48.1 Å²	48.1	26%	0.257	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-35	176.2	-66.2	174.8	0	0	0	112	P58 I59 L83 T85 D216	P58-L101 WeakPolarHBondContact CA-O 3.44Å; I59-L101 HydrophobicContact CD1-CB 4.28Å; I59-L101 HydrophobicContact CD1-CD1 4.41Å; I59-L101 PolarHBondContact N-O 2.82Å; L83-L101 HydrophobicContact CB-CB 4.44Å; L83-L101 HydrophobicContact CD2-CB 4.18Å; L83-L101 HydrophobicContact CD2-CD1 4.27Å; L83-L101 HydrophobicContact CG-CB 4.08Å; L83-L101 HydrophobicContact CG-CD1 4.17Å; L83-L101 PolarHBondContact O-N 3.44Å; T85-L101 HydrophobicContact CG2-CD2 4.31Å; T85-L101 HydrophobicContact CG2-CG 4.35Å; L101-D216 HydrophobicContact CD1-CB 3.75Å
102	G	87.5	Confident	76.3	Confident	7 Å²	7	42.9 Å²	42.9	7%	0.072	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.1	-155.2	-175	0	0	0	0	0	113.8	I59 L83	I59-G102 WeakPolarHBondContact O-CA 3.18Å; L83-G102 PolarHBondContact N-O 2.79Å
103	M	90.6	Very high	78.6	Confident	54 Å²	54	40 Å²	40	27%	0.266	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	141.8	-177.2	-69	-70.6	-86.8	0	0	110.3	I59 L80 T81 W82	I59-M103 PolarHBondContact O-N 2.91Å; L80-M103 HydrophobicContact CB-CE 3.76Å; L80-M103 HydrophobicContact CD1-CE 4.37Å; T81-M103 CarbonylContact O-C 3.54Å; T81-M103 WeakPolarHBondContact O-CA 3.46Å; W82-M103 HydrophobicContact CB-SD 4.46Å; W82-M103 HydrophobicContact CD2-SD 3.31Å; W82-M103 HydrophobicContact CE3-CG 3.98Å; W82-M103 HydrophobicContact CE3-SD 3.22Å; W82-M103 HydrophobicContact CG-SD 3.9Å; W82-M103 HydrophobicContact CH2-CG 4.41Å; W82-M103 HydrophobicContact CH2-SD 3.89Å; W82-M103 HydrophobicContact CZ2-CE 4.47Å; W82-M103 HydrophobicContact CZ2-SD 3.98Å; W82-M103 HydrophobicContact CZ3-CG 3.87Å; W82-M103 HydrophobicContact CZ3-SD 3.53Å; W82-M103 VanDerWaalsContact CZ3-SD 3.53Å
104	I	92.3	Very high	81.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	138.3	179.2	-69.5	161.9	0	0	0	110.3	T61 L80 T81 L83 I214 L387	T61-I104 WeakPolarHBondContact OG1-CG1 3.49Å; L80-I104 WeakPolarHBondContact CA-O 3.35Å; T81-I104 PolarHBondContact N-O 3.22Å; T81-I104 PolarHBondContact O-N 3.32Å; T81-I104 PolarHBondContact OG1-O 2.79Å; L83-I104 HydrophobicContact CB-CD1 3.6Å; L83-I104 HydrophobicContact CB-CG1 4.06Å; L83-I104 HydrophobicContact CD1-CD1 3.52Å; L83-I104 HydrophobicContact CD2-CD1 3.95Å; L83-I104 HydrophobicContact CD2-CG1 4.42Å; L83-I104 HydrophobicContact CG-CD1 3.84Å; I104-I214 HydrophobicContact CD1-CG2 3.76Å; I104-L387 HydrophobicContact CG2-CD2 4.34Å
105	D	92.8	Very high	83.5	Confident	39 Å²	39	40.6 Å²	40.6	21%	0.209	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	128.7	168.5	-61	-20.4	0	0	0	110.7	L65 R79 L80	L65-D105 HydrophobicContact CD1-CB 4.14Å; R79-D105 CarbonylContact O-C 3.55Å; R79-D105 WeakPolarHBondContact O-CA 3.44Å; L80-D105 WeakPolarHBondContact CD2-OD1 3.42Å
106	L	93.3	Very high	85.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	142.8	175.5	-70.7	-172.5	0	0	0	111.3	S78 R79 T81 F111 L212 I214 L387	S78-L106 WeakPolarHBondContact CA-O 3.29Å; S78-L106 WeakPolarHBondContact CB-O 3.18Å; R79-L106 HydrophobicContact CB-CB 4.1Å; R79-L106 PolarHBondContact N-O 3.48Å; R79-L106 WeakPolarHBondContact O-CB 3.33Å; R79-L106 PolarHBondContact O-N 3.17Å; T81-L106 HydrophobicContact CG2-CD1 3.4Å; T81-L106 VanDerWaalsContact CG2-CD1 3.4Å; T81-L106 HydrophobicContact CG2-CG 4.16Å; T81-L106 WeakPolarHBondContact OG1-CG 3.29Å; L106-F111 HydrophobicContact CB-CB 4.25Å; L106-F111 HydrophobicContact CB-CD2 3.67Å; L106-F111 HydrophobicContact CB-CE2 4.27Å; L106-F111 HydrophobicContact CB-CG 4.13Å; L106-F111 HydrophobicContact CD1-CB 4.09Å; L106-F111 HydrophobicContact CD1-CD1 3.96Å; L106-F111 HydrophobicContact CD1-CD2 3.86Å; L106-F111 HydrophobicContact CD1-CE1 4.33Å; L106-F111 HydrophobicContact CD1-CE2 4.22Å; L106-F111 HydrophobicContact CD1-CG 3.7Å; L106-F111 HydrophobicContact CD1-CZ 4.43Å; L106-F111 HydrophobicContact CD2-CD2 4.03Å; L106-F111 HydrophobicContact CD2-CE2 3.78Å; L106-F111 HydrophobicContact CD2-CZ 4.25Å; L106-F111 HydrophobicContact CG-CD2 4.09Å; L106-F111 HydrophobicContact CG-CE2 4.33Å; L106-F111 HydrophobicContact CG-CG 4.41Å; L106-L212 HydrophobicContact CD1-CD2 4.3Å; L106-I214 HydrophobicContact CD1-CD1 4.32Å; L106-I214 HydrophobicContact CD2-CD1 3.7Å; L106-I214 HydrophobicContact CG-CD1 4.28Å; L106-L387 HydrophobicContact CD2-CD1 3.87Å; L106-L387 HydrophobicContact CD2-CD2 3.71Å; L106-L387 HydrophobicContact CD2-CG 4.32Å
107	H	92.8	Very high	87.8	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.009	22%	0.217	C	C	.	.			trans	-64.5	127	179.8	-165.8	-89.2	0	0	0	112.4	Q66 D109 I110 F111 E391 I395	Q66-H107 PolarHBondContact O-CD2 3.36Å; Q66-H107 PolarHBondContact O-NE2 3.1Å; Q66-H107 VanDerWaalsContact O-NE2 3.15Å; H107-D109 VanDerWaalsContact CE1-CB 3.47Å; H107-D109 WeakPolarHBondContact CE1-CB 3.46Å; H107-D109 IonicContact CE1-OD2 3.7Å; H107-D109 PolarHBondContact ND1-N 3.2Å; H107-D109 VanDerWaalsContact ND1-N 3.16Å; H107-D109 PolarHBondContact O-N 2.95Å; H107-I110 HydrophobicContact CB-CD1 4.21Å; H107-I110 HydrophobicContact CB-CG1 4.47Å; H107-I110 PolarHBondContact O-N 3.3Å; H107-F111 PolarHBondContact O-N 2.81Å; H107-E391 PolarHBondContact N-OE1 3.46Å; H107-I395 HydrophobicContact CB-CD1 4.42Å; H107-I395 VanDerWaalsContact CD2-CD1 3.49Å; H107-I395 WeakPolarHBondContact CD2-CD1 3.45Å
108	P	92.1	Very high	89.9	Confident	10 Å²	10	42.2 Å²	42.2	7%	0.065	22%	0.216	C	C	.	.	H	α-helix	trans	-66.6	-33.5	-175	25.9	-33.9	0	0	0	113.3	R76 I110 A112	R76-P108 HydrophobicContact CB-CB 3.77Å; R76-P108 HydrophobicContact CB-CG 4.36Å; R76-P108 WeakPolarHBondContact O-CG 3.28Å; P108-I110 PolarHBondContact O-N 2.9Å; P108-A112 HydrophobicContact CB-CB 4.24Å; P108-A112 CarbonylContact O-C 3.42Å; P108-A112 VanDerWaalsContact O-CA 3.24Å; P108-A112 WeakPolarHBondContact O-CA 3.17Å; P108-A112 WeakPolarHBondContact O-CB 3.36Å; P108-A112 PolarHBondContact O-N 2.93Å
109	D	91.5	Very high	91.7	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-72.6	-7.5	179.1	-62	-18.5	0	0	0	113.4	P68 V69 H107 V113 Q398	P68-D109 WeakPolarHBondContact CA-OD2 3.39Å; P68-D109 WeakPolarHBondContact CB-OD2 3.11Å; V69-D109 PolarHBondContact N-OD2 3.49Å; H107-D109 VanDerWaalsContact CE1-CB 3.47Å; H107-D109 WeakPolarHBondContact CE1-CB 3.46Å; H107-D109 IonicContact CE1-OD2 3.7Å; H107-D109 PolarHBondContact ND1-N 3.2Å; H107-D109 VanDerWaalsContact ND1-N 3.16Å; H107-D109 PolarHBondContact O-N 2.95Å; D109-V113 WeakPolarHBondContact O-CG2 3.45Å; D109-Q398 PolarHBondContact O-NE2 3.43Å
110	I	94.2	Very high	92.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-105.6	-50.8	177.2	-62.6	172.4	0	0	0	110.5	H107 P108 L200 L203 S204 L390 E391 L394 I395	H107-I110 HydrophobicContact CB-CD1 4.21Å; H107-I110 HydrophobicContact CB-CG1 4.47Å; H107-I110 PolarHBondContact O-N 3.3Å; P108-I110 PolarHBondContact O-N 2.9Å; I110-L200 HydrophobicContact CB-CD2 4.22Å; I110-L200 HydrophobicContact CG1-CD2 4.01Å; I110-L200 HydrophobicContact CG2-CD2 4.13Å; I110-L203 HydrophobicContact CG2-CD1 3.8Å; I110-S204 PolarHBondContact O-OG 2.9Å; I110-L390 HydrophobicContact CG2-CD2 4.38Å; I110-E391 HydrophobicContact CD1-CB 3.96Å; I110-E391 HydrophobicContact CD1-CG 3.88Å; I110-L394 HydrophobicContact CD1-CB 3.79Å; I110-L394 HydrophobicContact CD1-CD1 4.31Å; I110-L394 HydrophobicContact CG1-CB 4.14Å; I110-L394 HydrophobicContact CG1-CD1 4.4Å; I110-L394 HydrophobicContact CG2-CD1 3.85Å; I110-I395 HydrophobicContact CD1-CD1 4.42Å; I110-I395 HydrophobicContact CD1-CG1 4.04Å
111	F	94.9	Very high	93.6	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.018	22%	0.215	C	C	.	.	H	α-helix	trans	-102.2	-6	-171.1	-63.2	-80.1	0	0	0	114.2	L106 H107 L203 S204 H207 L212 L387 E391	L106-F111 HydrophobicContact CB-CB 4.25Å; L106-F111 HydrophobicContact CB-CD2 3.67Å; L106-F111 HydrophobicContact CB-CE2 4.27Å; L106-F111 HydrophobicContact CB-CG 4.13Å; L106-F111 HydrophobicContact CD1-CB 4.09Å; L106-F111 HydrophobicContact CD1-CD1 3.96Å; L106-F111 HydrophobicContact CD1-CD2 3.86Å; L106-F111 HydrophobicContact CD1-CE1 4.33Å; L106-F111 HydrophobicContact CD1-CE2 4.22Å; L106-F111 HydrophobicContact CD1-CG 3.7Å; L106-F111 HydrophobicContact CD1-CZ 4.43Å; L106-F111 HydrophobicContact CD2-CD2 4.03Å; L106-F111 HydrophobicContact CD2-CE2 3.78Å; L106-F111 HydrophobicContact CD2-CZ 4.25Å; L106-F111 HydrophobicContact CG-CD2 4.09Å; L106-F111 HydrophobicContact CG-CE2 4.33Å; L106-F111 HydrophobicContact CG-CG 4.41Å; H107-F111 PolarHBondContact O-N 2.81Å; F111-L203 HydrophobicContact CD1-CB 4.29Å; F111-L203 HydrophobicContact CE1-CB 4.21Å; F111-L203 HydrophobicContact CE1-CD2 4.15Å; F111-S204 VanDerWaalsContact C-OG 3.23Å; F111-S204 PolarHBondContact O-OG 3.43Å; F111-H207 HydrophobicContact CD1-CB 4.26Å; F111-L212 HydrophobicContact CD1-CD2 3.74Å; F111-L212 HydrophobicContact CE1-CD2 3.44Å; F111-L212 VanDerWaalsContact CE1-CD2 3.44Å; F111-L212 HydrophobicContact CZ-CD2 4.4Å; F111-L387 HydrophobicContact CE2-CD1 3.88Å; F111-L387 HydrophobicContact CZ-CD1 3.62Å; F111-E391 HydrophobicContact CE2-CG 4.26Å
112	A	92.7	Very high	94.2	Very high	17 Å²	17	44.2 Å²	44.2	14%	0.14	22%	0.219	C	C	.	.	S	Bend	trans	-119	26.9	175.9	0	0	0	0	0	112.9	R79 P108	R79-A112 HydrophobicContact CG-CB 3.85Å; P108-A112 HydrophobicContact CB-CB 4.24Å; P108-A112 CarbonylContact O-C 3.42Å; P108-A112 VanDerWaalsContact O-CA 3.24Å; P108-A112 WeakPolarHBondContact O-CA 3.17Å; P108-A112 WeakPolarHBondContact O-CB 3.36Å; P108-A112 PolarHBondContact O-N 2.93Å
113	V	92.4	Very high	94.6	Very high	35 Å²	35	44 Å²	44	21%	0.212	22%	0.216	C	C	.	.	S	Bend	trans	-75.5	142.7	173.4	-177.7	0	0	0	0	109.5	D109 L200 S204	D109-V113 WeakPolarHBondContact O-CG2 3.45Å; V113-L200 HydrophobicContact CG2-CB 4.23Å; V113-S204 PolarHBondContact N-OG 3.41Å; V113-S204 WeakPolarHBondContact O-CB 3.17Å; V113-S204 PolarHBondContact O-OG 2.97Å
114	F	93.2	Very high	94.9	Very high	159 Å²	159	43.5 Å²	43.5	70%	0.697	22%	0.215	S	C	*	.			trans	-61.9	124.4	174.6	-178.3	-97.3	0	0	0	110.1	R116	F114-R116 HydrophobicContact CD1-CG 4.15Å; F114-R116 PolarHBondContact O-N 2.85Å
115	P	94.2	Very high	95.2	Very high	60 Å²	60	49 Å²	49	39%	0.39	24%	0.236	S	C	.	.			trans	-71.6	104.1	-170.4	28.4	-35.7	0	0	0	111.9	I117 I205	P115-I117 PolarHBondContact O-N 3.01Å; P115-I205 HydrophobicContact CB-CD1 3.95Å; P115-I205 HydrophobicContact CB-CG1 3.47Å; P115-I205 VanDerWaalsContact CB-CG1 3.47Å
116	R	96.7	Very high	95.4	Very high	116 Å²	116	48.2 Å²	48.2	44%	0.438	23%	0.23	S	C	.	.			trans	-94.7	92	179.7	-78	-169.8	65.7	176.5	0.1	112.3	F114 D118 L119 V120 S201	F114-R116 HydrophobicContact CD1-CG 4.15Å; F114-R116 PolarHBondContact O-N 2.85Å; R116-D118 VanDerWaalsContact CB-OD1 3.26Å; R116-D118 WeakPolarHBondContact CB-OD1 3.46Å; R116-D118 IonicContact CZ-OD2 3.57Å; R116-D118 IonicContact NE-OD1 3.03Å; R116-D118 PolarHBondContact NE-OD1 3.34Å; R116-D118 IonicContact NE-OD2 3.5Å; R116-D118 PolarHBondContact NE-OD2 3.2Å; R116-D118 IonicContact NH2-OD2 2.77Å; R116-D118 PolarHBondContact NH2-OD2 2.97Å; R116-D118 PolarHBondContact O-N 3.18Å; R116-L119 HydrophobicContact CB-CB 4.3Å; R116-L119 HydrophobicContact CB-CD1 4.05Å; R116-L119 HydrophobicContact CB-CG 4.13Å; R116-L119 PolarHBondContact O-N 2.91Å; R116-V120 PolarHBondContact O-N 3.3Å; R116-S201 PolarHBondContact N-OG 2.97Å
117	I	97.1	Very high	95.5	Very high	126 Å²	126	49.4 Å²	49.4	65%	0.646	24%	0.236	S	C	*	.	H	α-helix	trans	-62.2	-31.8	-177.7	-55.6	172.2	0	0	0	111.9	P115 L119 V120 H121	P115-I117 PolarHBondContact O-N 3.01Å; I117-L119 VanDerWaalsContact C-N 3.35Å; I117-L119 PolarHBondContact O-N 3.07Å; I117-V120 PolarHBondContact O-N 2.99Å; I117-H121 WeakPolarHBondContact O-CB 3.47Å; I117-H121 PolarHBondContact O-N 3.32Å
118	D	98.3	Very high	95.6	Very high	77 Å²	77	50.8 Å²	50.8	41%	0.412	25%	0.248	S	C	.	.	H	α-helix	trans	-57.8	-45	174.9	60.2	-44.1	0	0	0	112.1	R116 H121 K122	R116-D118 VanDerWaalsContact CB-OD1 3.26Å; R116-D118 WeakPolarHBondContact CB-OD1 3.46Å; R116-D118 IonicContact CZ-OD2 3.57Å; R116-D118 IonicContact NE-OD1 3.03Å; R116-D118 PolarHBondContact NE-OD1 3.34Å; R116-D118 IonicContact NE-OD2 3.5Å; R116-D118 PolarHBondContact NE-OD2 3.2Å; R116-D118 IonicContact NH2-OD2 2.77Å; R116-D118 PolarHBondContact NH2-OD2 2.97Å; R116-D118 PolarHBondContact O-N 3.18Å; D118-H121 PolarHBondContact O-N 3.35Å; D118-K122 WeakPolarHBondContact O-CG 3.46Å; D118-K122 PolarHBondContact O-N 2.87Å
119	L	97.2	Very high	95.8	Very high	7 Å²	7	52.6 Å²	52.6	4%	0.037	26%	0.255	C	S	.	.	H	α-helix	trans	-73.7	-35.1	178.9	-62.9	-177	0	0	0	112.3	R116 I117 H121 K122 N123 A197	R116-L119 HydrophobicContact CB-CB 4.3Å; R116-L119 HydrophobicContact CB-CD1 4.05Å; R116-L119 HydrophobicContact CB-CG 4.13Å; R116-L119 PolarHBondContact O-N 2.91Å; I117-L119 VanDerWaalsContact C-N 3.35Å; I117-L119 PolarHBondContact O-N 3.07Å; L119-H121 VanDerWaalsContact C-N 3.35Å; L119-K122 HydrophobicContact CD2-CD 4.21Å; L119-K122 PolarHBondContact O-N 3.4Å; L119-N123 PolarHBondContact O-N 3.07Å; L119-N123 PolarHBondContact O-ND2 3.14Å; L119-A197 HydrophobicContact CD1-CB 3.5Å
120	V	97.7	Very high	95.9	Very high	14 Å²	14	54.2 Å²	54.2	9%	0.085	26%	0.262	C	S	.	.	H	α-helix	trans	-60.4	-47.4	172.1	175.4	0	0	0	0	109.9	R116 I117 N123 L124 M202 I205 V371 V375	R116-V120 PolarHBondContact O-N 3.3Å; I117-V120 PolarHBondContact O-N 2.99Å; V120-N123 PolarHBondContact O-N 2.66Å; V120-L124 WeakPolarHBondContact O-CB 2.86Å; V120-L124 PolarHBondContact O-N 3.41Å; V120-M202 HydrophobicContact CG1-SD 4.04Å; V120-M202 HydrophobicContact CG2-CB 4.45Å; V120-I205 HydrophobicContact CG2-CD1 4.23Å; V120-V371 HydrophobicContact CG1-CG1 3.85Å; V120-V375 HydrophobicContact CG1-CG2 4.31Å
121	H	98.2	Very high	95.8	Very high	119 Å²	119	60.2 Å²	60.2	55%	0.551	28%	0.284	S	S	*	.	H	α-helix	trans	-62.8	-43.5	177.8	177.8	-98.6	0	0	0	112.6	I117 D118 L119 N123 L124 Y125	I117-H121 WeakPolarHBondContact O-CB 3.47Å; I117-H121 PolarHBondContact O-N 3.32Å; D118-H121 PolarHBondContact O-N 3.35Å; L119-H121 VanDerWaalsContact C-N 3.35Å; H121-N123 VanDerWaalsContact C-N 3.31Å; H121-N123 PolarHBondContact O-N 3.38Å; H121-L124 PolarHBondContact O-N 2.84Å; H121-Y125 WeakPolarHBondContact O-CB 3.49Å; H121-Y125 PolarHBondContact O-N 2.93Å
122	K	97.6	Very high	95.7	Very high	79 Å²	79	64 Å²	64	34%	0.343	30%	0.304	S	S	.	.	H	α-helix	trans	-56.9	-44.3	174.3	-78.7	-177.2	173.5	-172.9	0	112	D118 L119 W126 L190 E194	D118-K122 WeakPolarHBondContact O-CG 3.46Å; D118-K122 PolarHBondContact O-N 2.87Å; L119-K122 HydrophobicContact CD2-CD 4.21Å; L119-K122 PolarHBondContact O-N 3.4Å; K122-W126 VanDerWaalsContact O-CB 3.27Å; K122-W126 WeakPolarHBondContact O-CB 3.48Å; K122-W126 PolarHBondContact O-N 2.94Å; K122-L190 HydrophobicContact CB-CD2 4.4Å; K122-E194 WeakPolarHBondContact CD-OE2 3.38Å; K122-E194 IonicContact NZ-OE1 2.79Å; K122-E194 PolarHBondContact NZ-OE1 2.96Å; K122-E194 IonicContact NZ-OE2 2.79Å; K122-E194 PolarHBondContact NZ-OE2 3.25Å
123	N	97.5	Very high	95.9	Very high	2 Å²	2	67.4 Å²	67.4	1%	0.011	32%	0.319	C	S	.	.	H	α-helix	trans	-65.6	-43.8	177.8	-85.4	-70	0	0	0	112.3	L119 V120 H121 W126 Q127 E194 R195 G198 V371	L119-N123 PolarHBondContact O-N 3.07Å; L119-N123 PolarHBondContact O-ND2 3.14Å; V120-N123 PolarHBondContact O-N 2.66Å; H121-N123 VanDerWaalsContact C-N 3.31Å; H121-N123 PolarHBondContact O-N 3.38Å; N123-W126 PolarHBondContact O-N 3.35Å; N123-Q127 WeakPolarHBondContact O-CB 3.49Å; N123-Q127 VanDerWaalsContact O-CG 3.25Å; N123-Q127 WeakPolarHBondContact O-CG 3.43Å; N123-Q127 PolarHBondContact O-N 3.07Å; N123-E194 PolarHBondContact ND2-O 3.25Å; N123-R195 VanDerWaalsContact OD1-CA 3.3Å; N123-R195 WeakPolarHBondContact OD1-CA 3.38Å; N123-G198 WeakPolarHBondContact ND2-CA 3.44Å; N123-V371 HydrophobicContact CB-CB 4.26Å; N123-V371 HydrophobicContact CB-CG1 4.37Å; N123-V371 HydrophobicContact CB-CG2 4.1Å
124	L	97	Very high	95.9	Very high	44 Å²	44	66.8 Å²	66.8	23%	0.23	32%	0.315	C	S	.	.	H	α-helix	trans	-59.9	-48.9	176.8	-170.3	77.8	0	0	0	111.1	V120 H121 Q127 A128 W372 V375	V120-L124 WeakPolarHBondContact O-CB 2.86Å; V120-L124 PolarHBondContact O-N 3.41Å; H121-L124 PolarHBondContact O-N 2.84Å; L124-Q127 PolarHBondContact O-N 3.45Å; L124-A128 WeakPolarHBondContact O-CB 3.36Å; L124-A128 PolarHBondContact O-N 3.14Å; L124-W372 HydrophobicContact CD1-CB 4.37Å; L124-W372 HydrophobicContact CD1-CD2 4.02Å; L124-W372 HydrophobicContact CD1-CE3 3.31Å; L124-W372 HydrophobicContact CD1-CG 4.5Å; L124-W372 HydrophobicContact CD1-CZ3 3.77Å; L124-W372 HydrophobicContact CG-CE3 3.85Å; L124-W372 HydrophobicContact CG-CZ3 3.9Å; L124-V375 HydrophobicContact CD1-CB 4.45Å
125	Y	97	Very high	96	Very high	116 Å²	116	67.5 Å²	67.5	46%	0.455	31%	0.313	S	S	.	.	H	α-helix	trans	-62.8	-44.6	178.5	-177.2	-88.3	0	0	0	111.7	H121 A128 H129 Y188	H121-Y125 WeakPolarHBondContact O-CB 3.49Å; H121-Y125 PolarHBondContact O-N 2.93Å; Y125-A128 PolarHBondContact O-N 3.36Å; Y125-H129 AromaticContact CD1-ND1 3.98Å; Y125-H129 AromaticContact CD2-CE1 3.6Å; Y125-H129 AromaticContact CD2-ND1 3.76Å; Y125-H129 AromaticContact CE1-ND1 3.88Å; Y125-H129 AromaticContact CE2-CE1 3.26Å; Y125-H129 WeakPolarHBondContact CE2-CE1 3.3Å; Y125-H129 AromaticContact CE2-ND1 3.65Å; Y125-H129 AromaticContact CE2-NE2 3.87Å; Y125-H129 AromaticContact CG-ND1 3.92Å; Y125-H129 AromaticContact CZ-CE1 3.64Å; Y125-H129 AromaticContact CZ-ND1 3.71Å; Y125-H129 AromaticContact CZ-NE2 3.98Å; Y125-H129 PolarHBondContact O-N 3.5Å; Y125-H129 VanDerWaalsContact O-N 3.14Å; Y125-H129 PolarHBondContact O-ND1 3.27Å; Y125-Y188 WeakPolarHBondContact CD1-OH 3.25Å; Y125-Y188 HydrophobicContact CE1-CE1 4.39Å
126	W	97.7	Very high	96	Very high	22 Å²	22	72.6 Å²	72.6	8%	0.083	32%	0.324	C	S	.	.	H	α-helix	trans	-58.3	-50.7	175	171.3	64.3	0	0	0	111	K122 N123 A128 H129 Y130 Y188 L189 L190 R195	K122-W126 VanDerWaalsContact O-CB 3.27Å; K122-W126 WeakPolarHBondContact O-CB 3.48Å; K122-W126 PolarHBondContact O-N 2.94Å; N123-W126 PolarHBondContact O-N 3.35Å; W126-A128 VanDerWaalsContact C-N 3.28Å; W126-A128 PolarHBondContact O-N 3.43Å; W126-H129 PolarHBondContact O-N 2.99Å; W126-H129 VanDerWaalsContact O-N 3.12Å; W126-Y130 HydrophobicContact CZ2-CG 4.49Å; W126-Y130 WeakPolarHBondContact O-CB 3.48Å; W126-Y130 WeakPolarHBondContact O-CD1 3.29Å; W126-Y130 PolarHBondContact O-N 3.11Å; W126-Y188 WeakPolarHBondContact CA-OH 3.33Å; W126-Y188 HydrophobicContact CB-CE2 4.43Å; W126-Y188 WeakPolarHBondContact CB-OH 3.34Å; W126-Y188 AromaticContact CD1-CE2 3.77Å; W126-Y188 AromaticContact CD1-CZ 3.8Å; W126-Y188 VanDerWaalsContact CD1-O 3.28Å; W126-Y188 HydrophobicContact CG-CE2 4.44Å; W126-Y188 PolarHBondContact NE1-O 3.36Å; W126-L189 HydrophobicContact CZ2-CD1 4.1Å; W126-L190 HydrophobicContact CB-CB 4.4Å; W126-L190 HydrophobicContact CB-CD2 4.4Å; W126-L190 HydrophobicContact CD2-CB 4Å; W126-L190 HydrophobicContact CG-CB 3.89Å; W126-R195 HydrophobicContact CE3-CG 4.23Å; W126-R195 VanDerWaalsContact CH2-CD 3.46Å; W126-R195 HydrophobicContact CH2-CG 4.48Å; W126-R195 VanDerWaalsContact CZ3-CD 3.49Å; W126-R195 HydrophobicContact CZ3-CG 4.04Å
127	Q	95.8	Very high	95.8	Very high	26 Å²	26	70.6 Å²	70.6	12%	0.121	33%	0.327	C	S	.	.	H	α-helix	trans	-61.2	-34	-179.7	-75	175.9	-6.1	0	0	113.1	N123 L124 Y130 W372	N123-Q127 WeakPolarHBondContact O-CB 3.49Å; N123-Q127 VanDerWaalsContact O-CG 3.25Å; N123-Q127 WeakPolarHBondContact O-CG 3.43Å; N123-Q127 PolarHBondContact O-N 3.07Å; L124-Q127 PolarHBondContact O-N 3.45Å; Q127-Y130 WeakPolarHBondContact O-CD1 3.34Å; Q127-Y130 WeakPolarHBondContact O-CE1 3.3Å; Q127-W372 HydrophobicContact CB-CB 4.43Å; Q127-W372 HydrophobicContact CB-CE3 4.45Å
128	A	95.2	Very high	95.6	Very high	31 Å²	31	66.8 Å²	66.8	26%	0.256	31%	0.308	S	S	.	.	H	α-helix	trans	-67.4	-40.1	174.3	0	0	0	0	0	113	L124 Y125 W126 L132 W372	L124-A128 WeakPolarHBondContact O-CB 3.36Å; L124-A128 PolarHBondContact O-N 3.14Å; Y125-A128 PolarHBondContact O-N 3.36Å; W126-A128 VanDerWaalsContact C-N 3.28Å; W126-A128 PolarHBondContact O-N 3.43Å; A128-L132 WeakPolarHBondContact O-CD1 3.33Å; A128-L132 VanDerWaalsContact O-CG 3.29Å; A128-L132 WeakPolarHBondContact O-CG 3.31Å; A128-W372 HydrophobicContact CB-CE3 4.41Å; A128-W372 HydrophobicContact CB-CH2 4.09Å; A128-W372 HydrophobicContact CB-CZ3 3.63Å
129	H	95.6	Very high	95.3	Very high	47 Å²	47	66.6 Å²	66.6	22%	0.218	31%	0.309	C	S	.	.	H	α-helix	trans	-100	-31.1	-166.4	-69.9	81.4	0	0	0	114.9	Y125 W126 R131 L132 F186	Y125-H129 AromaticContact CD1-ND1 3.98Å; Y125-H129 AromaticContact CD2-CE1 3.6Å; Y125-H129 AromaticContact CD2-ND1 3.76Å; Y125-H129 AromaticContact CE1-ND1 3.88Å; Y125-H129 AromaticContact CE2-CE1 3.26Å; Y125-H129 WeakPolarHBondContact CE2-CE1 3.3Å; Y125-H129 AromaticContact CE2-ND1 3.65Å; Y125-H129 AromaticContact CE2-NE2 3.87Å; Y125-H129 AromaticContact CG-ND1 3.92Å; Y125-H129 AromaticContact CZ-CE1 3.64Å; Y125-H129 AromaticContact CZ-ND1 3.71Å; Y125-H129 AromaticContact CZ-NE2 3.98Å; Y125-H129 PolarHBondContact O-N 3.5Å; Y125-H129 VanDerWaalsContact O-N 3.14Å; Y125-H129 PolarHBondContact O-ND1 3.27Å; W126-H129 PolarHBondContact O-N 2.99Å; W126-H129 VanDerWaalsContact O-N 3.12Å; H129-R131 PolarHBondContact O-N 3.46Å; H129-L132 HydrophobicContact CB-CD1 4.48Å; H129-L132 WeakPolarHBondContact O-CB 3.29Å; H129-L132 PolarHBondContact O-N 3.05Å; H129-F186 HydrophobicContact CB-CB 4.37Å
130	Y	94.4	Very high	95.2	Very high	38 Å²	38	67.9 Å²	67.9	15%	0.149	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.9	-169.1	83.4	-78.1	0	0	0	114.4	V2 W126 Q127 Y187	V2-Y130 HydrophobicContact CG2-CE2 4.4Å; V2-Y130 VanDerWaalsContact CG2-OH 3.24Å; V2-Y130 WeakPolarHBondContact CG2-OH 2.89Å; W126-Y130 HydrophobicContact CZ2-CG 4.49Å; W126-Y130 WeakPolarHBondContact O-CB 3.48Å; W126-Y130 WeakPolarHBondContact O-CD1 3.29Å; W126-Y130 PolarHBondContact O-N 3.11Å; Q127-Y130 WeakPolarHBondContact O-CD1 3.34Å; Q127-Y130 WeakPolarHBondContact O-CE1 3.3Å; Y130-Y187 WeakPolarHBondContact O-CD2 3.46Å
131	R	91.5	Very high	95	Very high	126 Å²	126	72.7 Å²	72.7	48%	0.475	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-9.3	177.7	-55.4	168.9	-167	174.2	-7.1	113.1	V2 H129	V2-R131 HydrophobicContact CG2-CG 4.23Å; H129-R131 PolarHBondContact O-N 3.46Å
132	L	93.2	Very high	94.8	Very high	84 Å²	84	70.2 Å²	70.2	44%	0.44	33%	0.334	S	S	.	.			trans	-76.2	132.2	-172.3	-64	179.6	0	0	0	111.1	A128 H129 F186	A128-L132 WeakPolarHBondContact O-CD1 3.33Å; A128-L132 VanDerWaalsContact O-CG 3.29Å; A128-L132 WeakPolarHBondContact O-CG 3.31Å; H129-L132 HydrophobicContact CB-CD1 4.48Å; H129-L132 WeakPolarHBondContact O-CB 3.29Å; H129-L132 PolarHBondContact O-N 3.05Å; L132-F186 HydrophobicContact CB-CB 4.42Å; L132-F186 HydrophobicContact CB-CD2 4.05Å; L132-F186 PolarHBondContact O-N 3.42Å
133	I	95.3	Very high	94.6	Very high	87 Å²	87	70.5 Å²	70.5	45%	0.446	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	119.2	171.7	-57.8	172.7	0	0	0	106.8	W135 P183 E184	I133-W135 HydrophobicContact CB-CZ2 4.32Å; I133-W135 HydrophobicContact CD1-CZ2 4.34Å; I133-W135 HydrophobicContact CG2-CD2 4.15Å; I133-W135 HydrophobicContact CG2-CH2 4.28Å; I133-W135 HydrophobicContact CG2-CZ2 3.71Å; I133-P183 HydrophobicContact CG2-CB 4.1Å; I133-E184 WeakPolarHBondContact CA-O 3.49Å
134	D	92.9	Very high	94.3	Very high	23 Å²	23	70.7 Å²	70.7	12%	0.123	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	115.1	174.4	-172	1.9	0	0	0	110.5	R136 P183 E184 F186	D134-R136 VanDerWaalsContact CG-NE 3.29Å; D134-R136 VanDerWaalsContact OD1-CB 3.28Å; D134-R136 WeakPolarHBondContact OD1-CB 3.34Å; D134-R136 VanDerWaalsContact OD1-CG 3.25Å; D134-R136 WeakPolarHBondContact OD1-CG 3.31Å; D134-R136 IonicContact OD1-CZ 3.59Å; D134-R136 PolarHBondContact OD1-N 3Å; D134-R136 IonicContact OD1-NE 2.78Å; D134-R136 PolarHBondContact OD1-NE 3.39Å; D134-R136 IonicContact OD1-NH2 3.36Å; D134-R136 IonicContact OD2-CZ 3.71Å; D134-R136 IonicContact OD2-NE 3.5Å; D134-R136 PolarHBondContact OD2-NE 3Å; D134-R136 IonicContact OD2-NH2 3.8Å; D134-R136 PolarHBondContact OD2-NH2 2.97Å; D134-P183 VanDerWaalsContact O-CA 3.3Å; D134-P183 WeakPolarHBondContact O-CA 3.24Å; D134-E184 HydrophobicContact CB-CB 4.48Å; D134-E184 PolarHBondContact N-O 3.24Å; D134-E184 PolarHBondContact O-N 3.47Å; D134-F186 HydrophobicContact CB-CE2 3.96Å
135	W	95.2	Very high	94	Very high	174 Å²	174	73.9 Å²	73.9	66%	0.659	36%	0.364	S	S	*	.			trans	-89.9	-2.9	-178.9	-61	94.5	0	0	0	113.4	I133 C137 P183	I133-W135 HydrophobicContact CB-CZ2 4.32Å; I133-W135 HydrophobicContact CD1-CZ2 4.34Å; I133-W135 HydrophobicContact CG2-CD2 4.15Å; I133-W135 HydrophobicContact CG2-CH2 4.28Å; I133-W135 HydrophobicContact CG2-CZ2 3.71Å; W135-C137 PolarHBondContact O-N 3.43Å; W135-P183 HydrophobicContact CE3-CB 4Å; W135-P183 HydrophobicContact CZ3-CB 3.99Å; W135-P183 HydrophobicContact CZ3-CG 4.47Å
136	R	94.2	Very high	93.5	Very high	166 Å²	166	74.6 Å²	74.6	63%	0.626	37%	0.366	S	S	*	.			trans	-61.6	128.4	179.9	-70.7	175.3	-73.6	-179.7	-6.8	109.6	D134 P180 G182	D134-R136 VanDerWaalsContact CG-NE 3.29Å; D134-R136 VanDerWaalsContact OD1-CB 3.28Å; D134-R136 WeakPolarHBondContact OD1-CB 3.34Å; D134-R136 VanDerWaalsContact OD1-CG 3.25Å; D134-R136 WeakPolarHBondContact OD1-CG 3.31Å; D134-R136 IonicContact OD1-CZ 3.59Å; D134-R136 PolarHBondContact OD1-N 3Å; D134-R136 IonicContact OD1-NE 2.78Å; D134-R136 PolarHBondContact OD1-NE 3.39Å; D134-R136 IonicContact OD1-NH2 3.36Å; D134-R136 IonicContact OD2-CZ 3.71Å; D134-R136 IonicContact OD2-NE 3.5Å; D134-R136 PolarHBondContact OD2-NE 3Å; D134-R136 IonicContact OD2-NH2 3.8Å; D134-R136 PolarHBondContact OD2-NH2 2.97Å; R136-P180 HydrophobicContact CB-CB 3.84Å; R136-P180 HydrophobicContact CB-CG 3.88Å; R136-G182 WeakPolarHBondContact O-CA 3.48Å; R136-G182 PolarHBondContact O-N 3.25Å
137	C	92.8	Very high	92.9	Very high	74 Å²	74	75.3 Å²	75.3	50%	0.5	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-139	125.7	177.9	-175.8	0	0	0	0	109.1	W135 R181	W135-C137 PolarHBondContact O-N 3.43Å; C137-R181 PolarHBondContact SG-NH1 3.44Å
138	I	93.3	Very high	92.5	Very high	47 Å²	47	77.8 Å²	77.8	24%	0.241	40%	0.398	C	S	.	.			trans	-104.4	137.7	175.1	-65.4	176.6	0	0	0	109	T140 Q176 P180 R181	I138-T140 PolarHBondContact O-N 3.34Å; I138-Q176 HydrophobicContact CG2-CB 3.66Å; I138-Q176 HydrophobicContact CG2-CG 3.72Å; I138-P180 HydrophobicContact CD1-CG 3.8Å; I138-P180 HydrophobicContact CG1-CG 4.03Å; I138-P180 PolarHBondContact N-O 3.01Å; I138-R181 PolarHBondContact O-NH1 2.93Å
139	T	92.5	Very high	92.3	Very high	72 Å²	72	84.4 Å²	84.4	44%	0.442	42%	0.416	S	S	.	.			trans	-72.5	119.3	178.3	55.5	0	0	0	0	110.8	G175 Q176	T139-G175 WeakPolarHBondContact O-CA 3.37Å; T139-Q176 PolarHBondContact O-N 3.28Å
140	T	94.5	Very high	92.1	Very high	34 Å²	34	90 Å²	90	21%	0.209	44%	0.44	C	S	.	.	B	Isolated β-bridge	trans	-70.7	162.6	170.7	67.7	0	0	0	0	110.6	I138 A142 E143 L144	I138-T140 PolarHBondContact O-N 3.34Å; T140-A142 PolarHBondContact O-N 2.94Å; T140-E143 WeakPolarHBondContact CG2-OE1 3.5Å; T140-E143 PolarHBondContact N-OE2 3.45Å; T140-E143 PolarHBondContact O-N 3.22Å; T140-E143 VanDerWaalsContact O-N 3.07Å; T140-E143 WeakPolarHBondContact OG1-CG 3.33Å; T140-E143 PolarHBondContact OG1-N 2.72Å; T140-E143 PolarHBondContact OG1-OE1 2.64Å; T140-L144 PolarHBondContact O-N 3.39Å
141	R	93.5	Very high	92.1	Very high	116 Å²	116	92 Å²	92	44%	0.438	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-21.6	174.9	64.9	175.3	-71.3	-163	-5.7	114.4	N165 R167 T168	R141-N165 VanDerWaalsContact NH2-CB 3.28Å; R141-N165 PolarHBondContact NH2-ND2 3.14Å; R141-R167 HydrophobicContact CB-CB 4.3Å; R141-R167 WeakPolarHBondContact CB-O 3.29Å; R141-R167 WeakPolarHBondContact O-CD 3.38Å; R141-T168 VanDerWaalsContact CZ-CG2 3.43Å
142	A	93.2	Very high	92.2	Very high	67 Å²	67	88 Å²	88	55%	0.554	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-38.4	179	0	0	0	0	0	111.7	T140	T140-A142 PolarHBondContact O-N 2.94Å
143	E	93.8	Very high	92.3	Very high	84 Å²	84	86.5 Å²	86.5	39%	0.393	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-24.6	179.1	-71.2	154	-137.7	0	0	113.2	T140 S145 R181	T140-E143 WeakPolarHBondContact CG2-OE1 3.5Å; T140-E143 PolarHBondContact N-OE2 3.45Å; T140-E143 PolarHBondContact O-N 3.22Å; T140-E143 VanDerWaalsContact O-N 3.07Å; T140-E143 WeakPolarHBondContact OG1-CG 3.33Å; T140-E143 PolarHBondContact OG1-N 2.72Å; T140-E143 PolarHBondContact OG1-OE1 2.64Å; E143-S145 PolarHBondContact O-N 2.63Å; E143-R181 VanDerWaalsContact CD-NH2 3.33Å; E143-R181 IonicContact OE1-CZ 3.13Å; E143-R181 IonicContact OE1-NE 3.93Å; E143-R181 IonicContact OE1-NH1 3.35Å; E143-R181 PolarHBondContact OE1-NH1 3.05Å; E143-R181 IonicContact OE1-NH2 2.68Å; E143-R181 PolarHBondContact OE1-NH2 3.31Å; E143-R181 IonicContact OE2-CZ 3.44Å; E143-R181 IonicContact OE2-NH1 2.8Å; E143-R181 PolarHBondContact OE2-NH1 3.41Å; E143-R181 IonicContact OE2-NH2 3.45Å; E143-R181 PolarHBondContact OE2-NH2 3.44Å
144	L	92.5	Very high	92.4	Very high	7 Å²	7	86.5 Å²	86.5	4%	0.037	43%	0.434	C	S	.	.			trans	-56.6	112.6	179.6	-159.9	78.4	0	0	0	110.4	T140 Y146 R167 T173	T140-L144 PolarHBondContact O-N 3.39Å; L144-Y146 HydrophobicContact CD1-CD1 4.34Å; L144-Y146 HydrophobicContact CD1-CE1 3.63Å; L144-Y146 HydrophobicContact CD1-CE2 4.26Å; L144-Y146 HydrophobicContact CD2-CD2 4.09Å; L144-Y146 HydrophobicContact CD2-CE1 4.44Å; L144-Y146 HydrophobicContact CD2-CE2 3.69Å; L144-Y146 HydrophobicContact CG-CD1 4.2Å; L144-Y146 HydrophobicContact CG-CD2 4.36Å; L144-Y146 HydrophobicContact CG-CE1 3.93Å; L144-Y146 HydrophobicContact CG-CE2 4.08Å; L144-Y146 HydrophobicContact CG-CG 4.41Å; L144-R167 HydrophobicContact CD2-CB 4Å; L144-R167 HydrophobicContact CD2-CG 4.05Å; L144-R167 PolarHBondContact O-NE 2.95Å; L144-R167 PolarHBondContact O-NH1 3.07Å; L144-T173 WeakPolarHBondContact CD2-O 3.43Å
145	S	90	Very high	92.5	Very high	110 Å²	110	89.7 Å²	89.7	77%	0.769	45%	0.448	S	S	*	.			trans	-67.1	-40	-176.1	-176.8	0	0	0	0	111.7	E143 R167	E143-S145 PolarHBondContact O-N 2.63Å; S145-R167 PolarHBondContact O-NH2 3.45Å
146	Y	87.2	Confident	92.5	Very high	131 Å²	131	89.3 Å²	89.3	51%	0.514	45%	0.451	S	S	.	.	S	Bend	trans	-89.2	166.1	-177.3	65.7	-96.5	0	0	0	113.6	L144 R167 T173	L144-Y146 HydrophobicContact CD1-CD1 4.34Å; L144-Y146 HydrophobicContact CD1-CE1 3.63Å; L144-Y146 HydrophobicContact CD1-CE2 4.26Å; L144-Y146 HydrophobicContact CD2-CD2 4.09Å; L144-Y146 HydrophobicContact CD2-CE1 4.44Å; L144-Y146 HydrophobicContact CD2-CE2 3.69Å; L144-Y146 HydrophobicContact CG-CD1 4.2Å; L144-Y146 HydrophobicContact CG-CD2 4.36Å; L144-Y146 HydrophobicContact CG-CE1 3.93Å; L144-Y146 HydrophobicContact CG-CE2 4.08Å; L144-Y146 HydrophobicContact CG-CG 4.41Å; Y146-R167 PolarHBondContact O-NE 3.44Å; Y146-T173 VanDerWaalsContact CE2-O 3.25Å; Y146-T173 WeakPolarHBondContact CE2-O 3.42Å; Y146-T173 PolarHBondContact OH-O 2.93Å; Y146-T173 VanDerWaalsContact OH-O 3.09Å
147	G	83.6	Confident	92.6	Very high	38 Å²	38	85.5 Å²	85.5	39%	0.392	46%	0.463	S	S	.	.	S	Bend	trans	85.2	149.5	-177.9	0	0	0	0	0	113.1	R167	G147-R167 PolarHBondContact O-NE 3.47Å; G147-R167 PolarHBondContact O-NH2 2.81Å
148	T	87.8	Confident	92.7	Very high	78 Å²	78	85.1 Å²	85.1	48%	0.479	46%	0.459	S	S	.	.			trans	-86.1	136.1	-175.3	-33	0	0	0	0	111.3	K150 N165 R166	T148-K150 HydrophobicContact CG2-CB 3.51Å; T148-K150 PolarHBondContact O-N 3.3Å; T148-N165 PolarHBondContact O-OD1 2.91Å; T148-R166 PolarHBondContact O-N 3.13Å
149	R	91.1	Very high	92.8	Very high	170 Å²	170	87 Å²	87	64%	0.642	49%	0.49	S	S	*	.			trans	-74.6	-13.9	169	-62.5	-179.7	-176.6	177.1	-0.8	112.8
150	K	91.6	Very high	93	Very high	164 Å²	164	90.1 Å²	90.1	71%	0.713	50%	0.497	S	S	*	.	S	Bend	trans	-65.7	141.5	178.8	-171.9	176.2	178.5	176.9	0	110.9	T148 P152	T148-K150 HydrophobicContact CG2-CB 3.51Å; T148-K150 PolarHBondContact O-N 3.3Å; K150-P152 WeakPolarHBondContact O-CD 3.4Å
151	K	94.7	Very high	93.1	Very high	80 Å²	80	91.6 Å²	91.6	35%	0.348	51%	0.513	S	S	.	.			trans	-58.5	123.8	173.4	-157.7	-174	175.2	76.5	0	110.1	W153 H163 G164	K151-W153 VanDerWaalsContact C-N 3.3Å; K151-W153 WeakPolarHBondContact CD-O 3.25Å; K151-W153 WeakPolarHBondContact CE-O 3.49Å; K151-W153 VanDerWaalsContact CG-O 3.24Å; K151-W153 WeakPolarHBondContact CG-O 3.45Å; K151-W153 PolarHBondContact O-N 3.46Å; K151-H163 VanDerWaalsContact CG-O 3.29Å; K151-H163 WeakPolarHBondContact CG-O 3.46Å; K151-H163 PolarHBondContact NZ-O 3.18Å; K151-G164 WeakPolarHBondContact CA-O 3.47Å; K151-G164 PolarHBondContact N-O 2.89Å
152	P	93.8	Very high	93.3	Very high	43 Å²	43	94.3 Å²	94.3	28%	0.279	52%	0.523	S	S	.	.	S	Bend	trans	-62.2	-35	-177.6	-29	38.7	0	0	0	114.2	K150 H163 R166 W171	K150-P152 WeakPolarHBondContact O-CD 3.4Å; P152-H163 HydrophobicContact CG-CB 4.5Å; P152-R166 HydrophobicContact CB-CG 4.45Å; P152-R166 HydrophobicContact CG-CG 3.46Å; P152-R166 VanDerWaalsContact CG-CG 3.46Å; P152-W171 HydrophobicContact CG-CZ2 4.17Å
153	W	95.7	Very high	93.4	Very high	51 Å²	51	92.9 Å²	92.9	19%	0.193	51%	0.505	C	S	.	.	S	Bend	trans	-155.4	160.8	177.5	47.9	86.1	0	0	0	110.6	K151 T158 K160 A161 H163 W171	K151-W153 VanDerWaalsContact C-N 3.3Å; K151-W153 WeakPolarHBondContact CD-O 3.25Å; K151-W153 WeakPolarHBondContact CE-O 3.49Å; K151-W153 VanDerWaalsContact CG-O 3.24Å; K151-W153 WeakPolarHBondContact CG-O 3.45Å; K151-W153 PolarHBondContact O-N 3.46Å; W153-T158 HydrophobicContact CB-CG2 3.94Å; W153-T158 HydrophobicContact CG-CG2 4.39Å; W153-K160 HydrophobicContact CD2-CB 4.49Å; W153-K160 HydrophobicContact CD2-CD 4.3Å; W153-K160 HydrophobicContact CE3-CD 4.28Å; W153-K160 HydrophobicContact CH2-CD 4.15Å; W153-K160 HydrophobicContact CZ2-CB 3.71Å; W153-K160 HydrophobicContact CZ2-CD 4.11Å; W153-K160 HydrophobicContact CZ3-CD 4.24Å; W153-A161 VanDerWaalsContact CE2-O 3.31Å; W153-A161 VanDerWaalsContact CZ2-O 3.25Å; W153-A161 WeakPolarHBondContact CZ2-O 3.31Å; W153-A161 PolarHBondContact NE1-O 3.48Å; W153-H163 AromaticContact CZ2-CD2 3.68Å; W153-W171 AromaticContact CH2-CH2 3.72Å; W153-W171 HydrophobicContact CH2-CH2 3.72Å; W153-W171 HydrophobicContact CH2-CZ2 4.2Å; W153-W171 HydrophobicContact CZ3-CH2 4.03Å
154	P	96	Very high	93.4	Very high	87 Å²	87	91.1 Å²	91.1	57%	0.565	51%	0.509	S	S	*	.			trans	-57.1	157.7	175.8	-24.4	34.7	0	0	0	113.2	K156	P154-K156 PolarHBondContact O-N 3.27Å
155	Q	95.3	Very high	93.4	Very high	91 Å²	91	91.8 Å²	91.8	43%	0.425	51%	0.513	S	S	.	.	S	Bend	trans	-64	-27.7	-174.7	-174.8	69.9	-8.3	0	0	113.7
156	K	95.7	Very high	93.5	Very high	166 Å²	166	92.5 Å²	92.5	72%	0.722	50%	0.499	S	S	*	.	S	Bend	trans	-135.1	157.5	179.5	-60.6	-177.9	-179.4	-179.7	0	108.7	P154	P154-K156 PolarHBondContact O-N 3.27Å
157	G	95.8	Very high	93.9	Very high	85 Å²	85	87.5 Å²	87.5	88%	0.876	48%	0.479	S	S	*	.	S	Bend	trans	107.3	-20.8	173.4	0	0	0	0	0	116.4
158	T	95.9	Very high	94.4	Very high	67 Å²	67	86.5 Å²	86.5	41%	0.411	47%	0.466	S	S	.	.	S	Bend	trans	-99.8	-10.8	-174.9	57.3	0	0	0	0	116	W153 K160	W153-T158 HydrophobicContact CB-CG2 3.94Å; W153-T158 HydrophobicContact CG-CG2 4.39Å; T158-K160 PolarHBondContact O-N 3.05Å; T158-K160 VanDerWaalsContact O-N 3.15Å
159	G	95.6	Very high	94.7	Very high	87 Å²	87	88.2 Å²	88.2	90%	0.897	47%	0.468	S	S	*	.	S	Bend	trans	70.2	-1.6	-173.2	0	0	0	0	0	115.5
160	K	96.4	Very high	94.9	Very high	136 Å²	136	85.7 Å²	85.7	59%	0.591	47%	0.466	S	S	*	.	S	Bend	trans	-88.5	161.9	178.1	-63.3	-175.2	178.6	-177.8	0	112	W153 T158	W153-K160 HydrophobicContact CD2-CB 4.49Å; W153-K160 HydrophobicContact CD2-CD 4.3Å; W153-K160 HydrophobicContact CE3-CD 4.28Å; W153-K160 HydrophobicContact CH2-CD 4.15Å; W153-K160 HydrophobicContact CZ2-CB 3.71Å; W153-K160 HydrophobicContact CZ2-CD 4.11Å; W153-K160 HydrophobicContact CZ3-CD 4.24Å; T158-K160 PolarHBondContact O-N 3.05Å; T158-K160 VanDerWaalsContact O-N 3.15Å
161	A	96.6	Very high	95	Very high	66 Å²	66	80.6 Å²	80.6	55%	0.545	44%	0.442	S	S	.	.			trans	-55.8	148.4	172.1	0	0	0	0	0	112.1	W153 H163	W153-A161 VanDerWaalsContact CE2-O 3.31Å; W153-A161 VanDerWaalsContact CZ2-O 3.25Å; W153-A161 WeakPolarHBondContact CZ2-O 3.31Å; W153-A161 PolarHBondContact NE1-O 3.48Å; A161-H163 PolarHBondContact O-CD2 3.11Å; A161-H163 PolarHBondContact O-N 3.27Å
162	R	96.5	Very high	94.9	Very high	172 Å²	172	85.3 Å²	85.3	65%	0.649	47%	0.47	S	S	*	.			trans	-78	112.6	-176.6	-66.8	167.5	177.2	179.9	10	110.5
163	H	95.7	Very high	94.8	Very high	38 Å²	38	87 Å²	87	18%	0.176	48%	0.48	C	S	.	.			trans	-122.8	150.3	174.4	-68.5	-77	0	0	0	112.7	K151 P152 W153 A161 W171	K151-H163 VanDerWaalsContact CG-O 3.29Å; K151-H163 WeakPolarHBondContact CG-O 3.46Å; K151-H163 PolarHBondContact NZ-O 3.18Å; P152-H163 HydrophobicContact CG-CB 4.5Å; W153-H163 AromaticContact CZ2-CD2 3.68Å; A161-H163 PolarHBondContact O-CD2 3.11Å; A161-H163 PolarHBondContact O-N 3.27Å; H163-W171 HydrophobicContact CB-CZ2 4.08Å; H163-W171 AromaticContact CG-CZ2 3.87Å; H163-W171 AromaticContact ND1-NE1 3.91Å
164	G	94.1	Very high	94.7	Very high	46 Å²	46	85.5 Å²	85.5	47%	0.474	48%	0.48	S	S	.	.	S	Bend	trans	-106.6	-45.5	178.7	0	0	0	0	0	113.8	K151	K151-G164 WeakPolarHBondContact CA-O 3.47Å; K151-G164 PolarHBondContact N-O 2.89Å
165	N	92.5	Very high	94.6	Very high	21 Å²	21	81.4 Å²	81.4	11%	0.112	45%	0.454	C	S	.	.			trans	-142	139.7	-173.7	178.8	-22	0	0	0	108.2	R141 T148 R167 T168 W171	R141-N165 VanDerWaalsContact NH2-CB 3.28Å; R141-N165 PolarHBondContact NH2-ND2 3.14Å; T148-N165 PolarHBondContact O-OD1 2.91Å; N165-R167 VanDerWaalsContact C-N 3.29Å; N165-R167 PolarHBondContact O-N 3.1Å; N165-R167 WeakPolarHBondContact OD1-CB 3.45Å; N165-R167 WeakPolarHBondContact OD1-CG 3.41Å; N165-R167 PolarHBondContact OD1-N 3.31Å; N165-T168 PolarHBondContact O-OG1 2.94Å; N165-W171 PolarHBondContact O-NE1 3.49Å
166	R	92.8	Very high	94.5	Very high	125 Å²	125	82.1 Å²	82.1	47%	0.472	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-10.6	-178.8	-61.3	-173	70.1	-168.5	-1.3	114.2	T148 P152 T168 W171	T148-R166 PolarHBondContact O-N 3.13Å; P152-R166 HydrophobicContact CB-CG 4.45Å; P152-R166 HydrophobicContact CG-CG 3.46Å; P152-R166 VanDerWaalsContact CG-CG 3.46Å; R166-T168 VanDerWaalsContact C-N 3.31Å; R166-T168 PolarHBondContact O-N 3.35Å; R166-W171 VanDerWaalsContact C-CD1 3.5Å; R166-W171 HydrophobicContact CG-CZ2 4.27Å; R166-W171 WeakPolarHBondContact O-CB 3.39Å; R166-W171 VanDerWaalsContact O-CG 3.22Å
167	R	94.8	Very high	94.4	Very high	27 Å²	27	78.8 Å²	78.8	10%	0.102	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	1.2	-178.9	-57	-176	178.7	-173.7	-6.4	114.1	R141 L144 S145 Y146 G147 N165 G174 G175	R141-R167 HydrophobicContact CB-CB 4.3Å; R141-R167 WeakPolarHBondContact CB-O 3.29Å; R141-R167 WeakPolarHBondContact O-CD 3.38Å; L144-R167 HydrophobicContact CD2-CB 4Å; L144-R167 HydrophobicContact CD2-CG 4.05Å; L144-R167 PolarHBondContact O-NE 2.95Å; L144-R167 PolarHBondContact O-NH1 3.07Å; S145-R167 PolarHBondContact O-NH2 3.45Å; Y146-R167 PolarHBondContact O-NE 3.44Å; G147-R167 PolarHBondContact O-NE 3.47Å; G147-R167 PolarHBondContact O-NH2 2.81Å; N165-R167 VanDerWaalsContact C-N 3.29Å; N165-R167 PolarHBondContact O-N 3.1Å; N165-R167 WeakPolarHBondContact OD1-CB 3.45Å; N165-R167 WeakPolarHBondContact OD1-CG 3.41Å; N165-R167 PolarHBondContact OD1-N 3.31Å; R167-G174 WeakPolarHBondContact O-CA 3.27Å; R167-G175 PolarHBondContact O-N 3.44Å
168	T	93.9	Very high	94.3	Very high	17 Å²	17	83.9 Å²	83.9	10%	0.104	45%	0.451	C	S	.	.	S	Bend	trans	-74.4	149	-179.7	57.7	0	0	0	0	111.8	R141 N165 R166 I170 W171 G174	R141-T168 VanDerWaalsContact CZ-CG2 3.43Å; N165-T168 PolarHBondContact O-OG1 2.94Å; R166-T168 VanDerWaalsContact C-N 3.31Å; R166-T168 PolarHBondContact O-N 3.35Å; T168-I170 PolarHBondContact O-N 3.26Å; T168-W171 PolarHBondContact O-N 3.28Å; T168-G174 WeakPolarHBondContact O-CA 3.45Å
169	H	94.9	Very high	94.1	Very high	113 Å²	113	82.6 Å²	82.6	52%	0.523	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-23	177.7	67.7	-82.4	0	0	0	116.1	W171 G175	H169-W171 PolarHBondContact O-N 3.04Å; H169-G175 WeakPolarHBondContact CA-O 3.29Å; H169-G175 VanDerWaalsContact CB-O 3.25Å; H169-G175 WeakPolarHBondContact CB-O 3.49Å; H169-G175 PolarHBondContact N-O 3.39Å; H169-G175 VanDerWaalsContact N-O 3.09Å
170	I	94.7	Very high	94.1	Very high	117 Å²	117	80.4 Å²	80.4	60%	0.6	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-27.2	175.8	-56	170.5	0	0	0	111.6	T168	T168-I170 PolarHBondContact O-N 3.26Å
171	W	94.2	Very high	93.8	Very high	58 Å²	58	79.7 Å²	79.7	22%	0.22	42%	0.415	C	S	.	.	S	Bend	trans	-84.5	143.7	175.5	-63.7	94.3	0	0	0	110.4	P152 W153 H163 N165 R166 T168 H169 T173 G174	P152-W171 HydrophobicContact CG-CZ2 4.17Å; W153-W171 AromaticContact CH2-CH2 3.72Å; W153-W171 HydrophobicContact CH2-CH2 3.72Å; W153-W171 HydrophobicContact CH2-CZ2 4.2Å; W153-W171 HydrophobicContact CZ3-CH2 4.03Å; H163-W171 HydrophobicContact CB-CZ2 4.08Å; H163-W171 AromaticContact CG-CZ2 3.87Å; H163-W171 AromaticContact ND1-NE1 3.91Å; N165-W171 PolarHBondContact O-NE1 3.49Å; R166-W171 VanDerWaalsContact C-CD1 3.5Å; R166-W171 HydrophobicContact CG-CZ2 4.27Å; R166-W171 WeakPolarHBondContact O-CB 3.39Å; R166-W171 VanDerWaalsContact O-CG 3.22Å; T168-W171 PolarHBondContact O-N 3.28Å; H169-W171 PolarHBondContact O-N 3.04Å; W171-T173 PolarHBondContact O-N 2.95Å; W171-G174 PolarHBondContact O-N 2.95Å
172	L	92.7	Very high	93.3	Very high	179 Å²	179	77.6 Å²	77.6	94%	0.937	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-36.5	-179.2	-176	69.2	0	0	0	113.8
173	T	91.2	Very high	93.1	Very high	79 Å²	79	73.8 Å²	73.8	49%	0.485	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	14.1	-178.5	67.9	0	0	0	0	112.7	L144 Y146 W171	L144-T173 WeakPolarHBondContact CD2-O 3.43Å; Y146-T173 VanDerWaalsContact CE2-O 3.25Å; Y146-T173 WeakPolarHBondContact CE2-O 3.42Å; Y146-T173 PolarHBondContact OH-O 2.93Å; Y146-T173 VanDerWaalsContact OH-O 3.09Å; W171-T173 PolarHBondContact O-N 2.95Å
174	G	92.8	Very high	93	Very high	18 Å²	18	76.7 Å²	76.7	19%	0.186	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-74.6	156.9	-177.7	0	0	0	0	0	112.9	R167 T168 W171	R167-G174 WeakPolarHBondContact O-CA 3.27Å; T168-G174 WeakPolarHBondContact O-CA 3.45Å; W171-G174 PolarHBondContact O-N 2.95Å
175	G	94	Very high	93	Very high	2 Å²	2	78.5 Å²	78.5	2%	0.021	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-69.8	149.4	171.1	0	0	0	0	0	110.8	T139 R167 H169	T139-G175 WeakPolarHBondContact O-CA 3.37Å; R167-G175 PolarHBondContact O-N 3.44Å; H169-G175 WeakPolarHBondContact CA-O 3.29Å; H169-G175 VanDerWaalsContact CB-O 3.25Å; H169-G175 WeakPolarHBondContact CB-O 3.49Å; H169-G175 PolarHBondContact N-O 3.39Å; H169-G175 VanDerWaalsContact N-O 3.09Å
176	Q	94.5	Very high	93.1	Very high	106 Å²	106	81.3 Å²	81.3	50%	0.495	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-73.4	158	179.3	-57.3	-171	-3.9	0	0	111.6	I138 T139	I138-Q176 HydrophobicContact CG2-CB 3.66Å; I138-Q176 HydrophobicContact CG2-CG 3.72Å; T139-Q176 PolarHBondContact O-N 3.28Å
177	C	92.8	Very high	93.2	Very high	95 Å²	95	82.4 Å²	82.4	64%	0.642	43%	0.433	S	S	*	.	S	Bend	trans	-84.6	-50.7	-177.1	-171.1	0	0	0	0	112.5
178	K	93.6	Very high	93.2	Very high	192 Å²	192	85.1 Å²	85.1	84%	0.835	44%	0.444	S	S	*	.	S	Bend	trans	-131.5	147.8	177.4	-66.7	-175.9	177.8	-176.7	0	108.5
179	G	92.2	Very high	93.3	Very high	40 Å²	40	89.2 Å²	89.2	41%	0.412	46%	0.464	S	S	.	.	S	Bend	trans	165.2	179.4	180	0	0	0	0	0	109.9	R181	G179-R181 PolarHBondContact O-N 2.66Å
180	P	95.1	Very high	93.3	Very high	41 Å²	41	84.3 Å²	84.3	27%	0.266	44%	0.442	S	S	.	.			trans	-57.6	130.6	178.7	23.1	-36	0	0	0	111.7	R136 I138	R136-P180 HydrophobicContact CB-CB 3.84Å; R136-P180 HydrophobicContact CB-CG 3.88Å; I138-P180 HydrophobicContact CD1-CG 3.8Å; I138-P180 HydrophobicContact CG1-CG 4.03Å; I138-P180 PolarHBondContact N-O 3.01Å
181	R	90.2	Very high	93.4	Very high	122 Å²	122	82.5 Å²	82.5	46%	0.46	44%	0.438	S	S	.	.	B	Isolated β-bridge	trans	-117.2	72	177.4	-66.9	-61.8	-61.1	139.2	5	108	C137 I138 E143 G179	C137-R181 PolarHBondContact SG-NH1 3.44Å; I138-R181 PolarHBondContact O-NH1 2.93Å; E143-R181 VanDerWaalsContact CD-NH2 3.33Å; E143-R181 IonicContact OE1-CZ 3.13Å; E143-R181 IonicContact OE1-NE 3.93Å; E143-R181 IonicContact OE1-NH1 3.35Å; E143-R181 PolarHBondContact OE1-NH1 3.05Å; E143-R181 IonicContact OE1-NH2 2.68Å; E143-R181 PolarHBondContact OE1-NH2 3.31Å; E143-R181 IonicContact OE2-CZ 3.44Å; E143-R181 IonicContact OE2-NH1 2.8Å; E143-R181 PolarHBondContact OE2-NH1 3.41Å; E143-R181 IonicContact OE2-NH2 3.45Å; E143-R181 PolarHBondContact OE2-NH2 3.44Å; G179-R181 PolarHBondContact O-N 2.66Å
182	G	86.5	Confident	93.4	Very high	22 Å²	22	84.6 Å²	84.6	23%	0.227	45%	0.447	C	S	.	.	S	Bend	trans	-66.9	161.9	-175.7	0	0	0	0	0	113.6	R136	R136-G182 WeakPolarHBondContact O-CA 3.48Å; R136-G182 PolarHBondContact O-N 3.25Å
183	P	92.2	Very high	93.5	Very high	91 Å²	91	77.3 Å²	77.3	59%	0.591	41%	0.414	S	S	*	.			cis	-80	131.7	-4	30.9	-32.6	0	0	0	112.7	I133 D134 W135	I133-P183 HydrophobicContact CG2-CB 4.1Å; D134-P183 VanDerWaalsContact O-CA 3.3Å; D134-P183 WeakPolarHBondContact O-CA 3.24Å; W135-P183 HydrophobicContact CE3-CB 4Å; W135-P183 HydrophobicContact CZ3-CB 3.99Å; W135-P183 HydrophobicContact CZ3-CG 4.47Å
184	E	93.4	Very high	93.7	Very high	99 Å²	99	76.3 Å²	76.3	46%	0.463	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.2	174.7	-175.5	174.9	-179	0	0	110.2	I133 D134	I133-E184 WeakPolarHBondContact CA-O 3.49Å; D134-E184 HydrophobicContact CB-CB 4.48Å; D134-E184 PolarHBondContact N-O 3.24Å; D134-E184 PolarHBondContact O-N 3.47Å
185	S	94.5	Very high	93.9	Very high	85 Å²	85	78.9 Å²	78.9	59%	0.594	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	131.1	179.3	59.2	0	0	0	0	111.5	Y187	S185-Y187 VanDerWaalsContact C-N 3.27Å; S185-Y187 PolarHBondContact O-N 3.25Å
186	F	93.7	Very high	94	Very high	80 Å²	80	79.5 Å²	79.5	35%	0.351	41%	0.411	S	S	.	.			trans	-92.9	20.6	174.2	-64.5	-90	0	0	0	112.9	H129 L132 D134 Y188	H129-F186 HydrophobicContact CB-CB 4.37Å; L132-F186 HydrophobicContact CB-CB 4.42Å; L132-F186 HydrophobicContact CB-CD2 4.05Å; L132-F186 PolarHBondContact O-N 3.42Å; D134-F186 HydrophobicContact CB-CE2 3.96Å; F186-Y188 PolarHBondContact O-N 3.18Å
187	Y	95.4	Very high	94.1	Very high	148 Å²	148	75.8 Å²	75.8	58%	0.58	40%	0.398	S	S	*	.			trans	-70.5	125.2	-175.6	178.3	-100.1	0	0	0	111.2	Y130 S185	Y130-Y187 WeakPolarHBondContact O-CD2 3.46Å; S185-Y187 VanDerWaalsContact C-N 3.27Å; S185-Y187 PolarHBondContact O-N 3.25Å
188	Y	95.6	Very high	94.3	Very high	83 Å²	83	71.2 Å²	71.2	33%	0.325	37%	0.368	S	S	.	.			trans	-147.9	155.4	163.7	72.5	-82.2	0	0	0	108.7	Y125 W126 F186	Y125-Y188 WeakPolarHBondContact CD1-OH 3.25Å; Y125-Y188 HydrophobicContact CE1-CE1 4.39Å; W126-Y188 WeakPolarHBondContact CA-OH 3.33Å; W126-Y188 HydrophobicContact CB-CE2 4.43Å; W126-Y188 WeakPolarHBondContact CB-OH 3.34Å; W126-Y188 AromaticContact CD1-CE2 3.77Å; W126-Y188 AromaticContact CD1-CZ 3.8Å; W126-Y188 VanDerWaalsContact CD1-O 3.28Å; W126-Y188 HydrophobicContact CG-CE2 4.44Å; W126-Y188 PolarHBondContact NE1-O 3.36Å; F186-Y188 PolarHBondContact O-N 3.18Å
189	L	95.3	Very high	94.5	Very high	103 Å²	103	63.6 Å²	63.6	54%	0.539	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-103.2	124.3	178.5	-167.7	64.2	0	0	0	109.9	W126	W126-L189 HydrophobicContact CZ2-CD1 4.1Å
190	L	95	Very high	94.7	Very high	11 Å²	11	62 Å²	62	6%	0.058	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-75.6	137.5	172.1	-167.5	70.2	0	0	0	109.5	K122 W126 E194 R195	K122-L190 HydrophobicContact CB-CD2 4.4Å; W126-L190 HydrophobicContact CB-CB 4.4Å; W126-L190 HydrophobicContact CB-CD2 4.4Å; W126-L190 HydrophobicContact CD2-CB 4Å; W126-L190 HydrophobicContact CG-CB 3.89Å; L190-E194 HydrophobicContact CD1-CB 4.48Å; L190-E194 WeakPolarHBondContact CD1-OE2 3.45Å; L190-E194 HydrophobicContact CD2-CB 4.19Å; L190-E194 HydrophobicContact CG-CB 4.05Å; L190-R195 HydrophobicContact CB-CG 3.8Å; L190-R195 HydrophobicContact CD2-CG 3.79Å; L190-R195 HydrophobicContact CG-CG 4.04Å; L190-R195 PolarHBondContact O-NE 2.94Å
191	P	96	Very high	94.8	Very high	78 Å²	78	60.1 Å²	60.1	51%	0.506	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-50.8	143.5	177.3	-27.7	35.5	0	0	0	111.9	G193 E194 R195	P191-G193 PolarHBondContact O-N 2.69Å; P191-E194 HydrophobicContact CB-CB 4.49Å; P191-E194 HydrophobicContact CB-CG 4.28Å; P191-E194 HydrophobicContact CG-CG 4.49Å; P191-E194 PolarHBondContact O-N 2.77Å; P191-R195 PolarHBondContact O-N 3.31Å
192	Y	94.2	Very high	95.2	Very high	103 Å²	103	54.8 Å²	54.8	40%	0.404	29%	0.286	S	S	.	.	H	α-helix	trans	-59.4	-44.1	-173.8	-179.8	-113.3	0	0	0	112.6	E194 R195 L196 A397 V401	Y192-E194 PolarHBondContact O-N 3.4Å; Y192-R195 WeakPolarHBondContact O-CB 3.38Å; Y192-R195 PolarHBondContact O-N 3.39Å; Y192-L196 PolarHBondContact O-N 3.04Å; Y192-A397 WeakPolarHBondContact OH-CB 3.5Å; Y192-V401 HydrophobicContact CD1-CG2 3.59Å; Y192-V401 HydrophobicContact CE1-CG2 3.69Å
193	G	94.5	Very high	95.7	Very high	25 Å²	25	53.8 Å²	53.8	26%	0.258	28%	0.275	S	S	.	.	H	α-helix	trans	-59.8	-41.2	175.9	0	0	0	0	0	113.5	P191 R195 L196 A197	P191-G193 PolarHBondContact O-N 2.69Å; G193-R195 VanDerWaalsContact C-N 3.35Å; G193-R195 PolarHBondContact O-N 3.36Å; G193-L196 PolarHBondContact O-N 3.01Å; G193-A197 VanDerWaalsContact O-CB 3.24Å; G193-A197 WeakPolarHBondContact O-CB 3.41Å; G193-A197 PolarHBondContact O-N 2.89Å
194	E	96	Very high	95.9	Very high	59 Å²	59	49.7 Å²	49.7	28%	0.276	25%	0.249	S	C	.	.	H	α-helix	trans	-66.5	-35.7	176.1	-66.2	-161.5	165.6	0	0	112.3	K122 N123 L190 P191 Y192 G198	K122-E194 WeakPolarHBondContact CD-OE2 3.38Å; K122-E194 IonicContact NZ-OE1 2.79Å; K122-E194 PolarHBondContact NZ-OE1 2.96Å; K122-E194 IonicContact NZ-OE2 2.79Å; K122-E194 PolarHBondContact NZ-OE2 3.25Å; N123-E194 PolarHBondContact ND2-O 3.25Å; L190-E194 HydrophobicContact CD1-CB 4.48Å; L190-E194 WeakPolarHBondContact CD1-OE2 3.45Å; L190-E194 HydrophobicContact CD2-CB 4.19Å; L190-E194 HydrophobicContact CG-CB 4.05Å; P191-E194 HydrophobicContact CB-CB 4.49Å; P191-E194 HydrophobicContact CB-CG 4.28Å; P191-E194 HydrophobicContact CG-CG 4.49Å; P191-E194 PolarHBondContact O-N 2.77Å; Y192-E194 PolarHBondContact O-N 3.4Å; E194-G198 PolarHBondContact O-N 2.89Å; E194-G198 VanDerWaalsContact O-N 3.16Å
195	R	96.7	Very high	96.1	Very high	72 Å²	72	46.3 Å²	46.3	27%	0.272	23%	0.234	S	C	.	.	H	α-helix	trans	-64	-49.8	175.1	-73.1	-175.6	-76.9	151.6	-2.8	111.9	N123 W126 L190 P191 Y192 G193 G198 L199	N123-R195 VanDerWaalsContact OD1-CA 3.3Å; N123-R195 WeakPolarHBondContact OD1-CA 3.38Å; W126-R195 HydrophobicContact CE3-CG 4.23Å; W126-R195 VanDerWaalsContact CH2-CD 3.46Å; W126-R195 HydrophobicContact CH2-CG 4.48Å; W126-R195 VanDerWaalsContact CZ3-CD 3.49Å; W126-R195 HydrophobicContact CZ3-CG 4.04Å; L190-R195 HydrophobicContact CB-CG 3.8Å; L190-R195 HydrophobicContact CD2-CG 3.79Å; L190-R195 HydrophobicContact CG-CG 4.04Å; L190-R195 PolarHBondContact O-NE 2.94Å; P191-R195 PolarHBondContact O-N 3.31Å; Y192-R195 WeakPolarHBondContact O-CB 3.38Å; Y192-R195 PolarHBondContact O-N 3.39Å; G193-R195 VanDerWaalsContact C-N 3.35Å; G193-R195 PolarHBondContact O-N 3.36Å; R195-G198 PolarHBondContact O-N 3.43Å; R195-L199 PolarHBondContact O-N 2.89Å
196	L	96.5	Very high	96.2	Very high	15 Å²	15	42.7 Å²	42.7	8%	0.079	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-47.7	178.7	175.3	132.7	0	0	0	111.6	Y192 G193 G198 L199 L200 A397 Q398 V401	Y192-L196 PolarHBondContact O-N 3.04Å; G193-L196 PolarHBondContact O-N 3.01Å; L196-G198 VanDerWaalsContact C-N 3.31Å; L196-G198 PolarHBondContact O-N 3.26Å; L196-L199 WeakPolarHBondContact O-CB 3.2Å; L196-L199 PolarHBondContact O-N 3.35Å; L196-L199 VanDerWaalsContact O-N 3.12Å; L196-L200 HydrophobicContact CD2-CD1 3.43Å; L196-L200 VanDerWaalsContact CD2-CD1 3.43Å; L196-L200 HydrophobicContact CD2-CG 4.45Å; L196-L200 HydrophobicContact CG-CD1 3.9Å; L196-L200 HydrophobicContact CG-CG 4.44Å; L196-L200 VanDerWaalsContact O-CG 3.32Å; L196-L200 WeakPolarHBondContact O-CG 3.38Å; L196-L200 PolarHBondContact O-N 3.38Å; L196-A397 HydrophobicContact CD1-CB 3.26Å; L196-Q398 HydrophobicContact CD1-CG 4.36Å; L196-Q398 HydrophobicContact CD2-CG 3.87Å; L196-V401 HydrophobicContact CD2-CG2 4.44Å
197	A	96.2	Very high	96.4	Very high	27 Å²	27	40.4 Å²	40.4	22%	0.223	20%	0.198	C	C	.	.	H	α-helix	trans	-63.7	-33.7	-179	0	0	0	0	0	113.1	L119 G193 S201	L119-A197 HydrophobicContact CD1-CB 3.5Å; G193-A197 VanDerWaalsContact O-CB 3.24Å; G193-A197 WeakPolarHBondContact O-CB 3.41Å; G193-A197 PolarHBondContact O-N 2.89Å; A197-S201 VanDerWaalsContact O-CB 3.31Å; A197-S201 WeakPolarHBondContact O-CB 3.38Å; A197-S201 PolarHBondContact O-N 3.45Å; A197-S201 PolarHBondContact O-OG 3.04Å
198	G	97.5	Very high	96.4	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-70.5	-36	172.4	0	0	0	0	0	113.6	N123 E194 R195 L196 M202	N123-G198 WeakPolarHBondContact ND2-CA 3.44Å; E194-G198 PolarHBondContact O-N 2.89Å; E194-G198 VanDerWaalsContact O-N 3.16Å; R195-G198 PolarHBondContact O-N 3.43Å; L196-G198 VanDerWaalsContact C-N 3.31Å; L196-G198 PolarHBondContact O-N 3.26Å; G198-M202 WeakPolarHBondContact O-CB 3.38Å; G198-M202 PolarHBondContact O-N 2.89Å
199	L	97.1	Very high	96.4	Very high	32 Å²	32	38.3 Å²	38.3	17%	0.168	21%	0.21	C	C	.	.	H	α-helix	trans	-64.4	-47	173.9	-177.1	64.9	0	0	0	111.7	R195 L196 M202 L203 V371 M374 L394	R195-L199 PolarHBondContact O-N 2.89Å; L196-L199 WeakPolarHBondContact O-CB 3.2Å; L196-L199 PolarHBondContact O-N 3.35Å; L196-L199 VanDerWaalsContact O-N 3.12Å; L199-M202 PolarHBondContact O-N 2.89Å; L199-L203 PolarHBondContact O-N 2.86Å; L199-V371 HydrophobicContact CB-CG2 4.28Å; L199-V371 HydrophobicContact CD1-CG2 4.2Å; L199-M374 HydrophobicContact CD1-SD 3.93Å; L199-L394 HydrophobicContact CD2-CD2 3.77Å
200	L	97.1	Very high	96.4	Very high	7 Å²	7	39.8 Å²	39.8	4%	0.037	22%	0.218	C	C	.	.	H	α-helix	trans	-61.8	-43.8	176.9	-65.1	165.8	0	0	0	112	I110 V113 L196 M202 L203 S204 L394 Q398	I110-L200 HydrophobicContact CB-CD2 4.22Å; I110-L200 HydrophobicContact CG1-CD2 4.01Å; I110-L200 HydrophobicContact CG2-CD2 4.13Å; V113-L200 HydrophobicContact CG2-CB 4.23Å; L196-L200 HydrophobicContact CD2-CD1 3.43Å; L196-L200 VanDerWaalsContact CD2-CD1 3.43Å; L196-L200 HydrophobicContact CD2-CG 4.45Å; L196-L200 HydrophobicContact CG-CD1 3.9Å; L196-L200 HydrophobicContact CG-CG 4.44Å; L196-L200 VanDerWaalsContact O-CG 3.32Å; L196-L200 WeakPolarHBondContact O-CG 3.38Å; L196-L200 PolarHBondContact O-N 3.38Å; L200-M202 VanDerWaalsContact C-N 3.28Å; L200-M202 PolarHBondContact O-N 3.23Å; L200-L203 PolarHBondContact O-N 3.39Å; L200-S204 WeakPolarHBondContact O-CB 3.43Å; L200-S204 PolarHBondContact O-N 3.12Å; L200-S204 PolarHBondContact O-OG 2.98Å; L200-L394 HydrophobicContact CD2-CB 4.41Å; L200-L394 HydrophobicContact CD2-CD1 3.93Å; L200-Q398 HydrophobicContact CD1-CG 4.09Å
201	S	97.4	Very high	96.5	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-59.3	-41.7	175.3	-63.6	0	0	0	0	111.1	R116 A197 S204 I205	R116-S201 PolarHBondContact N-OG 2.97Å; A197-S201 VanDerWaalsContact O-CB 3.31Å; A197-S201 WeakPolarHBondContact O-CB 3.38Å; A197-S201 PolarHBondContact O-N 3.45Å; A197-S201 PolarHBondContact O-OG 3.04Å; S201-S204 PolarHBondContact O-N 2.9Å; S201-I205 WeakPolarHBondContact O-CB 3.43Å; S201-I205 WeakPolarHBondContact O-CD1 3.3Å; S201-I205 WeakPolarHBondContact O-CG1 3.26Å; S201-I205 PolarHBondContact O-N 3.25Å
202	M	97.8	Very high	96.5	Very high	10 Å²	10	38.2 Å²	38.2	5%	0.049	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-40.6	178.7	-167.5	65.1	-147.1	0	0	112.6	V120 G198 L199 L200 I205 K206 V371 M374 V375	V120-M202 HydrophobicContact CG1-SD 4.04Å; V120-M202 HydrophobicContact CG2-CB 4.45Å; G198-M202 WeakPolarHBondContact O-CB 3.38Å; G198-M202 PolarHBondContact O-N 2.89Å; L199-M202 PolarHBondContact O-N 2.89Å; L200-M202 VanDerWaalsContact C-N 3.28Å; L200-M202 PolarHBondContact O-N 3.23Å; M202-I205 PolarHBondContact O-N 2.95Å; M202-K206 HydrophobicContact CE-CD 4.19Å; M202-K206 HydrophobicContact CE-CG 3.93Å; M202-K206 PolarHBondContact O-N 3.37Å; M202-V371 HydrophobicContact CB-CG1 4.43Å; M202-V371 HydrophobicContact CB-CG2 4.47Å; M202-V371 HydrophobicContact CG-CG1 4.36Å; M202-M374 HydrophobicContact CB-CE 3.95Å; M202-M374 HydrophobicContact CB-SD 4.29Å; M202-M374 HydrophobicContact CE-CB 4.29Å; M202-M374 HydrophobicContact CG-CB 3.78Å; M202-M374 HydrophobicContact CG-CE 3.57Å; M202-M374 HydrophobicContact CG-SD 3.93Å; M202-V375 HydrophobicContact CE-CG2 3.86Å; M202-V375 HydrophobicContact SD-CG2 3.54Å; M202-V375 VanDerWaalsContact SD-CG2 3.54Å
203	L	97.4	Very high	96.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.3	-44.3	175.6	-75.7	167.5	0	0	0	111.4	I110 F111 L199 L200 I205 K206 H207 L369 M374 L380 L390 L394	I110-L203 HydrophobicContact CG2-CD1 3.8Å; F111-L203 HydrophobicContact CD1-CB 4.29Å; F111-L203 HydrophobicContact CE1-CB 4.21Å; F111-L203 HydrophobicContact CE1-CD2 4.15Å; L199-L203 PolarHBondContact O-N 2.86Å; L200-L203 PolarHBondContact O-N 3.39Å; L203-I205 VanDerWaalsContact C-N 3.32Å; L203-I205 PolarHBondContact O-N 3.2Å; L203-K206 PolarHBondContact O-N 3.08Å; L203-H207 WeakPolarHBondContact O-CB 3.32Å; L203-H207 PolarHBondContact O-N 3.48Å; L203-L369 HydrophobicContact CD2-CD2 4.45Å; L203-M374 HydrophobicContact CB-CE 4.33Å; L203-M374 HydrophobicContact CD2-CE 3.47Å; L203-M374 VanDerWaalsContact CD2-CE 3.47Å; L203-M374 HydrophobicContact CD2-SD 4.41Å; L203-M374 HydrophobicContact CG-CE 3.69Å; L203-L380 HydrophobicContact CD2-CD2 4.07Å; L203-L390 HydrophobicContact CD1-CD2 4.11Å; L203-L394 HydrophobicContact CD1-CD1 3.57Å
204	S	96.4	Very high	96.7	Very high	6 Å²	6	33.8 Å²	33.8	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-37.7	175.3	-67.3	0	0	0	0	112.1	I110 F111 V113 L200 S201 A208	I110-S204 PolarHBondContact O-OG 2.9Å; F111-S204 VanDerWaalsContact C-OG 3.23Å; F111-S204 PolarHBondContact O-OG 3.43Å; V113-S204 PolarHBondContact N-OG 3.41Å; V113-S204 WeakPolarHBondContact O-CB 3.17Å; V113-S204 PolarHBondContact O-OG 2.97Å; L200-S204 WeakPolarHBondContact O-CB 3.43Å; L200-S204 PolarHBondContact O-N 3.12Å; L200-S204 PolarHBondContact O-OG 2.98Å; S201-S204 PolarHBondContact O-N 2.9Å; S204-A208 VanDerWaalsContact O-CB 3.27Å; S204-A208 WeakPolarHBondContact O-CB 3.14Å; S204-A208 PolarHBondContact O-N 3.34Å
205	I	97.7	Very high	96.5	Very high	28 Å²	28	31 Å²	31	14%	0.144	17%	0.168	C	C	.	.	H	α-helix	trans	-64.1	-50.3	174.7	-71.9	164.2	0	0	0	110.9	P115 V120 S201 M202 L203 H207 A208 Q209	P115-I205 HydrophobicContact CB-CD1 3.95Å; P115-I205 HydrophobicContact CB-CG1 3.47Å; P115-I205 VanDerWaalsContact CB-CG1 3.47Å; V120-I205 HydrophobicContact CG2-CD1 4.23Å; S201-I205 WeakPolarHBondContact O-CB 3.43Å; S201-I205 WeakPolarHBondContact O-CD1 3.3Å; S201-I205 WeakPolarHBondContact O-CG1 3.26Å; S201-I205 PolarHBondContact O-N 3.25Å; M202-I205 PolarHBondContact O-N 2.95Å; L203-I205 VanDerWaalsContact C-N 3.32Å; L203-I205 PolarHBondContact O-N 3.2Å; I205-H207 VanDerWaalsContact C-N 3.29Å; I205-H207 PolarHBondContact O-N 2.96Å; I205-A208 PolarHBondContact O-N 2.96Å; I205-A208 VanDerWaalsContact O-N 3.14Å; I205-Q209 HydrophobicContact CG2-CG 4.33Å; I205-Q209 VanDerWaalsContact CG2-OE1 3.23Å; I205-Q209 WeakPolarHBondContact O-CB 3.49Å; I205-Q209 WeakPolarHBondContact O-CG 3.4Å; I205-Q209 PolarHBondContact O-N 3.23Å
206	K	97.5	Very high	96.2	Very high	9 Å²	9	29.5 Å²	29.5	4%	0.039	17%	0.166	C	C	.	.	H	α-helix	trans	-58.6	-41.9	178.7	-77.7	-63.9	-174.1	-173.5	0	112.2	M202 L203 Q209 N210 D211 L212 M374 H377 D378 L380	M202-K206 HydrophobicContact CE-CD 4.19Å; M202-K206 HydrophobicContact CE-CG 3.93Å; M202-K206 PolarHBondContact O-N 3.37Å; L203-K206 PolarHBondContact O-N 3.08Å; K206-Q209 PolarHBondContact O-N 3.48Å; K206-N210 PolarHBondContact O-N 3.48Å; K206-D211 HydrophobicContact CD-CB 3.62Å; K206-D211 IonicContact NZ-OD2 3.05Å; K206-D211 PolarHBondContact O-N 2.89Å; K206-L212 HydrophobicContact CB-CB 4.3Å; K206-L212 PolarHBondContact O-N 3.43Å; K206-M374 WeakPolarHBondContact CE-O 3.18Å; K206-M374 HydrophobicContact CG-CE 4.2Å; K206-M374 PolarHBondContact NZ-O 3.29Å; K206-H377 PolarHBondContact NZ-O 2.86Å; K206-D378 PolarHBondContact NZ-O 3.27Å; K206-L380 HydrophobicContact CG-CD2 4.46Å
207	H	96.7	Very high	95.8	Very high	31 Å²	31	30.7 Å²	30.7	14%	0.144	17%	0.172	C	C	.	.	H	α-helix	trans	-64	-46.8	174.1	178	-102.8	0	0	0	112.1	T81 F111 L203 I205 Q209 N210 L212	T81-H207 WeakPolarHBondContact CG2-CD2 3.29Å; T81-H207 VanDerWaalsContact CG2-NE2 3.26Å; T81-H207 WeakPolarHBondContact CG2-NE2 2.97Å; F111-H207 HydrophobicContact CD1-CB 4.26Å; L203-H207 WeakPolarHBondContact O-CB 3.32Å; L203-H207 PolarHBondContact O-N 3.48Å; I205-H207 VanDerWaalsContact C-N 3.29Å; I205-H207 PolarHBondContact O-N 2.96Å; H207-Q209 VanDerWaalsContact C-N 3.26Å; H207-Q209 PolarHBondContact O-N 3.01Å; H207-N210 PolarHBondContact O-N 3.48Å; H207-N210 VanDerWaalsContact O-N 3.15Å; H207-L212 HydrophobicContact CB-CB 4.49Å; H207-L212 HydrophobicContact CB-CD2 3.91Å
208	A	96	Very high	95.5	Very high	78 Å²	78	29.4 Å²	29.4	65%	0.645	16%	0.162	S	C	*	.	H	α-helix	trans	-65.4	-27.1	179.8	0	0	0	0	0	113.9	S204 I205 N210	S204-A208 VanDerWaalsContact O-CB 3.27Å; S204-A208 WeakPolarHBondContact O-CB 3.14Å; S204-A208 PolarHBondContact O-N 3.34Å; I205-A208 PolarHBondContact O-N 2.96Å; I205-A208 VanDerWaalsContact O-N 3.14Å; A208-N210 VanDerWaalsContact C-N 3.33Å
209	Q	95.8	Very high	95	Very high	110 Å²	110	31 Å²	31	51%	0.514	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-4	177.1	-70.7	177.7	-43.7	0	0	113.6	I205 K206 H207 D211	I205-Q209 HydrophobicContact CG2-CG 4.33Å; I205-Q209 VanDerWaalsContact CG2-OE1 3.23Å; I205-Q209 WeakPolarHBondContact O-CB 3.49Å; I205-Q209 WeakPolarHBondContact O-CG 3.4Å; I205-Q209 PolarHBondContact O-N 3.23Å; K206-Q209 PolarHBondContact O-N 3.48Å; H207-Q209 VanDerWaalsContact C-N 3.26Å; H207-Q209 PolarHBondContact O-N 3.01Å; Q209-D211 HydrophobicContact CB-CB 4.47Å; Q209-D211 PolarHBondContact O-N 3.33Å
210	N	95.1	Very high	94.5	Very high	134 Å²	134	29.7 Å²	29.7	72%	0.717	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	25.1	-170.2	-51.5	-49.7	0	0	0	114	K206 H207 A208	K206-N210 PolarHBondContact O-N 3.48Å; H207-N210 PolarHBondContact O-N 3.48Å; H207-N210 VanDerWaalsContact O-N 3.15Å; A208-N210 VanDerWaalsContact C-N 3.33Å
211	D	96.3	Very high	94	Very high	42 Å²	42	29.8 Å²	29.8	23%	0.225	16%	0.164	C	C	.	.			trans	-91.8	-9.3	178.4	-70.6	-14.3	0	0	0	112.5	K206 Q209 D378 T379 L380	K206-D211 HydrophobicContact CD-CB 3.62Å; K206-D211 IonicContact NZ-OD2 3.05Å; K206-D211 PolarHBondContact O-N 2.89Å; Q209-D211 HydrophobicContact CB-CB 4.47Å; Q209-D211 PolarHBondContact O-N 3.33Å; D211-D378 WeakPolarHBondContact CB-O 3.3Å; D211-D378 VanDerWaalsContact CG-O 3.29Å; D211-T379 WeakPolarHBondContact O-CA 3.47Å; D211-L380 PolarHBondContact O-N 2.71Å
212	L	96.8	Very high	93.5	Very high	13 Å²	13	34.8 Å²	34.8	7%	0.068	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	118.9	178	174.8	67.1	0	0	0	110.1	L106 F111 K206 H207 L380 I382	L106-L212 HydrophobicContact CD1-CD2 4.3Å; F111-L212 HydrophobicContact CD1-CD2 3.74Å; F111-L212 HydrophobicContact CE1-CD2 3.44Å; F111-L212 VanDerWaalsContact CE1-CD2 3.44Å; F111-L212 HydrophobicContact CZ-CD2 4.4Å; K206-L212 HydrophobicContact CB-CB 4.3Å; K206-L212 PolarHBondContact O-N 3.43Å; H207-L212 HydrophobicContact CB-CB 4.49Å; H207-L212 HydrophobicContact CB-CD2 3.91Å; L212-L380 WeakPolarHBondContact CA-O 3.27Å; L212-L380 HydrophobicContact CD1-CB 4.38Å; L212-L380 HydrophobicContact CD1-CD2 3.86Å; L212-L380 HydrophobicContact CD1-CG 4.03Å; L212-I382 HydrophobicContact CD1-CD1 3.59Å; L212-I382 HydrophobicContact CD1-CG1 3.9Å
213	H	95.9	Very high	93.2	Very high	34 Å²	34	36.6 Å²	36.6	16%	0.157	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	137.4	174.6	-64.2	-88.3	0	0	0	110.4	E84 W280 L380 V381 I382	E84-H213 IonicContact OE1-CE1 2.72Å; E84-H213 IonicContact OE1-CG 3.11Å; E84-H213 IonicContact OE1-ND1 2.64Å; E84-H213 PolarHBondContact OE1-ND1 2.93Å; H213-W280 HydrophobicContact CB-CZ2 4.17Å; H213-W280 AromaticContact CD2-CD1 3.75Å; H213-W280 AromaticContact CD2-NE1 3.47Å; H213-W280 PolarHBondContact CD2-NE1 2.91Å; H213-W280 AromaticContact CE1-CD1 3.75Å; H213-W280 AromaticContact CE1-NE1 3.36Å; H213-W280 PolarHBondContact CE1-NE1 3.45Å; H213-W280 AromaticContact CG-NE1 3.49Å; H213-W280 AromaticContact ND1-NE1 3.4Å; H213-W280 PolarHBondContact ND1-NE1 3Å; H213-W280 AromaticContact NE2-CD1 3.41Å; H213-W280 AromaticContact NE2-NE1 3.38Å; H213-W280 PolarHBondContact NE2-NE1 3.39Å; H213-L380 PolarHBondContact N-O 3.49Å; H213-V381 HydrophobicContact CB-CG1 4.5Å; H213-V381 HydrophobicContact CB-CG2 4.38Å; H213-V381 WeakPolarHBondContact O-CA 3.47Å; H213-I382 PolarHBondContact O-N 2.72Å
214	I	95.8	Very high	92.8	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.9	177.6	-57.6	167.6	0	0	0	107.8	T81 L83 E84 I104 L106 I382 L387	T81-I214 HydrophobicContact CG2-CD1 4.31Å; T81-I214 WeakPolarHBondContact OG1-CD1 3.37Å; L83-I214 HydrophobicContact CD1-CG2 4.22Å; E84-I214 PolarHBondContact N-O 2.85Å; I104-I214 HydrophobicContact CD1-CG2 3.76Å; L106-I214 HydrophobicContact CD1-CD1 4.32Å; L106-I214 HydrophobicContact CD2-CD1 3.7Å; L106-I214 HydrophobicContact CG-CD1 4.28Å; I214-I382 WeakPolarHBondContact CA-O 3.14Å; I214-L387 HydrophobicContact CD1-CD2 3.84Å; I214-L387 HydrophobicContact CG1-CD2 4.42Å; I214-L387 HydrophobicContact CG2-CD2 4.12Å
215	V	93.3	Very high	92.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	142.3	-179	174.5	0	0	0	0	108.8	E84 L86 D217 F218 W280 V381 I382 S383 L384	E84-V215 HydrophobicContact CB-CG2 4.31Å; E84-V215 CarbonylContact O-C 3.57Å; E84-V215 VanDerWaalsContact O-CA 3.29Å; E84-V215 WeakPolarHBondContact O-CA 2.86Å; L86-V215 HydrophobicContact CD1-CG1 4.28Å; L86-V215 HydrophobicContact CG-CG1 3.83Å; L86-V215 HydrophobicContact CG-CG2 4.38Å; V215-D217 WeakPolarHBondContact CG1-O 3.44Å; V215-F218 HydrophobicContact CB-CD1 4.22Å; V215-F218 HydrophobicContact CB-CE1 3.92Å; V215-F218 HydrophobicContact CG1-CD1 3.97Å; V215-F218 HydrophobicContact CG1-CE1 4.18Å; V215-F218 HydrophobicContact CG2-CE1 4.33Å; V215-W280 HydrophobicContact CG2-CH2 4.49Å; V215-V381 HydrophobicContact CB-CG1 4.29Å; V215-V381 HydrophobicContact CG2-CG1 3.41Å; V215-V381 VanDerWaalsContact CG2-CG1 3.41Å; V215-I382 PolarHBondContact N-O 2.82Å; V215-S383 CarbonylContact O-C 3.57Å; V215-S383 VanDerWaalsContact O-CA 3.29Å; V215-S383 WeakPolarHBondContact O-CA 3.24Å; V215-L384 PolarHBondContact O-N 3.39Å
216	D	89.3	Confident	92.2	Very high	41 Å²	41	42.2 Å²	42.2	22%	0.219	22%	0.223	C	C	.	.	S	Bend	trans	-59.8	-69.2	175.2	-175	27.7	0	0	0	111.2	L83 E84 L101 L384	L83-D216 HydrophobicContact CD1-CB 3.98Å; E84-D216 PolarHBondContact O-N 3.36Å; L101-D216 HydrophobicContact CD1-CB 3.75Å; D216-L384 WeakPolarHBondContact O-CB 3.23Å; D216-L384 PolarHBondContact O-N 3.04Å
217	D	88.1	Confident	91.9	Very high	40 Å²	40	45.1 Å²	45.1	21%	0.214	24%	0.239	C	C	.	.			trans	-129.9	151.6	175.9	-69.5	-40.3	0	0	0	111	K87 V215 M219	K87-D217 IonicContact NZ-OD2 3.07Å; V215-D217 WeakPolarHBondContact CG1-O 3.44Å; D217-M219 HydrophobicContact CB-CB 4.42Å; D217-M219 HydrophobicContact CB-CG 4.2Å; D217-M219 PolarHBondContact O-N 3.17Å
218	F	89.5	Confident	91.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.233	C	C	.	.			trans	-85.7	20.2	174.2	-64.7	-37.4	0	0	0	115.2	L86 V215 L220 F286 V287 D288 N320 I323 V381	L86-F218 HydrophobicContact CD1-CD1 3.76Å; V215-F218 HydrophobicContact CB-CD1 4.22Å; V215-F218 HydrophobicContact CB-CE1 3.92Å; V215-F218 HydrophobicContact CG1-CD1 3.97Å; V215-F218 HydrophobicContact CG1-CE1 4.18Å; V215-F218 HydrophobicContact CG2-CE1 4.33Å; F218-L220 PolarHBondContact O-N 3.39Å; F218-F286 HydrophobicContact CE1-CD1 4.09Å; F218-F286 HydrophobicContact CE2-CB 4.42Å; F218-F286 HydrophobicContact CZ-CB 4.32Å; F218-F286 HydrophobicContact CZ-CD1 4.31Å; F218-V287 VanDerWaalsContact CE2-O 3.24Å; F218-V287 WeakPolarHBondContact CE2-O 3.31Å; F218-V287 WeakPolarHBondContact CZ-O 3.32Å; F218-D288 HydrophobicContact CD2-CB 3.77Å; F218-D288 HydrophobicContact CE2-CB 3.68Å; F218-N320 VanDerWaalsContact C-OD1 3.27Å; F218-N320 HydrophobicContact CB-CB 4.07Å; F218-I323 HydrophobicContact CB-CD1 3.84Å; F218-I323 HydrophobicContact CB-CG2 3.92Å; F218-I323 HydrophobicContact CD1-CD1 4.1Å; F218-I323 HydrophobicContact CD2-CD1 4.43Å; F218-I323 HydrophobicContact CG-CD1 3.91Å; F218-V381 HydrophobicContact CE1-CG1 3.85Å; F218-V381 HydrophobicContact CZ-CG1 4.39Å
219	M	87.4	Confident	91.1	Very high	35 Å²	35	44.1 Å²	44.1	17%	0.172	22%	0.22	C	C	.	.			trans	-65.4	121.8	169	-70.2	-80.8	99.1	0	0	110.6	K87 D217 E225 D319 N320	K87-M219 HydrophobicContact CG-CB 4.26Å; D217-M219 HydrophobicContact CB-CB 4.42Å; D217-M219 HydrophobicContact CB-CG 4.2Å; D217-M219 PolarHBondContact O-N 3.17Å; M219-E225 HydrophobicContact CE-CG 4.17Å; M219-E225 WeakPolarHBondContact CE-OE1 3.36Å; M219-E225 HydrophobicContact SD-CG 4.21Å; M219-D319 HydrophobicContact CE-CB 3.88Å; M219-N320 HydrophobicContact CE-CB 4.4Å; M219-N320 WeakPolarHBondContact CE-OD1 3.34Å; M219-N320 PolarHBondContact N-OD1 3.43Å
220	L	86.6	Confident	90.9	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	22%	0.219	C	C	.	.			trans	-85	-116.1	176	-58	179.7	0	0	0	110.8	L86 P88 F218 A267 Y270 I271 A322 I323	L86-L220 HydrophobicContact CB-CD2 4.2Å; L86-L220 HydrophobicContact CD1-CD2 4.05Å; P88-L220 VanDerWaalsContact CD-O 3.31Å; P88-L220 WeakPolarHBondContact CD-O 3.02Å; F218-L220 PolarHBondContact O-N 3.39Å; L220-A267 HydrophobicContact CD1-CB 4.5Å; L220-Y270 HydrophobicContact CB-CD1 4.07Å; L220-Y270 HydrophobicContact CB-CE1 3.86Å; L220-Y270 HydrophobicContact CD1-CD1 4.21Å; L220-Y270 HydrophobicContact CD2-CD1 4Å; L220-Y270 HydrophobicContact CD2-CE1 3.86Å; L220-Y270 HydrophobicContact CG-CD1 4.32Å; L220-Y270 HydrophobicContact CG-CE1 4.34Å; L220-I271 HydrophobicContact CD1-CD1 4.03Å; L220-I271 HydrophobicContact CD1-CG1 3.93Å; L220-I271 HydrophobicContact CD2-CD1 4.32Å; L220-I271 HydrophobicContact CD2-CG1 3.94Å; L220-A322 HydrophobicContact CB-CB 4.46Å; L220-A322 HydrophobicContact CD1-CB 3.84Å; L220-A322 HydrophobicContact CG-CB 4.36Å; L220-I323 HydrophobicContact CD1-CB 4.43Å
221	S	87.1	Confident	90.6	Very high	9 Å²	9	38 Å²	38	6%	0.063	19%	0.187	C	C	.	.			trans	-95.9	148.3	171.2	-176.8	0	0	0	0	110.9	T223 L224 E225	S221-T223 VanDerWaalsContact C-N 3.32Å; S221-T223 PolarHBondContact O-N 3.2Å; S221-T223 PolarHBondContact OG-OG1 3.32Å; S221-T223 VanDerWaalsContact OG-OG1 3.06Å; S221-L224 PolarHBondContact O-N 3.29Å; S221-E225 WeakPolarHBondContact O-CG 3.12Å; S221-E225 PolarHBondContact O-N 3.28Å
222	K	87.1	Confident	90	Very high	106 Å²	106	36.7 Å²	36.7	46%	0.461	18%	0.18	S	C	.	.	H	α-helix	trans	-59	-42.8	177.9	-67.3	-179.4	178.3	177.6	0	112.3	L224 E225 E226	K222-L224 PolarHBondContact O-N 2.98Å; K222-E225 PolarHBondContact O-N 3.38Å; K222-E226 WeakPolarHBondContact O-CB 3.39Å; K222-E226 VanDerWaalsContact O-CG 3.29Å; K222-E226 WeakPolarHBondContact O-CG 3.31Å; K222-E226 PolarHBondContact O-N 2.89Å
223	T	90.8	Very high	89.5	Confident	47 Å²	47	39.2 Å²	39.2	29%	0.288	20%	0.196	S	C	.	.	H	α-helix	trans	-60.6	-45.1	177.5	36.8	0	0	0	0	112.6	D48 S221 E225 E226 D227	D48-T223 HydrophobicContact CB-CG2 4.46Å; D48-T223 VanDerWaalsContact CG-CG2 3.43Å; D48-T223 VanDerWaalsContact OD2-CB 3.32Å; D48-T223 WeakPolarHBondContact OD2-CB 3.18Å; D48-T223 WeakPolarHBondContact OD2-CG2 3.33Å; D48-T223 PolarHBondContact OD2-OG1 3.32Å; S221-T223 VanDerWaalsContact C-N 3.32Å; S221-T223 PolarHBondContact O-N 3.2Å; S221-T223 PolarHBondContact OG-OG1 3.32Å; S221-T223 VanDerWaalsContact OG-OG1 3.06Å; T223-E225 VanDerWaalsContact C-N 3.34Å; T223-E225 PolarHBondContact O-N 3.38Å; T223-E226 PolarHBondContact O-N 3.29Å; T223-D227 WeakPolarHBondContact O-CB 3.24Å; T223-D227 PolarHBondContact O-N 2.72Å
224	L	90.2	Very high	89	Confident	23 Å²	23	38.9 Å²	38.9	12%	0.12	20%	0.195	C	C	.	.	H	α-helix	trans	-65.4	-37.4	177.7	-65.7	175.5	0	0	0	112.3	S221 K222 A228 E266 Y270 A322	S221-L224 PolarHBondContact O-N 3.29Å; K222-L224 PolarHBondContact O-N 2.98Å; L224-A228 VanDerWaalsContact O-CB 3.3Å; L224-A228 WeakPolarHBondContact O-CB 3.49Å; L224-A228 PolarHBondContact O-N 3.33Å; L224-E266 HydrophobicContact CD2-CB 4.08Å; L224-Y270 HydrophobicContact CD1-CD1 4.45Å; L224-Y270 HydrophobicContact CD1-CD2 4.41Å; L224-Y270 HydrophobicContact CD1-CG 4.02Å; L224-A322 HydrophobicContact CB-CB 4.09Å
225	E	88.7	Confident	88.2	Confident	8 Å²	8	39.3 Å²	39.3	4%	0.037	20%	0.198	C	C	.	.	H	α-helix	trans	-70	-37	176	-66.4	-68.8	174.9	0	0	111.8	M219 S221 K222 T223 A228 K229 L321 A322	M219-E225 HydrophobicContact CE-CG 4.17Å; M219-E225 WeakPolarHBondContact CE-OE1 3.36Å; M219-E225 HydrophobicContact SD-CG 4.21Å; S221-E225 WeakPolarHBondContact O-CG 3.12Å; S221-E225 PolarHBondContact O-N 3.28Å; K222-E225 PolarHBondContact O-N 3.38Å; T223-E225 VanDerWaalsContact C-N 3.34Å; T223-E225 PolarHBondContact O-N 3.38Å; E225-A228 PolarHBondContact O-N 2.83Å; E225-K229 WeakPolarHBondContact O-CB 3.43Å; E225-K229 VanDerWaalsContact O-CG 3.24Å; E225-K229 WeakPolarHBondContact O-CG 3.32Å; E225-K229 PolarHBondContact O-N 3.14Å; E225-L321 PolarHBondContact OE2-N 3.44Å; E225-A322 VanDerWaalsContact CD-CB 3.45Å; E225-A322 HydrophobicContact CG-CB 4.12Å; E225-A322 WeakPolarHBondContact OE1-CB 3.24Å; E225-A322 PolarHBondContact OE2-N 3.39Å
226	E	91.2	Very high	87.4	Confident	121 Å²	121	41.7 Å²	41.7	57%	0.565	21%	0.209	S	C	*	.	H	α-helix	trans	-63.9	-46.1	173.5	-74.3	168.5	-167.5	0	0	111.7	K222 T223 A228 K229 H230	K222-E226 WeakPolarHBondContact O-CB 3.39Å; K222-E226 VanDerWaalsContact O-CG 3.29Å; K222-E226 WeakPolarHBondContact O-CG 3.31Å; K222-E226 PolarHBondContact O-N 2.89Å; T223-E226 PolarHBondContact O-N 3.29Å; E226-A228 VanDerWaalsContact C-N 3.32Å; E226-A228 PolarHBondContact O-N 3.12Å; E226-K229 WeakPolarHBondContact O-CB 3.44Å; E226-K229 PolarHBondContact O-N 2.87Å; E226-H230 PolarHBondContact O-N 2.78Å
227	D	91.5	Very high	87.1	Confident	71 Å²	71	43.2 Å²	43.2	38%	0.38	22%	0.22	S	C	.	.	H	α-helix	trans	-61	-41	175.4	-77.1	-18.7	0	0	0	111.6	T223 H230 I231 T263	T223-D227 WeakPolarHBondContact O-CB 3.24Å; T223-D227 PolarHBondContact O-N 2.72Å; D227-H230 PolarHBondContact O-N 3.5Å; D227-I231 PolarHBondContact O-N 2.92Å; D227-I231 VanDerWaalsContact O-N 3.07Å; D227-T263 HydrophobicContact CB-CG2 3.94Å
228	A	88.5	Confident	86.4	Confident	3 Å²	3	42.1 Å²	42.1	3%	0.025	22%	0.216	C	C	.	.	H	α-helix	trans	-63.8	-42.5	175.8	0	0	0	0	0	112	L224 E225 E226 I231 L232 L321 L325	L224-A228 VanDerWaalsContact O-CB 3.3Å; L224-A228 WeakPolarHBondContact O-CB 3.49Å; L224-A228 PolarHBondContact O-N 3.33Å; E225-A228 PolarHBondContact O-N 2.83Å; E226-A228 VanDerWaalsContact C-N 3.32Å; E226-A228 PolarHBondContact O-N 3.12Å; A228-I231 PolarHBondContact O-N 3.38Å; A228-L232 WeakPolarHBondContact O-CB 3.29Å; A228-L232 PolarHBondContact O-N 3.4Å; A228-L321 HydrophobicContact CB-CB 3.75Å; A228-L325 HydrophobicContact CB-CD1 3.55Å
229	K	88.7	Confident	85.5	Confident	85 Å²	85	42.5 Å²	42.5	37%	0.37	22%	0.219	S	C	.	.	H	α-helix	trans	-61.5	-43.2	174.6	-74.5	170.5	-176	179	0	111.3	E225 E226 I231 L232 T233 Y318 L321	E225-K229 WeakPolarHBondContact O-CB 3.43Å; E225-K229 VanDerWaalsContact O-CG 3.24Å; E225-K229 WeakPolarHBondContact O-CG 3.32Å; E225-K229 PolarHBondContact O-N 3.14Å; E226-K229 WeakPolarHBondContact O-CB 3.44Å; E226-K229 PolarHBondContact O-N 2.87Å; K229-I231 PolarHBondContact O-N 3.36Å; K229-L232 PolarHBondContact O-N 3.47Å; K229-T233 WeakPolarHBondContact O-CG2 3.33Å; K229-T233 PolarHBondContact O-N 2.79Å; K229-T233 PolarHBondContact O-OG1 3.25Å; K229-Y318 WeakPolarHBondContact CE-O 3.44Å; K229-L321 HydrophobicContact CG-CD1 3.8Å
230	H	91.6	Very high	84.9	Confident	104 Å²	104	46.4 Å²	46.4	48%	0.481	24%	0.24	S	C	.	.	H	α-helix	trans	-61.2	-41.4	177.4	-173.7	-85.6	0	0	0	112.5	E226 D227 L232 T233 E234	E226-H230 PolarHBondContact O-N 2.78Å; D227-H230 PolarHBondContact O-N 3.5Å; H230-L232 VanDerWaalsContact C-N 3.34Å; H230-T233 PolarHBondContact O-N 2.84Å; H230-T233 PolarHBondContact O-OG1 3.03Å; H230-E234 IonicContact CE1-OE1 3.04Å; H230-E234 PolarHBondContact CE1-OE1 3.3Å; H230-E234 IonicContact ND1-OE1 3.8Å; H230-E234 WeakPolarHBondContact O-CG 3.42Å; H230-E234 PolarHBondContact O-N 2.88Å
231	I	87.6	Confident	84.2	Confident	11 Å²	11	50.1 Å²	50.1	6%	0.056	26%	0.26	C	S	.	.	H	α-helix	trans	-67	-38.1	176.5	-72.2	160.6	0	0	0	111.6	D227 A228 K229 E234 A235 L260 T263	D227-I231 PolarHBondContact O-N 2.92Å; D227-I231 VanDerWaalsContact O-N 3.07Å; A228-I231 PolarHBondContact O-N 3.38Å; K229-I231 PolarHBondContact O-N 3.36Å; I231-E234 PolarHBondContact O-N 3.5Å; I231-A235 WeakPolarHBondContact O-CB 3.36Å; I231-A235 PolarHBondContact O-N 3.5Å; I231-L260 HydrophobicContact CG2-CB 4.36Å; I231-L260 HydrophobicContact CG2-CD1 4.37Å; I231-L260 HydrophobicContact CG2-CG 4.36Å; I231-T263 HydrophobicContact CD1-CG2 3.42Å; I231-T263 VanDerWaalsContact CD1-CG2 3.42Å; I231-T263 WeakPolarHBondContact CD1-OG1 3.27Å
232	L	84.5	Confident	83	Confident	14 Å²	14	56.6 Å²	56.6	7%	0.073	29%	0.293	C	S	.	.	H	α-helix	trans	-65.4	-41.5	178.2	-175.5	147.2	0	0	0	111.3	A228 K229 H230 A235 Q236 L296 Y318 L321	A228-L232 WeakPolarHBondContact O-CB 3.29Å; A228-L232 PolarHBondContact O-N 3.4Å; K229-L232 PolarHBondContact O-N 3.47Å; H230-L232 VanDerWaalsContact C-N 3.34Å; L232-A235 PolarHBondContact O-N 3.06Å; L232-Q236 VanDerWaalsContact CD2-CD 3.48Å; L232-Q236 HydrophobicContact CD2-CG 4.16Å; L232-Q236 VanDerWaalsContact CD2-NE2 3.34Å; L232-Q236 WeakPolarHBondContact O-CG 3.45Å; L232-Q236 PolarHBondContact O-N 3.22Å; L232-L296 HydrophobicContact CD1-CD2 3.6Å; L232-Y318 HydrophobicContact CD1-CD1 4.22Å; L232-Y318 HydrophobicContact CD1-CE1 4.24Å; L232-Y318 HydrophobicContact CD2-CD1 4.06Å; L232-Y318 HydrophobicContact CD2-CE1 3.5Å; L232-L321 HydrophobicContact CD1-CD1 3.92Å; L232-L321 HydrophobicContact CD1-CD2 3.85Å
233	T	86.2	Confident	81.6	Confident	66 Å²	66	57.5 Å²	57.5	41%	0.405	31%	0.308	S	S	.	.	H	α-helix	trans	-67.6	-38.9	174.8	59.2	0	0	0	0	111.9	K229 H230 A235 Q236 T237	K229-T233 WeakPolarHBondContact O-CG2 3.33Å; K229-T233 PolarHBondContact O-N 2.79Å; K229-T233 PolarHBondContact O-OG1 3.25Å; H230-T233 PolarHBondContact O-N 2.84Å; H230-T233 PolarHBondContact O-OG1 3.03Å; T233-A235 VanDerWaalsContact C-N 3.31Å; T233-A235 PolarHBondContact O-N 2.88Å; T233-Q236 PolarHBondContact O-N 2.79Å; T233-T237 WeakPolarHBondContact O-CB 3.38Å; T233-T237 VanDerWaalsContact O-CG2 3.29Å; T233-T237 WeakPolarHBondContact O-CG2 3.45Å; T233-T237 PolarHBondContact O-N 2.93Å; T233-T237 PolarHBondContact O-OG1 3.09Å
234	E	85.1	Confident	79.8	Confident	28 Å²	28	58.8 Å²	58.8	13%	0.131	31%	0.313	C	S	.	.	H	α-helix	trans	-58.3	-41.6	170.6	-77.2	-174	162	0	0	111.7	H230 I231 T237 A238 R259	H230-E234 IonicContact CE1-OE1 3.04Å; H230-E234 PolarHBondContact CE1-OE1 3.3Å; H230-E234 IonicContact ND1-OE1 3.8Å; H230-E234 WeakPolarHBondContact O-CG 3.42Å; H230-E234 PolarHBondContact O-N 2.88Å; I231-E234 PolarHBondContact O-N 3.5Å; E234-T237 WeakPolarHBondContact CA-OG1 3.44Å; E234-T237 PolarHBondContact O-OG1 3.25Å; E234-A238 VanDerWaalsContact O-CB 3.31Å; E234-A238 WeakPolarHBondContact O-CB 3.39Å; E234-A238 PolarHBondContact O-N 3.12Å; E234-R259 IonicContact OE1-CZ 3.95Å; E234-R259 IonicContact OE1-NH1 2.75Å; E234-R259 PolarHBondContact OE1-NH1 3.34Å
235	A	78.5	Confident	78.1	Confident	9 Å²	9	66 Å²	66	7%	0.074	35%	0.351	C	S	.	.	H	α-helix	trans	-70.1	-40.4	177.9	0	0	0	0	0	112.5	I231 L232 T233 S239	I231-A235 WeakPolarHBondContact O-CB 3.36Å; I231-A235 PolarHBondContact O-N 3.5Å; L232-A235 PolarHBondContact O-N 3.06Å; T233-A235 VanDerWaalsContact C-N 3.31Å; T233-A235 PolarHBondContact O-N 2.88Å; A235-S239 VanDerWaalsContact O-CB 3.24Å; A235-S239 WeakPolarHBondContact O-CB 3.42Å; A235-S239 PolarHBondContact O-N 2.88Å
236	Q	76.8	Confident	76.8	Confident	51 Å²	51	68.3 Å²	68.3	24%	0.238	36%	0.362	C	S	.	.	H	α-helix	trans	-64.8	-43	175.6	-75	176.3	-18.3	0	0	111.7	L232 T233 S239 L240 Y318	L232-Q236 VanDerWaalsContact CD2-CD 3.48Å; L232-Q236 HydrophobicContact CD2-CG 4.16Å; L232-Q236 VanDerWaalsContact CD2-NE2 3.34Å; L232-Q236 WeakPolarHBondContact O-CG 3.45Å; L232-Q236 PolarHBondContact O-N 3.22Å; T233-Q236 PolarHBondContact O-N 2.79Å; Q236-S239 WeakPolarHBondContact O-CA 3.06Å; Q236-S239 VanDerWaalsContact O-CB 3.23Å; Q236-S239 WeakPolarHBondContact O-CB 3.13Å; Q236-S239 PolarHBondContact O-N 3.07Å; Q236-L240 WeakPolarHBondContact O-CG 3.37Å; Q236-L240 PolarHBondContact O-N 3.46Å; Q236-L240 VanDerWaalsContact O-N 3.09Å; Q236-Y318 PolarHBondContact NE2-OH 3.4Å
237	T	83	Confident	75.8	Confident	73 Å²	73	68.3 Å²	68.3	45%	0.448	37%	0.365	S	S	.	.	H	α-helix	trans	-65.6	-44.5	177	50.9	0	0	0	0	111.7	T233 E234 S239 L240 N241	T233-T237 WeakPolarHBondContact O-CB 3.38Å; T233-T237 VanDerWaalsContact O-CG2 3.29Å; T233-T237 WeakPolarHBondContact O-CG2 3.45Å; T233-T237 PolarHBondContact O-N 2.93Å; T233-T237 PolarHBondContact O-OG1 3.09Å; E234-T237 WeakPolarHBondContact CA-OG1 3.44Å; E234-T237 PolarHBondContact O-OG1 3.25Å; T237-S239 PolarHBondContact O-N 3.29Å; T237-L240 PolarHBondContact O-N 3.39Å; T237-N241 PolarHBondContact O-N 2.69Å
238	A	74.7	Confident	74.7	Confident	16 Å²	16	67.6 Å²	67.6	13%	0.132	36%	0.364	C	S	.	.	H	α-helix	trans	-60	-29.9	170.6	0	0	0	0	0	111.9	E234	E234-A238 VanDerWaalsContact O-CB 3.31Å; E234-A238 WeakPolarHBondContact O-CB 3.39Å; E234-A238 PolarHBondContact O-N 3.12Å
239	S	69.5	Low	73.9	Confident	9 Å²	9	72.2 Å²	72.2	6%	0.063	39%	0.388	C	S	.	.	H	α-helix	trans	-70.3	-38.8	179.4	-174.4	0	0	0	0	114	K14 A235 Q236 T237 V298	K14-S239 WeakPolarHBondContact CE-OG 3.28Å; K14-S239 VanDerWaalsContact NZ-CB 3.33Å; K14-S239 PolarHBondContact NZ-O 2.88Å; K14-S239 PolarHBondContact NZ-OG 3.2Å; A235-S239 VanDerWaalsContact O-CB 3.24Å; A235-S239 WeakPolarHBondContact O-CB 3.42Å; A235-S239 PolarHBondContact O-N 2.88Å; Q236-S239 WeakPolarHBondContact O-CA 3.06Å; Q236-S239 VanDerWaalsContact O-CB 3.23Å; Q236-S239 WeakPolarHBondContact O-CB 3.13Å; Q236-S239 PolarHBondContact O-N 3.07Å; T237-S239 PolarHBondContact O-N 3.29Å; S239-V298 VanDerWaalsContact OG-CG1 3.28Å; S239-V298 WeakPolarHBondContact OG-CG1 3.26Å
240	L	74.1	Confident	73.4	Confident	116 Å²	116	69.8 Å²	69.8	61%	0.607	38%	0.382	S	S	*	.	H	α-helix	trans	-75	-31.5	179.6	-66.5	171.1	0	0	0	112	Q236 T237 L242	Q236-L240 WeakPolarHBondContact O-CG 3.37Å; Q236-L240 PolarHBondContact O-N 3.46Å; Q236-L240 VanDerWaalsContact O-N 3.09Å; T237-L240 PolarHBondContact O-N 3.39Å; L240-L242 PolarHBondContact O-N 2.8Å
241	N	72.9	Confident	73	Confident	83 Å²	83	68.5 Å²	68.5	44%	0.444	39%	0.389	S	S	.	.			trans	-76.4	72.4	175.1	-63.7	-10.7	0	0	0	110.3	T237 T243 D244	T237-N241 PolarHBondContact O-N 2.69Å; N241-T243 PolarHBondContact O-N 2.81Å; N241-D244 PolarHBondContact O-N 3.29Å
242	L	62.7	Low	72.7	Confident	145 Å²	145	71.3 Å²	71.3	76%	0.759	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-9.5	176.5	-116.8	103.8	0	0	0	114	L240 D244	L240-L242 PolarHBondContact O-N 2.8Å; L242-D244 PolarHBondContact O-N 2.91Å
243	T	56.4	Low	72.4	Confident	125 Å²	125	71 Å²	71	77%	0.767	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-13.3	-177.1	48.6	0	0	0	0	113.5	N241 L245	N241-T243 PolarHBondContact O-N 2.81Å; T243-L245 PolarHBondContact O-N 2.85Å
244	D	52.7	Low	72.1	Confident	73 Å²	73	73.2 Å²	73.2	39%	0.39	41%	0.407	S	S	.	.			trans	-104.6	78.8	-174.8	-67.3	-16	0	0	0	108	N241 L242 E246	N241-D244 PolarHBondContact O-N 3.29Å; L242-D244 PolarHBondContact O-N 2.91Å; D244-E246 HydrophobicContact CB-CB 4.16Å; D244-E246 HydrophobicContact CB-CG 3.56Å; D244-E246 PolarHBondContact O-N 3.48Å
245	L	55.4	Low	72.1	Confident	176 Å²	176	75 Å²	75	92%	0.921	42%	0.419	S	S	*	.			trans	-68.3	58.2	149.9	-162.2	92.7	0	0	0	107	T243 D247	T243-L245 PolarHBondContact O-N 2.85Å; L245-D247 PolarHBondContact O-N 3Å
246	E	61.8	Low	72.3	Confident	56 Å²	56	76 Å²	76	26%	0.262	42%	0.421	S	S	.	.			trans	-68.1	128.5	-172.9	-97.5	171.4	-177.5	0	0	107.3	D244 N253 R256	D244-E246 HydrophobicContact CB-CB 4.16Å; D244-E246 HydrophobicContact CB-CG 3.56Å; D244-E246 PolarHBondContact O-N 3.48Å; E246-N253 WeakPolarHBondContact CB-ND2 3.27Å; E246-N253 PolarHBondContact OE2-OD1 3.31Å; E246-R256 IonicContact OE2-NH1 3.77Å; E246-R256 PolarHBondContact OE2-NH1 2.81Å
247	D	70.1	Confident	72.6	Confident	121 Å²	121	75.9 Å²	75.9	65%	0.647	42%	0.42	S	S	*	.			trans	-47.1	133.5	172.3	-75	-30.4	0	0	0	109	L245 L249 S250 N253	L245-D247 PolarHBondContact O-N 3Å; D247-L249 PolarHBondContact O-N 2.75Å; D247-S250 WeakPolarHBondContact O-CB 3.08Å; D247-S250 PolarHBondContact O-N 3.26Å; D247-N253 PolarHBondContact O-ND2 3.35Å
248	P	66.9	Low	72.7	Confident	55 Å²	55	79.2 Å²	79.2	36%	0.357	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.3	177.6	24.3	-33.8	0	0	0	111.4
249	L	72	Confident	73.4	Confident	100 Å²	100	84.2 Å²	84.2	52%	0.524	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	1.9	177.6	-55.5	-179.2	0	0	0	114.2	D247 E341 F345	D247-L249 PolarHBondContact O-N 2.75Å; L249-E341 HydrophobicContact CD2-CB 3.67Å; L249-F345 HydrophobicContact CD2-CE2 3.56Å; L249-F345 HydrophobicContact CD2-CZ 3.72Å
250	S	79.5	Confident	74.3	Confident	35 Å²	35	84.2 Å²	84.2	25%	0.245	44%	0.44	C	S	.	.			trans	-55.1	139.2	176.8	174	0	0	0	0	110.9	D247 L252 N253 K254	D247-S250 WeakPolarHBondContact O-CB 3.08Å; D247-S250 PolarHBondContact O-N 3.26Å; S250-L252 PolarHBondContact O-N 2.79Å; S250-L252 PolarHBondContact OG-N 2.75Å; S250-N253 PolarHBondContact O-N 2.68Å; S250-K254 PolarHBondContact O-N 2.91Å
251	A	82.4	Confident	74.9	Confident	76 Å²	76	79.7 Å²	79.7	63%	0.628	42%	0.418	S	S	*	.	H	α-helix	trans	-56.3	-34.9	176.6	0	0	0	0	0	111.5	K254 T255	A251-K254 WeakPolarHBondContact O-CB 3.4Å; A251-K254 PolarHBondContact O-N 2.83Å; A251-T255 VanDerWaalsContact O-CG2 3.31Å; A251-T255 WeakPolarHBondContact O-CG2 3.49Å; A251-T255 PolarHBondContact O-N 2.91Å; A251-T255 PolarHBondContact O-OG1 2.94Å
252	L	82.6	Confident	75.8	Confident	70 Å²	70	80.6 Å²	80.6	37%	0.366	42%	0.417	S	S	.	.	H	α-helix	trans	-65.2	-50.1	177.8	-175.6	60	0	0	0	111.3	S250 K254 T255 R256	S250-L252 PolarHBondContact O-N 2.79Å; S250-L252 PolarHBondContact OG-N 2.75Å; L252-K254 VanDerWaalsContact C-N 3.28Å; L252-K254 PolarHBondContact O-N 3.46Å; L252-T255 PolarHBondContact O-N 3.41Å; L252-T255 PolarHBondContact O-OG1 3.31Å; L252-R256 WeakPolarHBondContact O-CG 3.44Å; L252-R256 PolarHBondContact O-N 3.47Å
253	N	77.3	Confident	77.1	Confident	8 Å²	8	74.4 Å²	74.4	4%	0.043	39%	0.386	C	S	.	.	H	α-helix	trans	-60.6	-39.2	177	-73.6	-23.8	0	0	0	112.1	E246 D247 S250 T255 R256 H257	E246-N253 WeakPolarHBondContact CB-ND2 3.27Å; E246-N253 PolarHBondContact OE2-OD1 3.31Å; D247-N253 PolarHBondContact O-ND2 3.35Å; S250-N253 PolarHBondContact O-N 2.68Å; N253-T255 PolarHBondContact O-N 3.15Å; N253-R256 PolarHBondContact O-N 2.89Å; N253-R256 PolarHBondContact OD1-NH1 2.84Å; N253-H257 VanDerWaalsContact O-CB 3.28Å; N253-H257 WeakPolarHBondContact O-CB 3.42Å; N253-H257 PolarHBondContact O-N 2.87Å
254	K	79.1	Confident	78.7	Confident	113 Å²	113	68.8 Å²	68.8	49%	0.491	35%	0.351	S	S	.	.	H	α-helix	trans	-58.5	-46.1	172.2	-168.7	-173.5	-170.6	168.2	0	112.1	S250 A251 L252 Y258 F345	S250-K254 PolarHBondContact O-N 2.91Å; A251-K254 WeakPolarHBondContact O-CB 3.4Å; A251-K254 PolarHBondContact O-N 2.83Å; L252-K254 VanDerWaalsContact C-N 3.28Å; L252-K254 PolarHBondContact O-N 3.46Å; K254-Y258 WeakPolarHBondContact O-CB 3.12Å; K254-Y258 PolarHBondContact O-N 2.96Å; K254-F345 HydrophobicContact CB-CE1 4.33Å; K254-F345 HydrophobicContact CD-CD1 4.04Å; K254-F345 HydrophobicContact CD-CE1 3.56Å; K254-F345 HydrophobicContact CG-CD1 4.25Å; K254-F345 HydrophobicContact CG-CE1 3.78Å; K254-F345 HydrophobicContact CG-CZ 4.38Å
255	T	84.9	Confident	80.5	Confident	64 Å²	64	67.4 Å²	67.4	39%	0.393	34%	0.344	S	S	.	.	H	α-helix	trans	-65.8	-42.7	179.8	58.8	0	0	0	0	112.5	A251 L252 N253 Y258 R259	A251-T255 VanDerWaalsContact O-CG2 3.31Å; A251-T255 WeakPolarHBondContact O-CG2 3.49Å; A251-T255 PolarHBondContact O-N 2.91Å; A251-T255 PolarHBondContact O-OG1 2.94Å; L252-T255 PolarHBondContact O-N 3.41Å; L252-T255 PolarHBondContact O-OG1 3.31Å; N253-T255 PolarHBondContact O-N 3.15Å; T255-Y258 PolarHBondContact O-N 3.5Å; T255-R259 WeakPolarHBondContact O-CG 3.41Å; T255-R259 PolarHBondContact O-N 2.71Å
256	R	84	Confident	82.3	Confident	32 Å²	32	61.7 Å²	61.7	12%	0.121	31%	0.312	C	S	.	.	H	α-helix	trans	-67	-43.6	178.4	-66.4	177.6	177.3	147.5	-8.9	111.5	Y15 E246 L252 N253 Y258 R259 L260	Y15-R256 HydrophobicContact CD1-CB 4.04Å; Y15-R256 HydrophobicContact CE1-CB 3.15Å; Y15-R256 HydrophobicContact CE1-CG 3.98Å; E246-R256 IonicContact OE2-NH1 3.77Å; E246-R256 PolarHBondContact OE2-NH1 2.81Å; L252-R256 WeakPolarHBondContact O-CG 3.44Å; L252-R256 PolarHBondContact O-N 3.47Å; N253-R256 PolarHBondContact O-N 2.89Å; N253-R256 PolarHBondContact OD1-NH1 2.84Å; R256-Y258 VanDerWaalsContact C-N 3.32Å; R256-Y258 PolarHBondContact O-N 3.33Å; R256-R259 PolarHBondContact O-N 3.02Å; R256-L260 WeakPolarHBondContact O-CB 3.36Å; R256-L260 PolarHBondContact O-N 2.71Å
257	H	82.4	Confident	83.7	Confident	47 Å²	47	59.1 Å²	59.1	22%	0.218	30%	0.301	C	S	.	.	H	α-helix	trans	-61.1	-40	174.9	-178	76.4	0	0	0	112.2	N253 T261	N253-H257 VanDerWaalsContact O-CB 3.28Å; N253-H257 WeakPolarHBondContact O-CB 3.42Å; N253-H257 PolarHBondContact O-N 2.87Å; H257-T261 WeakPolarHBondContact O-CB 3.39Å; H257-T261 PolarHBondContact O-N 2.83Å; H257-T261 PolarHBondContact O-OG1 2.96Å
258	Y	85.2	Confident	84.7	Confident	144 Å²	144	53.4 Å²	53.4	57%	0.565	27%	0.27	S	S	*	.	H	α-helix	trans	-61.8	-47	174.2	173.1	-99.5	0	0	0	112	K254 T255 R256 T261 K262	K254-Y258 WeakPolarHBondContact O-CB 3.12Å; K254-Y258 PolarHBondContact O-N 2.96Å; T255-Y258 PolarHBondContact O-N 3.5Å; R256-Y258 VanDerWaalsContact C-N 3.32Å; R256-Y258 PolarHBondContact O-N 3.33Å; Y258-T261 PolarHBondContact O-N 3.34Å; Y258-K262 VanDerWaalsContact O-CB 3.32Å; Y258-K262 WeakPolarHBondContact O-CB 3.35Å; Y258-K262 PolarHBondContact O-N 2.83Å
259	R	88.5	Confident	85.9	Confident	121 Å²	121	51.8 Å²	51.8	46%	0.457	26%	0.258	S	S	.	.	H	α-helix	trans	-59.3	-48.1	177.2	-73.2	175.9	-178.5	175.2	1.2	111.7	E234 T255 R256 T261 K262 T263	E234-R259 IonicContact OE1-CZ 3.95Å; E234-R259 IonicContact OE1-NH1 2.75Å; E234-R259 PolarHBondContact OE1-NH1 3.34Å; T255-R259 WeakPolarHBondContact O-CG 3.41Å; T255-R259 PolarHBondContact O-N 2.71Å; R256-R259 PolarHBondContact O-N 3.02Å; R259-T261 PolarHBondContact O-N 3.48Å; R259-K262 WeakPolarHBondContact O-CB 2.99Å; R259-K262 PolarHBondContact O-N 3Å; R259-T263 WeakPolarHBondContact O-CG2 3.48Å; R259-T263 PolarHBondContact O-N 3.46Å; R259-T263 PolarHBondContact O-OG1 2.88Å
260	L	88.7	Confident	86.9	Confident	8 Å²	8	47.9 Å²	47.9	4%	0.042	24%	0.237	C	C	.	.	H	α-helix	trans	-57.2	-49.7	176.5	-178.7	161.5	0	0	0	111.4	L12 Y15 I231 R256 K262 T263 M264 N332	L12-L260 HydrophobicContact CD2-CD1 3.73Å; L12-L260 HydrophobicContact CD2-CD2 4.42Å; L12-L260 HydrophobicContact CG-CD1 4.26Å; Y15-L260 HydrophobicContact CD2-CD1 3.96Å; Y15-L260 HydrophobicContact CE2-CD1 3.74Å; I231-L260 HydrophobicContact CG2-CB 4.36Å; I231-L260 HydrophobicContact CG2-CD1 4.37Å; I231-L260 HydrophobicContact CG2-CG 4.36Å; R256-L260 WeakPolarHBondContact O-CB 3.36Å; R256-L260 PolarHBondContact O-N 2.71Å; L260-K262 VanDerWaalsContact C-N 3.28Å; L260-K262 PolarHBondContact O-N 3.34Å; L260-T263 PolarHBondContact O-N 3.36Å; L260-T263 PolarHBondContact O-OG1 2.79Å; L260-M264 HydrophobicContact CD2-CE 4.29Å; L260-M264 HydrophobicContact CD2-CG 3.97Å; L260-M264 HydrophobicContact CD2-SD 3.29Å; L260-M264 WeakPolarHBondContact CD2-SD 3.26Å; L260-M264 HydrophobicContact CG-SD 4.44Å; L260-M264 WeakPolarHBondContact O-CB 3.44Å; L260-M264 VanDerWaalsContact O-CG 3.25Å; L260-M264 WeakPolarHBondContact O-CG 3.35Å; L260-M264 PolarHBondContact O-N 2.89Å; L260-N332 WeakPolarHBondContact CD2-ND2 3.34Å
261	T	87.9	Confident	87.5	Confident	21 Å²	21	46.4 Å²	46.4	13%	0.129	23%	0.226	C	C	.	.	H	α-helix	trans	-65.4	-35.9	-178.4	-57.3	0	0	0	0	111.5	H257 Y258 R259 N265 N332	H257-T261 WeakPolarHBondContact O-CB 3.39Å; H257-T261 PolarHBondContact O-N 2.83Å; H257-T261 PolarHBondContact O-OG1 2.96Å; Y258-T261 PolarHBondContact O-N 3.34Å; R259-T261 PolarHBondContact O-N 3.48Å; T261-N265 WeakPolarHBondContact O-CB 2.97Å; T261-N265 PolarHBondContact O-N 3.43Å; T261-N265 PolarHBondContact O-ND2 3.23Å; T261-N332 PolarHBondContact OG1-ND2 2.98Å; T261-N332 VanDerWaalsContact OG1-ND2 3.11Å
262	K	90.5	Very high	87.9	Confident	102 Å²	102	44.7 Å²	44.7	44%	0.443	20%	0.203	S	C	.	.	H	α-helix	trans	-61.4	-54.1	175.8	-178.2	-172	167.7	-165.6	0	111.3	Y258 R259 L260 M264 N265 E266	Y258-K262 VanDerWaalsContact O-CB 3.32Å; Y258-K262 WeakPolarHBondContact O-CB 3.35Å; Y258-K262 PolarHBondContact O-N 2.83Å; R259-K262 WeakPolarHBondContact O-CB 2.99Å; R259-K262 PolarHBondContact O-N 3Å; L260-K262 VanDerWaalsContact C-N 3.28Å; L260-K262 PolarHBondContact O-N 3.34Å; K262-M264 PolarHBondContact O-N 3.2Å; K262-N265 PolarHBondContact O-N 3.49Å; K262-E266 WeakPolarHBondContact CE-OE1 3.45Å; K262-E266 IonicContact NZ-OE1 3.76Å; K262-E266 WeakPolarHBondContact O-CG 3.42Å; K262-E266 PolarHBondContact O-N 3.45Å
263	T	90.3	Very high	88.3	Confident	15 Å²	15	43.1 Å²	43.1	9%	0.092	19%	0.194	C	C	.	.	H	α-helix	trans	-66.6	-37.6	-177.7	58.9	0	0	0	0	112.2	D227 I231 R259 L260 N265 E266 A267	D227-T263 HydrophobicContact CB-CG2 3.94Å; I231-T263 HydrophobicContact CD1-CG2 3.42Å; I231-T263 VanDerWaalsContact CD1-CG2 3.42Å; I231-T263 WeakPolarHBondContact CD1-OG1 3.27Å; R259-T263 WeakPolarHBondContact O-CG2 3.48Å; R259-T263 PolarHBondContact O-N 3.46Å; R259-T263 PolarHBondContact O-OG1 2.88Å; L260-T263 PolarHBondContact O-N 3.36Å; L260-T263 PolarHBondContact O-OG1 2.79Å; T263-N265 VanDerWaalsContact C-N 3.33Å; T263-N265 PolarHBondContact O-N 3.29Å; T263-E266 PolarHBondContact O-N 2.71Å; T263-A267 WeakPolarHBondContact O-CB 3.47Å; T263-A267 PolarHBondContact O-N 3.03Å
264	M	90.6	Very high	88.8	Confident	8 Å²	8	43.4 Å²	43.4	4%	0.039	20%	0.195	C	C	.	.	H	α-helix	trans	-56.2	-46.2	171.7	-81.5	-172.3	131.1	0	0	112.1	L260 K262 A268 L325 G328 N332	L260-M264 HydrophobicContact CD2-CE 4.29Å; L260-M264 HydrophobicContact CD2-CG 3.97Å; L260-M264 HydrophobicContact CD2-SD 3.29Å; L260-M264 WeakPolarHBondContact CD2-SD 3.26Å; L260-M264 HydrophobicContact CG-SD 4.44Å; L260-M264 WeakPolarHBondContact O-CB 3.44Å; L260-M264 VanDerWaalsContact O-CG 3.25Å; L260-M264 WeakPolarHBondContact O-CG 3.35Å; L260-M264 PolarHBondContact O-N 2.89Å; K262-M264 PolarHBondContact O-N 3.2Å; M264-A268 VanDerWaalsContact O-CB 3.29Å; M264-A268 WeakPolarHBondContact O-CB 3.33Å; M264-A268 PolarHBondContact O-N 3.39Å; M264-L325 HydrophobicContact CE-CD2 4.39Å; M264-L325 WeakPolarHBondContact CE-O 3.25Å; M264-L325 HydrophobicContact CG-CB 4.03Å; M264-L325 HydrophobicContact CG-CD2 4.31Å; M264-L325 WeakPolarHBondContact CG-O 3.46Å; M264-G328 WeakPolarHBondContact CE-O 3.24Å; M264-N332 HydrophobicContact CE-CB 3.97Å; M264-N332 HydrophobicContact SD-CB 3.64Å; M264-N332 PolarHBondContact SD-ND2 3.34Å
265	N	91.1	Very high	89.3	Confident	44 Å²	44	38 Å²	38	24%	0.235	17%	0.172	C	C	.	.	H	α-helix	trans	-70.1	-41.3	-179.6	-73.4	-19.7	0	0	0	111.8	T261 K262 T263 A268 I269 H356	T261-N265 WeakPolarHBondContact O-CB 2.97Å; T261-N265 PolarHBondContact O-N 3.43Å; T261-N265 PolarHBondContact O-ND2 3.23Å; K262-N265 PolarHBondContact O-N 3.49Å; T263-N265 VanDerWaalsContact C-N 3.33Å; T263-N265 PolarHBondContact O-N 3.29Å; N265-A268 PolarHBondContact O-N 3.13Å; N265-I269 WeakPolarHBondContact O-CB 2.89Å; N265-I269 WeakPolarHBondContact O-CD1 3.47Å; N265-I269 WeakPolarHBondContact O-CG1 3.43Å; N265-I269 PolarHBondContact O-N 3.34Å; N265-H356 PolarHBondContact OD1-NE2 3.28Å
266	E	91.8	Very high	89.5	Confident	55 Å²	55	38.9 Å²	38.9	26%	0.257	17%	0.174	S	C	.	.	H	α-helix	trans	-60.7	-45.8	175.5	-73.2	170.8	163.9	0	0	111.1	I43 L224 K262 T263 I269 Y270	I43-E266 HydrophobicContact CD1-CB 4.43Å; I43-E266 HydrophobicContact CD1-CG 4.4Å; L224-E266 HydrophobicContact CD2-CB 4.08Å; K262-E266 WeakPolarHBondContact CE-OE1 3.45Å; K262-E266 IonicContact NZ-OE1 3.76Å; K262-E266 WeakPolarHBondContact O-CG 3.42Å; K262-E266 PolarHBondContact O-N 3.45Å; T263-E266 PolarHBondContact O-N 2.71Å; E266-I269 PolarHBondContact O-N 3.2Å; E266-Y270 PolarHBondContact O-N 3.34Å
267	A	91.5	Very high	89.6	Confident	3 Å²	3	43.8 Å²	43.8	3%	0.025	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-40.1	175.6	0	0	0	0	0	112.5	L220 T263 Y270 I271 A326	L220-A267 HydrophobicContact CD1-CB 4.5Å; T263-A267 WeakPolarHBondContact O-CB 3.47Å; T263-A267 PolarHBondContact O-N 3.03Å; A267-Y270 PolarHBondContact O-N 3.03Å; A267-I271 WeakPolarHBondContact O-CG1 3.43Å; A267-I271 PolarHBondContact O-N 2.59Å; A267-I271 VanDerWaalsContact O-N 3.07Å; A267-A326 HydrophobicContact CB-CB 3.83Å
268	A	92.3	Very high	89.7	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.8	-38.6	176.2	0	0	0	0	0	112.7	M264 N265 I271 R272 A326 P357	M264-A268 VanDerWaalsContact O-CB 3.29Å; M264-A268 WeakPolarHBondContact O-CB 3.33Å; M264-A268 PolarHBondContact O-N 3.39Å; N265-A268 PolarHBondContact O-N 3.13Å; A268-I271 PolarHBondContact O-N 2.78Å; A268-R272 WeakPolarHBondContact O-CB 3.48Å; A268-R272 PolarHBondContact O-N 2.82Å; A268-A326 HydrophobicContact CB-CB 4.38Å; A268-P357 HydrophobicContact CB-CB 4.06Å; A268-P357 HydrophobicContact CB-CG 4.05Å
269	I	92.3	Very high	89.9	Confident	21 Å²	21	42.6 Å²	42.6	11%	0.108	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-44.9	174.5	-69.3	162.6	0	0	0	109.8	I40 I43 N265 E266 I271 R272 Q273 P357	I40-I269 HydrophobicContact CG2-CG1 4.21Å; I40-I269 HydrophobicContact CG2-CG2 3.84Å; I43-I269 HydrophobicContact CD1-CB 3.78Å; I43-I269 HydrophobicContact CD1-CD1 4.1Å; I43-I269 HydrophobicContact CD1-CG2 3.54Å; I43-I269 HydrophobicContact CG1-CG2 3.9Å; N265-I269 WeakPolarHBondContact O-CB 2.89Å; N265-I269 WeakPolarHBondContact O-CD1 3.47Å; N265-I269 WeakPolarHBondContact O-CG1 3.43Å; N265-I269 PolarHBondContact O-N 3.34Å; E266-I269 PolarHBondContact O-N 3.2Å; I269-I271 PolarHBondContact O-N 3.16Å; I269-R272 PolarHBondContact O-N 3.25Å; I269-R272 VanDerWaalsContact O-N 3.17Å; I269-Q273 HydrophobicContact CG2-CG 4.31Å; I269-Q273 WeakPolarHBondContact O-CG 3.49Å; I269-Q273 PolarHBondContact O-N 3.44Å; I269-P357 HydrophobicContact CG1-CB 3.82Å; I269-P357 HydrophobicContact CG1-CG 3.85Å
270	Y	91.8	Very high	90	Very high	19 Å²	19	37 Å²	37	8%	0.075	19%	0.189	C	C	.	.	H	α-helix	trans	-56.7	-49.8	176.9	178.6	-91.4	0	0	0	111.8	I45 L86 P88 L220 L224 E266 A267 R272 Q273 L274	I45-Y270 HydrophobicContact CD1-CE2 4.45Å; L86-Y270 PolarHBondContact O-OH 3.27Å; P88-Y270 WeakPolarHBondContact CD-OH 3.47Å; L220-Y270 HydrophobicContact CB-CD1 4.07Å; L220-Y270 HydrophobicContact CB-CE1 3.86Å; L220-Y270 HydrophobicContact CD1-CD1 4.21Å; L220-Y270 HydrophobicContact CD2-CD1 4Å; L220-Y270 HydrophobicContact CD2-CE1 3.86Å; L220-Y270 HydrophobicContact CG-CD1 4.32Å; L220-Y270 HydrophobicContact CG-CE1 4.34Å; L224-Y270 HydrophobicContact CD1-CD1 4.45Å; L224-Y270 HydrophobicContact CD1-CD2 4.41Å; L224-Y270 HydrophobicContact CD1-CG 4.02Å; E266-Y270 PolarHBondContact O-N 3.34Å; A267-Y270 PolarHBondContact O-N 3.03Å; Y270-R272 VanDerWaalsContact C-N 3.31Å; Y270-R272 PolarHBondContact O-N 2.82Å; Y270-Q273 PolarHBondContact O-N 3.3Å; Y270-L274 HydrophobicContact CE1-CD1 4.18Å; Y270-L274 WeakPolarHBondContact O-CB 3.41Å; Y270-L274 PolarHBondContact O-N 2.87Å
271	I	92.5	Very high	90.1	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-40.5	177.3	-65.9	-179.8	0	0	0	111.1	L220 A267 A268 I269 L274 A275 F286 I323 A326 L361	L220-I271 HydrophobicContact CD1-CD1 4.03Å; L220-I271 HydrophobicContact CD1-CG1 3.93Å; L220-I271 HydrophobicContact CD2-CD1 4.32Å; L220-I271 HydrophobicContact CD2-CG1 3.94Å; A267-I271 WeakPolarHBondContact O-CG1 3.43Å; A267-I271 PolarHBondContact O-N 2.59Å; A267-I271 VanDerWaalsContact O-N 3.07Å; A268-I271 PolarHBondContact O-N 2.78Å; I269-I271 PolarHBondContact O-N 3.16Å; I271-L274 PolarHBondContact O-N 2.88Å; I271-A275 WeakPolarHBondContact O-CB 3.47Å; I271-A275 PolarHBondContact O-N 3.1Å; I271-F286 HydrophobicContact CG2-CE2 4.17Å; I271-F286 HydrophobicContact CG2-CZ 3.86Å; I271-I323 HydrophobicContact CD1-CB 4.48Å; I271-I323 HydrophobicContact CD1-CD1 4.42Å; I271-I323 HydrophobicContact CD1-CG1 3.84Å; I271-A326 HydrophobicContact CD1-CB 3.42Å; I271-A326 VanDerWaalsContact CD1-CB 3.42Å; I271-A326 HydrophobicContact CG1-CB 4.34Å; I271-L361 HydrophobicContact CB-CD1 4.13Å; I271-L361 HydrophobicContact CD1-CD1 4.49Å; I271-L361 HydrophobicContact CG2-CD1 3.81Å; I271-L361 HydrophobicContact CG2-CD2 4.02Å
272	R	91.5	Very high	90.3	Very high	40 Å²	40	40.7 Å²	40.7	15%	0.151	22%	0.219	C	C	.	.	H	α-helix	trans	-64.4	-43.5	-179.8	-168	72.2	-152.2	150.6	15	111.6	I40 A268 I269 Y270 L274 A275 D276 G281 P282	I40-R272 HydrophobicContact CD1-CG 4.35Å; A268-R272 WeakPolarHBondContact O-CB 3.48Å; A268-R272 PolarHBondContact O-N 2.82Å; I269-R272 PolarHBondContact O-N 3.25Å; I269-R272 VanDerWaalsContact O-N 3.17Å; Y270-R272 VanDerWaalsContact C-N 3.31Å; Y270-R272 PolarHBondContact O-N 2.82Å; R272-L274 VanDerWaalsContact C-N 3.33Å; R272-L274 PolarHBondContact O-N 3.45Å; R272-A275 PolarHBondContact O-N 3.06Å; R272-D276 IonicContact CZ-OD1 2.69Å; R272-D276 IonicContact NE-OD1 3.52Å; R272-D276 PolarHBondContact NE-OD1 3.21Å; R272-D276 IonicContact NE-OD2 3.76Å; R272-D276 IonicContact NH2-OD1 3Å; R272-D276 PolarHBondContact NH2-OD1 3.3Å; R272-D276 WeakPolarHBondContact O-CB 3.27Å; R272-D276 VanDerWaalsContact O-CG 3.23Å; R272-D276 PolarHBondContact O-N 3.18Å; R272-G281 PolarHBondContact NH1-O 3.11Å; R272-G281 PolarHBondContact NH2-O 3.12Å; R272-P282 PolarHBondContact NH1-O 3.35Å
273	Q	89.8	Confident	90.5	Very high	37 Å²	37	36.8 Å²	36.8	17%	0.173	21%	0.205	C	C	.	.	H	α-helix	trans	-59.2	-45.3	173.2	-71.4	173.7	-26.2	0	0	111.1	I269 Y270 D276 L277	I269-Q273 HydrophobicContact CG2-CG 4.31Å; I269-Q273 WeakPolarHBondContact O-CG 3.49Å; I269-Q273 PolarHBondContact O-N 3.44Å; Y270-Q273 PolarHBondContact O-N 3.3Å; Q273-D276 PolarHBondContact O-N 2.95Å; Q273-L277 VanDerWaalsContact O-CG 3.29Å; Q273-L277 WeakPolarHBondContact O-CG 3.27Å; Q273-L277 PolarHBondContact O-N 2.97Å
274	L	88.3	Confident	90.8	Very high	13 Å²	13	36.1 Å²	36.1	7%	0.068	20%	0.201	C	C	.	.	H	α-helix	trans	-62.5	-44.4	177.4	-173.4	157.2	0	0	0	111.9	L86 Y270 I271 R272 D276 L277 R278 W280	L86-L274 HydrophobicContact CB-CD1 4.38Å; L86-L274 HydrophobicContact CD2-CD1 3.6Å; L86-L274 HydrophobicContact CD2-CD2 3.68Å; L86-L274 HydrophobicContact CD2-CG 4.32Å; Y270-L274 HydrophobicContact CE1-CD1 4.18Å; Y270-L274 WeakPolarHBondContact O-CB 3.41Å; Y270-L274 PolarHBondContact O-N 2.87Å; I271-L274 PolarHBondContact O-N 2.88Å; R272-L274 VanDerWaalsContact C-N 3.33Å; R272-L274 PolarHBondContact O-N 3.45Å; L274-D276 VanDerWaalsContact C-N 3.34Å; L274-D276 PolarHBondContact O-N 3.45Å; L274-L277 PolarHBondContact O-N 3.36Å; L274-R278 HydrophobicContact CD2-CG 4.36Å; L274-R278 WeakPolarHBondContact O-CG 3.36Å; L274-R278 PolarHBondContact O-N 3.42Å; L274-W280 HydrophobicContact CD2-CE3 4.15Å; L274-W280 HydrophobicContact CD2-CH2 3.9Å; L274-W280 HydrophobicContact CD2-CZ2 4.45Å; L274-W280 HydrophobicContact CD2-CZ3 3.7Å
275	A	89.7	Confident	91	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64	-38.3	177.8	0	0	0	0	0	112.5	I271 R272 R278 C279 W280 I284	I271-A275 WeakPolarHBondContact O-CB 3.47Å; I271-A275 PolarHBondContact O-N 3.1Å; R272-A275 PolarHBondContact O-N 3.06Å; A275-R278 PolarHBondContact O-N 3.21Å; A275-C279 WeakPolarHBondContact O-CA 3.3Å; A275-C279 PolarHBondContact O-N 3.21Å; A275-W280 HydrophobicContact CB-CB 4.2Å; A275-W280 HydrophobicContact CB-CE3 4.21Å; A275-W280 PolarHBondContact O-N 3.46Å; A275-I284 HydrophobicContact CB-CD1 3.42Å; A275-I284 VanDerWaalsContact CB-CD1 3.42Å
276	D	88.4	Confident	91.2	Very high	83 Å²	83	33.7 Å²	33.7	44%	0.444	19%	0.188	S	C	.	.	H	α-helix	trans	-69.9	-37.6	176.4	-68.8	-20.8	0	0	0	110.9	R272 Q273 L274 R278 C279	R272-D276 IonicContact CZ-OD1 2.69Å; R272-D276 IonicContact NE-OD1 3.52Å; R272-D276 PolarHBondContact NE-OD1 3.21Å; R272-D276 IonicContact NE-OD2 3.76Å; R272-D276 IonicContact NH2-OD1 3Å; R272-D276 PolarHBondContact NH2-OD1 3.3Å; R272-D276 WeakPolarHBondContact O-CB 3.27Å; R272-D276 VanDerWaalsContact O-CG 3.23Å; R272-D276 PolarHBondContact O-N 3.18Å; Q273-D276 PolarHBondContact O-N 2.95Å; L274-D276 VanDerWaalsContact C-N 3.34Å; L274-D276 PolarHBondContact O-N 3.45Å; D276-R278 VanDerWaalsContact C-N 3.35Å; D276-R278 PolarHBondContact O-N 2.91Å; D276-C279 PolarHBondContact O-N 3.33Å
277	L	86.4	Confident	91.4	Very high	135 Å²	135	31.1 Å²	31.1	71%	0.707	18%	0.176	S	C	*	.	H	α-helix	trans	-64.6	-36	173.4	-72.6	173.3	0	0	0	112.9	Q273 L274	Q273-L277 VanDerWaalsContact O-CG 3.29Å; Q273-L277 WeakPolarHBondContact O-CG 3.27Å; Q273-L277 PolarHBondContact O-N 2.97Å; L274-L277 PolarHBondContact O-N 3.36Å
278	R	85.8	Confident	91.3	Very high	54 Å²	54	31.3 Å²	31.3	20%	0.204	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-2.1	180	-64.5	-174	-169.8	178.7	9	114.3	E84 T85 L274 A275 D276 W280	E84-R278 WeakPolarHBondContact OE2-CD 3.39Å; E84-R278 IonicContact OE2-CZ 3.5Å; E84-R278 IonicContact OE2-NE 2.82Å; E84-R278 IonicContact OE2-NH1 3.57Å; E84-R278 PolarHBondContact OE2-NH1 2.92Å; T85-R278 PolarHBondContact O-NH1 3.01Å; T85-R278 PolarHBondContact O-NH2 3.14Å; L274-R278 HydrophobicContact CD2-CG 4.36Å; L274-R278 WeakPolarHBondContact O-CG 3.36Å; L274-R278 PolarHBondContact O-N 3.42Å; A275-R278 PolarHBondContact O-N 3.21Å; D276-R278 VanDerWaalsContact C-N 3.35Å; D276-R278 PolarHBondContact O-N 2.91Å; R278-W280 VanDerWaalsContact C-N 3.28Å; R278-W280 HydrophobicContact CB-CD2 4.22Å; R278-W280 HydrophobicContact CB-CG 4.05Å; R278-W280 PolarHBondContact O-N 3.36Å
279	C	88.5	Confident	91	Very high	112 Å²	112	31.9 Å²	31.9	76%	0.757	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	35.7	-175.3	-58.6	0	0	0	0	114.1	A275 D276 G281	A275-C279 WeakPolarHBondContact O-CA 3.3Å; A275-C279 PolarHBondContact O-N 3.21Å; D276-C279 PolarHBondContact O-N 3.33Å; C279-G281 PolarHBondContact O-N 2.72Å
280	W	90.9	Very high	90.1	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.008	19%	0.192	C	C	.	.			trans	-70.2	-7.2	179.1	-72.4	-10	0	0	0	114.6	E84 L86 H213 V215 L274 A275 R278 I284 F286 T379 V381	E84-W280 VanDerWaalsContact OE2-CZ2 3.32Å; E84-W280 WeakPolarHBondContact OE2-CZ2 3.07Å; L86-W280 HydrophobicContact CD2-CH2 3.72Å; L86-W280 HydrophobicContact CD2-CZ3 4.17Å; H213-W280 HydrophobicContact CB-CZ2 4.17Å; H213-W280 AromaticContact CD2-CD1 3.75Å; H213-W280 AromaticContact CD2-NE1 3.47Å; H213-W280 PolarHBondContact CD2-NE1 2.91Å; H213-W280 AromaticContact CE1-CD1 3.75Å; H213-W280 AromaticContact CE1-NE1 3.36Å; H213-W280 PolarHBondContact CE1-NE1 3.45Å; H213-W280 AromaticContact CG-NE1 3.49Å; H213-W280 AromaticContact ND1-NE1 3.4Å; H213-W280 PolarHBondContact ND1-NE1 3Å; H213-W280 AromaticContact NE2-CD1 3.41Å; H213-W280 AromaticContact NE2-NE1 3.38Å; H213-W280 PolarHBondContact NE2-NE1 3.39Å; V215-W280 HydrophobicContact CG2-CH2 4.49Å; L274-W280 HydrophobicContact CD2-CE3 4.15Å; L274-W280 HydrophobicContact CD2-CH2 3.9Å; L274-W280 HydrophobicContact CD2-CZ2 4.45Å; L274-W280 HydrophobicContact CD2-CZ3 3.7Å; A275-W280 HydrophobicContact CB-CB 4.2Å; A275-W280 HydrophobicContact CB-CE3 4.21Å; A275-W280 PolarHBondContact O-N 3.46Å; R278-W280 VanDerWaalsContact C-N 3.28Å; R278-W280 HydrophobicContact CB-CD2 4.22Å; R278-W280 HydrophobicContact CB-CG 4.05Å; R278-W280 PolarHBondContact O-N 3.36Å; W280-I284 HydrophobicContact CB-CD1 4.11Å; W280-I284 HydrophobicContact CE3-CD1 4.08Å; W280-I284 HydrophobicContact CE3-CG2 4.34Å; W280-F286 AromaticContact CZ3-CE1 3.94Å; W280-F286 HydrophobicContact CZ3-CE1 3.94Å; W280-F286 HydrophobicContact CZ3-CZ 4.21Å; W280-T379 HydrophobicContact CB-CG2 4.02Å; W280-T379 HydrophobicContact CG-CG2 4.45Å; W280-T379 WeakPolarHBondContact O-CB 3.45Å; W280-T379 WeakPolarHBondContact O-CG2 3.48Å; W280-T379 PolarHBondContact O-OG1 3.5Å; W280-V381 HydrophobicContact CD2-CG2 4.5Å; W280-V381 HydrophobicContact CE3-CG2 4.22Å; W280-V381 HydrophobicContact CH2-CG1 4.01Å; W280-V381 HydrophobicContact CH2-CG2 3.94Å; W280-V381 HydrophobicContact CZ2-CG2 4.27Å; W280-V381 HydrophobicContact CZ3-CG2 3.94Å
281	G	90.4	Very high	88.7	Confident	26 Å²	26	34.4 Å²	34.4	27%	0.268	20%	0.195	S	C	.	.			trans	84	-172.5	-179.9	0	0	0	0	0	114.4	R272 C279	R272-G281 PolarHBondContact NH1-O 3.11Å; R272-G281 PolarHBondContact NH2-O 3.12Å; C279-G281 PolarHBondContact O-N 2.72Å
282	P	91.7	Very high	86.9	Confident	81 Å²	81	34.8 Å²	34.8	53%	0.526	20%	0.198	S	C	.	.	S	Bend	trans	-79.8	-30.5	-174.2	29.7	-33.8	0	0	0	113.8	R272 D378	R272-P282 PolarHBondContact NH1-O 3.35Å; P282-D378 VanDerWaalsContact CD-OD2 3.26Å; P282-D378 WeakPolarHBondContact CD-OD2 3.46Å; P282-D378 VanDerWaalsContact CG-OD2 3.3Å; P282-D378 WeakPolarHBondContact CG-OD2 3.35Å
283	S	94.8	Very high	85	Confident	21 Å²	21	33.9 Å²	33.9	15%	0.147	20%	0.199	C	C	.	.			trans	-119.4	124.3	-173.5	66.3	0	0	0	0	112	G360 H377 D378 T379	S283-G360 WeakPolarHBondContact CA-O 3.25Å; S283-H377 WeakPolarHBondContact OG-CA 3.5Å; S283-D378 PolarHBondContact N-OD2 3.18Å; S283-D378 PolarHBondContact O-N 2.99Å; S283-D378 VanDerWaalsContact O-N 3.14Å; S283-D378 PolarHBondContact OG-N 2.69Å; S283-D378 PolarHBondContact OG-OD2 3.24Å; S283-T379 PolarHBondContact O-N 2.71Å; S283-T379 VanDerWaalsContact O-N 3.12Å; S283-T379 PolarHBondContact O-OG1 2.82Å
284	I	96.3	Very high	83.1	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	126.4	-167.2	-44.8	-179.9	0	0	0	109.2	A275 W280 F286 G360 L361 T362 H377 V381	A275-I284 HydrophobicContact CB-CD1 3.42Å; A275-I284 VanDerWaalsContact CB-CD1 3.42Å; W280-I284 HydrophobicContact CB-CD1 4.11Å; W280-I284 HydrophobicContact CE3-CD1 4.08Å; W280-I284 HydrophobicContact CE3-CG2 4.34Å; I284-F286 HydrophobicContact CB-CE2 4.25Å; I284-F286 HydrophobicContact CB-CZ 4.41Å; I284-F286 HydrophobicContact CG2-CD2 4.35Å; I284-F286 HydrophobicContact CG2-CE1 4.01Å; I284-F286 HydrophobicContact CG2-CE2 3.81Å; I284-F286 HydrophobicContact CG2-CZ 3.61Å; I284-G360 PolarHBondContact N-O 3.4Å; I284-L361 HydrophobicContact CB-CD2 4.03Å; I284-L361 HydrophobicContact CD1-CD2 3.79Å; I284-L361 HydrophobicContact CG1-CD2 4.06Å; I284-T362 PolarHBondContact O-N 2.89Å; I284-H377 PolarHBondContact O-CD2 2.94Å; I284-V381 HydrophobicContact CG2-CG2 3.7Å
285	L	96.4	Very high	81.3	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	109.6	175.7	-179.6	59	0	0	0	110.2	V287 T362 M364 L369 H377 T379 L380 V381	L285-V287 HydrophobicContact CG-CG2 4.22Å; L285-T362 HydrophobicContact CD1-CG2 4.02Å; L285-M364 HydrophobicContact CD1-CB 4.15Å; L285-M364 HydrophobicContact CD1-CG 3.69Å; L285-M364 HydrophobicContact CD1-SD 3.68Å; L285-M364 HydrophobicContact CD2-SD 4.49Å; L285-L369 HydrophobicContact CD2-CD1 4.22Å; L285-H377 HydrophobicContact CB-CB 3.79Å; L285-T379 PolarHBondContact N-O 2.77Å; L285-L380 HydrophobicContact CB-CD1 4.21Å; L285-L380 HydrophobicContact CD2-CD1 3.79Å; L285-L380 HydrophobicContact CG-CD1 3.99Å; L285-V381 PolarHBondContact O-N 2.97Å
286	F	95.4	Very high	79.4	Confident	1 Å²	1	35.9 Å²	35.9	0%	0.004	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	131.4	171.5	-61.2	-76.1	0	0	0	110.3	F218 I271 W280 I284 I323 L361 T362 L363 M364 V381	F218-F286 HydrophobicContact CE1-CD1 4.09Å; F218-F286 HydrophobicContact CE2-CB 4.42Å; F218-F286 HydrophobicContact CZ-CB 4.32Å; F218-F286 HydrophobicContact CZ-CD1 4.31Å; I271-F286 HydrophobicContact CG2-CE2 4.17Å; I271-F286 HydrophobicContact CG2-CZ 3.86Å; W280-F286 AromaticContact CZ3-CE1 3.94Å; W280-F286 HydrophobicContact CZ3-CE1 3.94Å; W280-F286 HydrophobicContact CZ3-CZ 4.21Å; I284-F286 HydrophobicContact CB-CE2 4.25Å; I284-F286 HydrophobicContact CB-CZ 4.41Å; I284-F286 HydrophobicContact CG2-CD2 4.35Å; I284-F286 HydrophobicContact CG2-CE1 4.01Å; I284-F286 HydrophobicContact CG2-CE2 3.81Å; I284-F286 HydrophobicContact CG2-CZ 3.61Å; F286-I323 HydrophobicContact CB-CD1 4.36Å; F286-I323 HydrophobicContact CD1-CD1 3.76Å; F286-I323 HydrophobicContact CD2-CD1 4.18Å; F286-I323 HydrophobicContact CE1-CD1 4.05Å; F286-I323 HydrophobicContact CE2-CD1 4.43Å; F286-I323 HydrophobicContact CG-CD1 3.84Å; F286-I323 HydrophobicContact CZ-CD1 4.38Å; F286-L361 HydrophobicContact CE2-CD2 4.22Å; F286-T362 PolarHBondContact N-O 2.92Å; F286-L363 HydrophobicContact CB-CD1 3.66Å; F286-L363 CarbonylContact O-C 3.5Å; F286-L363 WeakPolarHBondContact O-CA 3.41Å; F286-M364 PolarHBondContact O-N 2.88Å; F286-V381 CarbonylContact C-O 3.6Å; F286-V381 WeakPolarHBondContact CA-O 3.34Å; F286-V381 HydrophobicContact CD1-CB 3.67Å; F286-V381 HydrophobicContact CD1-CG1 3.91Å; F286-V381 HydrophobicContact CD1-CG2 4.17Å; F286-V381 HydrophobicContact CE1-CB 3.94Å; F286-V381 HydrophobicContact CE1-CG1 4.04Å; F286-V381 HydrophobicContact CE1-CG2 3.98Å
287	V	94	Very high	77.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	112.4	179.3	-174.4	0	0	0	0	109.5	F218 L285 M364 V366 L369 L380 V381 I382 S383 A386	F218-V287 VanDerWaalsContact CE2-O 3.24Å; F218-V287 WeakPolarHBondContact CE2-O 3.31Å; F218-V287 WeakPolarHBondContact CZ-O 3.32Å; L285-V287 HydrophobicContact CG-CG2 4.22Å; V287-M364 VanDerWaalsContact CA-O 3.27Å; V287-M364 WeakPolarHBondContact CA-O 3.49Å; V287-V366 HydrophobicContact CG1-CB 4.33Å; V287-V366 HydrophobicContact CG1-CG2 3.78Å; V287-L369 HydrophobicContact CG2-CD1 3.95Å; V287-L380 HydrophobicContact CG2-CD1 3.68Å; V287-V381 PolarHBondContact N-O 3Å; V287-I382 HydrophobicContact CB-CG1 4.28Å; V287-I382 HydrophobicContact CB-CG2 4.5Å; V287-I382 HydrophobicContact CG2-CG1 4.45Å; V287-S383 PolarHBondContact O-N 3.04Å; V287-S383 VanDerWaalsContact O-N 3.1Å; V287-A386 WeakPolarHBondContact O-CB 3.29Å
288	D	90.6	Very high	75.6	Confident	7 Å²	7	30 Å²	30	4%	0.037	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	152.6	179.4	-157.8	9.2	0	0	0	112.9	F218 N320 L363 M364 P365 V366 S383	F218-D288 HydrophobicContact CD2-CB 3.77Å; F218-D288 HydrophobicContact CE2-CB 3.68Å; D288-N320 PolarHBondContact OD2-ND2 3.03Å; D288-L363 HydrophobicContact CB-CD1 4.26Å; D288-M364 PolarHBondContact N-O 3.09Å; D288-P365 CarbonylContact O-C 3.34Å; D288-P365 VanDerWaalsContact O-CA 3.27Å; D288-P365 WeakPolarHBondContact O-CA 3.43Å; D288-V366 WeakPolarHBondContact O-CG2 3.48Å; D288-V366 PolarHBondContact O-N 3.29Å; D288-S383 PolarHBondContact OD1-OG 2.7Å
289	A	85.3	Confident	73.2	Confident	13 Å²	13	32 Å²	32	11%	0.107	21%	0.213	C	C	.	.	S	Bend	trans	-68.5	-40.1	178.6	0	0	0	0	0	111.6	K385 A386 M389	A289-K385 HydrophobicContact CB-CB 3.83Å; A289-A386 HydrophobicContact CB-CB 4.41Å; A289-M389 HydrophobicContact CB-SD 3.64Å
290	H	73	Confident	70.6	Confident	72 Å²	72	31.2 Å²	31.2	33%	0.333	21%	0.208	S	C	.	.	S	Bend	trans	-80.9	134.9	-179.1	-60.5	-62.5	0	0	0	110.5
291	S	62.8	Low	67.8	Low	20 Å²	20	36.8 Å²	36.8	14%	0.14	24%	0.244	C	C	.	.			trans	-69.9	125.8	168.5	-179.7	0	0	0	0	107.8	A293 S294 Q295	S291-A293 PolarHBondContact O-N 2.77Å; S291-A293 VanDerWaalsContact O-N 3.13Å; S291-A293 WeakPolarHBondContact OG-CB 3.23Å; S291-A293 PolarHBondContact OG-N 3.14Å; S291-S294 PolarHBondContact O-N 3.07Å; S291-S294 PolarHBondContact O-OG 3.23Å; S291-Q295 PolarHBondContact O-N 3.12Å
292	P	54.7	Low	65.3	Low	13 Å²	13	39.2 Å²	39.2	8%	0.084	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-24	174.5	30.1	-37	0	0	0	110.1	T8 Q295 L296 L363	T8-P292 HydrophobicContact CG2-CB 3.54Å; T8-P292 HydrophobicContact CG2-CG 3.53Å; P292-Q295 PolarHBondContact O-N 3.36Å; P292-L296 WeakPolarHBondContact O-CB 3.44Å; P292-L296 WeakPolarHBondContact O-CG 3.17Å; P292-L296 PolarHBondContact O-N 3.15Å; P292-L363 HydrophobicContact CB-CD2 4.48Å
293	A	52	Low	62.7	Low	20 Å²	20	39.8 Å²	39.8	17%	0.165	28%	0.275	C	S	.	.	H	α-helix	trans	-66	-36.5	174.1	0	0	0	0	0	113	E7 S291 Q295 L296 A297	E7-A293 HydrophobicContact CB-CB 3.66Å; E7-A293 HydrophobicContact CG-CB 4.49Å; E7-A293 WeakPolarHBondContact OE2-CB 3.42Å; S291-A293 PolarHBondContact O-N 2.77Å; S291-A293 VanDerWaalsContact O-N 3.13Å; S291-A293 WeakPolarHBondContact OG-CB 3.23Å; S291-A293 PolarHBondContact OG-N 3.14Å; A293-Q295 VanDerWaalsContact C-N 3.31Å; A293-Q295 PolarHBondContact O-N 3.07Å; A293-L296 PolarHBondContact O-N 3.21Å; A293-A297 WeakPolarHBondContact O-CB 3.41Å; A293-A297 PolarHBondContact O-N 3.15Å
294	S	49.2	Very low	59.5	Low	55 Å²	55	47.5 Å²	47.5	39%	0.385	31%	0.309	S	S	.	.	H	α-helix	trans	-68.8	-32.7	177.2	47.6	0	0	0	0	111.9	S291 L296 F316	S291-S294 PolarHBondContact O-N 3.07Å; S291-S294 PolarHBondContact O-OG 3.23Å; S294-L296 VanDerWaalsContact C-N 3.31Å; S294-F316 WeakPolarHBondContact O-CD1 3.47Å; S294-F316 WeakPolarHBondContact O-CE1 3.46Å
295	Q	51.4	Low	56.5	Low	15 Å²	15	54.2 Å²	54.2	7%	0.07	35%	0.345	C	S	.	.	H	α-helix	trans	-73.7	-25.9	177.4	-65.6	177.5	-21	0	0	112.8	S291 P292 A293 S317 D319	S291-Q295 PolarHBondContact O-N 3.12Å; P292-Q295 PolarHBondContact O-N 3.36Å; A293-Q295 VanDerWaalsContact C-N 3.31Å; A293-Q295 PolarHBondContact O-N 3.07Å; Q295-S317 PolarHBondContact NE2-O 2.93Å; Q295-D319 PolarHBondContact NE2-O 2.87Å
296	L	50	Low	53.5	Low	23 Å²	23	61 Å²	61	12%	0.12	38%	0.38	C	S	.	.	H	α-helix	trans	-104	-4.1	-173.4	-64.7	178.9	0	0	0	113.4	T8 L11 L232 P292 A293 S294 V298 L321	T8-L296 HydrophobicContact CG2-CD1 4.12Å; L11-L296 HydrophobicContact CD1-CB 3.33Å; L11-L296 HydrophobicContact CD1-CD1 4.06Å; L11-L296 HydrophobicContact CD1-CD2 3.22Å; L11-L296 HydrophobicContact CD1-CG 3.62Å; L11-L296 VanDerWaalsContact CD2-O 3.31Å; L11-L296 WeakPolarHBondContact CD2-O 3.44Å; L11-L296 HydrophobicContact CG-CB 3.84Å; L11-L296 WeakPolarHBondContact CG-O 3.31Å; L232-L296 HydrophobicContact CD1-CD2 3.6Å; P292-L296 WeakPolarHBondContact O-CB 3.44Å; P292-L296 WeakPolarHBondContact O-CG 3.17Å; P292-L296 PolarHBondContact O-N 3.15Å; A293-L296 PolarHBondContact O-N 3.21Å; S294-L296 VanDerWaalsContact C-N 3.31Å; L296-V298 PolarHBondContact O-N 3.42Å; L296-L321 HydrophobicContact CD2-CD2 4.35Å
297	A	47.2	Very low	50.4	Low	56 Å²	56	68.4 Å²	68.4	46%	0.463	42%	0.419	S	S	.	.			trans	-64.7	107.2	177.1	0	0	0	0	0	110	A293	A293-A297 WeakPolarHBondContact O-CB 3.41Å; A293-A297 PolarHBondContact O-N 3.15Å
298	V	46.3	Very low	47.3	Very low	37 Å²	37	75.8 Å²	75.8	22%	0.224	46%	0.459	C	S	.	.			trans	-63.3	126.7	166.9	-179.5	0	0	0	0	107.1	L11 S239 L296 C300	L11-V298 HydrophobicContact CD2-CG2 3.48Å; L11-V298 VanDerWaalsContact CD2-CG2 3.48Å; S239-V298 VanDerWaalsContact OG-CG1 3.28Å; S239-V298 WeakPolarHBondContact OG-CG1 3.26Å; L296-V298 PolarHBondContact O-N 3.42Å; V298-C300 PolarHBondContact O-N 2.97Å
299	P	36.8	Very low	44.4	Very low	98 Å²	98	83 Å²	83	64%	0.636	50%	0.498	S	S	*	.			trans	-60.4	111.8	170	22.9	-29.6	0	0	0	108.5	P301	P299-P301 WeakPolarHBondContact O-CD 3.46Å
300	C	34	Very low	41.8	Very low	95 Å²	95	90.3 Å²	90.3	64%	0.642	53%	0.529	S	S	*	.			trans	-65	124	172	-68.8	0	0	0	0	108.2	V298 G302	V298-C300 PolarHBondContact O-N 2.97Å; C300-G302 PolarHBondContact O-N 3.31Å
301	P	31.5	Very low	39.6	Very low	119 Å²	119	93.7 Å²	93.7	77%	0.773	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	105.6	172.3	26.2	-30.2	0	0	0	108.2	P299	P299-P301 WeakPolarHBondContact O-CD 3.46Å
302	G	37.1	Very low	38	Very low	77 Å²	77	98 Å²	98	79%	0.794	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	140.8	-0.9	175.7	0	0	0	0	0	117.7	C300 E304	C300-G302 PolarHBondContact O-N 3.31Å; G302-E304 PolarHBondContact O-N 2.86Å
303	S	38.2	Very low	36.7	Very low	93 Å²	93	104 Å²	104	65%	0.65	61%	0.608	S	S	*	*			trans	-93.5	65.5	168.8	68.5	0	0	0	0	111.4	N305	S303-N305 PolarHBondContact O-N 3.47Å
304	E	27.5	Very low	35.8	Very low	182 Å²	182	110.3 Å²	110.3	85%	0.85	64%	0.636	S	S	*	*			trans	-81.5	89.8	160.9	-70.7	-179.1	-175.9	0	0	107.7	G302	G302-E304 PolarHBondContact O-N 2.86Å
305	N	33.2	Very low	35.2	Very low	141 Å²	141	114.5 Å²	114.5	75%	0.754	65%	0.654	S	S	*	*			trans	-126.3	90.5	169.3	-77.6	-37.1	0	0	0	109.3	S303	S303-N305 PolarHBondContact O-N 3.47Å
306	I	33.4	Very low	35	Very low	144 Å²	144	118.7 Å²	118.7	74%	0.738	67%	0.672	S	S	*	*			trans	35.5	88.9	135.1	-48.2	168	0	0	0	114.5
307	D	30.6	Very low	35.3	Very low	157 Å²	157	120.3 Å²	120.3	84%	0.84	69%	0.685	S	S	*	*			trans	-161.6	81.3	134.8	-87	-24.9	0	0	0	107.5	N309	D307-N309 PolarHBondContact O-N 3.43Å; D307-N309 VanDerWaalsContact O-N 3.16Å
308	N	28.7	Very low	36	Very low	154 Å²	154	121.5 Å²	121.5	82%	0.824	68%	0.678	S	S	*	*			trans	-74.3	95.8	169.8	-68.3	-37.5	0	0	0	107.7
309	N	29.3	Very low	37.2	Very low	160 Å²	160	122.2 Å²	122.2	86%	0.856	68%	0.681	S	S	*	*	S	Bend	trans	173.4	61.2	151.7	-84.3	-20.4	0	0	0	110.8	D307	D307-N309 PolarHBondContact O-N 3.43Å; D307-N309 VanDerWaalsContact O-N 3.16Å
310	E	30.3	Very low	39.4	Very low	165 Å²	165	118 Å²	118	77%	0.771	65%	0.653	S	S	*	*			trans	-174.9	90.5	155	-105.4	163.2	-155.7	0	0	106.1	D312	E310-D312 PolarHBondContact O-N 3.01Å
311	T	27.9	Very low	41.9	Very low	144 Å²	144	113.8 Å²	113.8	88%	0.883	62%	0.624	S	S	*	*			trans	-72.4	64.2	167.3	50.4	0	0	0	0	108.7	N313	T311-N313 PolarHBondContact O-N 3.3Å
312	D	28.2	Very low	44.6	Very low	109 Å²	109	108.1 Å²	108.1	58%	0.583	59%	0.588	S	S	*	*			trans	-76.9	103.8	160.5	-78.4	-5.1	0	0	0	105.1	E310 M314	E310-D312 PolarHBondContact O-N 3.01Å; D312-M314 PolarHBondContact O-N 3.2Å
313	N	27.9	Very low	47.2	Very low	141 Å²	141	104.5 Å²	104.5	75%	0.754	55%	0.55	S	S	*	.			trans	-50.2	92.7	158.9	-77.4	-32.4	0	0	0	106.5	T311 N315	T311-N313 PolarHBondContact O-N 3.3Å; N313-N315 PolarHBondContact O-N 2.92Å
314	M	34	Very low	49.6	Very low	152 Å²	152	100.7 Å²	100.7	75%	0.749	52%	0.524	S	S	*	.			trans	-66.4	79.3	166.2	-72.6	-73.3	-169.5	0	0	105.2	D312 F316	D312-M314 PolarHBondContact O-N 3.2Å; M314-F316 PolarHBondContact O-N 3.3Å
315	N	35.8	Very low	52.5	Low	142 Å²	142	93.7 Å²	93.7	76%	0.759	49%	0.492	S	S	*	.			trans	-57.1	95.5	162.5	-76	-21.3	0	0	0	104.2	N313 S317	N313-N315 PolarHBondContact O-N 2.92Å; N315-S317 PolarHBondContact O-N 3.45Å
316	F	48.3	Very low	55.3	Low	104 Å²	104	87 Å²	87	46%	0.456	46%	0.456	S	S	.	.			trans	-55.2	101.1	164.7	-77.2	-81.4	0	0	0	105.1	S294 M314 Y318	S294-F316 WeakPolarHBondContact O-CD1 3.47Å; S294-F316 WeakPolarHBondContact O-CE1 3.46Å; M314-F316 PolarHBondContact O-N 3.3Å; F316-Y318 VanDerWaalsContact C-N 3.32Å; F316-Y318 WeakPolarHBondContact O-CD2 3.37Å; F316-Y318 PolarHBondContact O-N 2.93Å
317	S	54.5	Low	58	Low	56 Å²	56	81 Å²	81	39%	0.392	43%	0.427	S	S	.	.			trans	-66	102.1	175.5	-135	0	0	0	0	105.2	Q295 N315 D319	Q295-S317 PolarHBondContact NE2-O 2.93Å; N315-S317 PolarHBondContact O-N 3.45Å; S317-D319 WeakPolarHBondContact CB-OD2 3.36Å; S317-D319 PolarHBondContact O-N 3.2Å; S317-D319 PolarHBondContact OG-OD2 2.96Å
318	Y	63.2	Low	60.8	Low	81 Å²	81	74.2 Å²	74.2	32%	0.318	39%	0.394	S	S	.	.			trans	-72.2	50.4	174.6	-67.7	-69.1	0	0	0	110.3	K229 L232 Q236 F316 L321	K229-Y318 WeakPolarHBondContact CE-O 3.44Å; L232-Y318 HydrophobicContact CD1-CD1 4.22Å; L232-Y318 HydrophobicContact CD1-CE1 4.24Å; L232-Y318 HydrophobicContact CD2-CD1 4.06Å; L232-Y318 HydrophobicContact CD2-CE1 3.5Å; Q236-Y318 PolarHBondContact NE2-OH 3.4Å; F316-Y318 VanDerWaalsContact C-N 3.32Å; F316-Y318 WeakPolarHBondContact O-CD2 3.37Å; F316-Y318 PolarHBondContact O-N 2.93Å; Y318-L321 HydrophobicContact CD1-CD1 4.25Å
319	D	70.3	Confident	63.7	Low	52 Å²	52	67 Å²	67	28%	0.278	36%	0.355	S	S	.	.			trans	-106.8	135.2	-176.1	-60.4	-21	0	0	0	107.5	M219 Q295 S317	M219-D319 HydrophobicContact CE-CB 3.88Å; Q295-D319 PolarHBondContact NE2-O 2.87Å; S317-D319 WeakPolarHBondContact CB-OD2 3.36Å; S317-D319 PolarHBondContact O-N 3.2Å; S317-D319 PolarHBondContact OG-OD2 2.96Å
320	N	84.2	Confident	66.6	Low	10 Å²	10	62.5 Å²	62.5	5%	0.053	33%	0.327	C	S	.	.	S	Bend	trans	79.2	31.2	175.8	-47.8	-27.3	0	0	0	112.2	F218 M219 D288 I323 S324	F218-N320 VanDerWaalsContact C-OD1 3.27Å; F218-N320 HydrophobicContact CB-CB 4.07Å; M219-N320 HydrophobicContact CE-CB 4.4Å; M219-N320 WeakPolarHBondContact CE-OD1 3.34Å; M219-N320 PolarHBondContact N-OD1 3.43Å; D288-N320 PolarHBondContact OD2-ND2 3.03Å; N320-I323 HydrophobicContact CB-CG2 3.73Å; N320-I323 WeakPolarHBondContact O-CG2 3.28Å; N320-S324 PolarHBondContact O-N 3.05Å
321	L	85.5	Confident	69.4	Low	6 Å²	6	57.6 Å²	57.6	3%	0.031	30%	0.304	C	S	.	.	H	α-helix	trans	-71.7	-41.2	178.2	-65.9	-179.8	0	0	0	111	E225 A228 K229 L232 L296 Y318 I323 S324 L325	E225-L321 PolarHBondContact OE2-N 3.44Å; A228-L321 HydrophobicContact CB-CB 3.75Å; K229-L321 HydrophobicContact CG-CD1 3.8Å; L232-L321 HydrophobicContact CD1-CD1 3.92Å; L232-L321 HydrophobicContact CD1-CD2 3.85Å; L296-L321 HydrophobicContact CD2-CD2 4.35Å; Y318-L321 HydrophobicContact CD1-CD1 4.25Å; L321-I323 VanDerWaalsContact C-N 3.33Å; L321-I323 PolarHBondContact O-N 3.06Å; L321-S324 WeakPolarHBondContact O-CB 3.41Å; L321-S324 PolarHBondContact O-N 3.19Å; L321-L325 WeakPolarHBondContact O-CG 3.38Å; L321-L325 PolarHBondContact O-N 3.48Å
322	A	89.1	Confident	72.1	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-39.5	-178.1	0	0	0	0	0	112.2	L220 L224 E225 L325 A326	L220-A322 HydrophobicContact CB-CB 4.46Å; L220-A322 HydrophobicContact CD1-CB 3.84Å; L220-A322 HydrophobicContact CG-CB 4.36Å; L224-A322 HydrophobicContact CB-CB 4.09Å; E225-A322 VanDerWaalsContact CD-CB 3.45Å; E225-A322 HydrophobicContact CG-CB 4.12Å; E225-A322 WeakPolarHBondContact OE1-CB 3.24Å; E225-A322 PolarHBondContact OE2-N 3.39Å; A322-L325 PolarHBondContact O-N 2.89Å; A322-A326 WeakPolarHBondContact O-CB 3.17Å; A322-A326 PolarHBondContact O-N 2.99Å
323	I	90.5	Very high	74.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67.9	-36.1	176	-168.5	162.5	0	0	0	112.3	L86 F218 L220 I271 F286 N320 L321 A326 C327	L86-I323 HydrophobicContact CD1-CD1 4.17Å; F218-I323 HydrophobicContact CB-CD1 3.84Å; F218-I323 HydrophobicContact CB-CG2 3.92Å; F218-I323 HydrophobicContact CD1-CD1 4.1Å; F218-I323 HydrophobicContact CD2-CD1 4.43Å; F218-I323 HydrophobicContact CG-CD1 3.91Å; L220-I323 HydrophobicContact CD1-CB 4.43Å; I271-I323 HydrophobicContact CD1-CB 4.48Å; I271-I323 HydrophobicContact CD1-CD1 4.42Å; I271-I323 HydrophobicContact CD1-CG1 3.84Å; F286-I323 HydrophobicContact CB-CD1 4.36Å; F286-I323 HydrophobicContact CD1-CD1 3.76Å; F286-I323 HydrophobicContact CD2-CD1 4.18Å; F286-I323 HydrophobicContact CE1-CD1 4.05Å; F286-I323 HydrophobicContact CE2-CD1 4.43Å; F286-I323 HydrophobicContact CG-CD1 3.84Å; F286-I323 HydrophobicContact CZ-CD1 4.38Å; N320-I323 HydrophobicContact CB-CG2 3.73Å; N320-I323 WeakPolarHBondContact O-CG2 3.28Å; L321-I323 VanDerWaalsContact C-N 3.33Å; L321-I323 PolarHBondContact O-N 3.06Å; I323-A326 PolarHBondContact O-N 3.31Å; I323-C327 PolarHBondContact O-N 2.85Å; I323-C327 PolarHBondContact O-SG 3.06Å
324	S	88.4	Confident	77.6	Confident	14 Å²	14	41.5 Å²	41.5	10%	0.098	21%	0.213	C	C	.	.	H	α-helix	trans	-64.4	-45.7	175.6	-175.4	0	0	0	0	110.9	N320 L321 A326 C327 G328	N320-S324 PolarHBondContact O-N 3.05Å; L321-S324 WeakPolarHBondContact O-CB 3.41Å; L321-S324 PolarHBondContact O-N 3.19Å; S324-A326 PolarHBondContact O-N 3.09Å; S324-C327 PolarHBondContact O-N 2.98Å; S324-G328 PolarHBondContact O-N 3.29Å
325	L	89.4	Confident	79.9	Confident	34 Å²	34	37.9 Å²	37.9	18%	0.178	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-42.1	173.2	-69.4	-176	0	0	0	111.9	A228 M264 L321 A322 C327 G328 S329	A228-L325 HydrophobicContact CB-CD1 3.55Å; M264-L325 HydrophobicContact CE-CD2 4.39Å; M264-L325 WeakPolarHBondContact CE-O 3.25Å; M264-L325 HydrophobicContact CG-CB 4.03Å; M264-L325 HydrophobicContact CG-CD2 4.31Å; M264-L325 WeakPolarHBondContact CG-O 3.46Å; L321-L325 WeakPolarHBondContact O-CG 3.38Å; L321-L325 PolarHBondContact O-N 3.48Å; A322-L325 PolarHBondContact O-N 2.89Å; L325-C327 PolarHBondContact O-N 3.37Å; L325-G328 PolarHBondContact O-N 2.97Å; L325-S329 PolarHBondContact O-N 2.9Å; L325-S329 VanDerWaalsContact O-N 3.08Å
326	A	91.2	Very high	81.9	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.8	-45.6	177.8	0	0	0	0	0	112.2	A267 A268 I271 A322 I323 S324 G328 S329	A267-A326 HydrophobicContact CB-CB 3.83Å; A268-A326 HydrophobicContact CB-CB 4.38Å; I271-A326 HydrophobicContact CD1-CB 3.42Å; I271-A326 VanDerWaalsContact CD1-CB 3.42Å; I271-A326 HydrophobicContact CG1-CB 4.34Å; A322-A326 WeakPolarHBondContact O-CB 3.17Å; A322-A326 PolarHBondContact O-N 2.99Å; I323-A326 PolarHBondContact O-N 3.31Å; S324-A326 PolarHBondContact O-N 3.09Å; A326-G328 VanDerWaalsContact C-N 3.33Å; A326-G328 PolarHBondContact O-N 2.66Å; A326-S329 VanDerWaalsContact O-CB 3.3Å; A326-S329 WeakPolarHBondContact O-CB 3.41Å; A326-S329 PolarHBondContact O-N 2.88Å; A326-S329 PolarHBondContact O-OG 2.99Å
327	C	91.5	Very high	83.5	Confident	19 Å²	19	29.6 Å²	29.6	13%	0.128	15%	0.153	C	C	.	.	H	α-helix	trans	-68	-32.5	177.8	-64.4	0	0	0	0	112.4	I323 S324 L325 S329 L363	I323-C327 PolarHBondContact O-N 2.85Å; I323-C327 PolarHBondContact O-SG 3.06Å; S324-C327 PolarHBondContact O-N 2.98Å; L325-C327 PolarHBondContact O-N 3.37Å; C327-S329 VanDerWaalsContact C-N 3.31Å; C327-S329 PolarHBondContact O-N 2.85Å; C327-L363 HydrophobicContact CB-CB 3.9Å
328	G	88.2	Confident	84.9	Confident	15 Å²	15	32.5 Å²	32.5	16%	0.155	16%	0.163	C	C	.	.	H	α-helix	trans	-76.1	-13	175.8	0	0	0	0	0	114.9	M264 S324 L325 A326 Y330 E331 N332	M264-G328 WeakPolarHBondContact CE-O 3.24Å; S324-G328 PolarHBondContact O-N 3.29Å; L325-G328 PolarHBondContact O-N 2.97Å; A326-G328 VanDerWaalsContact C-N 3.33Å; A326-G328 PolarHBondContact O-N 2.66Å; G328-Y330 PolarHBondContact O-N 2.92Å; G328-E331 PolarHBondContact O-N 3.14Å; G328-N332 PolarHBondContact O-N 3.32Å
329	S	90.1	Very high	85.5	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.007	15%	0.152	C	C	.	.	H	α-helix	trans	-58.5	-45.4	-170.8	63.7	0	0	0	0	113.4	L325 A326 C327 N332 H333 H356 G358	L325-S329 PolarHBondContact O-N 2.9Å; L325-S329 VanDerWaalsContact O-N 3.08Å; A326-S329 VanDerWaalsContact O-CB 3.3Å; A326-S329 WeakPolarHBondContact O-CB 3.41Å; A326-S329 PolarHBondContact O-N 2.88Å; A326-S329 PolarHBondContact O-OG 2.99Å; C327-S329 VanDerWaalsContact C-N 3.31Å; C327-S329 PolarHBondContact O-N 2.85Å; S329-N332 PolarHBondContact O-N 2.89Å; S329-H333 WeakPolarHBondContact O-CB 3.21Å; S329-H333 PolarHBondContact O-N 2.88Å; S329-H356 PolarHBondContact OG-CE1 3.05Å; S329-G358 WeakPolarHBondContact OG-CA 3.29Å
330	Y	90.9	Very high	85.9	Confident	66 Å²	66	31.9 Å²	31.9	26%	0.259	17%	0.172	S	C	.	.	H	α-helix	trans	-68.2	-37.8	179.9	179.7	-107.9	0	0	0	112.3	G328 H333 V334 R353 H356 R359	G328-Y330 PolarHBondContact O-N 2.92Å; Y330-H333 PolarHBondContact O-N 3.35Å; Y330-V334 HydrophobicContact CD1-CG2 4.37Å; Y330-V334 HydrophobicContact CD2-CG2 4.42Å; Y330-V334 HydrophobicContact CE1-CG2 3.93Å; Y330-V334 HydrophobicContact CE2-CG2 4Å; Y330-V334 WeakPolarHBondContact O-CG2 3.43Å; Y330-V334 PolarHBondContact O-N 2.89Å; Y330-R353 HydrophobicContact CE2-CB 4.27Å; Y330-H356 HydrophobicContact CD2-CB 3.87Å; Y330-H356 AromaticContact CD2-CG 3.83Å; Y330-H356 AromaticContact CD2-ND1 3.81Å; Y330-H356 HydrophobicContact CE2-CB 4.33Å; Y330-H356 PolarHBondContact N-CE1 2.93Å; Y330-R359 HydrophobicContact CD2-CB 4.03Å; Y330-R359 HydrophobicContact CE2-CB 4.24Å; Y330-R359 HydrophobicContact CE2-CG 4.41Å; Y330-R359 HydrophobicContact CG-CB 4.36Å
331	E	87.7	Confident	85.3	Confident	63 Å²	63	33 Å²	33	29%	0.294	18%	0.177	S	C	.	.	H	α-helix	trans	-65.9	-44.2	175.8	-175.4	177.5	178.3	0	0	111	T9 G328 H333 V334 K335	T9-E331 VanDerWaalsContact CG2-OE1 3.31Å; T9-E331 WeakPolarHBondContact CG2-OE1 3.49Å; G328-E331 PolarHBondContact O-N 3.14Å; E331-H333 VanDerWaalsContact C-N 3.31Å; E331-H333 PolarHBondContact O-N 2.86Å; E331-V334 PolarHBondContact O-N 3.12Å; E331-K335 HydrophobicContact CG-CD 4.18Å; E331-K335 HydrophobicContact CG-CG 4.47Å; E331-K335 WeakPolarHBondContact O-CB 3.5Å; E331-K335 WeakPolarHBondContact O-CG 3.41Å; E331-K335 PolarHBondContact O-N 2.92Å; E331-K335 WeakPolarHBondContact OE1-CE 3.22Å; E331-K335 IonicContact OE1-NZ 4Å; E331-K335 PolarHBondContact OE1-NZ 3.32Å
332	N	85.8	Confident	84.8	Confident	9 Å²	9	34.6 Å²	34.6	5%	0.048	19%	0.189	C	C	.	.	H	α-helix	trans	-58.5	-44	175.4	-177.9	47.5	0	0	0	111.3	L260 T261 M264 G328 S329 K335 S336	L260-N332 WeakPolarHBondContact CD2-ND2 3.34Å; T261-N332 PolarHBondContact OG1-ND2 2.98Å; T261-N332 VanDerWaalsContact OG1-ND2 3.11Å; M264-N332 HydrophobicContact CE-CB 3.97Å; M264-N332 HydrophobicContact SD-CB 3.64Å; M264-N332 PolarHBondContact SD-ND2 3.34Å; G328-N332 PolarHBondContact O-N 3.32Å; S329-N332 PolarHBondContact O-N 2.89Å; N332-K335 PolarHBondContact O-N 3.33Å; N332-S336 WeakPolarHBondContact O-CB 3.26Å; N332-S336 PolarHBondContact O-N 3.28Å; N332-S336 PolarHBondContact O-OG 3.28Å
333	H	84.8	Confident	83.9	Confident	16 Å²	16	39.4 Å²	39.4	7%	0.074	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-44.5	175.4	-177.6	-77.8	0	0	0	113.3	S329 Y330 E331 K335 S336 E337 I350 H356	S329-H333 WeakPolarHBondContact O-CB 3.21Å; S329-H333 PolarHBondContact O-N 2.88Å; Y330-H333 PolarHBondContact O-N 3.35Å; E331-H333 VanDerWaalsContact C-N 3.31Å; E331-H333 PolarHBondContact O-N 2.86Å; H333-K335 VanDerWaalsContact C-N 3.35Å; H333-S336 PolarHBondContact O-N 3.4Å; H333-S336 PolarHBondContact O-OG 2.91Å; H333-E337 IonicContact CE1-OE1 3.76Å; H333-E337 PolarHBondContact CE1-OE1 3.4Å; H333-E337 IonicContact ND1-OE1 2.66Å; H333-E337 IonicContact NE2-OE1 3.1Å; H333-E337 WeakPolarHBondContact O-CG 3.32Å; H333-E337 PolarHBondContact O-N 3.06Å; H333-E337 VanDerWaalsContact O-N 3.14Å; H333-I350 VanDerWaalsContact NE2-CG2 3.33Å; H333-I350 WeakPolarHBondContact NE2-CG2 3.36Å; H333-H356 AromaticContact CD2-CD2 3.44Å; H333-H356 PolarHBondContact CD2-CD2 3.4Å; H333-H356 VanDerWaalsContact CD2-CD2 3.44Å; H333-H356 AromaticContact CD2-NE2 3.83Å; H333-H356 AromaticContact CG-CD2 3.65Å; H333-H356 AromaticContact CG-NE2 3.95Å; H333-H356 AromaticContact NE2-CD2 3.98Å
334	V	86.6	Confident	82.8	Confident	30 Å²	30	42.6 Å²	42.6	18%	0.182	25%	0.249	C	C	.	.	H	α-helix	trans	-67.4	-38.4	178.4	171	0	0	0	0	111	Y330 E331 E337 I338	Y330-V334 HydrophobicContact CD1-CG2 4.37Å; Y330-V334 HydrophobicContact CD2-CG2 4.42Å; Y330-V334 HydrophobicContact CE1-CG2 3.93Å; Y330-V334 HydrophobicContact CE2-CG2 4Å; Y330-V334 WeakPolarHBondContact O-CG2 3.43Å; Y330-V334 PolarHBondContact O-N 2.89Å; E331-V334 PolarHBondContact O-N 3.12Å; V334-E337 PolarHBondContact O-N 3.28Å; V334-I338 HydrophobicContact CG1-CD1 3.58Å; V334-I338 HydrophobicContact CG1-CG1 4.45Å; V334-I338 VanDerWaalsContact O-CG1 3.27Å; V334-I338 WeakPolarHBondContact O-CG1 3.25Å; V334-I338 PolarHBondContact O-N 3.26Å; V334-I338 VanDerWaalsContact O-N 3.12Å
335	K	81.3	Confident	81.6	Confident	76 Å²	76	44.4 Å²	44.4	33%	0.33	26%	0.255	S	S	.	.	H	α-helix	trans	-65.2	-44.3	176.2	-75.8	178.9	-179.7	171.7	0	111.8	T9 E331 N332 H333 E337 I338 S339	T9-K335 VanDerWaalsContact CB-NZ 3.33Å; E331-K335 HydrophobicContact CG-CD 4.18Å; E331-K335 HydrophobicContact CG-CG 4.47Å; E331-K335 WeakPolarHBondContact O-CB 3.5Å; E331-K335 WeakPolarHBondContact O-CG 3.41Å; E331-K335 PolarHBondContact O-N 2.92Å; E331-K335 WeakPolarHBondContact OE1-CE 3.22Å; E331-K335 IonicContact OE1-NZ 4Å; E331-K335 PolarHBondContact OE1-NZ 3.32Å; N332-K335 PolarHBondContact O-N 3.33Å; H333-K335 VanDerWaalsContact C-N 3.35Å; K335-E337 VanDerWaalsContact C-N 3.26Å; K335-E337 PolarHBondContact O-N 2.92Å; K335-I338 PolarHBondContact O-N 3.05Å; K335-S339 WeakPolarHBondContact O-CB 3.33Å; K335-S339 PolarHBondContact O-N 3Å
336	S	79.4	Confident	80	Confident	20 Å²	20	51.3 Å²	51.3	14%	0.14	28%	0.283	C	S	.	.	H	α-helix	trans	-67.3	-24.9	178.7	67.2	0	0	0	0	113.3	N332 H333 S339 S342	N332-S336 WeakPolarHBondContact O-CB 3.26Å; N332-S336 PolarHBondContact O-N 3.28Å; N332-S336 PolarHBondContact O-OG 3.28Å; H333-S336 PolarHBondContact O-N 3.4Å; H333-S336 PolarHBondContact O-OG 2.91Å; S336-S339 PolarHBondContact O-OG 3.33Å; S336-S342 WeakPolarHBondContact O-CB 3.3Å
337	E	80.4	Confident	78.3	Confident	52 Å²	52	55.1 Å²	55.1	24%	0.243	30%	0.303	C	S	.	.	H	α-helix	trans	-79	-32.8	171.3	-76.7	-175.7	167	0	0	113.8	H333 V334 K335 S342 R353	H333-E337 IonicContact CE1-OE1 3.76Å; H333-E337 PolarHBondContact CE1-OE1 3.4Å; H333-E337 IonicContact ND1-OE1 2.66Å; H333-E337 IonicContact NE2-OE1 3.1Å; H333-E337 WeakPolarHBondContact O-CG 3.32Å; H333-E337 PolarHBondContact O-N 3.06Å; H333-E337 VanDerWaalsContact O-N 3.14Å; V334-E337 PolarHBondContact O-N 3.28Å; K335-E337 VanDerWaalsContact C-N 3.26Å; K335-E337 PolarHBondContact O-N 2.92Å; E337-S342 PolarHBondContact O-OG 3.16Å; E337-R353 IonicContact OE2-CZ 3.43Å; E337-R353 IonicContact OE2-NE 3.45Å; E337-R353 PolarHBondContact OE2-NE 2.99Å; E337-R353 IonicContact OE2-NH2 3.98Å; E337-R353 PolarHBondContact OE2-NH2 2.85Å
338	I	83.5	Confident	76.4	Confident	118 Å²	118	61.9 Å²	61.9	61%	0.605	34%	0.338	S	S	*	.	H	α-helix	trans	-86.5	-25.1	-177	-65.5	169.2	0	0	0	111.4	V334 K335	V334-I338 HydrophobicContact CG1-CD1 3.58Å; V334-I338 HydrophobicContact CG1-CG1 4.45Å; V334-I338 VanDerWaalsContact O-CG1 3.27Å; V334-I338 WeakPolarHBondContact O-CG1 3.25Å; V334-I338 PolarHBondContact O-N 3.26Å; V334-I338 VanDerWaalsContact O-N 3.12Å; K335-I338 PolarHBondContact O-N 3.05Å
339	S	77.7	Confident	74.8	Confident	11 Å²	11	66.3 Å²	66.3	8%	0.077	37%	0.367	C	S	.	.	S	Bend	trans	-59.4	146.9	-178.1	66.8	0	0	0	0	111.8	C17 K335 S336 E341 S342	C17-S339 WeakPolarHBondContact SG-CB 3.32Å; K335-S339 WeakPolarHBondContact O-CB 3.33Å; K335-S339 PolarHBondContact O-N 3Å; S336-S339 PolarHBondContact O-OG 3.33Å; S339-E341 PolarHBondContact O-N 3.46Å; S339-S342 WeakPolarHBondContact O-CB 3.42Å; S339-S342 PolarHBondContact O-N 3.02Å; S339-S342 VanDerWaalsContact O-N 3.14Å; S339-S342 PolarHBondContact O-OG 3.34Å
340	P	77.9	Confident	73.4	Confident	108 Å²	108	69.9 Å²	69.9	70%	0.701	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-63.3	-31.8	-179.4	25.7	-33.8	0	0	0	112.3	S342 S343	P340-S342 PolarHBondContact O-N 3.45Å; P340-S343 PolarHBondContact O-OG 2.88Å
341	E	71.5	Confident	72.2	Confident	35 Å²	35	67.5 Å²	67.5	16%	0.164	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-68.1	-15.7	176.2	63.1	-106.4	-166	0	0	114.7	C17 L249 S339 S343 A344 F345	C17-E341 PolarHBondContact SG-OE1 2.89Å; L249-E341 HydrophobicContact CD2-CB 3.67Å; S339-E341 PolarHBondContact O-N 3.46Å; E341-S343 PolarHBondContact O-N 3.45Å; E341-S343 VanDerWaalsContact O-N 3.07Å; E341-A344 WeakPolarHBondContact O-CB 3.37Å; E341-A344 PolarHBondContact O-N 2.97Å; E341-F345 HydrophobicContact CB-CD2 3.97Å; E341-F345 HydrophobicContact CB-CE2 3.86Å; E341-F345 HydrophobicContact CG-CD2 3.99Å; E341-F345 HydrophobicContact CG-CE2 4Å; E341-F345 VanDerWaalsContact O-CD2 3.29Å; E341-F345 WeakPolarHBondContact O-CD2 3.46Å; E341-F345 PolarHBondContact O-N 3.12Å; E341-F345 VanDerWaalsContact O-N 3.14Å
342	S	74.1	Confident	71.9	Confident	39 Å²	39	67.9 Å²	67.9	27%	0.273	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-54.2	-29.8	176	68.1	0	0	0	0	113	S336 E337 S339 P340 A344 F345	S336-S342 WeakPolarHBondContact O-CB 3.3Å; E337-S342 PolarHBondContact O-OG 3.16Å; S339-S342 WeakPolarHBondContact O-CB 3.42Å; S339-S342 PolarHBondContact O-N 3.02Å; S339-S342 VanDerWaalsContact O-N 3.14Å; S339-S342 PolarHBondContact O-OG 3.34Å; P340-S342 PolarHBondContact O-N 3.45Å; S342-A344 VanDerWaalsContact C-N 3.28Å; S342-A344 PolarHBondContact O-N 2.97Å; S342-F345 CarbonylContact O-C 3.22Å; S342-F345 VanDerWaalsContact O-C 3.22Å; S342-F345 PolarHBondContact O-N 3.17Å
343	S	70.4	Confident	71.9	Confident	102 Å²	102	71.9 Å²	71.9	71%	0.713	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-63.2	-31.4	175.6	62.1	0	0	0	0	113.3	P340 E341	P340-S343 PolarHBondContact O-OG 2.88Å; E341-S343 PolarHBondContact O-N 3.45Å; E341-S343 VanDerWaalsContact O-N 3.07Å
344	A	68.2	Low	71.8	Confident	67 Å²	67	74.7 Å²	74.7	55%	0.554	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-29.3	174.9	0	0	0	0	0	112	E341 S342	E341-A344 WeakPolarHBondContact O-CB 3.37Å; E341-A344 PolarHBondContact O-N 2.97Å; S342-A344 VanDerWaalsContact C-N 3.28Å; S342-A344 PolarHBondContact O-N 2.97Å
345	F	62.3	Low	71.8	Confident	51 Å²	51	75.5 Å²	75.5	22%	0.224	43%	0.432	C	S	.	.			trans	-104.1	71	180	-56.8	-58.7	0	0	0	111.5	L249 K254 E341 S342 L347	L249-F345 HydrophobicContact CD2-CE2 3.56Å; L249-F345 HydrophobicContact CD2-CZ 3.72Å; K254-F345 HydrophobicContact CB-CE1 4.33Å; K254-F345 HydrophobicContact CD-CD1 4.04Å; K254-F345 HydrophobicContact CD-CE1 3.56Å; K254-F345 HydrophobicContact CG-CD1 4.25Å; K254-F345 HydrophobicContact CG-CE1 3.78Å; K254-F345 HydrophobicContact CG-CZ 4.38Å; E341-F345 HydrophobicContact CB-CD2 3.97Å; E341-F345 HydrophobicContact CB-CE2 3.86Å; E341-F345 HydrophobicContact CG-CD2 3.99Å; E341-F345 HydrophobicContact CG-CE2 4Å; E341-F345 VanDerWaalsContact O-CD2 3.29Å; E341-F345 WeakPolarHBondContact O-CD2 3.46Å; E341-F345 PolarHBondContact O-N 3.12Å; E341-F345 VanDerWaalsContact O-N 3.14Å; S342-F345 CarbonylContact O-C 3.22Å; S342-F345 VanDerWaalsContact O-C 3.22Å; S342-F345 PolarHBondContact O-N 3.17Å; F345-L347 PolarHBondContact O-N 3.46Å
346	K	57.2	Low	72.2	Confident	179 Å²	179	72.3 Å²	72.3	78%	0.778	42%	0.419	S	S	*	.			trans	-66.5	101.5	162.3	-88.2	-178	176.9	175.9	0	108.9	D348	K346-D348 PolarHBondContact O-N 2.96Å
347	L	55	Low	72.7	Confident	81 Å²	81	72.1 Å²	72.1	42%	0.424	42%	0.417	S	S	.	.			trans	-75	108.1	164.6	-81.5	147.4	0	0	0	107.4	F345 S349 I350	F345-L347 PolarHBondContact O-N 3.46Å; L347-S349 PolarHBondContact O-N 3.18Å; L347-I350 HydrophobicContact CB-CD1 3.71Å; L347-I350 HydrophobicContact CB-CG1 3.6Å; L347-I350 HydrophobicContact CD1-CD1 4.49Å
348	D	50.5	Low	73.2	Confident	161 Å²	161	69.7 Å²	69.7	86%	0.861	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	4.6	-174.3	-73.3	-30.6	0	0	0	114.8	K346	K346-D348 PolarHBondContact O-N 2.96Å
349	S	55.7	Low	73.5	Confident	108 Å²	108	70.1 Å²	70.1	76%	0.755	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.8	39.4	-177.7	68.6	0	0	0	0	113.5	L347 A351	L347-S349 PolarHBondContact O-N 3.18Å; S349-A351 PolarHBondContact O-N 3.31Å
350	I	60.1	Low	74.2	Confident	75 Å²	75	70.9 Å²	70.9	39%	0.385	41%	0.41	S	S	.	.			trans	-69.5	115.7	174.5	-71.4	163	0	0	0	109.4	H333 L347	H333-I350 VanDerWaalsContact NE2-CG2 3.33Å; H333-I350 WeakPolarHBondContact NE2-CG2 3.36Å; L347-I350 HydrophobicContact CB-CD1 3.71Å; L347-I350 HydrophobicContact CB-CG1 3.6Å; L347-I350 HydrophobicContact CD1-CD1 4.49Å
351	A	67	Low	74.9	Confident	16 Å²	16	66.2 Å²	66.2	13%	0.132	38%	0.379	C	S	.	.			trans	-60	134.8	165.6	0	0	0	0	0	108.3	S349 R353	S349-A351 PolarHBondContact O-N 3.31Å; A351-R353 PolarHBondContact O-N 3.33Å
352	P	80.7	Confident	76	Confident	72 Å²	72	66.1 Å²	66.1	47%	0.468	38%	0.381	S	S	.	.			trans	-55.5	146.6	176	23	-32.4	0	0	0	109.7	A354 T355 H356	P352-A354 PolarHBondContact O-N 3.2Å; P352-T355 VanDerWaalsContact CD-OG1 3.25Å; P352-T355 WeakPolarHBondContact CD-OG1 3.48Å; P352-T355 HydrophobicContact CG-CG2 4.04Å; P352-T355 WeakPolarHBondContact CG-OG1 3.41Å; P352-T355 PolarHBondContact O-N 3.19Å; P352-T355 PolarHBondContact O-OG1 3.16Å; P352-H356 PolarHBondContact O-N 2.77Å
353	R	84.7	Confident	76.8	Confident	93 Å²	93	65.6 Å²	65.6	35%	0.351	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-23.4	177.8	-65.4	-176.7	-175	-177.6	-2.3	114.3	Y330 E337 A351 R359	Y330-R353 HydrophobicContact CE2-CB 4.27Å; E337-R353 IonicContact OE2-CZ 3.43Å; E337-R353 IonicContact OE2-NE 3.45Å; E337-R353 PolarHBondContact OE2-NE 2.99Å; E337-R353 IonicContact OE2-NH2 3.98Å; E337-R353 PolarHBondContact OE2-NH2 2.85Å; A351-R353 PolarHBondContact O-N 3.33Å; R353-R359 VanDerWaalsContact O-CD 3.31Å; R353-R359 WeakPolarHBondContact O-CD 3.4Å; R353-R359 PolarHBondContact O-NH1 3.36Å; R353-R359 VanDerWaalsContact O-NH1 3.14Å
354	A	84.3	Confident	77.7	Confident	74 Å²	74	61.2 Å²	61.2	61%	0.612	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-31.9	175.8	0	0	0	0	0	114.2	P352	P352-A354 PolarHBondContact O-N 3.2Å
355	T	85.9	Confident	78.7	Confident	47 Å²	47	58.2 Å²	58.2	29%	0.288	32%	0.318	S	S	.	.	S	Bend	trans	-110.8	9.4	-173	63.8	0	0	0	0	113	P352	P352-T355 VanDerWaalsContact CD-OG1 3.25Å; P352-T355 WeakPolarHBondContact CD-OG1 3.48Å; P352-T355 HydrophobicContact CG-CG2 4.04Å; P352-T355 WeakPolarHBondContact CG-OG1 3.41Å; P352-T355 PolarHBondContact O-N 3.19Å; P352-T355 PolarHBondContact O-OG1 3.16Å
356	H	89.8	Confident	80.1	Confident	9 Å²	9	56.2 Å²	56.2	4%	0.042	31%	0.31	C	S	.	.			trans	-65.5	130.2	177.8	-173.2	-81.4	0	0	0	110.5	N265 S329 Y330 H333 P352 G358 R359	N265-H356 PolarHBondContact OD1-NE2 3.28Å; S329-H356 PolarHBondContact OG-CE1 3.05Å; Y330-H356 HydrophobicContact CD2-CB 3.87Å; Y330-H356 AromaticContact CD2-CG 3.83Å; Y330-H356 AromaticContact CD2-ND1 3.81Å; Y330-H356 HydrophobicContact CE2-CB 4.33Å; Y330-H356 PolarHBondContact N-CE1 2.93Å; H333-H356 AromaticContact CD2-CD2 3.44Å; H333-H356 PolarHBondContact CD2-CD2 3.4Å; H333-H356 VanDerWaalsContact CD2-CD2 3.44Å; H333-H356 AromaticContact CD2-NE2 3.83Å; H333-H356 AromaticContact CG-CD2 3.65Å; H333-H356 AromaticContact CG-NE2 3.95Å; H333-H356 AromaticContact NE2-CD2 3.98Å; P352-H356 PolarHBondContact O-N 2.77Å; H356-G358 VanDerWaalsContact C-N 3.33Å; H356-G358 PolarHBondContact ND1-N 3.43Å; H356-G358 PolarHBondContact O-N 3.15Å; H356-R359 WeakPolarHBondContact O-CB 3.32Å; H356-R359 PolarHBondContact O-N 3.16Å; H356-R359 VanDerWaalsContact O-N 3.13Å
357	P	90.3	Very high	81.5	Confident	17 Å²	17	51.9 Å²	51.9	11%	0.11	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-34.9	-172.5	24.4	-34.7	0	0	0	113.5	A268 I269 R359	A268-P357 HydrophobicContact CB-CB 4.06Å; A268-P357 HydrophobicContact CB-CG 4.05Å; I269-P357 HydrophobicContact CG1-CB 3.82Å; I269-P357 HydrophobicContact CG1-CG 3.85Å; P357-R359 VanDerWaalsContact C-N 3.27Å; P357-R359 PolarHBondContact O-N 3.48Å
358	G	89.4	Confident	83.1	Confident	1 Å²	1	49 Å²	49	1%	0.01	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-1.1	178.4	0	0	0	0	0	115.8	S329 H356 G360 L361	S329-G358 WeakPolarHBondContact OG-CA 3.29Å; H356-G358 VanDerWaalsContact C-N 3.33Å; H356-G358 PolarHBondContact ND1-N 3.43Å; H356-G358 PolarHBondContact O-N 3.15Å; G358-G360 PolarHBondContact O-N 2.95Å; G358-L361 PolarHBondContact O-N 3Å
359	R	91.1	Very high	85.2	Confident	126 Å²	126	42.5 Å²	42.5	48%	0.475	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	124.3	-179.6	177	174.6	171.5	157	-2.6	109.7	Y330 R353 H356 P357	Y330-R359 HydrophobicContact CD2-CB 4.03Å; Y330-R359 HydrophobicContact CE2-CB 4.24Å; Y330-R359 HydrophobicContact CE2-CG 4.41Å; Y330-R359 HydrophobicContact CG-CB 4.36Å; R353-R359 VanDerWaalsContact O-CD 3.31Å; R353-R359 WeakPolarHBondContact O-CD 3.4Å; R353-R359 PolarHBondContact O-NH1 3.36Å; R353-R359 VanDerWaalsContact O-NH1 3.14Å; H356-R359 WeakPolarHBondContact O-CB 3.32Å; H356-R359 PolarHBondContact O-N 3.16Å; H356-R359 VanDerWaalsContact O-N 3.13Å; P357-R359 VanDerWaalsContact C-N 3.27Å; P357-R359 PolarHBondContact O-N 3.48Å
360	G	92	Very high	87	Confident	28 Å²	28	39 Å²	39	29%	0.289	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.2	-1.9	179	0	0	0	0	0	114.5	S283 I284 G358	S283-G360 WeakPolarHBondContact CA-O 3.25Å; I284-G360 PolarHBondContact N-O 3.4Å; G358-G360 PolarHBondContact O-N 2.95Å
361	L	93.4	Very high	88.8	Confident	9 Å²	9	35.5 Å²	35.5	5%	0.047	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	125	171.7	-54	-177.2	0	0	0	109.4	I271 I284 F286 G358	I271-L361 HydrophobicContact CB-CD1 4.13Å; I271-L361 HydrophobicContact CD1-CD1 4.49Å; I271-L361 HydrophobicContact CG2-CD1 3.81Å; I271-L361 HydrophobicContact CG2-CD2 4.02Å; I284-L361 HydrophobicContact CB-CD2 4.03Å; I284-L361 HydrophobicContact CD1-CD2 3.79Å; I284-L361 HydrophobicContact CG1-CD2 4.06Å; F286-L361 HydrophobicContact CE2-CD2 4.22Å; G358-L361 PolarHBondContact O-N 3Å
362	T	93.3	Very high	90.2	Very high	33 Å²	33	39.7 Å²	39.7	20%	0.202	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	131.6	176.5	-53.6	0	0	0	0	109.6	I284 L285 F286 M364 H377	I284-T362 PolarHBondContact O-N 2.89Å; L285-T362 HydrophobicContact CD1-CG2 4.02Å; F286-T362 PolarHBondContact N-O 2.92Å; T362-M364 HydrophobicContact CG2-CG 4.06Å; T362-H377 WeakPolarHBondContact CB-NE2 3.2Å; T362-H377 PolarHBondContact OG1-NE2 2.85Å
363	L	92.1	Very high	90.9	Very high	28 Å²	28	37 Å²	37	15%	0.147	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	130	169.8	-178.7	65.6	0	0	0	109.2	F286 D288 P292 C327	F286-L363 HydrophobicContact CB-CD1 3.66Å; F286-L363 CarbonylContact O-C 3.5Å; F286-L363 WeakPolarHBondContact O-CA 3.41Å; D288-L363 HydrophobicContact CB-CD1 4.26Å; P292-L363 HydrophobicContact CB-CD2 4.48Å; C327-L363 HydrophobicContact CB-CB 3.9Å
364	M	88.9	Confident	91.5	Very high	10 Å²	10	32.7 Å²	32.7	5%	0.049	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	144.6	175.8	-69.9	-171.5	65.8	0	0	110.5	L285 F286 V287 D288 T362 S368 S373	L285-M364 HydrophobicContact CD1-CB 4.15Å; L285-M364 HydrophobicContact CD1-CG 3.69Å; L285-M364 HydrophobicContact CD1-SD 3.68Å; L285-M364 HydrophobicContact CD2-SD 4.49Å; F286-M364 PolarHBondContact O-N 2.88Å; V287-M364 VanDerWaalsContact CA-O 3.27Å; V287-M364 WeakPolarHBondContact CA-O 3.49Å; D288-M364 PolarHBondContact N-O 3.09Å; T362-M364 HydrophobicContact CG2-CG 4.06Å; M364-S368 WeakPolarHBondContact CE-O 3.43Å; M364-S373 PolarHBondContact SD-OG 3.29Å; M364-S373 VanDerWaalsContact SD-OG 3.34Å
365	P	89.5	Confident	92	Very high	4 Å²	4	32.1 Å²	32.1	3%	0.026	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	151.6	168.7	32.1	-34.4	0	0	0	110.9	H4 D288 H367 S368	H4-P365 HydrophobicContact CB-CG 4.42Å; D288-P365 CarbonylContact O-C 3.34Å; D288-P365 VanDerWaalsContact O-CA 3.27Å; D288-P365 WeakPolarHBondContact O-CA 3.43Å; P365-H367 VanDerWaalsContact C-N 3.27Å; P365-H367 WeakPolarHBondContact CB-NE2 3.47Å; P365-H367 WeakPolarHBondContact CG-CE1 2.94Å; P365-H367 PolarHBondContact O-N 2.94Å; P365-H367 VanDerWaalsContact O-N 3.15Å; P365-S368 WeakPolarHBondContact CG-OG 3.25Å; P365-S368 WeakPolarHBondContact O-CB 3.26Å; P365-S368 PolarHBondContact O-N 3.36Å
366	V	90.7	Very high	92.4	Very high	10 Å²	10	34.9 Å²	34.9	6%	0.061	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-49.7	-44.5	-177.1	174	0	0	0	0	113.2	V287 D288 S368 L369 A386 L390	V287-V366 HydrophobicContact CG1-CB 4.33Å; V287-V366 HydrophobicContact CG1-CG2 3.78Å; D288-V366 WeakPolarHBondContact O-CG2 3.48Å; D288-V366 PolarHBondContact O-N 3.29Å; V366-S368 PolarHBondContact O-N 3.36Å; V366-L369 WeakPolarHBondContact O-CB 3.31Å; V366-L369 PolarHBondContact O-N 2.99Å; V366-L369 VanDerWaalsContact O-N 3.12Å; V366-A386 VanDerWaalsContact CG2-CA 3.45Å; V366-A386 HydrophobicContact CG2-CB 3.2Å; V366-L390 HydrophobicContact CG1-CB 4Å
367	H	87	Confident	92.8	Very high	88 Å²	88	35.5 Å²	35.5	41%	0.407	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-65.3	-13.1	-177	56	75.4	0	0	0	114	H4 P365	H4-H367 AromaticContact CD2-CE1 3.51Å; H4-H367 AromaticContact CD2-ND1 3.84Å; H4-H367 AromaticContact CE1-CE1 3.82Å; H4-H367 AromaticContact NE2-CE1 3.29Å; H4-H367 PolarHBondContact NE2-CE1 3.01Å; H4-H367 VanDerWaalsContact NE2-CE1 3.29Å; H4-H367 AromaticContact NE2-ND1 3.85Å; P365-H367 VanDerWaalsContact C-N 3.27Å; P365-H367 WeakPolarHBondContact CB-NE2 3.47Å; P365-H367 WeakPolarHBondContact CG-CE1 2.94Å; P365-H367 PolarHBondContact O-N 2.94Å; P365-H367 VanDerWaalsContact O-N 3.15Å
368	S	88.9	Confident	93	Very high	21 Å²	21	38.2 Å²	38.2	15%	0.147	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-100.8	-3.1	179.6	-57.8	0	0	0	0	113.5	H4 M364 P365 V366 N370	H4-S368 WeakPolarHBondContact CB-OG 3.34Å; H4-S368 PolarHBondContact CD2-OG 2.9Å; M364-S368 WeakPolarHBondContact CE-O 3.43Å; P365-S368 WeakPolarHBondContact CG-OG 3.25Å; P365-S368 WeakPolarHBondContact O-CB 3.26Å; P365-S368 PolarHBondContact O-N 3.36Å; V366-S368 PolarHBondContact O-N 3.36Å; S368-N370 PolarHBondContact O-N 2.89Å; S368-N370 PolarHBondContact O-ND2 3.28Å; S368-N370 VanDerWaalsContact O-ND2 3.14Å
369	L	93.5	Very high	93.3	Very high	24 Å²	24	38.4 Å²	38.4	13%	0.126	19%	0.194	C	C	.	.			trans	-57.7	131.2	-179.2	-173.3	64.8	0	0	0	110.5	L203 L285 V287 V366 M374 L380 L390	L203-L369 HydrophobicContact CD2-CD2 4.45Å; L285-L369 HydrophobicContact CD2-CD1 4.22Å; V287-L369 HydrophobicContact CG2-CD1 3.95Å; V366-L369 WeakPolarHBondContact O-CB 3.31Å; V366-L369 PolarHBondContact O-N 2.99Å; V366-L369 VanDerWaalsContact O-N 3.12Å; L369-M374 HydrophobicContact CD1-CG 3.84Å; L369-M374 HydrophobicContact CD1-SD 4.16Å; L369-M374 HydrophobicContact CD2-SD 4.42Å; L369-M374 HydrophobicContact CG-SD 4.21Å; L369-L380 HydrophobicContact CD1-CD1 4.24Å; L369-L390 HydrophobicContact CD2-CD1 3.51Å
370	N	94.9	Very high	93.6	Very high	34 Å²	34	32.5 Å²	32.5	18%	0.182	17%	0.172	C	C	.	.			trans	-147	158.1	-176.2	66.5	66.1	0	0	0	110.8	S368 W372 S373 M374	S368-N370 PolarHBondContact O-N 2.89Å; S368-N370 PolarHBondContact O-ND2 3.28Å; S368-N370 VanDerWaalsContact O-ND2 3.14Å; N370-W372 PolarHBondContact O-N 3.21Å; N370-W372 WeakPolarHBondContact OD1-CB 3.37Å; N370-W372 PolarHBondContact OD1-N 2.96Å; N370-S373 PolarHBondContact ND2-OG 3.34Å; N370-S373 PolarHBondContact O-N 2.85Å; N370-S373 WeakPolarHBondContact OD1-CB 3.25Å; N370-S373 PolarHBondContact OD1-N 3.36Å; N370-S373 PolarHBondContact OD1-OG 3Å; N370-M374 WeakPolarHBondContact O-CG 3.4Å; N370-M374 PolarHBondContact O-N 3.03Å
371	V	97	Very high	93.9	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.012	16%	0.158	C	C	.	.	H	α-helix	trans	-59.5	-42.4	-178.8	178.5	0	0	0	0	112.1	V120 N123 L199 M202 S373 M374 V375	V120-V371 HydrophobicContact CG1-CG1 3.85Å; N123-V371 HydrophobicContact CB-CB 4.26Å; N123-V371 HydrophobicContact CB-CG1 4.37Å; N123-V371 HydrophobicContact CB-CG2 4.1Å; L199-V371 HydrophobicContact CB-CG2 4.28Å; L199-V371 HydrophobicContact CD1-CG2 4.2Å; M202-V371 HydrophobicContact CB-CG1 4.43Å; M202-V371 HydrophobicContact CB-CG2 4.47Å; M202-V371 HydrophobicContact CG-CG1 4.36Å; V371-S373 PolarHBondContact O-N 2.88Å; V371-M374 PolarHBondContact O-N 3.07Å; V371-V375 HydrophobicContact CG1-CG2 4.11Å; V371-V375 WeakPolarHBondContact O-CG2 3.44Å; V371-V375 PolarHBondContact O-N 3.17Å
372	W	96.6	Very high	94	Very high	104 Å²	104	30.7 Å²	30.7	39%	0.394	16%	0.156	S	C	.	.	H	α-helix	trans	-55.1	-52.7	179.2	-176.7	-82.7	0	0	0	112.3	L124 Q127 A128 N370 M374 V375 H376	L124-W372 HydrophobicContact CD1-CB 4.37Å; L124-W372 HydrophobicContact CD1-CD2 4.02Å; L124-W372 HydrophobicContact CD1-CE3 3.31Å; L124-W372 HydrophobicContact CD1-CG 4.5Å; L124-W372 HydrophobicContact CD1-CZ3 3.77Å; L124-W372 HydrophobicContact CG-CE3 3.85Å; L124-W372 HydrophobicContact CG-CZ3 3.9Å; Q127-W372 HydrophobicContact CB-CB 4.43Å; Q127-W372 HydrophobicContact CB-CE3 4.45Å; A128-W372 HydrophobicContact CB-CE3 4.41Å; A128-W372 HydrophobicContact CB-CH2 4.09Å; A128-W372 HydrophobicContact CB-CZ3 3.63Å; N370-W372 PolarHBondContact O-N 3.21Å; N370-W372 WeakPolarHBondContact OD1-CB 3.37Å; N370-W372 PolarHBondContact OD1-N 2.96Å; W372-M374 VanDerWaalsContact C-N 3.33Å; W372-M374 PolarHBondContact O-N 3.47Å; W372-V375 PolarHBondContact O-N 2.9Å; W372-H376 AromaticContact CD1-CD2 3.47Å; W372-H376 VanDerWaalsContact CD1-CD2 3.47Å; W372-H376 AromaticContact CD2-CD2 3.93Å; W372-H376 AromaticContact CD2-NE2 3.83Å; W372-H376 AromaticContact CE2-CD2 3.5Å; W372-H376 AromaticContact CE2-NE2 3.18Å; W372-H376 AromaticContact CG-CD2 3.9Å; W372-H376 AromaticContact CH2-NE2 3.94Å; W372-H376 AromaticContact CZ2-NE2 3.27Å; W372-H376 VanDerWaalsContact CZ2-NE2 3.27Å; W372-H376 WeakPolarHBondContact CZ2-NE2 3.45Å; W372-H376 AromaticContact NE1-CD2 3.2Å; W372-H376 PolarHBondContact NE1-CD2 3.39Å; W372-H376 AromaticContact NE1-NE2 3.34Å; W372-H376 PolarHBondContact NE1-NE2 2.87Å; W372-H376 PolarHBondContact O-CD2 3.5Å; W372-H376 PolarHBondContact O-N 3Å; W372-H376 VanDerWaalsContact O-N 3.12Å
373	S	95.3	Very high	94	Very high	16 Å²	16	29.3 Å²	29.3	11%	0.112	15%	0.147	C	C	.	.	H	α-helix	trans	-60	-43.3	177.8	-65.2	0	0	0	0	111.2	M364 N370 V371 V375 H376 H377	M364-S373 PolarHBondContact SD-OG 3.29Å; M364-S373 VanDerWaalsContact SD-OG 3.34Å; N370-S373 PolarHBondContact ND2-OG 3.34Å; N370-S373 PolarHBondContact O-N 2.85Å; N370-S373 WeakPolarHBondContact OD1-CB 3.25Å; N370-S373 PolarHBondContact OD1-N 3.36Å; N370-S373 PolarHBondContact OD1-OG 3Å; V371-S373 PolarHBondContact O-N 2.88Å; S373-V375 PolarHBondContact O-N 3.45Å; S373-H376 PolarHBondContact O-N 3.43Å; S373-H377 PolarHBondContact O-N 3.15Å; S373-H377 PolarHBondContact O-ND1 2.79Å
374	M	96.7	Very high	94	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-65.5	-35.1	179.7	-67	170.1	72.9	0	0	113.4	L199 M202 L203 K206 L369 N370 V371 W372 H377 L380	L199-M374 HydrophobicContact CD1-SD 3.93Å; M202-M374 HydrophobicContact CB-CE 3.95Å; M202-M374 HydrophobicContact CB-SD 4.29Å; M202-M374 HydrophobicContact CE-CB 4.29Å; M202-M374 HydrophobicContact CG-CB 3.78Å; M202-M374 HydrophobicContact CG-CE 3.57Å; M202-M374 HydrophobicContact CG-SD 3.93Å; L203-M374 HydrophobicContact CB-CE 4.33Å; L203-M374 HydrophobicContact CD2-CE 3.47Å; L203-M374 VanDerWaalsContact CD2-CE 3.47Å; L203-M374 HydrophobicContact CD2-SD 4.41Å; L203-M374 HydrophobicContact CG-CE 3.69Å; K206-M374 WeakPolarHBondContact CE-O 3.18Å; K206-M374 HydrophobicContact CG-CE 4.2Å; K206-M374 PolarHBondContact NZ-O 3.29Å; L369-M374 HydrophobicContact CD1-CG 3.84Å; L369-M374 HydrophobicContact CD1-SD 4.16Å; L369-M374 HydrophobicContact CD2-SD 4.42Å; L369-M374 HydrophobicContact CG-SD 4.21Å; N370-M374 WeakPolarHBondContact O-CG 3.4Å; N370-M374 PolarHBondContact O-N 3.03Å; V371-M374 PolarHBondContact O-N 3.07Å; W372-M374 VanDerWaalsContact C-N 3.33Å; W372-M374 PolarHBondContact O-N 3.47Å; M374-H377 VanDerWaalsContact O-O 3.07Å; M374-L380 HydrophobicContact CE-CD2 3.78Å; M374-L380 HydrophobicContact CG-CD2 4.45Å
375	V	95.7	Very high	94.1	Very high	62 Å²	62	33 Å²	33	38%	0.376	16%	0.163	S	C	.	.	H	α-helix	trans	-73	-34.6	178.2	171.4	0	0	0	0	111.4	V120 L124 M202 V371 W372 S373	V120-V375 HydrophobicContact CG1-CG2 4.31Å; L124-V375 HydrophobicContact CD1-CB 4.45Å; M202-V375 HydrophobicContact CE-CG2 3.86Å; M202-V375 HydrophobicContact SD-CG2 3.54Å; M202-V375 VanDerWaalsContact SD-CG2 3.54Å; V371-V375 HydrophobicContact CG1-CG2 4.11Å; V371-V375 WeakPolarHBondContact O-CG2 3.44Å; V371-V375 PolarHBondContact O-N 3.17Å; W372-V375 PolarHBondContact O-N 2.9Å; S373-V375 PolarHBondContact O-N 3.45Å
376	H	95	Very high	94.3	Very high	104 Å²	104	32.9 Å²	32.9	48%	0.481	16%	0.162	S	C	.	.	H	α-helix	trans	-79.1	-19.2	-177.6	-83.9	-64.6	0	0	0	115	W372 S373	W372-H376 AromaticContact CD1-CD2 3.47Å; W372-H376 VanDerWaalsContact CD1-CD2 3.47Å; W372-H376 AromaticContact CD2-CD2 3.93Å; W372-H376 AromaticContact CD2-NE2 3.83Å; W372-H376 AromaticContact CE2-CD2 3.5Å; W372-H376 AromaticContact CE2-NE2 3.18Å; W372-H376 AromaticContact CG-CD2 3.9Å; W372-H376 AromaticContact CH2-NE2 3.94Å; W372-H376 AromaticContact CZ2-NE2 3.27Å; W372-H376 VanDerWaalsContact CZ2-NE2 3.27Å; W372-H376 WeakPolarHBondContact CZ2-NE2 3.45Å; W372-H376 AromaticContact NE1-CD2 3.2Å; W372-H376 PolarHBondContact NE1-CD2 3.39Å; W372-H376 AromaticContact NE1-NE2 3.34Å; W372-H376 PolarHBondContact NE1-NE2 2.87Å; W372-H376 PolarHBondContact O-CD2 3.5Å; W372-H376 PolarHBondContact O-N 3Å; W372-H376 VanDerWaalsContact O-N 3.12Å; S373-H376 PolarHBondContact O-N 3.43Å
377	H	96.7	Very high	94.5	Very high	23 Å²	23	32.4 Å²	32.4	11%	0.106	16%	0.159	C	C	.	.			trans	-102.7	139.7	175.8	-61.1	80	0	0	0	109.6	K206 S283 I284 L285 T362 S373 M374	K206-H377 PolarHBondContact NZ-O 2.86Å; S283-H377 WeakPolarHBondContact OG-CA 3.5Å; I284-H377 PolarHBondContact O-CD2 2.94Å; L285-H377 HydrophobicContact CB-CB 3.79Å; T362-H377 WeakPolarHBondContact CB-NE2 3.2Å; T362-H377 PolarHBondContact OG1-NE2 2.85Å; S373-H377 PolarHBondContact O-N 3.15Å; S373-H377 PolarHBondContact O-ND1 2.79Å; M374-H377 VanDerWaalsContact O-O 3.07Å
378	D	94.7	Very high	94.7	Very high	73 Å²	73	32 Å²	32	39%	0.39	16%	0.158	S	C	.	.	S	Bend	trans	-71.2	-46.4	179	-57.4	-49	0	0	0	109.5	K206 D211 P282 S283	K206-D378 PolarHBondContact NZ-O 3.27Å; D211-D378 WeakPolarHBondContact CB-O 3.3Å; D211-D378 VanDerWaalsContact CG-O 3.29Å; P282-D378 VanDerWaalsContact CD-OD2 3.26Å; P282-D378 WeakPolarHBondContact CD-OD2 3.46Å; P282-D378 VanDerWaalsContact CG-OD2 3.3Å; P282-D378 WeakPolarHBondContact CG-OD2 3.35Å; S283-D378 PolarHBondContact N-OD2 3.18Å; S283-D378 PolarHBondContact O-N 2.99Å; S283-D378 VanDerWaalsContact O-N 3.14Å; S283-D378 PolarHBondContact OG-N 2.69Å; S283-D378 PolarHBondContact OG-OD2 3.24Å
379	T	97.2	Very high	94.9	Very high	6 Å²	6	33.8 Å²	33.8	4%	0.037	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	142.9	178.6	44	0	0	0	0	113.3	D211 W280 S283 L285	D211-T379 WeakPolarHBondContact O-CA 3.47Å; W280-T379 HydrophobicContact CB-CG2 4.02Å; W280-T379 HydrophobicContact CG-CG2 4.45Å; W280-T379 WeakPolarHBondContact O-CB 3.45Å; W280-T379 WeakPolarHBondContact O-CG2 3.48Å; W280-T379 PolarHBondContact O-OG1 3.5Å; S283-T379 PolarHBondContact O-N 2.71Å; S283-T379 VanDerWaalsContact O-N 3.12Å; S283-T379 PolarHBondContact O-OG1 2.82Å; L285-T379 PolarHBondContact N-O 2.77Å
380	L	97.5	Very high	94.9	Very high	1 Å²	1	33 Å²	33	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	116.8	176	179	68	0	0	0	108.4	L203 K206 D211 L212 H213 L285 V287 L369 M374 I382	L203-L380 HydrophobicContact CD2-CD2 4.07Å; K206-L380 HydrophobicContact CG-CD2 4.46Å; D211-L380 PolarHBondContact O-N 2.71Å; L212-L380 WeakPolarHBondContact CA-O 3.27Å; L212-L380 HydrophobicContact CD1-CB 4.38Å; L212-L380 HydrophobicContact CD1-CD2 3.86Å; L212-L380 HydrophobicContact CD1-CG 4.03Å; H213-L380 PolarHBondContact N-O 3.49Å; L285-L380 HydrophobicContact CB-CD1 4.21Å; L285-L380 HydrophobicContact CD2-CD1 3.79Å; L285-L380 HydrophobicContact CG-CD1 3.99Å; V287-L380 HydrophobicContact CG2-CD1 3.68Å; L369-L380 HydrophobicContact CD1-CD1 4.24Å; M374-L380 HydrophobicContact CE-CD2 3.78Å; M374-L380 HydrophobicContact CG-CD2 4.45Å; L380-I382 HydrophobicContact CD1-CG1 4.44Å; L380-I382 HydrophobicContact CD2-CD1 4.02Å; L380-I382 HydrophobicContact CD2-CG1 4.4Å; L380-I382 HydrophobicContact CG-CD1 4.18Å; L380-I382 HydrophobicContact CG-CG1 4Å
381	V	96.6	Very high	94.8	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	119.1	-179.3	-170.7	0	0	0	0	108.8	H213 V215 F218 W280 I284 L285 F286 V287	H213-V381 HydrophobicContact CB-CG1 4.5Å; H213-V381 HydrophobicContact CB-CG2 4.38Å; H213-V381 WeakPolarHBondContact O-CA 3.47Å; V215-V381 HydrophobicContact CB-CG1 4.29Å; V215-V381 HydrophobicContact CG2-CG1 3.41Å; V215-V381 VanDerWaalsContact CG2-CG1 3.41Å; F218-V381 HydrophobicContact CE1-CG1 3.85Å; F218-V381 HydrophobicContact CZ-CG1 4.39Å; W280-V381 HydrophobicContact CD2-CG2 4.5Å; W280-V381 HydrophobicContact CE3-CG2 4.22Å; W280-V381 HydrophobicContact CH2-CG1 4.01Å; W280-V381 HydrophobicContact CH2-CG2 3.94Å; W280-V381 HydrophobicContact CZ2-CG2 4.27Å; W280-V381 HydrophobicContact CZ3-CG2 3.94Å; I284-V381 HydrophobicContact CG2-CG2 3.7Å; L285-V381 PolarHBondContact O-N 2.97Å; F286-V381 CarbonylContact C-O 3.6Å; F286-V381 WeakPolarHBondContact CA-O 3.34Å; F286-V381 HydrophobicContact CD1-CB 3.67Å; F286-V381 HydrophobicContact CD1-CG1 3.91Å; F286-V381 HydrophobicContact CD1-CG2 4.17Å; F286-V381 HydrophobicContact CE1-CB 3.94Å; F286-V381 HydrophobicContact CE1-CG1 4.04Å; F286-V381 HydrophobicContact CE1-CG2 3.98Å; V287-V381 PolarHBondContact N-O 3Å
382	I	96.2	Very high	94.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.7	-174.9	-52.2	-175.4	0	0	0	109.4	L212 H213 I214 V215 V287 L380 A386 L387 L390	L212-I382 HydrophobicContact CD1-CD1 3.59Å; L212-I382 HydrophobicContact CD1-CG1 3.9Å; H213-I382 PolarHBondContact O-N 2.72Å; I214-I382 WeakPolarHBondContact CA-O 3.14Å; V215-I382 PolarHBondContact N-O 2.82Å; V287-I382 HydrophobicContact CB-CG1 4.28Å; V287-I382 HydrophobicContact CB-CG2 4.5Å; V287-I382 HydrophobicContact CG2-CG1 4.45Å; L380-I382 HydrophobicContact CD1-CG1 4.44Å; L380-I382 HydrophobicContact CD2-CD1 4.02Å; L380-I382 HydrophobicContact CD2-CG1 4.4Å; L380-I382 HydrophobicContact CG-CD1 4.18Å; L380-I382 HydrophobicContact CG-CG1 4Å; I382-A386 HydrophobicContact CG2-CB 3.69Å; I382-L387 HydrophobicContact CG2-CB 4.03Å; I382-L390 HydrophobicContact CD1-CD1 4.46Å
383	S	93.6	Very high	94.4	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.021	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	155.6	172.6	70.9	0	0	0	0	111.6	V215 V287 D288 K385 A386 L387	V215-S383 CarbonylContact O-C 3.57Å; V215-S383 VanDerWaalsContact O-CA 3.29Å; V215-S383 WeakPolarHBondContact O-CA 3.24Å; V287-S383 PolarHBondContact O-N 3.04Å; V287-S383 VanDerWaalsContact O-N 3.1Å; D288-S383 PolarHBondContact OD1-OG 2.7Å; S383-K385 VanDerWaalsContact C-N 3.3Å; S383-K385 PolarHBondContact O-N 2.73Å; S383-A386 WeakPolarHBondContact O-CB 3.32Å; S383-A386 PolarHBondContact O-N 3.03Å; S383-A386 WeakPolarHBondContact OG-CB 3.39Å; S383-A386 PolarHBondContact OG-N 3.43Å; S383-L387 PolarHBondContact O-N 3.47Å
384	L	92.5	Very high	94.4	Very high	27 Å²	27	38.5 Å²	38.5	14%	0.141	18%	0.182	C	C	.	.	H	α-helix	trans	-57.6	-46.7	-178.4	-174.7	151.4	0	0	0	111.4	L83 V215 D216 A386 L387 E388	L83-L384 HydrophobicContact CD2-CD1 4.48Å; V215-L384 PolarHBondContact O-N 3.39Å; D216-L384 WeakPolarHBondContact O-CB 3.23Å; D216-L384 PolarHBondContact O-N 3.04Å; L384-A386 VanDerWaalsContact C-N 3.3Å; L384-A386 PolarHBondContact O-N 3.07Å; L384-L387 WeakPolarHBondContact O-CB 3.46Å; L384-L387 PolarHBondContact O-N 3.27Å; L384-E388 HydrophobicContact CD2-CG 4.43Å; L384-E388 WeakPolarHBondContact CD2-OE1 3.2Å; L384-E388 PolarHBondContact O-N 2.86Å
385	K	90.4	Very high	94.2	Very high	90 Å²	90	38.8 Å²	38.8	39%	0.391	18%	0.183	S	C	.	.	H	α-helix	trans	-61.7	-40	176.5	-64.3	172.9	-178.3	164.8	0	111.4	A289 S383 L387 M389	A289-K385 HydrophobicContact CB-CB 3.83Å; S383-K385 VanDerWaalsContact C-N 3.3Å; S383-K385 PolarHBondContact O-N 2.73Å; K385-L387 VanDerWaalsContact C-N 3.34Å; K385-M389 WeakPolarHBondContact O-CG 3.37Å; K385-M389 PolarHBondContact O-N 3.47Å
386	A	93.2	Very high	94	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.8	-40.1	178.7	0	0	0	0	0	112.5	V287 A289 V366 I382 S383 L384 L390	V287-A386 WeakPolarHBondContact O-CB 3.29Å; A289-A386 HydrophobicContact CB-CB 4.41Å; V366-A386 VanDerWaalsContact CG2-CA 3.45Å; V366-A386 HydrophobicContact CG2-CB 3.2Å; I382-A386 HydrophobicContact CG2-CB 3.69Å; S383-A386 WeakPolarHBondContact O-CB 3.32Å; S383-A386 PolarHBondContact O-N 3.03Å; S383-A386 WeakPolarHBondContact OG-CB 3.39Å; S383-A386 PolarHBondContact OG-N 3.43Å; L384-A386 VanDerWaalsContact C-N 3.3Å; L384-A386 PolarHBondContact O-N 3.07Å; A386-L390 VanDerWaalsContact O-CB 3.23Å; A386-L390 WeakPolarHBondContact O-CB 3.46Å; A386-L390 PolarHBondContact O-N 3.45Å
387	L	94.9	Very high	93.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.2	-48.1	177.7	178.8	69	0	0	0	111.4	I104 L106 F111 I214 I382 S383 L384 K385 M389 L390 E391	I104-L387 HydrophobicContact CG2-CD2 4.34Å; L106-L387 HydrophobicContact CD2-CD1 3.87Å; L106-L387 HydrophobicContact CD2-CD2 3.71Å; L106-L387 HydrophobicContact CD2-CG 4.32Å; F111-L387 HydrophobicContact CE2-CD1 3.88Å; F111-L387 HydrophobicContact CZ-CD1 3.62Å; I214-L387 HydrophobicContact CD1-CD2 3.84Å; I214-L387 HydrophobicContact CG1-CD2 4.42Å; I214-L387 HydrophobicContact CG2-CD2 4.12Å; I382-L387 HydrophobicContact CG2-CB 4.03Å; S383-L387 PolarHBondContact O-N 3.47Å; L384-L387 WeakPolarHBondContact O-CB 3.46Å; L384-L387 PolarHBondContact O-N 3.27Å; K385-L387 VanDerWaalsContact C-N 3.34Å; L387-M389 PolarHBondContact O-N 3.47Å; L387-L390 WeakPolarHBondContact O-CB 3.4Å; L387-L390 PolarHBondContact O-N 2.8Å; L387-L390 VanDerWaalsContact O-N 3.15Å; L387-E391 HydrophobicContact CD1-CG 4.3Å; L387-E391 HydrophobicContact CG-CG 4.48Å; L387-E391 WeakPolarHBondContact O-CG 3.24Å; L387-E391 PolarHBondContact O-N 3Å
388	E	92	Very high	93.6	Very high	81 Å²	81	32.8 Å²	32.8	38%	0.379	16%	0.162	S	C	.	.	H	α-helix	trans	-59.4	-48.8	179.2	-67.7	176.2	169	0	0	111.2	R63 L384 L390 E391 E392	R63-E388 IonicContact CZ-OE1 3.5Å; R63-E388 IonicContact NH1-OE1 3.43Å; R63-E388 PolarHBondContact NH1-OE1 3.33Å; L384-E388 HydrophobicContact CD2-CG 4.43Å; L384-E388 WeakPolarHBondContact CD2-OE1 3.2Å; L384-E388 PolarHBondContact O-N 2.86Å; E388-L390 VanDerWaalsContact C-N 3.27Å; E388-L390 PolarHBondContact O-N 3.15Å; E388-E391 PolarHBondContact O-N 2.83Å; E388-E392 WeakPolarHBondContact O-CG 3.39Å; E388-E392 PolarHBondContact O-N 3.3Å
389	M	91.7	Very high	93.4	Very high	58 Å²	58	31.3 Å²	31.3	29%	0.286	16%	0.156	S	C	.	.	H	α-helix	trans	-60.3	-36.5	175.8	-72.6	-178.1	60.8	0	0	113.2	A289 K385 L387 R393	A289-M389 HydrophobicContact CB-SD 3.64Å; K385-M389 WeakPolarHBondContact O-CG 3.37Å; K385-M389 PolarHBondContact O-N 3.47Å; L387-M389 PolarHBondContact O-N 3.47Å; M389-R393 WeakPolarHBondContact O-CB 3.33Å; M389-R393 WeakPolarHBondContact O-CD 3.25Å; M389-R393 WeakPolarHBondContact O-CG 3.47Å; M389-R393 PolarHBondContact O-N 2.84Å
390	L	94.4	Very high	93	Very high	7 Å²	7	34 Å²	34	4%	0.037	17%	0.172	C	C	.	.	H	α-helix	trans	-69.5	-46.8	178.8	-178.3	160.4	0	0	0	110.4	I110 L203 V366 L369 I382 A386 L387 E388 R393 L394	I110-L390 HydrophobicContact CG2-CD2 4.38Å; L203-L390 HydrophobicContact CD1-CD2 4.11Å; V366-L390 HydrophobicContact CG1-CB 4Å; L369-L390 HydrophobicContact CD2-CD1 3.51Å; I382-L390 HydrophobicContact CD1-CD1 4.46Å; A386-L390 VanDerWaalsContact O-CB 3.23Å; A386-L390 WeakPolarHBondContact O-CB 3.46Å; A386-L390 PolarHBondContact O-N 3.45Å; L387-L390 WeakPolarHBondContact O-CB 3.4Å; L387-L390 PolarHBondContact O-N 2.8Å; L387-L390 VanDerWaalsContact O-N 3.15Å; E388-L390 VanDerWaalsContact C-N 3.27Å; E388-L390 PolarHBondContact O-N 3.15Å; L390-R393 PolarHBondContact O-N 2.68Å; L390-L394 HydrophobicContact CD2-CD1 3.36Å; L390-L394 HydrophobicContact CD2-CG 3.98Å; L390-L394 HydrophobicContact CG-CD1 4.13Å; L390-L394 HydrophobicContact CG-CG 4.43Å; L390-L394 WeakPolarHBondContact O-CB 3.2Å; L390-L394 WeakPolarHBondContact O-CG 3.17Å; L390-L394 PolarHBondContact O-N 3.47Å
391	E	93.7	Very high	92.6	Very high	14 Å²	14	34.6 Å²	34.6	7%	0.065	18%	0.175	C	C	.	.	H	α-helix	trans	-60.3	-49	-179.9	-71.7	-169.5	148.8	0	0	111.4	H107 I110 F111 L387 E388 R393 L394 I395	H107-E391 PolarHBondContact N-OE1 3.46Å; I110-E391 HydrophobicContact CD1-CB 3.96Å; I110-E391 HydrophobicContact CD1-CG 3.88Å; F111-E391 HydrophobicContact CE2-CG 4.26Å; L387-E391 HydrophobicContact CD1-CG 4.3Å; L387-E391 HydrophobicContact CG-CG 4.48Å; L387-E391 WeakPolarHBondContact O-CG 3.24Å; L387-E391 PolarHBondContact O-N 3Å; E388-E391 PolarHBondContact O-N 2.83Å; E391-R393 VanDerWaalsContact C-N 3.31Å; E391-R393 PolarHBondContact O-N 3.35Å; E391-L394 PolarHBondContact O-N 3.19Å; E391-I395 WeakPolarHBondContact O-CB 3.45Å; E391-I395 VanDerWaalsContact O-CG1 3.25Å; E391-I395 WeakPolarHBondContact O-CG1 3.48Å; E391-I395 PolarHBondContact O-N 3.33Å
392	E	91.9	Very high	92.1	Very high	112 Å²	112	35.3 Å²	35.3	52%	0.523	18%	0.18	S	C	.	.	H	α-helix	trans	-56.6	-44.8	177.4	-70	-179.5	169.1	0	0	112.3	E388 A396	E388-E392 WeakPolarHBondContact O-CG 3.39Å; E388-E392 PolarHBondContact O-N 3.3Å; E392-A396 VanDerWaalsContact O-CB 3.29Å; E392-A396 WeakPolarHBondContact O-CB 3.49Å; E392-A396 PolarHBondContact O-N 3.48Å
393	R	93.3	Very high	91.5	Very high	129 Å²	129	43.3 Å²	43.3	49%	0.487	21%	0.21	S	C	.	.	H	α-helix	trans	-70.6	-40.8	-178.3	-74	177.9	-179.8	-161.9	1.1	112.6	M389 L390 E391 A397	M389-R393 WeakPolarHBondContact O-CB 3.33Å; M389-R393 WeakPolarHBondContact O-CD 3.25Å; M389-R393 WeakPolarHBondContact O-CG 3.47Å; M389-R393 PolarHBondContact O-N 2.84Å; L390-R393 PolarHBondContact O-N 2.68Å; E391-R393 VanDerWaalsContact C-N 3.31Å; E391-R393 PolarHBondContact O-N 3.35Å; R393-A397 WeakPolarHBondContact O-CB 3.36Å; R393-A397 PolarHBondContact O-N 3.2Å
394	L	94.4	Very high	90.8	Very high	17 Å²	17	46.8 Å²	46.8	9%	0.089	23%	0.228	C	C	.	.	H	α-helix	trans	-71.2	-37	-179.9	-70.2	-172.1	0	0	0	111.9	I110 L199 L200 L203 L390 E391 A397 Q398	I110-L394 HydrophobicContact CD1-CB 3.79Å; I110-L394 HydrophobicContact CD1-CD1 4.31Å; I110-L394 HydrophobicContact CG1-CB 4.14Å; I110-L394 HydrophobicContact CG1-CD1 4.4Å; I110-L394 HydrophobicContact CG2-CD1 3.85Å; L199-L394 HydrophobicContact CD2-CD2 3.77Å; L200-L394 HydrophobicContact CD2-CB 4.41Å; L200-L394 HydrophobicContact CD2-CD1 3.93Å; L203-L394 HydrophobicContact CD1-CD1 3.57Å; L390-L394 HydrophobicContact CD2-CD1 3.36Å; L390-L394 HydrophobicContact CD2-CG 3.98Å; L390-L394 HydrophobicContact CG-CD1 4.13Å; L390-L394 HydrophobicContact CG-CG 4.43Å; L390-L394 WeakPolarHBondContact O-CB 3.2Å; L390-L394 WeakPolarHBondContact O-CG 3.17Å; L390-L394 PolarHBondContact O-N 3.47Å; E391-L394 PolarHBondContact O-N 3.19Å; L394-A397 PolarHBondContact O-N 3.24Å; L394-Q398 WeakPolarHBondContact O-CG 3.4Å; L394-Q398 PolarHBondContact O-N 3.35Å
395	I	92.1	Very high	90	Very high	7 Å²	7	50.9 Å²	50.9	4%	0.036	25%	0.247	C	C	.	.	H	α-helix	trans	-65.1	-48.3	173.5	-67.9	169	0	0	0	109.8	Q66 V69 H107 I110 E391 A397 Q398 T399	Q66-I395 HydrophobicContact CB-CD1 3.76Å; Q66-I395 HydrophobicContact CB-CG2 4.39Å; Q66-I395 HydrophobicContact CG-CD1 4.45Å; V69-I395 HydrophobicContact CG2-CG2 3.78Å; H107-I395 HydrophobicContact CB-CD1 4.42Å; H107-I395 VanDerWaalsContact CD2-CD1 3.49Å; H107-I395 WeakPolarHBondContact CD2-CD1 3.45Å; I110-I395 HydrophobicContact CD1-CD1 4.42Å; I110-I395 HydrophobicContact CD1-CG1 4.04Å; E391-I395 WeakPolarHBondContact O-CB 3.45Å; E391-I395 VanDerWaalsContact O-CG1 3.25Å; E391-I395 WeakPolarHBondContact O-CG1 3.48Å; E391-I395 PolarHBondContact O-N 3.33Å; I395-A397 VanDerWaalsContact C-N 3.26Å; I395-A397 PolarHBondContact O-N 2.96Å; I395-Q398 WeakPolarHBondContact O-CB 3.46Å; I395-Q398 PolarHBondContact O-N 3.2Å; I395-Q398 VanDerWaalsContact O-N 3.15Å; I395-T399 WeakPolarHBondContact O-CG2 3.15Å; I395-T399 PolarHBondContact O-N 3.38Å
396	A	91	Very high	89	Confident	51 Å²	51	55.2 Å²	55.2	42%	0.421	26%	0.262	S	S	.	.	H	α-helix	trans	-55.6	-43.9	174	0	0	0	0	0	111.5	E392 Q398 T399 V400	E392-A396 VanDerWaalsContact O-CB 3.29Å; E392-A396 WeakPolarHBondContact O-CB 3.49Å; E392-A396 PolarHBondContact O-N 3.48Å; A396-Q398 PolarHBondContact O-N 2.67Å; A396-T399 PolarHBondContact O-N 3.49Å; A396-T399 PolarHBondContact O-OG1 3.47Å; A396-V400 WeakPolarHBondContact O-CG2 3.24Å; A396-V400 PolarHBondContact O-N 3.26Å
397	A	92.8	Very high	87.8	Confident	10 Å²	10	61.6 Å²	61.6	8%	0.083	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-39.8	177.8	0	0	0	0	0	113.3	Y192 L196 R393 L394 I395 V400 V401	Y192-A397 WeakPolarHBondContact OH-CB 3.5Å; L196-A397 HydrophobicContact CD1-CB 3.26Å; R393-A397 WeakPolarHBondContact O-CB 3.36Å; R393-A397 PolarHBondContact O-N 3.2Å; L394-A397 PolarHBondContact O-N 3.24Å; I395-A397 VanDerWaalsContact C-N 3.26Å; I395-A397 PolarHBondContact O-N 2.96Å; A397-V400 PolarHBondContact O-N 3.28Å; A397-V401 WeakPolarHBondContact O-CG2 3.21Å; A397-V401 PolarHBondContact O-N 3.06Å
398	Q	91.8	Very high	86	Confident	3 Å²	3	69.3 Å²	69.3	1%	0.014	33%	0.332	C	S	.	.	H	α-helix	trans	-61.7	-43.5	172.5	-78.8	176.1	-4.7	0	0	111.4	V69 D109 L196 L200 L394 I395 A396 V400 V401 V402	V69-Q398 HydrophobicContact CB-CB 4.34Å; V69-Q398 HydrophobicContact CG1-CB 4.34Å; V69-Q398 HydrophobicContact CG2-CB 3.91Å; D109-Q398 PolarHBondContact O-NE2 3.43Å; L196-Q398 HydrophobicContact CD1-CG 4.36Å; L196-Q398 HydrophobicContact CD2-CG 3.87Å; L200-Q398 HydrophobicContact CD1-CG 4.09Å; L394-Q398 WeakPolarHBondContact O-CG 3.4Å; L394-Q398 PolarHBondContact O-N 3.35Å; I395-Q398 WeakPolarHBondContact O-CB 3.46Å; I395-Q398 PolarHBondContact O-N 3.2Å; I395-Q398 VanDerWaalsContact O-N 3.15Å; A396-Q398 PolarHBondContact O-N 2.67Å; Q398-V400 PolarHBondContact O-N 3.03Å; Q398-V401 PolarHBondContact O-N 3.34Å; Q398-V402 WeakPolarHBondContact O-CG2 3.17Å; Q398-V402 PolarHBondContact O-N 3.25Å
399	T	90.3	Very high	83.9	Confident	42 Å²	42	68.3 Å²	68.3	26%	0.258	34%	0.338	S	S	.	.	H	α-helix	trans	-61	-33.8	178.6	66.1	0	0	0	0	112.6	V69 I395 A396 R403	V69-T399 HydrophobicContact CB-CG2 4.44Å; V69-T399 HydrophobicContact CG1-CG2 3.96Å; V69-T399 HydrophobicContact CG2-CG2 3.66Å; I395-T399 WeakPolarHBondContact O-CG2 3.15Å; I395-T399 PolarHBondContact O-N 3.38Å; A396-T399 PolarHBondContact O-N 3.49Å; A396-T399 PolarHBondContact O-OG1 3.47Å; T399-R403 WeakPolarHBondContact O-CB 3.3Å; T399-R403 WeakPolarHBondContact O-CD 3.16Å; T399-R403 WeakPolarHBondContact O-CG 2.99Å; T399-R403 PolarHBondContact O-N 3.37Å
400	V	89.4	Confident	81.7	Confident	62 Å²	62	71 Å²	71	38%	0.376	36%	0.359	S	S	.	.	H	α-helix	trans	-66.2	-49.9	175.3	175	0	0	0	0	110.6	A396 A397 Q398 V402 R403 D404	A396-V400 WeakPolarHBondContact O-CG2 3.24Å; A396-V400 PolarHBondContact O-N 3.26Å; A397-V400 PolarHBondContact O-N 3.28Å; Q398-V400 PolarHBondContact O-N 3.03Å; V400-V402 VanDerWaalsContact C-N 3.32Å; V400-V402 PolarHBondContact O-N 3.25Å; V400-R403 PolarHBondContact O-N 3.5Å; V400-D404 PolarHBondContact O-N 3.37Å
401	V	88.8	Confident	79.1	Confident	13 Å²	13	80.6 Å²	80.6	8%	0.079	40%	0.397	C	S	.	.	H	α-helix	trans	-58.2	-46	179.2	175.8	0	0	0	0	111.1	Y192 L196 A397 Q398 R403 D404 E405	Y192-V401 HydrophobicContact CD1-CG2 3.59Å; Y192-V401 HydrophobicContact CE1-CG2 3.69Å; L196-V401 HydrophobicContact CD2-CG2 4.44Å; A397-V401 WeakPolarHBondContact O-CG2 3.21Å; A397-V401 PolarHBondContact O-N 3.06Å; Q398-V401 PolarHBondContact O-N 3.34Å; V401-R403 PolarHBondContact O-N 3.47Å; V401-D404 PolarHBondContact O-N 3.37Å; V401-E405 WeakPolarHBondContact O-CG 3.29Å; V401-E405 PolarHBondContact O-N 3.27Å
402	V	86.3	Confident	76.6	Confident	16 Å²	16	87.9 Å²	87.9	10%	0.097	44%	0.435	C	S	.	.	H	α-helix	trans	-64	-40.5	179.5	171.2	0	0	0	0	111.6	V69 Y70 Q398 V400 D404 E405 Y406	V69-V402 HydrophobicContact CG1-CB 4.26Å; V69-V402 HydrophobicContact CG1-CG2 3.88Å; Y70-V402 HydrophobicContact CD1-CG2 4.25Å; Y70-V402 HydrophobicContact CE1-CG2 3.37Å; Y70-V402 HydrophobicContact CE2-CG2 4.31Å; Y70-V402 VanDerWaalsContact CZ-CG2 3.41Å; Y70-V402 VanDerWaalsContact OH-CG2 3.3Å; Y70-V402 WeakPolarHBondContact OH-CG2 3.45Å; Q398-V402 WeakPolarHBondContact O-CG2 3.17Å; Q398-V402 PolarHBondContact O-N 3.25Å; V400-V402 VanDerWaalsContact C-N 3.32Å; V400-V402 PolarHBondContact O-N 3.25Å; V402-D404 VanDerWaalsContact C-N 3.34Å; V402-D404 PolarHBondContact O-N 3.16Å; V402-E405 PolarHBondContact O-N 3.48Å; V402-Y406 HydrophobicContact CG1-CD2 3.86Å; V402-Y406 HydrophobicContact CG1-CE2 3.42Å; V402-Y406 VanDerWaalsContact CG1-CE2 3.42Å; V402-Y406 WeakPolarHBondContact O-CD2 3.38Å; V402-Y406 PolarHBondContact O-N 2.99Å; V402-Y406 VanDerWaalsContact O-N 3.16Å
403	R	82.8	Confident	74	Confident	167 Å²	167	90.1 Å²	90.1	63%	0.63	45%	0.445	S	S	*	.	H	α-helix	trans	-62.5	-41.4	175.2	-77	170.6	-177.7	-175.7	2.9	112.2	T399 V400 V401 E405 Y406 N407	T399-R403 WeakPolarHBondContact O-CB 3.3Å; T399-R403 WeakPolarHBondContact O-CD 3.16Å; T399-R403 WeakPolarHBondContact O-CG 2.99Å; T399-R403 PolarHBondContact O-N 3.37Å; V400-R403 PolarHBondContact O-N 3.5Å; V401-R403 PolarHBondContact O-N 3.47Å; R403-E405 VanDerWaalsContact C-N 3.35Å; R403-Y406 PolarHBondContact O-N 3.19Å; R403-N407 VanDerWaalsContact O-CG 3.3Å; R403-N407 PolarHBondContact O-N 3.03Å; R403-N407 PolarHBondContact O-ND2 2.92Å
404	D	79.7	Confident	71.5	Confident	76 Å²	76	88.7 Å²	88.7	41%	0.406	45%	0.453	S	S	.	.	H	α-helix	trans	-65.1	-40.3	178.6	-67.1	-20	0	0	0	111	V400 V401 V402 Y406 N407 E408	V400-D404 PolarHBondContact O-N 3.37Å; V401-D404 PolarHBondContact O-N 3.37Å; V402-D404 VanDerWaalsContact C-N 3.34Å; V402-D404 PolarHBondContact O-N 3.16Å; D404-Y406 VanDerWaalsContact C-N 3.32Å; D404-Y406 PolarHBondContact O-N 3.49Å; D404-N407 PolarHBondContact O-N 2.62Å; D404-N407 VanDerWaalsContact O-N 3.15Å; D404-E408 WeakPolarHBondContact O-CB 3.38Å; D404-E408 WeakPolarHBondContact O-CG 3.42Å; D404-E408 PolarHBondContact O-N 3.16Å
405	E	76.1	Confident	68.8	Low	113 Å²	113	92.1 Å²	92.1	53%	0.528	48%	0.479	S	S	.	.	H	α-helix	trans	-60.3	-38.3	174.2	-71.9	174	-176.2	0	0	112.8	V401 V402 R403 A409	V401-E405 WeakPolarHBondContact O-CG 3.29Å; V401-E405 PolarHBondContact O-N 3.27Å; V402-E405 PolarHBondContact O-N 3.48Å; R403-E405 VanDerWaalsContact C-N 3.35Å; E405-A409 PolarHBondContact O-N 3.33Å; E405-A409 VanDerWaalsContact O-N 3.17Å
406	Y	69.6	Low	66.1	Low	181 Å²	181	97.8 Å²	97.8	71%	0.71	51%	0.514	S	S	*	.	H	α-helix	trans	-69.8	-36	174.5	-76.1	-65	0	0	0	112.9	V402 R403 D404 A409	V402-Y406 HydrophobicContact CG1-CD2 3.86Å; V402-Y406 HydrophobicContact CG1-CE2 3.42Å; V402-Y406 VanDerWaalsContact CG1-CE2 3.42Å; V402-Y406 WeakPolarHBondContact O-CD2 3.38Å; V402-Y406 PolarHBondContact O-N 2.99Å; V402-Y406 VanDerWaalsContact O-N 3.16Å; R403-Y406 PolarHBondContact O-N 3.19Å; D404-Y406 VanDerWaalsContact C-N 3.32Å; D404-Y406 PolarHBondContact O-N 3.49Å; Y406-A409 WeakPolarHBondContact O-CB 3.34Å; Y406-A409 PolarHBondContact O-N 3.18Å
407	N	67.2	Low	63.6	Low	134 Å²	134	99.7 Å²	99.7	72%	0.717	52%	0.521	S	S	*	.	H	α-helix	trans	-73.8	-31.1	178.1	-69	-28.9	0	0	0	112.3	R403 D404 A409	R403-N407 VanDerWaalsContact O-CG 3.3Å; R403-N407 PolarHBondContact O-N 3.03Å; R403-N407 PolarHBondContact O-ND2 2.92Å; D404-N407 PolarHBondContact O-N 2.62Å; D404-N407 VanDerWaalsContact O-N 3.15Å; N407-A409 VanDerWaalsContact C-N 3.33Å
408	E	57.6	Low	60.8	Low	162 Å²	162	105 Å²	105	76%	0.757	55%	0.549	S	S	*	.	S	Bend	trans	-85.3	-2.7	175.9	-70.8	-173.7	172.7	0	0	113.6	D404	D404-E408 WeakPolarHBondContact O-CB 3.38Å; D404-E408 WeakPolarHBondContact O-CG 3.42Å; D404-E408 PolarHBondContact O-N 3.16Å
409	A	48	Very low	58.3	Low	60 Å²	60	116 Å²	116	50%	0.496	59%	0.59	S	S	.	*			trans	-49.2	130.2	179.6	0	0	0	0	0	110.4	E405 Y406 N407	E405-A409 PolarHBondContact O-N 3.33Å; E405-A409 VanDerWaalsContact O-N 3.17Å; Y406-A409 WeakPolarHBondContact O-CB 3.34Å; Y406-A409 PolarHBondContact O-N 3.18Å; N407-A409 VanDerWaalsContact C-N 3.33Å
410	P	45	Very low	55.8	Low	114 Å²	114	122.5 Å²	122.5	74%	0.74	62%	0.615	S	S	*	*			trans	-63.2	146.4	-166.2	26	-33.3	0	0	0	109.8	L412	P410-L412 PolarHBondContact O-N 3.1Å
411	Y	40.1	Very low	53.1	Low	210 Å²	210	123.9 Å²	123.9	82%	0.824	62%	0.624	S	S	*	*			trans	-34.5	110.1	155	-67.4	-90.4	0	0	0	108.2	H413	Y411-H413 PolarHBondContact O-N 3.08Å
412	L	40.7	Very low	50.6	Low	167 Å²	167	129.2 Å²	129.2	87%	0.874	66%	0.656	S	S	*	*			trans	-52.5	114	160.2	-80.8	155.3	0	0	0	103.6	P410 P414	P410-L412 PolarHBondContact O-N 3.1Å; L412-P414 VanDerWaalsContact O-N 3.12Å
413	H	38.3	Very low	48	Very low	158 Å²	158	137.8 Å²	137.8	73%	0.731	70%	0.695	S	S	*	*			trans	-45.2	128.5	163.8	-168.4	-74.3	0	0	0	104.7	Y411 S415	Y411-H413 PolarHBondContact O-N 3.08Å; H413-S415 PolarHBondContact O-N 3.15Å
414	P	40.2	Very low	46.1	Very low	99 Å²	99	136.3 Å²	136.3	64%	0.643	71%	0.705	S	S	*	*			trans	-49.7	119	176.3	22	-30.7	0	0	0	104.1	L412 T416	L412-P414 VanDerWaalsContact O-N 3.12Å; P414-T416 PolarHBondContact O-N 2.87Å
415	S	36.4	Very low	43.9	Very low	90 Å²	90	140.6 Å²	140.6	63%	0.629	73%	0.728	S	S	*	*			trans	-12	123.1	172.8	46.4	0	0	0	0	110.2	H413 P417	H413-S415 PolarHBondContact O-N 3.15Å; S415-P417 WeakPolarHBondContact O-CD 3.06Å
416	T	35.7	Very low	41.9	Very low	126 Å²	126	138.5 Å²	138.5	77%	0.773	74%	0.736	S	S	*	*			trans	-45.7	109.6	140.3	35.2	0	0	0	0	104.1	P414 D418	P414-T416 PolarHBondContact O-N 2.87Å; T416-D418 PolarHBondContact O-N 3.39Å; T416-D418 VanDerWaalsContact O-N 3.09Å
417	P	39.3	Very low	40.2	Very low	90 Å²	90	139.5 Å²	139.5	58%	0.584	75%	0.747	S	S	*	*			trans	-57.9	125.9	165.6	-6.2	23.3	0	0	0	101.6	S415 W419	S415-P417 WeakPolarHBondContact O-CD 3.06Å; P417-W419 PolarHBondContact O-N 3.29Å
418	D	33.7	Very low	38.6	Very low	122 Å²	122	137.8 Å²	137.8	65%	0.652	75%	0.752	S	S	*	*			trans	-46.5	112.4	169.1	-136.1	-9.4	0	0	0	104.9	T416 F420 T421	T416-D418 PolarHBondContact O-N 3.39Å; T416-D418 VanDerWaalsContact O-N 3.09Å; D418-F420 PolarHBondContact O-N 3.25Å; D418-T421 PolarHBondContact O-N 3.04Å
419	W	40.1	Very low	37.5	Very low	234 Å²	234	137.4 Å²	137.4	89%	0.886	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-6.8	-169.4	166.5	-85.2	0	0	0	112.2	P417	P417-W419 PolarHBondContact O-N 3.29Å
420	F	36.4	Very low	37.1	Very low	178 Å²	178	141.7 Å²	141.7	78%	0.781	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-11.3	-179.3	-82.8	-84.4	0	0	0	116.1	D418	D418-F420 PolarHBondContact O-N 3.25Å
421	T	33.2	Very low	37	Very low	91 Å²	91	146 Å²	146	56%	0.558	77%	0.772	S	S	*	*	S	Bend	trans	-149.8	134.4	-176.8	46.2	0	0	0	0	113.2	D418	D418-T421 PolarHBondContact O-N 3.04Å
422	T	37	Very low	37	Very low	125 Å²	125	142.3 Å²	142.3	77%	0.767	77%	0.771	S	S	*	*			trans	92.3	89.5	167.8	65.2	0	0	0	0	117.9
423	E	31.8	Very low	36.9	Very low	196 Å²	196	140.7 Å²	140.7	92%	0.916	76%	0.764	S	S	*	*			trans	-60.7	113.7	148.1	-59.3	169.7	163.5	0	0	109.2
424	V	42.1	Very low	37	Very low	136 Å²	136	141.1 Å²	141.1	82%	0.824	76%	0.764	S	S	*	*			trans	-151.7	118.2	151.7	-171.4	0	0	0	0	109.6
425	D	33.1	Very low	37.1	Very low	167 Å²	167	141.2 Å²	141.2	89%	0.893	77%	0.766	S	S	*	*			trans	-61.8	142.8	173.9	-62.3	-57.4	0	0	0	113.3
426	G	34.8	Very low	37.2	Very low	68 Å²	68	144.2 Å²	144.2	70%	0.701	77%	0.768	S	S	*	*			trans	141.1	102.3	154.2	0	0	0	0	0	117.4
427	Q	34.3	Very low	37.3	Very low	202 Å²	202	145.5 Å²	145.5	94%	0.944	77%	0.766	S	S	*	*			trans	59.4	92.9	147.4	-68.7	167.2	-32.1	0	0	118.1
428	A	33.9	Very low	37.4	Very low	98 Å²	98	148.5 Å²	148.5	81%	0.81	78%	0.777	S	S	*	*			trans	-139.1	67.4	168.4	0	0	0	0	0	112.1
429	D	33.6	Very low	37.8	Very low	154 Å²	154	151.7 Å²	151.7	82%	0.824	78%	0.78	S	S	*	*			trans	-125	100	166.4	-67.6	-30.7	0	0	0	107.1
430	D	39.8	Very low	38	Very low	150 Å²	150	148.3 Å²	148.3	80%	0.802	77%	0.773	S	S	*	*	S	Bend	trans	173	33.7	158.6	-93.2	-10.4	0	0	0	116.6
431	Y	41.5	Very low	38.5	Very low	204 Å²	204	148.6 Å²	148.6	80%	0.8	78%	0.775	S	S	*	*			trans	-137.2	20	-175.7	-72.7	-78.1	0	0	0	118.6
432	V	41.5	Very low	39.7	Very low	133 Å²	133	149.3 Å²	149.3	81%	0.806	78%	0.783	S	S	*	*	S	Bend	trans	-88.6	-11.6	-176.9	-179.7	0	0	0	0	114.9
433	N	38.8	Very low	41	Very low	133 Å²	133	147 Å²	147	71%	0.711	77%	0.766	S	S	*	*	S	Bend	trans	-107.8	2.6	-163.7	-75.4	-14.6	0	0	0	118.7
434	K	40.8	Very low	42.4	Very low	168 Å²	168	144.9 Å²	144.9	73%	0.73	76%	0.76	S	S	*	*	S	Bend	trans	-89.8	-8.2	-166.5	-93.7	177.1	178.4	170.6	0	118.3
435	S	40.8	Very low	43.4	Very low	100 Å²	100	145.6 Å²	145.6	70%	0.699	76%	0.758	S	S	*	*	S	Bend	trans	-101.5	2.7	-169.1	54.2	0	0	0	0	116.2
436	F	38.1	Very low	45.3	Very low	154 Å²	154	139 Å²	139	68%	0.675	73%	0.73	S	S	*	*	S	Bend	trans	-114.5	0.2	-176	-75.3	-84.7	0	0	0	116.1
437	E	38.5	Very low	47.3	Very low	152 Å²	152	137.5 Å²	137.5	71%	0.71	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-85.4	-13.1	-168.4	-67.9	-172.2	156.4	0	0	116.4	R439	E437-R439 PolarHBondContact O-N 3.17Å
438	N	42	Very low	49.2	Very low	154 Å²	154	131.7 Å²	131.7	82%	0.824	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-97.6	19.5	-168.7	-70.3	-18.7	0	0	0	116.4
439	R	42.3	Very low	50.7	Low	189 Å²	189	132.1 Å²	132.1	71%	0.713	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-94.5	4.2	179.7	-82.9	-171.7	-86.8	-146.9	-6.9	115.7	E437	E437-R439 PolarHBondContact O-N 3.17Å
440	H	43.8	Very low	52.4	Low	162 Å²	162	128.9 Å²	128.9	75%	0.75	65%	0.65	S	S	*	*	S	Bend	trans	-128	132.2	174.4	-69	-66.7	0	0	0	110.6	S442	H440-S442 VanDerWaalsContact C-N 3.3Å; H440-S442 PolarHBondContact O-N 3.48Å
441	F	47.3	Very low	53.6	Low	185 Å²	185	128.9 Å²	128.9	81%	0.811	64%	0.639	S	S	*	*			trans	-56.7	92.1	168.1	-79.3	-90.5	0	0	0	109
442	S	58.6	Low	54.9	Low	105 Å²	105	127.6 Å²	127.6	73%	0.734	63%	0.633	S	S	*	*			trans	-92.5	-14.2	176.6	50.2	0	0	0	0	112.7	H440	H440-S442 VanDerWaalsContact C-N 3.3Å; H440-S442 PolarHBondContact O-N 3.48Å
443	D	63.7	Low	55.9	Low	77 Å²	77	127 Å²	127	41%	0.412	63%	0.625	S	S	.	*	S	Bend	trans	-80.9	142.1	-176.4	-72.9	-19.4	0	0	0	112.8	I445	D443-I445 PolarHBondContact O-N 3.13Å
444	L	62.1	Low	56.8	Low	151 Å²	151	124 Å²	124	79%	0.791	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-56.4	132.8	174	-78.1	145.4	0	0	0	111.1	G446 S447	L444-G446 PolarHBondContact O-N 3.11Å; L444-G446 VanDerWaalsContact O-N 3.11Å; L444-S447 PolarHBondContact O-N 3.46Å; L444-S447 VanDerWaalsContact O-N 3.13Å
445	I	62.9	Low	56.8	Low	151 Å²	151	125.2 Å²	125.2	77%	0.774	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.3	118	173.3	-64.6	167.2	0	0	0	108.7	D443 W450	D443-I445 PolarHBondContact O-N 3.13Å; I445-W450 HydrophobicContact CG2-CH2 4.47Å; I445-W450 HydrophobicContact CG2-CZ2 4.22Å
446	G	72.1	Confident	57.6	Low	30 Å²	30	126.5 Å²	126.5	31%	0.309	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	106.2	-1.7	179.6	0	0	0	0	0	116.5	L444 R451	L444-G446 PolarHBondContact O-N 3.11Å; L444-G446 VanDerWaalsContact O-N 3.11Å; G446-R451 PolarHBondContact O-NE 3.09Å
447	S	77.4	Confident	58.7	Low	36 Å²	36	125.1 Å²	125.1	25%	0.252	62%	0.619	S	S	.	*			trans	-59.7	155.7	173.6	99.7	0	0	0	0	112.1	L444 K449 W450 R451	L444-S447 PolarHBondContact O-N 3.46Å; L444-S447 VanDerWaalsContact O-N 3.13Å; S447-K449 PolarHBondContact O-N 3.02Å; S447-K449 PolarHBondContact OG-N 3.16Å; S447-W450 WeakPolarHBondContact O-CB 3.48Å; S447-W450 PolarHBondContact O-N 3.33Å; S447-W450 VanDerWaalsContact O-N 3.16Å; S447-W450 PolarHBondContact OG-N 3.3Å; S447-R451 PolarHBondContact O-N 2.86Å
448	S	74.5	Confident	59.8	Low	80 Å²	80	123.6 Å²	123.6	56%	0.559	61%	0.613	S	S	*	*	H	α-helix	trans	-61.6	-31.6	178.1	57.7	0	0	0	0	112.6	R452	S448-R452 WeakPolarHBondContact O-CG 3.32Å; S448-R452 PolarHBondContact O-N 2.83Å
449	K	64.8	Low	60.8	Low	107 Å²	107	121.8 Å²	121.8	47%	0.465	60%	0.601	S	S	.	*	H	α-helix	trans	-72.1	-43.8	174	-166.4	178.5	174.3	-166.2	0	110.9	S447 R451 R452 D453	S447-K449 PolarHBondContact O-N 3.02Å; S447-K449 PolarHBondContact OG-N 3.16Å; K449-R451 VanDerWaalsContact C-N 3.3Å; K449-R451 PolarHBondContact O-N 2.82Å; K449-R452 PolarHBondContact O-N 3.29Å; K449-R452 VanDerWaalsContact O-N 3.08Å; K449-D453 PolarHBondContact O-N 2.81Å; K449-D453 VanDerWaalsContact O-N 3.1Å
450	W	68.8	Low	62	Low	85 Å²	85	117.6 Å²	117.6	32%	0.322	59%	0.594	S	S	.	*	H	α-helix	trans	-56.7	-41.8	172.5	-177.3	87.3	0	0	0	111.9	I445 S447 D453 T454	I445-W450 HydrophobicContact CG2-CH2 4.47Å; I445-W450 HydrophobicContact CG2-CZ2 4.22Å; S447-W450 WeakPolarHBondContact O-CB 3.48Å; S447-W450 PolarHBondContact O-N 3.33Å; S447-W450 VanDerWaalsContact O-N 3.16Å; S447-W450 PolarHBondContact OG-N 3.3Å; W450-D453 PolarHBondContact O-N 3.45Å; W450-T454 HydrophobicContact CD2-CG2 4.28Å; W450-T454 HydrophobicContact CZ2-CG2 4.3Å; W450-T454 WeakPolarHBondContact O-CB 3.42Å; W450-T454 WeakPolarHBondContact O-CG2 3.43Å; W450-T454 PolarHBondContact O-N 2.94Å; W450-T454 VanDerWaalsContact O-N 3.16Å; W450-T454 PolarHBondContact O-OG1 3Å
451	R	66.3	Low	63.2	Low	151 Å²	151	114.6 Å²	114.6	57%	0.57	58%	0.584	S	S	*	*	H	α-helix	trans	-67.8	-32.5	175.9	-70.5	-173.5	-153	179	3.2	113.8	G446 S447 K449 L455	G446-R451 PolarHBondContact O-NE 3.09Å; S447-R451 PolarHBondContact O-N 2.86Å; K449-R451 VanDerWaalsContact C-N 3.3Å; K449-R451 PolarHBondContact O-N 2.82Å; R451-L455 HydrophobicContact CB-CD1 4.42Å; R451-L455 WeakPolarHBondContact O-CB 3.34Å; R451-L455 WeakPolarHBondContact O-CD1 3Å; R451-L455 WeakPolarHBondContact O-CG 3.42Å; R451-L455 PolarHBondContact O-N 2.72Å
452	R	67.3	Low	64.3	Low	177 Å²	177	109.6 Å²	109.6	67%	0.668	57%	0.567	S	S	*	*	H	α-helix	trans	-72.6	-32.5	177.5	-79	-171.6	-129.8	125.2	-1.9	112.8	S448 K449	S448-R452 WeakPolarHBondContact O-CG 3.32Å; S448-R452 PolarHBondContact O-N 2.83Å; K449-R452 PolarHBondContact O-N 3.29Å; K449-R452 VanDerWaalsContact O-N 3.08Å
453	D	63.7	Low	64.8	Low	120 Å²	120	109.9 Å²	109.9	64%	0.642	56%	0.555	S	S	*	*	H	α-helix	trans	-89.9	-15.8	-176.6	-63.1	-17.8	0	0	0	112.9	K449 W450	K449-D453 PolarHBondContact O-N 2.81Å; K449-D453 VanDerWaalsContact O-N 3.1Å; W450-D453 PolarHBondContact O-N 3.45Å
454	T	56.9	Low	64.9	Low	70 Å²	70	112.7 Å²	112.7	43%	0.429	57%	0.566	S	S	.	*	H	α-helix	trans	-107	-15.8	-177.5	56.1	0	0	0	0	115.4	W450	W450-T454 HydrophobicContact CD2-CG2 4.28Å; W450-T454 HydrophobicContact CZ2-CG2 4.3Å; W450-T454 WeakPolarHBondContact O-CB 3.42Å; W450-T454 WeakPolarHBondContact O-CG2 3.43Å; W450-T454 PolarHBondContact O-N 2.94Å; W450-T454 VanDerWaalsContact O-N 3.16Å; W450-T454 PolarHBondContact O-OG1 3Å
455	L	41.7	Very low	65.1	Low	194 Å²	194	109.2 Å²	109.2	100%	1.016	55%	0.546	S	S	*	.			trans	-95.5	0	171.9	-69.4	170.8	0	0	0	110.1	R451	R451-L455 HydrophobicContact CB-CD1 4.42Å; R451-L455 WeakPolarHBondContact O-CB 3.34Å; R451-L455 WeakPolarHBondContact O-CD1 3Å; R451-L455 WeakPolarHBondContact O-CG 3.42Å; R451-L455 PolarHBondContact O-N 2.72Å

Retrieved 455 of 455 residues in 835.1 ms (Link to these results)

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