A0A3Q0KF97_SCHMA Loading...

Cell polarity protein

AlphaFold DB , UniProt , Accession A0A3Q0KF97, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 592 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	49.5	Very low	54.8	Low	221 Å²	221	188.7 Å²	188.7	100%	1.089	86%	0.855	S	S	*	*				0	158.4	0	-92.4	46.1	172.7	0	0	110.8
2	N	47.8	Very low	54.2	Low	162 Å²	162	189 Å²	189	87%	0.866	85%	0.853	S	S	*	*			trans	58.1	76.8	158	-54.6	-2.3	0	0	0	117.5
3	R	51.8	Low	53.6	Low	236 Å²	236	193.5 Å²	193.5	89%	0.891	86%	0.86	S	S	*	*			trans	-113	145	162.5	-78.2	-174.4	173.5	-175.3	-1.2	110.9
4	L	60.1	Low	53.1	Low	138 Å²	138	194.2 Å²	194.2	72%	0.723	86%	0.861	S	S	*	*			trans	60	89.8	154.6	-62.7	161.4	0	0	0	118.6
5	R	62.7	Low	52.5	Low	245 Å²	245	192.4 Å²	192.4	93%	0.925	85%	0.852	S	S	*	*			trans	-104.8	80	161.1	-143.2	-178.8	-164.8	-150.4	4.8	110.8
6	R	57.8	Low	52.1	Low	219 Å²	219	190.9 Å²	190.9	83%	0.826	85%	0.848	S	S	*	*			trans	-117.5	83.9	176.9	-84.2	-172.4	174.2	139.1	-3.4	111.4
7	T	57.8	Low	51.4	Low	122 Å²	122	188.5 Å²	188.5	75%	0.748	85%	0.845	S	S	*	*			trans	-144.1	30.9	-177.4	45.8	0	0	0	0	114.7	S9	T7-S9 PolarHBondContact O-N 3.02Å
8	F	56.1	Low	51	Low	200 Å²	200	188.9 Å²	188.9	88%	0.877	85%	0.846	S	S	*	*			trans	-79.6	113.5	172.2	-81.7	-74.5	0	0	0	112.3	F10	F8-F10 PolarHBondContact O-N 3.3Å
9	S	52.3	Low	50.6	Low	101 Å²	101	186.8 Å²	186.8	71%	0.706	84%	0.843	S	S	*	*			trans	-53	103.9	-167.3	-174.1	0	0	0	0	116.4	T7 R11	T7-S9 PolarHBondContact O-N 3.02Å; S9-R11 VanDerWaalsContact C-N 3.34Å; S9-R11 PolarHBondContact O-N 3.01Å
10	F	49.6	Very low	50.2	Low	202 Å²	202	186.3 Å²	186.3	89%	0.886	84%	0.842	S	S	*	*			trans	-92.9	44.6	161.2	-76.9	-79.5	0	0	0	112.7	F8 K12	F8-F10 PolarHBondContact O-N 3.3Å; F10-K12 VanDerWaalsContact C-N 3.32Å; F10-K12 PolarHBondContact O-N 3.03Å; F10-K12 VanDerWaalsContact O-N 3.15Å
11	R	57.9	Low	50	Low	230 Å²	230	182.1 Å²	182.1	87%	0.868	84%	0.841	S	S	*	*			trans	-88.7	66.4	172.9	-77.5	-166.1	176.4	-175.7	1.4	113.3	S9 R13	S9-R11 VanDerWaalsContact C-N 3.34Å; S9-R11 PolarHBondContact O-N 3.01Å; R11-R13 PolarHBondContact O-N 3.15Å; R11-R13 VanDerWaalsContact O-N 3.15Å
12	K	46.9	Very low	49.9	Very low	192 Å²	192	173.2 Å²	173.2	84%	0.835	81%	0.806	S	S	*	*			trans	5.2	90.6	149.3	-162.8	167.7	-170.8	167.7	0	115.4	F10 K14	F10-K12 VanDerWaalsContact C-N 3.32Å; F10-K12 PolarHBondContact O-N 3.03Å; F10-K12 VanDerWaalsContact O-N 3.15Å; K12-K14 VanDerWaalsContact C-N 3.31Å; K12-K14 PolarHBondContact O-N 2.9Å
13	R	47.1	Very low	49.8	Very low	248 Å²	248	170.7 Å²	170.7	94%	0.936	79%	0.792	S	S	*	*			trans	-66	82.2	170.9	-91.9	-175.4	164.7	-178.1	-3.9	110.9	R11 K15	R11-R13 PolarHBondContact O-N 3.15Å; R11-R13 VanDerWaalsContact O-N 3.15Å; R13-K15 PolarHBondContact O-N 3.46Å
14	K	46.8	Very low	49.4	Very low	203 Å²	203	165 Å²	165	88%	0.883	79%	0.789	S	S	*	*			trans	-87.3	74	167.5	-170.5	178.6	178.1	-179.9	0	109.5	K12	K12-K14 VanDerWaalsContact C-N 3.31Å; K12-K14 PolarHBondContact O-N 2.9Å
15	K	42.8	Very low	49.4	Very low	167 Å²	167	161.5 Å²	161.5	73%	0.726	78%	0.776	S	S	*	*			trans	-136.2	136.6	-179.8	-164.8	-178.6	-177.2	-171.3	0	109.9	R13	R13-K15 PolarHBondContact O-N 3.46Å
16	Q	46.1	Very low	49.5	Very low	169 Å²	169	154.4 Å²	154.4	79%	0.79	75%	0.752	S	S	*	*	S	Bend	trans	52.8	79.1	171	-70.4	160.9	-89.9	0	0	116.3
17	N	40.3	Very low	50.4	Low	149 Å²	149	147.7 Å²	147.7	80%	0.797	74%	0.736	S	S	*	*			trans	-155.3	89.6	141.8	-154.7	-12.1	0	0	0	111
18	K	45	Very low	51.7	Low	197 Å²	197	146.8 Å²	146.8	86%	0.857	72%	0.724	S	S	*	*	S	Bend	trans	-160	24.5	172.6	-145.3	-162.1	176.7	-169.5	0	114.6
19	N	43.8	Very low	53.3	Low	149 Å²	149	141 Å²	141	80%	0.797	70%	0.699	S	S	*	*	S	Bend	trans	-113.9	-13.1	-177.8	-69.9	29.8	0	0	0	113.4	A21	N19-A21 PolarHBondContact O-N 3.16Å
20	E	42.5	Very low	55.2	Low	176 Å²	176	140.8 Å²	140.8	82%	0.822	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	35.6	-167.8	-65.3	-71.4	119.2	0	0	113.2
21	A	44.9	Very low	57.2	Low	99 Å²	99	135.4 Å²	135.4	82%	0.818	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.5	15.9	-173.5	0	0	0	0	0	114.2	N19	N19-A21 PolarHBondContact O-N 3.16Å
22	G	48.6	Very low	58.9	Low	33 Å²	33	127.8 Å²	127.8	34%	0.34	64%	0.639	S	S	.	*			trans	-115.5	-6.7	-163.1	0	0	0	0	0	117.3	S25	G22-S25 PolarHBondContact O-OG 3.02Å
23	D	45.1	Very low	61.1	Low	110 Å²	110	118.9 Å²	118.9	59%	0.588	60%	0.601	S	S	*	*	S	Bend	trans	-74.5	-45.9	-172.3	-108.2	-80.2	0	0	0	113.3	S25 K26	D23-S25 PolarHBondContact O-N 3.08Å; D23-S25 VanDerWaalsContact O-N 3.09Å; D23-K26 WeakPolarHBondContact O-CB 3.43Å; D23-K26 PolarHBondContact O-N 3.35Å; D23-K26 WeakPolarHBondContact OD1-CE 3.45Å; D23-K26 IonicContact OD1-NZ 2.74Å; D23-K26 PolarHBondContact OD1-NZ 3.46Å; D23-K26 WeakPolarHBondContact OD2-CE 3.36Å; D23-K26 IonicContact OD2-NZ 2.88Å; D23-K26 PolarHBondContact OD2-NZ 2.8Å
24	S	43	Very low	63.3	Low	117 Å²	117	109.3 Å²	109.3	82%	0.818	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-22.8	177.5	-43.3	0	0	0	0	113.8
25	S	60.3	Low	65.6	Low	64 Å²	64	103.3 Å²	103.3	45%	0.448	55%	0.547	S	S	.	.	H	α-helix	trans	-83.4	-16.4	177.6	42.4	0	0	0	0	114.6	G22 D23 Q28 Q29	G22-S25 PolarHBondContact O-OG 3.02Å; D23-S25 PolarHBondContact O-N 3.08Å; D23-S25 VanDerWaalsContact O-N 3.09Å; S25-Q28 PolarHBondContact O-N 3.3Å; S25-Q29 VanDerWaalsContact O-CB 3.3Å; S25-Q29 WeakPolarHBondContact O-CB 3.34Å; S25-Q29 PolarHBondContact O-N 2.82Å
26	K	65.5	Low	68.1	Low	96 Å²	96	98.4 Å²	98.4	42%	0.417	53%	0.526	S	S	.	.	H	α-helix	trans	-58.4	-51.7	-179.7	-65.6	174.6	-171.5	165.9	0	113.3	D23 Q29 W30	D23-K26 WeakPolarHBondContact O-CB 3.43Å; D23-K26 PolarHBondContact O-N 3.35Å; D23-K26 WeakPolarHBondContact OD1-CE 3.45Å; D23-K26 IonicContact OD1-NZ 2.74Å; D23-K26 PolarHBondContact OD1-NZ 3.46Å; D23-K26 WeakPolarHBondContact OD2-CE 3.36Å; D23-K26 IonicContact OD2-NZ 2.88Å; D23-K26 PolarHBondContact OD2-NZ 2.8Å; K26-Q29 PolarHBondContact O-N 3.22Å; K26-W30 PolarHBondContact O-N 3.09Å
27	P	76.5	Confident	70.4	Confident	77 Å²	77	90.4 Å²	90.4	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-67.3	-38.7	-179.8	25.8	-34.6	0	0	0	112.5	Q29 W30 L31	P27-Q29 VanDerWaalsContact C-N 3.29Å; P27-Q29 PolarHBondContact O-N 3.16Å; P27-W30 PolarHBondContact O-N 3.18Å; P27-W30 VanDerWaalsContact O-N 3.16Å; P27-L31 PolarHBondContact O-N 2.92Å
28	Q	84.5	Confident	72.9	Confident	104 Å²	104	89.8 Å²	89.8	49%	0.486	48%	0.479	S	S	.	.	H	α-helix	trans	-58.6	-43.9	175.6	-177.3	59.7	48.5	0	0	111	S25 W30 L31 D32	S25-Q28 PolarHBondContact O-N 3.3Å; Q28-W30 PolarHBondContact O-N 2.91Å; Q28-L31 WeakPolarHBondContact O-CB 3.39Å; Q28-L31 PolarHBondContact O-N 3.43Å; Q28-L31 VanDerWaalsContact O-N 3.11Å; Q28-D32 PolarHBondContact NE2-OD1 3.45Å; Q28-D32 PolarHBondContact O-N 3.17Å
29	Q	90.1	Very high	75.2	Confident	78 Å²	78	87.3 Å²	87.3	36%	0.364	47%	0.47	S	S	.	.	H	α-helix	trans	-63.7	-26.5	-180	179.9	167.9	65.6	0	0	113.5	S25 K26 P27 D33 R146	S25-Q29 VanDerWaalsContact O-CB 3.3Å; S25-Q29 WeakPolarHBondContact O-CB 3.34Å; S25-Q29 PolarHBondContact O-N 2.82Å; K26-Q29 PolarHBondContact O-N 3.22Å; P27-Q29 VanDerWaalsContact C-N 3.29Å; P27-Q29 PolarHBondContact O-N 3.16Å; Q29-D33 VanDerWaalsContact O-CG 3.25Å; Q29-D33 PolarHBondContact O-N 2.9Å; Q29-R146 VanDerWaalsContact CD-CZ 3.46Å
30	W	91.2	Very high	77.4	Confident	96 Å²	96	81.7 Å²	81.7	36%	0.364	45%	0.447	S	S	.	.	H	α-helix	trans	-77	-37.7	173.5	-60.7	-2.8	0	0	0	111.7	K26 P27 Q28 D33 E34	K26-W30 PolarHBondContact O-N 3.09Å; P27-W30 PolarHBondContact O-N 3.18Å; P27-W30 VanDerWaalsContact O-N 3.16Å; Q28-W30 PolarHBondContact O-N 2.91Å; W30-D33 PolarHBondContact O-N 3.26Å; W30-E34 PolarHBondContact O-N 2.98Å
31	L	92.4	Very high	79.4	Confident	89 Å²	89	80.7 Å²	80.7	47%	0.466	44%	0.44	S	S	.	.	H	α-helix	trans	-65.7	-39.7	172.1	-63.7	171.8	0	0	0	111.7	P27 Q28 D33 E34 V35	P27-L31 PolarHBondContact O-N 2.92Å; Q28-L31 WeakPolarHBondContact O-CB 3.39Å; Q28-L31 PolarHBondContact O-N 3.43Å; Q28-L31 VanDerWaalsContact O-N 3.11Å; L31-D33 PolarHBondContact O-N 3.16Å; L31-E34 WeakPolarHBondContact O-CB 3.26Å; L31-E34 PolarHBondContact O-N 3.2Å; L31-V35 PolarHBondContact O-N 3.41Å; L31-V35 VanDerWaalsContact O-N 3.16Å
32	D	93.3	Very high	81.8	Confident	70 Å²	70	76.2 Å²	76.2	37%	0.374	40%	0.403	S	S	.	.	H	α-helix	trans	-60.5	-34.6	173.3	-61.7	-18.5	0	0	0	110.9	Q28 K36	Q28-D32 PolarHBondContact NE2-OD1 3.45Å; Q28-D32 PolarHBondContact O-N 3.17Å; D32-K36 VanDerWaalsContact O-CG 3.3Å; D32-K36 WeakPolarHBondContact O-CG 3.45Å; D32-K36 PolarHBondContact O-N 2.72Å; D32-K36 PolarHBondContact O-NZ 3.08Å
33	D	93.3	Very high	84	Confident	6 Å²	6	77.4 Å²	77.4	3%	0.032	41%	0.406	C	S	.	.	H	α-helix	trans	-74.8	-38.3	176.7	-70.5	-11.8	0	0	0	111.6	Q29 W30 L31 V35 K36 I37 R146	Q29-D33 VanDerWaalsContact O-CG 3.25Å; Q29-D33 PolarHBondContact O-N 2.9Å; W30-D33 PolarHBondContact O-N 3.26Å; L31-D33 PolarHBondContact O-N 3.16Å; D33-V35 VanDerWaalsContact C-N 3.28Å; D33-V35 PolarHBondContact O-N 3.15Å; D33-K36 WeakPolarHBondContact O-CB 3.35Å; D33-K36 PolarHBondContact O-N 3.37Å; D33-K36 VanDerWaalsContact O-N 3.14Å; D33-K36 IonicContact OD1-NZ 2.7Å; D33-K36 PolarHBondContact OD1-NZ 3.47Å; D33-I37 HydrophobicContact CB-CD1 4.43Å; D33-I37 VanDerWaalsContact O-CD1 3.23Å; D33-I37 WeakPolarHBondContact O-CD1 3.4Å; D33-I37 WeakPolarHBondContact O-CG1 3.38Å; D33-I37 PolarHBondContact O-N 3.11Å; D33-R146 IonicContact OD1-NH2 2.72Å; D33-R146 PolarHBondContact OD1-NH2 3.39Å; D33-R146 IonicContact OD2-CZ 2.74Å; D33-R146 IonicContact OD2-NE 3.2Å; D33-R146 PolarHBondContact OD2-NE 2.86Å; D33-R146 IonicContact OD2-NH2 3.51Å; D33-R146 PolarHBondContact OD2-NH2 3.37Å
34	E	94	Very high	86.4	Confident	47 Å²	47	72.6 Å²	72.6	22%	0.22	38%	0.38	C	S	.	.	H	α-helix	trans	-54.8	-43	172.4	-87.5	-178.8	-131.6	0	0	112.9	W30 L31 I37 K38 H149 C153	W30-E34 PolarHBondContact O-N 2.98Å; L31-E34 WeakPolarHBondContact O-CB 3.26Å; L31-E34 PolarHBondContact O-N 3.2Å; E34-I37 PolarHBondContact O-N 3.14Å; E34-K38 WeakPolarHBondContact O-CD 3.29Å; E34-K38 VanDerWaalsContact O-CG 3.29Å; E34-K38 WeakPolarHBondContact O-CG 3.43Å; E34-K38 PolarHBondContact O-N 3.24Å; E34-K38 VanDerWaalsContact O-N 3.15Å; E34-K38 IonicContact OE2-NZ 3.89Å; E34-H149 IonicContact OE1-CE1 2.93Å; E34-H149 IonicContact OE1-NE2 3.05Å; E34-H149 PolarHBondContact OE1-NE2 3.32Å; E34-C153 HydrophobicContact CG-CB 4.2Å; E34-C153 WeakPolarHBondContact CG-SG 3.42Å
35	V	94.4	Very high	89	Confident	76 Å²	76	70.8 Å²	70.8	46%	0.461	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-49.9	174.9	176.7	0	0	0	0	110.2	L31 D33 I37 K38 E39	L31-V35 PolarHBondContact O-N 3.41Å; L31-V35 VanDerWaalsContact O-N 3.16Å; D33-V35 VanDerWaalsContact C-N 3.28Å; D33-V35 PolarHBondContact O-N 3.15Å; V35-I37 VanDerWaalsContact C-N 3.28Å; V35-I37 PolarHBondContact O-N 2.93Å; V35-K38 WeakPolarHBondContact O-CB 3.39Å; V35-K38 PolarHBondContact O-N 3.02Å; V35-K38 VanDerWaalsContact O-N 3.1Å; V35-E39 HydrophobicContact CG1-CG 4.47Å; V35-E39 WeakPolarHBondContact O-CG 3.38Å; V35-E39 PolarHBondContact O-N 2.86Å
36	K	95	Very high	90.8	Very high	64 Å²	64	67.9 Å²	67.9	28%	0.278	34%	0.338	S	S	.	.	H	α-helix	trans	-56.7	-36.3	176.9	-74.3	-178.9	-140.3	86.1	0	113.8	D32 D33 E39 G40 F41 C42	D32-K36 VanDerWaalsContact O-CG 3.3Å; D32-K36 WeakPolarHBondContact O-CG 3.45Å; D32-K36 PolarHBondContact O-N 2.72Å; D32-K36 PolarHBondContact O-NZ 3.08Å; D33-K36 WeakPolarHBondContact O-CB 3.35Å; D33-K36 PolarHBondContact O-N 3.37Å; D33-K36 VanDerWaalsContact O-N 3.14Å; D33-K36 IonicContact OD1-NZ 2.7Å; D33-K36 PolarHBondContact OD1-NZ 3.47Å; K36-E39 CarbonylContact O-C 3.58Å; K36-E39 PolarHBondContact O-N 3.32Å; K36-G40 CarbonylContact O-C 3.47Å; K36-G40 PolarHBondContact O-N 2.97Å; K36-F41 WeakPolarHBondContact CB-O 3.49Å; K36-F41 CarbonylContact O-C 3.58Å; K36-F41 PolarHBondContact O-N 2.89Å; K36-C42 HydrophobicContact CB-CB 4.1Å
37	I	94.8	Very high	92.2	Very high	2 Å²	2	67.3 Å²	67.3	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-74.8	-33.7	-179.9	-61.3	153.5	0	0	0	110.7	D33 E34 V35 G40 C42 V83 A150 C153 A154 I157	D33-I37 HydrophobicContact CB-CD1 4.43Å; D33-I37 VanDerWaalsContact O-CD1 3.23Å; D33-I37 WeakPolarHBondContact O-CD1 3.4Å; D33-I37 WeakPolarHBondContact O-CG1 3.38Å; D33-I37 PolarHBondContact O-N 3.11Å; E34-I37 PolarHBondContact O-N 3.14Å; V35-I37 VanDerWaalsContact C-N 3.28Å; V35-I37 PolarHBondContact O-N 2.93Å; I37-G40 PolarHBondContact O-N 2.76Å; I37-G40 VanDerWaalsContact O-N 3.14Å; I37-C42 HydrophobicContact CD1-CB 4.42Å; I37-C42 HydrophobicContact CG1-CB 3.47Å; I37-C42 VanDerWaalsContact CG1-CB 3.47Å; I37-V83 HydrophobicContact CG1-CG1 4.45Å; I37-A150 HydrophobicContact CD1-CB 3.66Å; I37-A150 WeakPolarHBondContact CD1-O 3.46Å; I37-C153 HydrophobicContact CD1-CB 3.97Å; I37-A154 HydrophobicContact CG2-CB 3.98Å; I37-I157 HydrophobicContact CG2-CD1 3.87Å
38	K	93	Very high	93.2	Very high	136 Å²	136	64.6 Å²	64.6	59%	0.591	32%	0.316	S	S	*	.	H	α-helix	trans	-67.6	-36.2	170.4	-69	163.4	-176.8	158.9	0	111.7	E34 V35 G40 I157	E34-K38 WeakPolarHBondContact O-CD 3.29Å; E34-K38 VanDerWaalsContact O-CG 3.29Å; E34-K38 WeakPolarHBondContact O-CG 3.43Å; E34-K38 PolarHBondContact O-N 3.24Å; E34-K38 VanDerWaalsContact O-N 3.15Å; E34-K38 IonicContact OE2-NZ 3.89Å; V35-K38 WeakPolarHBondContact O-CB 3.39Å; V35-K38 PolarHBondContact O-N 3.02Å; V35-K38 VanDerWaalsContact O-N 3.1Å; K38-G40 PolarHBondContact O-N 3.48Å; K38-I157 HydrophobicContact CB-CD1 4.47Å; K38-I157 HydrophobicContact CG-CD1 3.68Å; K38-I157 HydrophobicContact CG-CG1 4.29Å
39	E	93.1	Very high	93.8	Very high	145 Å²	145	59.9 Å²	59.9	68%	0.678	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-12.6	169.4	-67.1	172.4	172.3	0	0	113.2	V35 K36	V35-E39 HydrophobicContact CG1-CG 4.47Å; V35-E39 WeakPolarHBondContact O-CG 3.38Å; V35-E39 PolarHBondContact O-N 2.86Å; K36-E39 CarbonylContact O-C 3.58Å; K36-E39 PolarHBondContact O-N 3.32Å
40	G	89.9	Confident	94.1	Very high	30 Å²	30	56.5 Å²	56.5	31%	0.309	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-1	178	0	0	0	0	0	116.1	K36 I37 K38 S84	K36-G40 CarbonylContact O-C 3.47Å; K36-G40 PolarHBondContact O-N 2.97Å; I37-G40 PolarHBondContact O-N 2.76Å; I37-G40 VanDerWaalsContact O-N 3.14Å; K38-G40 PolarHBondContact O-N 3.48Å; G40-S84 PolarHBondContact O-OG 3.07Å
41	F	85.7	Confident	94.2	Very high	156 Å²	156	54.5 Å²	54.5	68%	0.684	28%	0.276	S	S	*	.			trans	-119.9	77.2	-174	-176.3	-103.6	0	0	0	113	K36	K36-F41 WeakPolarHBondContact CB-O 3.49Å; K36-F41 CarbonylContact O-C 3.58Å; K36-F41 PolarHBondContact O-N 2.89Å
42	C	94.5	Very high	94.4	Very high	4 Å²	4	52.9 Å²	52.9	3%	0.027	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.9	169.2	-162.1	0	0	0	0	110.6	K36 I37 F44 S82 V83	K36-C42 HydrophobicContact CB-CB 4.1Å; I37-C42 HydrophobicContact CD1-CB 4.42Å; I37-C42 HydrophobicContact CG1-CB 3.47Å; I37-C42 VanDerWaalsContact CG1-CB 3.47Å; C42-F44 VanDerWaalsContact SG-CE2 3.52Å; C42-F44 WeakPolarHBondContact SG-CZ 3.15Å; C42-S82 CarbonylContact O-C 3.33Å; C42-S82 VanDerWaalsContact O-CA 3.32Å; C42-S82 WeakPolarHBondContact O-CA 3.41Å; C42-V83 HydrophobicContact CB-CB 4.48Å; C42-V83 WeakPolarHBondContact CB-O 3.45Å; C42-V83 PolarHBondContact N-O 2.67Å; C42-V83 PolarHBondContact O-N 3.24Å
43	S	94.7	Very high	94.5	Very high	59 Å²	59	53 Å²	53	41%	0.413	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	140.2	-177	60.5	0	0	0	0	113.4	L81	S43-L81 CarbonylContact C-O 3.52Å; S43-L81 WeakPolarHBondContact CA-O 3.38Å
44	F	96.3	Very high	94.7	Very high	8 Å²	8	53.4 Å²	53.4	4%	0.035	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	139.4	-173.5	-57.8	-78.9	0	0	0	112	C42 V46 V80 L81 V83 E142 R146 L147 A150	C42-F44 VanDerWaalsContact SG-CE2 3.52Å; C42-F44 WeakPolarHBondContact SG-CZ 3.15Å; F44-V46 HydrophobicContact CB-CG1 4.45Å; F44-V46 PolarHBondContact O-N 3.27Å; F44-V80 WeakPolarHBondContact O-CA 3.38Å; F44-L81 PolarHBondContact N-O 2.98Å; F44-L81 PolarHBondContact O-N 3.18Å; F44-V83 HydrophobicContact CD2-CG2 4.07Å; F44-V83 HydrophobicContact CE2-CG2 4.02Å; F44-E142 HydrophobicContact CD1-CG 4.14Å; F44-R146 HydrophobicContact CE1-CG 4.33Å; F44-L147 HydrophobicContact CB-CD2 3.47Å; F44-L147 VanDerWaalsContact CB-CD2 3.47Å; F44-L147 HydrophobicContact CD1-CD2 3.76Å; F44-L147 HydrophobicContact CD2-CD2 3.61Å; F44-L147 HydrophobicContact CE1-CD2 4.37Å; F44-L147 HydrophobicContact CE2-CD2 4.24Å; F44-L147 HydrophobicContact CG-CD2 3.32Å; F44-A150 HydrophobicContact CE2-CB 3.59Å; F44-A150 HydrophobicContact CZ-CB 3.69Å
45	Q	96.8	Very high	94.8	Very high	80 Å²	80	61.3 Å²	61.3	37%	0.374	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	117.8	175.3	-68.9	-177.4	-11.6	0	0	110.5	V140	Q45-V140 HydrophobicContact CB-CB 4.29Å; Q45-V140 WeakPolarHBondContact O-CB 3.41Å; Q45-V140 PolarHBondContact O-N 3.01Å
46	V	97.2	Very high	94.9	Very high	2 Å²	2	63 Å²	63	1%	0.012	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	172.4	-175.1	-60.7	0	0	0	0	110.9	F44 A79 L81 F137 L138 L147	F44-V46 HydrophobicContact CB-CG1 4.45Å; F44-V46 PolarHBondContact O-N 3.27Å; V46-A79 CarbonylContact C-O 3.39Å; V46-A79 HydrophobicContact CG2-CB 4.13Å; V46-A79 WeakPolarHBondContact CG2-O 3.35Å; V46-A79 PolarHBondContact N-O 3.4Å; V46-A79 PolarHBondContact O-N 3.34Å; V46-L81 HydrophobicContact CG1-CB 4.03Å; V46-L81 HydrophobicContact CG2-CB 3.88Å; V46-F137 HydrophobicContact CG2-CD1 4.01Å; V46-L138 CarbonylContact C-O 3.6Å; V46-L138 VanDerWaalsContact CA-O 3.29Å; V46-L138 WeakPolarHBondContact CA-O 3.22Å; V46-L147 HydrophobicContact CG1-CD1 3.87Å
47	K	96.7	Very high	94.9	Very high	85 Å²	85	61.4 Å²	61.4	37%	0.37	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.5	157.5	-51.6	175.6	-174.2	170.4	0	108.2	P76 Q77 F137 L138 V140	K47-P76 HydrophobicContact CB-CB 3.92Å; K47-P76 HydrophobicContact CD-CB 4.2Å; K47-Q77 CarbonylContact C-O 3.11Å; K47-Q77 WeakPolarHBondContact CA-O 3.5Å; K47-Q77 WeakPolarHBondContact CB-O 3.45Å; K47-F137 CarbonylContact O-C 3.55Å; K47-F137 WeakPolarHBondContact O-CA 3.28Å; K47-L138 HydrophobicContact CB-CB 4.34Å; K47-L138 PolarHBondContact N-O 2.93Å; K47-L138 PolarHBondContact O-N 3.18Å; K47-V140 HydrophobicContact CG-CG2 3.84Å
48	Y	97	Very high	95	Very high	20 Å²	20	68.1 Å²	68.1	8%	0.078	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	126.6	173.6	-175.3	-140.1	0	0	0	108.9	G50 P76 Q77 V90 I99 V100 H135 A136 F137	Y48-G50 VanDerWaalsContact CE2-O 3.3Å; Y48-G50 WeakPolarHBondContact CE2-O 3.28Å; Y48-G50 VanDerWaalsContact CZ-CA 3.45Å; Y48-P76 WeakPolarHBondContact O-CA 3.34Å; Y48-Q77 PolarHBondContact N-O 2.64Å; Y48-Q77 PolarHBondContact O-N 2.74Å; Y48-V90 HydrophobicContact CG-CG1 4.43Å; Y48-I99 HydrophobicContact CD1-CG2 4.13Å; Y48-I99 HydrophobicContact CE1-CG2 3.91Å; Y48-V100 HydrophobicContact CE1-CG2 3.98Å; Y48-H135 HydrophobicContact CE2-CB 4.43Å; Y48-H135 AromaticContact CE2-ND1 3.96Å; Y48-H135 AromaticContact CZ-ND1 3.9Å; Y48-H135 PolarHBondContact OH-CE1 2.93Å; Y48-H135 PolarHBondContact OH-ND1 3.38Å; Y48-A136 WeakPolarHBondContact CD2-O 3.21Å; Y48-F137 AromaticContact CD2-CD1 3.85Å; Y48-F137 HydrophobicContact CD2-CD1 3.85Å; Y48-F137 AromaticContact CD2-CE1 3.39Å; Y48-F137 HydrophobicContact CD2-CE1 3.39Å; Y48-F137 AromaticContact CD2-CZ 3.83Å; Y48-F137 HydrophobicContact CD2-CZ 3.83Å; Y48-F137 AromaticContact CE2-CE1 3.97Å; Y48-F137 HydrophobicContact CE2-CE1 3.97Å; Y48-F137 AromaticContact CE2-CZ 3.93Å; Y48-F137 HydrophobicContact CE2-CZ 3.93Å; Y48-F137 HydrophobicContact CG-CE1 4.16Å
49	L	96.4	Very high	95.1	Very high	4 Å²	4	62.7 Å²	62.7	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-12	174.3	-71.8	164.4	0	0	0	112	I67 L70 R71 P76 A136 L138	L49-I67 HydrophobicContact CD1-CG2 3.61Å; L49-L70 HydrophobicContact CB-CB 4.01Å; L49-R71 HydrophobicContact CD1-CG 4.02Å; L49-R71 HydrophobicContact CD2-CG 4.14Å; L49-P76 HydrophobicContact CD2-CB 3.88Å; L49-A136 HydrophobicContact CB-CB 4.04Å; L49-A136 WeakPolarHBondContact CB-O 3.47Å; L49-A136 HydrophobicContact CD1-CB 4.01Å; L49-A136 PolarHBondContact N-O 2.97Å; L49-L138 HydrophobicContact CD1-CD1 4.19Å; L49-L138 HydrophobicContact CD1-CD2 4.2Å; L49-L138 HydrophobicContact CD1-CG 3.86Å; L49-L138 HydrophobicContact CD2-CD1 4.12Å; L49-L138 HydrophobicContact CG-CD1 4.3Å; L49-L138 HydrophobicContact CG-CG 4.23Å
50	G	95.8	Very high	95.2	Very high	8 Å²	8	59.4 Å²	59.4	8%	0.082	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	100.1	-164	-170.1	0	0	0	0	0	112.2	Y48 A136	Y48-G50 VanDerWaalsContact CE2-O 3.3Å; Y48-G50 WeakPolarHBondContact CE2-O 3.28Å; Y48-G50 VanDerWaalsContact CZ-CA 3.45Å; G50-A136 PolarHBondContact O-N 2.99Å
51	N	94.9	Very high	95.6	Very high	54 Å²	54	64.6 Å²	64.6	29%	0.289	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	159	177.2	59.6	-11.8	0	0	0	112	M133 C134 H135	N51-M133 HydrophobicContact CB-CE 4.22Å; N51-C134 CarbonylContact C-O 3.56Å; N51-C134 WeakPolarHBondContact CA-O 3.4Å; N51-H135 PolarHBondContact ND2-CE1 3.48Å
52	I	95.8	Very high	96.1	Very high	55 Å²	55	58.7 Å²	58.7	28%	0.282	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	148.1	177.2	-167.2	168.7	0	0	0	109.5	V54 A66 A69 L70 C134	I52-V54 HydrophobicContact CG2-CG1 4.45Å; I52-A66 HydrophobicContact CG2-CB 3.62Å; I52-A69 HydrophobicContact CD1-CB 3.94Å; I52-L70 HydrophobicContact CB-CD1 4.11Å; I52-L70 HydrophobicContact CB-CD2 4.22Å; I52-L70 HydrophobicContact CB-CG 4.16Å; I52-L70 HydrophobicContact CG2-CD1 3.89Å; I52-L70 HydrophobicContact CG2-CG 4.26Å; I52-C134 HydrophobicContact CG2-CB 4.2Å; I52-C134 PolarHBondContact N-O 3.05Å; I52-C134 PolarHBondContact O-N 3.09Å
53	E	96.3	Very high	96.2	Very high	72 Å²	72	58.6 Å²	58.6	34%	0.336	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	140.9	172	-180	172	177.9	0	0	110.6	R131 M133	E53-R131 VanDerWaalsContact CD-CD 3.47Å; E53-R131 HydrophobicContact CG-CB 4.27Å; E53-R131 WeakPolarHBondContact OE1-CD 3.21Å; E53-R131 WeakPolarHBondContact OE1-CG 3.44Å; E53-R131 IonicContact OE1-CZ 2.69Å; E53-R131 IonicContact OE1-NE 3.5Å; E53-R131 IonicContact OE1-NH1 2.74Å; E53-R131 PolarHBondContact OE1-NH1 3.19Å; E53-R131 WeakPolarHBondContact OE2-CD 3.37Å; E53-R131 IonicContact OE2-CZ 3.74Å; E53-R131 IonicContact OE2-NE 3.65Å; E53-R131 IonicContact OE2-NH1 2.71Å; E53-R131 PolarHBondContact OE2-NH1 3.48Å; E53-M133 HydrophobicContact CB-SD 4.08Å
54	V	97	Very high	96.3	Very high	15 Å²	15	56.6 Å²	56.6	9%	0.091	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.8	172.9	-64	0	0	0	0	109.7	I52 E56 V62 I123 W132 C134	I52-V54 HydrophobicContact CG2-CG1 4.45Å; V54-E56 WeakPolarHBondContact CG2-O 3.39Å; V54-V62 HydrophobicContact CB-CG1 3.85Å; V54-V62 HydrophobicContact CG1-CG1 3.76Å; V54-V62 HydrophobicContact CG2-CG1 4.35Å; V54-I123 HydrophobicContact CG2-CG2 3.97Å; V54-W132 HydrophobicContact CG2-CB 3.78Å; V54-W132 PolarHBondContact N-O 3.46Å; V54-W132 WeakPolarHBondContact O-CB 3.48Å; V54-C134 HydrophobicContact CG1-CB 3.65Å; V54-C134 HydrophobicContact CG2-CB 4.17Å
55	Y	95.2	Very high	96.3	Very high	212 Å²	212	62.3 Å²	62.3	83%	0.831	29%	0.294	S	S	*	.	S	Bend	trans	-86.1	-35.3	177.6	-64.3	-77.3	0	0	0	112
56	E	96.8	Very high	96.2	Very high	112 Å²	112	58.8 Å²	58.8	52%	0.523	28%	0.279	S	S	.	.			trans	-83.4	142.3	-178.5	-87.2	-67.4	-177	0	0	113.1	V54 V62	V54-E56 WeakPolarHBondContact CG2-O 3.39Å; E56-V62 HydrophobicContact CB-CG1 4.32Å; E56-V62 HydrophobicContact CB-CG2 3.78Å; E56-V62 HydrophobicContact CG-CG2 4.19Å
57	S	95.1	Very high	96.1	Very high	30 Å²	30	58.7 Å²	58.7	21%	0.21	28%	0.278	C	S	.	.	S	Bend	trans	-82	-20.4	177.5	69.5	0	0	0	0	113.2	S108 W132	S57-S108 WeakPolarHBondContact O-CB 3.4Å; S57-S108 PolarHBondContact O-OG 3.23Å; S57-W132 VanDerWaalsContact CB-CE2 3.49Å; S57-W132 VanDerWaalsContact CB-CZ2 3.45Å
58	R	96.2	Very high	96	Very high	143 Å²	143	60.5 Å²	60.5	54%	0.54	29%	0.286	S	S	.	.	S	Bend	trans	-149.6	153.5	-177	-53.9	-158.9	158.5	83.4	3.5	110	S108 F109	R58-S108 VanDerWaalsContact CZ-O 3.29Å; R58-S108 PolarHBondContact NE-O 3.05Å; R58-S108 PolarHBondContact NH2-O 3.46Å; R58-F109 HydrophobicContact CB-CB 4.15Å; R58-F109 HydrophobicContact CB-CD2 4.23Å; R58-F109 HydrophobicContact CB-CG 4.09Å; R58-F109 HydrophobicContact CG-CB 3.96Å; R58-F109 HydrophobicContact CG-CD2 4.48Å; R58-F109 HydrophobicContact CG-CG 4.36Å
59	G	96.2	Very high	96	Very high	23 Å²	23	61.4 Å²	61.4	24%	0.237	30%	0.298	C	S	.	.			trans	146.5	128	170.7	0	0	0	0	0	112.8	V62 C63 F109	G59-V62 WeakPolarHBondContact O-CB 3.45Å; G59-V62 PolarHBondContact O-N 3.38Å; G59-C63 PolarHBondContact O-N 3.15Å; G59-F109 VanDerWaalsContact C-CE1 3.48Å
60	M	95.7	Very high	96	Very high	75 Å²	75	61.3 Å²	61.3	37%	0.369	30%	0.297	S	S	.	.	H	α-helix	trans	-65.4	-40.2	179.6	-170	174	71.7	0	0	111.7	V62 C63 E64 A111	M60-V62 VanDerWaalsContact C-N 3.31Å; M60-V62 PolarHBondContact O-N 3.37Å; M60-C63 WeakPolarHBondContact O-CB 3.5Å; M60-C63 PolarHBondContact O-N 2.84Å; M60-E64 WeakPolarHBondContact O-CG 3.38Å; M60-E64 PolarHBondContact O-N 2.75Å; M60-A111 HydrophobicContact CG-CB 4.43Å
61	Q	96.7	Very high	95.9	Very high	140 Å²	140	64.1 Å²	64.1	65%	0.654	31%	0.305	S	S	*	.	H	α-helix	trans	-60.9	-39.5	175.2	-67.7	172.7	-9.6	0	0	112	C63 E64 E65	Q61-C63 VanDerWaalsContact C-N 3.33Å; Q61-C63 PolarHBondContact O-N 2.65Å; Q61-E64 PolarHBondContact O-N 3.34Å; Q61-E65 WeakPolarHBondContact O-CG 3.48Å; Q61-E65 PolarHBondContact O-N 3.33Å
62	V	96.9	Very high	95.7	Very high	32 Å²	32	70 Å²	70	19%	0.194	33%	0.328	C	S	.	.	H	α-helix	trans	-62.6	-41.6	177.5	-175.5	0	0	0	0	110.6	V54 E56 G59 M60 A66 I123	V54-V62 HydrophobicContact CB-CG1 3.85Å; V54-V62 HydrophobicContact CG1-CG1 3.76Å; V54-V62 HydrophobicContact CG2-CG1 4.35Å; E56-V62 HydrophobicContact CB-CG1 4.32Å; E56-V62 HydrophobicContact CB-CG2 3.78Å; E56-V62 HydrophobicContact CG-CG2 4.19Å; G59-V62 WeakPolarHBondContact O-CB 3.45Å; G59-V62 PolarHBondContact O-N 3.38Å; M60-V62 VanDerWaalsContact C-N 3.31Å; M60-V62 PolarHBondContact O-N 3.37Å; V62-A66 VanDerWaalsContact O-CB 3.26Å; V62-A66 WeakPolarHBondContact O-CB 3.42Å; V62-A66 PolarHBondContact O-N 2.83Å; V62-I123 HydrophobicContact CB-CD1 4.4Å; V62-I123 HydrophobicContact CG1-CD1 4.09Å
63	C	96.7	Very high	95.4	Very high	1 Å²	1	71.2 Å²	71.2	1%	0.007	34%	0.342	C	S	.	.	H	α-helix	trans	-65.1	-47.7	171.3	-68.2	0	0	0	0	112.3	G59 M60 Q61 E65 A66 I67 A111 A121	G59-C63 PolarHBondContact O-N 3.15Å; M60-C63 WeakPolarHBondContact O-CB 3.5Å; M60-C63 PolarHBondContact O-N 2.84Å; Q61-C63 VanDerWaalsContact C-N 3.33Å; Q61-C63 PolarHBondContact O-N 2.65Å; C63-E65 VanDerWaalsContact C-N 3.3Å; C63-E65 PolarHBondContact O-N 3.13Å; C63-A66 PolarHBondContact O-N 2.86Å; C63-I67 WeakPolarHBondContact O-CD1 3.35Å; C63-I67 WeakPolarHBondContact O-CG1 3.25Å; C63-I67 PolarHBondContact O-N 2.98Å; C63-A111 HydrophobicContact CB-CB 4.35Å; C63-A121 HydrophobicContact CB-CB 4.12Å
64	E	95.7	Very high	94.8	Very high	18 Å²	18	72.8 Å²	72.8	8%	0.084	35%	0.347	C	S	.	.	H	α-helix	trans	-54.4	-45.1	177	-72.3	170	174.3	0	0	111.3	M60 Q61 K68 R114	M60-E64 WeakPolarHBondContact O-CG 3.38Å; M60-E64 PolarHBondContact O-N 2.75Å; Q61-E64 PolarHBondContact O-N 3.34Å; E64-K68 WeakPolarHBondContact O-CB 3.4Å; E64-K68 PolarHBondContact O-N 2.83Å; E64-R114 VanDerWaalsContact CD-NH2 3.3Å; E64-R114 VanDerWaalsContact OE1-CB 3.26Å; E64-R114 WeakPolarHBondContact OE1-CB 3.45Å; E64-R114 IonicContact OE1-CZ 2.7Å; E64-R114 VanDerWaalsContact OE1-CZ 3.27Å; E64-R114 IonicContact OE1-NE 2.73Å; E64-R114 PolarHBondContact OE1-NE 3.29Å; E64-R114 IonicContact OE1-NH2 3.68Å; E64-R114 PolarHBondContact OE1-NH2 2.73Å; E64-R114 IonicContact OE2-CZ 3.93Å; E64-R114 IonicContact OE2-NH2 3.41Å; E64-R114 PolarHBondContact OE2-NH2 3.01Å
65	E	96.1	Very high	94.6	Very high	128 Å²	128	81.6 Å²	81.6	60%	0.598	39%	0.385	S	S	*	.	H	α-helix	trans	-70.2	-43.3	177.8	-70.3	-163.9	148.4	0	0	113.5	Q61 C63 I67 K68 A69	Q61-E65 WeakPolarHBondContact O-CG 3.48Å; Q61-E65 PolarHBondContact O-N 3.33Å; C63-E65 VanDerWaalsContact C-N 3.3Å; C63-E65 PolarHBondContact O-N 3.13Å; E65-I67 PolarHBondContact O-N 3.38Å; E65-K68 CarbonylContact O-C 3.52Å; E65-K68 WeakPolarHBondContact O-CB 3.38Å; E65-K68 PolarHBondContact O-N 3.29Å; E65-A69 WeakPolarHBondContact O-CB 3.17Å; E65-A69 PolarHBondContact O-N 3.28Å
66	A	96.1	Very high	94.5	Very high	5 Å²	5	74.6 Å²	74.6	4%	0.041	37%	0.365	C	S	.	.	H	α-helix	trans	-58.7	-45.5	177.2	0	0	0	0	0	111.9	I52 V62 C63 A69 L70 C134	I52-A66 HydrophobicContact CG2-CB 3.62Å; V62-A66 VanDerWaalsContact O-CB 3.26Å; V62-A66 WeakPolarHBondContact O-CB 3.42Å; V62-A66 PolarHBondContact O-N 2.83Å; C63-A66 PolarHBondContact O-N 2.86Å; A66-A69 PolarHBondContact O-N 2.65Å; A66-L70 WeakPolarHBondContact O-CB 3.25Å; A66-L70 WeakPolarHBondContact O-CG 3.38Å; A66-L70 PolarHBondContact O-N 3.09Å; A66-C134 HydrophobicContact CB-CB 3.82Å; A66-C134 WeakPolarHBondContact CB-SG 3.25Å
67	I	95.2	Very high	94.4	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-67.8	-40.8	177.3	-50.9	160.3	0	0	0	110.1	L49 C63 E65 A69 L70 R71 D113 A121 A136	L49-I67 HydrophobicContact CD1-CG2 3.61Å; C63-I67 WeakPolarHBondContact O-CD1 3.35Å; C63-I67 WeakPolarHBondContact O-CG1 3.25Å; C63-I67 PolarHBondContact O-N 2.98Å; E65-I67 PolarHBondContact O-N 3.38Å; I67-A69 VanDerWaalsContact C-N 3.32Å; I67-A69 PolarHBondContact O-N 3.21Å; I67-L70 PolarHBondContact O-N 3.16Å; I67-R71 HydrophobicContact CG2-CG 4.39Å; I67-R71 WeakPolarHBondContact O-CB 3.48Å; I67-R71 VanDerWaalsContact O-CG 3.25Å; I67-R71 WeakPolarHBondContact O-CG 3.11Å; I67-R71 PolarHBondContact O-N 3.08Å; I67-D113 HydrophobicContact CD1-CB 3.8Å; I67-A121 HydrophobicContact CD1-CB 3.77Å; I67-A121 HydrophobicContact CG1-CB 3.82Å; I67-A136 HydrophobicContact CB-CB 4.32Å; I67-A136 HydrophobicContact CG1-CB 3.8Å; I67-A136 HydrophobicContact CG2-CB 4.34Å
68	K	95	Very high	94.4	Very high	123 Å²	123	77.8 Å²	77.8	54%	0.535	38%	0.375	S	S	.	.	H	α-helix	trans	-62.3	-33	176.1	178.1	-176.1	177.6	-172.7	0	113.2	E64 E65	E64-K68 WeakPolarHBondContact O-CB 3.4Å; E64-K68 PolarHBondContact O-N 2.83Å; E65-K68 CarbonylContact O-C 3.52Å; E65-K68 WeakPolarHBondContact O-CB 3.38Å; E65-K68 PolarHBondContact O-N 3.29Å
69	A	95.7	Very high	94.5	Very high	39 Å²	39	71.1 Å²	71.1	32%	0.322	35%	0.35	S	S	.	.	H	α-helix	trans	-74.9	-50.2	173	0	0	0	0	0	111.6	I52 E65 A66 I67 R71 K72 S73	I52-A69 HydrophobicContact CD1-CB 3.94Å; E65-A69 WeakPolarHBondContact O-CB 3.17Å; E65-A69 PolarHBondContact O-N 3.28Å; A66-A69 PolarHBondContact O-N 2.65Å; I67-A69 VanDerWaalsContact C-N 3.32Å; I67-A69 PolarHBondContact O-N 3.21Å; A69-R71 VanDerWaalsContact C-N 3.33Å; A69-R71 PolarHBondContact O-N 2.98Å; A69-K72 WeakPolarHBondContact O-CB 3.4Å; A69-K72 PolarHBondContact O-N 2.95Å; A69-S73 PolarHBondContact O-N 2.91Å
70	L	95.8	Very high	94.5	Very high	2 Å²	2	71.2 Å²	71.2	1%	0.01	35%	0.346	C	S	.	.	H	α-helix	trans	-64.4	-34.1	-176.9	-73.8	165.9	0	0	0	113.2	L49 I52 A66 I67 K72 S73 K74 A136	L49-L70 HydrophobicContact CB-CB 4.01Å; I52-L70 HydrophobicContact CB-CD1 4.11Å; I52-L70 HydrophobicContact CB-CD2 4.22Å; I52-L70 HydrophobicContact CB-CG 4.16Å; I52-L70 HydrophobicContact CG2-CD1 3.89Å; I52-L70 HydrophobicContact CG2-CG 4.26Å; A66-L70 WeakPolarHBondContact O-CB 3.25Å; A66-L70 WeakPolarHBondContact O-CG 3.38Å; A66-L70 PolarHBondContact O-N 3.09Å; I67-L70 PolarHBondContact O-N 3.16Å; L70-K72 PolarHBondContact O-N 2.91Å; L70-K72 VanDerWaalsContact O-N 3.15Å; L70-S73 PolarHBondContact O-N 2.91Å; L70-K74 HydrophobicContact CD2-CD 4.31Å; L70-K74 PolarHBondContact O-N 2.8Å; L70-A136 HydrophobicContact CD1-CB 3.6Å
71	R	93.6	Very high	94.6	Very high	68 Å²	68	67.7 Å²	67.7	26%	0.257	33%	0.329	S	S	.	.	H	α-helix	trans	-57.7	-21.7	170.1	-78.2	176.6	-177.1	121.4	-1.6	114.1	L49 I67 A69 D113 H116	L49-R71 HydrophobicContact CD1-CG 4.02Å; L49-R71 HydrophobicContact CD2-CG 4.14Å; I67-R71 HydrophobicContact CG2-CG 4.39Å; I67-R71 WeakPolarHBondContact O-CB 3.48Å; I67-R71 VanDerWaalsContact O-CG 3.25Å; I67-R71 WeakPolarHBondContact O-CG 3.11Å; I67-R71 PolarHBondContact O-N 3.08Å; A69-R71 VanDerWaalsContact C-N 3.33Å; A69-R71 PolarHBondContact O-N 2.98Å; R71-D113 IonicContact CZ-OD2 2.68Å; R71-D113 IonicContact NH1-OD2 3.86Å; R71-D113 PolarHBondContact NH1-OD2 3.37Å; R71-D113 IonicContact NH2-OD2 3.46Å; R71-D113 PolarHBondContact NH2-OD2 3.1Å; R71-H116 PolarHBondContact NH1-CE1 3.2Å; R71-H116 PolarHBondContact NH1-ND1 3.12Å; R71-H116 VanDerWaalsContact NH1-ND1 3.14Å; R71-H116 VanDerWaalsContact NH2-CB 3.35Å; R71-H116 PolarHBondContact NH2-ND1 2.86Å
72	K	92.4	Very high	94.6	Very high	176 Å²	176	62.9 Å²	62.9	77%	0.765	31%	0.31	S	S	*	.	H	α-helix	trans	-95.3	-34.9	177.4	-62.6	-179.9	-180	-173.9	0	112.9	A69 L70	A69-K72 WeakPolarHBondContact O-CB 3.4Å; A69-K72 PolarHBondContact O-N 2.95Å; L70-K72 PolarHBondContact O-N 2.91Å; L70-K72 VanDerWaalsContact O-N 3.15Å
73	S	87.9	Confident	94.6	Very high	82 Å²	82	61.4 Å²	61.4	57%	0.573	30%	0.301	S	S	*	.	H	α-helix	trans	-90	-30.1	-169.4	61.4	0	0	0	0	114.8	A69 L70	A69-S73 PolarHBondContact O-N 2.91Å; L70-S73 PolarHBondContact O-N 2.91Å
74	K	85.5	Confident	94.5	Very high	104 Å²	104	63.1 Å²	63.1	45%	0.452	31%	0.314	S	S	.	.	S	Bend	trans	-131.9	145.2	-172.7	-69.2	176.1	-178.7	171.4	0	111.7	L70	L70-K74 HydrophobicContact CD2-CD 4.31Å; L70-K74 PolarHBondContact O-N 2.8Å
75	K	92.1	Very high	94.4	Very high	201 Å²	201	62.6 Å²	62.6	87%	0.874	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-74.2	129.3	172.6	-71.8	179.4	179.5	173.5	0	109.2	Q77	K75-Q77 PolarHBondContact O-N 2.98Å
76	P	92.6	Very high	94.3	Very high	64 Å²	64	60.9 Å²	60.9	42%	0.416	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-67.4	118.4	-179.7	23.7	-32.1	0	0	0	112.1	K47 Y48 L49	K47-P76 HydrophobicContact CB-CB 3.92Å; K47-P76 HydrophobicContact CD-CB 4.2Å; Y48-P76 WeakPolarHBondContact O-CA 3.34Å; L49-P76 HydrophobicContact CD2-CB 3.88Å
77	Q	94.4	Very high	94.2	Very high	88 Å²	88	61.3 Å²	61.3	41%	0.411	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	143	174.3	-179.7	174.1	-6.7	0	0	110.2	K47 Y48 K75 D92	K47-Q77 CarbonylContact C-O 3.11Å; K47-Q77 WeakPolarHBondContact CA-O 3.5Å; K47-Q77 WeakPolarHBondContact CB-O 3.45Å; Y48-Q77 PolarHBondContact N-O 2.64Å; Y48-Q77 PolarHBondContact O-N 2.74Å; K75-Q77 PolarHBondContact O-N 2.98Å; Q77-D92 PolarHBondContact NE2-OD1 3.45Å
78	K	96.6	Very high	94.3	Very high	122 Å²	122	61.3 Å²	61.3	53%	0.53	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	135.2	173.4	-65.8	-174.1	-175.4	176.2	0	110.4	D93	K78-D93 HydrophobicContact CB-CB 3.59Å; K78-D93 HydrophobicContact CD-CB 4.45Å; K78-D93 WeakPolarHBondContact CD-OD2 3.19Å; K78-D93 IonicContact NZ-OD2 2.68Å; K78-D93 PolarHBondContact O-N 3.21Å
79	A	97.1	Very high	94.3	Very high	2 Å²	2	61 Å²	61	2%	0.017	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	162.8	-179.8	0	0	0	0	0	112.1	V46 V90 S91 I99	V46-A79 CarbonylContact C-O 3.39Å; V46-A79 HydrophobicContact CG2-CB 4.13Å; V46-A79 WeakPolarHBondContact CG2-O 3.35Å; V46-A79 PolarHBondContact N-O 3.4Å; V46-A79 PolarHBondContact O-N 3.34Å; A79-V90 HydrophobicContact CB-CG1 3.69Å; A79-S91 CarbonylContact C-O 3.5Å; A79-S91 WeakPolarHBondContact CA-O 3.29Å; A79-S91 VanDerWaalsContact CB-O 3.28Å; A79-S91 WeakPolarHBondContact CB-O 3.39Å; A79-I99 HydrophobicContact CB-CD1 4.39Å
80	V	97	Very high	94.4	Very high	26 Å²	26	59.2 Å²	59.2	16%	0.158	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.6	166.7	-178.1	0	0	0	0	108	F44 V90 S91	F44-V80 WeakPolarHBondContact O-CA 3.38Å; V80-V90 WeakPolarHBondContact O-CA 3.21Å; V80-S91 PolarHBondContact N-O 3.04Å; V80-S91 PolarHBondContact O-N 3.07Å
81	L	97.1	Very high	94.4	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	107.9	170	172.3	62.2	0	0	0	108.2	S43 F44 V46 V83 L88 R89 V90 F120	S43-L81 CarbonylContact C-O 3.52Å; S43-L81 WeakPolarHBondContact CA-O 3.38Å; F44-L81 PolarHBondContact N-O 2.98Å; F44-L81 PolarHBondContact O-N 3.18Å; V46-L81 HydrophobicContact CG1-CB 4.03Å; V46-L81 HydrophobicContact CG2-CB 3.88Å; L81-V83 HydrophobicContact CD1-CG2 4.46Å; L81-V83 HydrophobicContact CD2-CG2 4.41Å; L81-V83 HydrophobicContact CG-CG2 4.01Å; L81-L88 HydrophobicContact CD1-CB 4.42Å; L81-R89 CarbonylContact C-O 3.58Å; L81-R89 WeakPolarHBondContact CA-O 3.23Å; L81-V90 HydrophobicContact CD1-CG2 4.04Å; L81-F120 HydrophobicContact CD2-CD1 4.36Å; L81-F120 HydrophobicContact CD2-CE1 4.13Å
82	S	96.4	Very high	94.6	Very high	39 Å²	39	57.9 Å²	57.9	27%	0.273	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	131.7	171.2	-63.3	0	0	0	0	109.8	C42 R89	C42-S82 CarbonylContact O-C 3.33Å; C42-S82 VanDerWaalsContact O-CA 3.32Å; C42-S82 WeakPolarHBondContact O-CA 3.41Å; S82-R89 PolarHBondContact N-O 3.19Å; S82-R89 PolarHBondContact O-N 3.16Å
83	V	96.8	Very high	94.6	Very high	1 Å²	1	52 Å²	52	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	119.7	-175	-178.5	0	0	0	0	108.8	I37 C42 F44 L81 L88 A150 V151 A154	I37-V83 HydrophobicContact CG1-CG1 4.45Å; C42-V83 HydrophobicContact CB-CB 4.48Å; C42-V83 WeakPolarHBondContact CB-O 3.45Å; C42-V83 PolarHBondContact N-O 2.67Å; C42-V83 PolarHBondContact O-N 3.24Å; F44-V83 HydrophobicContact CD2-CG2 4.07Å; F44-V83 HydrophobicContact CE2-CG2 4.02Å; L81-V83 HydrophobicContact CD1-CG2 4.46Å; L81-V83 HydrophobicContact CD2-CG2 4.41Å; L81-V83 HydrophobicContact CG-CG2 4.01Å; V83-L88 HydrophobicContact CB-CD2 4.31Å; V83-L88 HydrophobicContact CG1-CD2 3.87Å; V83-L88 HydrophobicContact CG2-CD2 4.11Å; V83-A150 HydrophobicContact CG1-CB 4.43Å; V83-V151 HydrophobicContact CG1-CG2 4.27Å; V83-V151 HydrophobicContact CG2-CG2 4.2Å; V83-A154 HydrophobicContact CG1-CB 3.92Å
84	S	95	Very high	94.9	Very high	38 Å²	38	54.1 Å²	54.1	27%	0.266	28%	0.278	S	S	.	.			trans	-133.7	155.3	177.2	-50.9	0	0	0	0	109.2	G40 D86 A87	G40-S84 PolarHBondContact O-OG 3.07Å; S84-D86 PolarHBondContact O-N 2.82Å; S84-A87 PolarHBondContact N-O 2.88Å; S84-A87 VanDerWaalsContact N-O 3.07Å; S84-A87 PolarHBondContact O-N 2.79Å; S84-A87 VanDerWaalsContact O-O 3.12Å
85	G	93.2	Very high	95.2	Very high	7 Å²	7	52.8 Å²	52.8	7%	0.072	28%	0.282	C	S	.	.	S	Bend	trans	-60.1	-9.2	-179.4	0	0	0	0	0	116.6	C158	G85-C158 WeakPolarHBondContact O-CB 3.26Å
86	D	93.7	Very high	95.2	Very high	92 Å²	92	49.1 Å²	49.1	49%	0.492	27%	0.268	S	S	.	.	S	Bend	trans	-109.7	-29.1	175.9	-71	-60.2	0	0	0	114	S84 T103 I104 K161	S84-D86 PolarHBondContact O-N 2.82Å; D86-T103 WeakPolarHBondContact O-CA 3.49Å; D86-I104 PolarHBondContact O-N 3.39Å; D86-K161 IonicContact OD1-NZ 3.27Å; D86-K161 PolarHBondContact OD1-NZ 3.5Å; D86-K161 IonicContact OD2-NZ 3.41Å; D86-K161 PolarHBondContact OD2-NZ 2.98Å
87	A	95.4	Very high	95.3	Very high	13 Å²	13	52.5 Å²	52.5	11%	0.107	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	151.9	-175	0	0	0	0	0	114.3	S84 Q102	S84-A87 PolarHBondContact N-O 2.88Å; S84-A87 VanDerWaalsContact N-O 3.07Å; S84-A87 PolarHBondContact O-N 2.79Å; S84-A87 VanDerWaalsContact O-O 3.12Å; A87-Q102 CarbonylContact C-O 3.33Å; A87-Q102 WeakPolarHBondContact CA-O 3.37Å
88	L	96.3	Very high	95.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	122.9	163.7	-54.1	-178.8	0	0	0	108.6	L81 V83 Q102 I104 V107 Y122 V151	L81-L88 HydrophobicContact CD1-CB 4.42Å; V83-L88 HydrophobicContact CB-CD2 4.31Å; V83-L88 HydrophobicContact CG1-CD2 3.87Å; V83-L88 HydrophobicContact CG2-CD2 4.11Å; L88-Q102 HydrophobicContact CB-CB 4.39Å; L88-Q102 PolarHBondContact N-O 3.21Å; L88-Q102 PolarHBondContact O-N 3.48Å; L88-I104 HydrophobicContact CD1-CD1 4.41Å; L88-I104 HydrophobicContact CD2-CD1 3.6Å; L88-I104 HydrophobicContact CG-CD1 3.69Å; L88-V107 HydrophobicContact CD1-CG2 4.24Å; L88-Y122 HydrophobicContact CD1-CD1 3.75Å; L88-Y122 HydrophobicContact CD1-CE1 3.64Å; L88-Y122 HydrophobicContact CD1-CG 4.39Å; L88-V151 HydrophobicContact CD1-CG1 4.01Å; L88-V151 HydrophobicContact CD1-CG2 4.23Å; L88-V151 HydrophobicContact CD2-CG1 4.28Å; L88-V151 HydrophobicContact CD2-CG2 3.75Å
89	R	96.5	Very high	95.3	Very high	118 Å²	118	48.6 Å²	48.6	45%	0.445	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134.2	-178.5	-76.2	177.8	169.6	178.5	-10	110.9	L81 S82 L98 V100 D101	L81-R89 CarbonylContact C-O 3.58Å; L81-R89 WeakPolarHBondContact CA-O 3.23Å; S82-R89 PolarHBondContact N-O 3.19Å; S82-R89 PolarHBondContact O-N 3.16Å; R89-L98 HydrophobicContact CB-CD1 3.9Å; R89-L98 HydrophobicContact CG-CD1 4.08Å; R89-V100 WeakPolarHBondContact CA-O 3.37Å; R89-D101 WeakPolarHBondContact CG-OD1 2.86Å; R89-D101 IonicContact CZ-OD1 2.91Å; R89-D101 IonicContact CZ-OD2 3Å; R89-D101 VanDerWaalsContact NE-CG 3.27Å; R89-D101 IonicContact NE-OD1 2.79Å; R89-D101 PolarHBondContact NE-OD1 2.84Å; R89-D101 IonicContact NE-OD2 3.89Å; R89-D101 PolarHBondContact NE-OD2 3.49Å; R89-D101 IonicContact NH2-OD1 2.84Å; R89-D101 IonicContact NH2-OD2 3.27Å; R89-D101 PolarHBondContact NH2-OD2 3Å
90	V	97.1	Very high	95.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	109.6	-179.8	-174.2	0	0	0	0	108.3	Y48 A79 V80 L81 I99 V100 F137	Y48-V90 HydrophobicContact CG-CG1 4.43Å; A79-V90 HydrophobicContact CB-CG1 3.69Å; V80-V90 WeakPolarHBondContact O-CA 3.21Å; L81-V90 HydrophobicContact CD1-CG2 4.04Å; V90-I99 HydrophobicContact CG1-CB 4.49Å; V90-I99 HydrophobicContact CG1-CD1 4.33Å; V90-I99 WeakPolarHBondContact O-CA 3.42Å; V90-I99 WeakPolarHBondContact O-CB 3.49Å; V90-I99 PolarHBondContact O-N 2.82Å; V90-V100 HydrophobicContact CB-CB 3.94Å; V90-V100 HydrophobicContact CB-CG2 4.15Å; V90-V100 HydrophobicContact CG2-CB 3.94Å; V90-V100 HydrophobicContact CG2-CG2 4.26Å; V90-V100 PolarHBondContact N-O 3.29Å; V90-V100 PolarHBondContact O-N 3.22Å; V90-F137 HydrophobicContact CG1-CE1 4.16Å; V90-F137 HydrophobicContact CG2-CE1 3.64Å; V90-F137 HydrophobicContact CG2-CZ 3.81Å
91	S	96.6	Very high	95.1	Very high	24 Å²	24	51.7 Å²	51.7	17%	0.168	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	145.3	175.9	-63.9	0	0	0	0	111.4	A79 V80 H97	A79-S91 CarbonylContact C-O 3.5Å; A79-S91 WeakPolarHBondContact CA-O 3.29Å; A79-S91 VanDerWaalsContact CB-O 3.28Å; A79-S91 WeakPolarHBondContact CB-O 3.39Å; V80-S91 PolarHBondContact N-O 3.04Å; V80-S91 PolarHBondContact O-N 3.07Å; S91-H97 CarbonylContact C-O 3.56Å; S91-H97 VanDerWaalsContact CA-O 3.26Å; S91-H97 WeakPolarHBondContact CA-O 3.41Å
92	D	96.4	Very high	95	Very high	18 Å²	18	52.8 Å²	52.8	10%	0.096	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	137.7	176.4	179.6	54.3	0	0	0	112.3	Q77 V94 S95 Q96 H97 I99	Q77-D92 PolarHBondContact NE2-OD1 3.45Å; D92-V94 VanDerWaalsContact C-N 3.27Å; D92-V94 PolarHBondContact O-N 3.16Å; D92-V94 PolarHBondContact OD2-N 3.01Å; D92-S95 VanDerWaalsContact CB-OG 3.32Å; D92-S95 WeakPolarHBondContact CB-OG 3.39Å; D92-S95 WeakPolarHBondContact OD2-CB 3.48Å; D92-S95 PolarHBondContact OD2-N 3.47Å; D92-S95 PolarHBondContact OD2-OG 3.21Å; D92-Q96 VanDerWaalsContact O-CA 3.22Å; D92-Q96 WeakPolarHBondContact O-CA 3.39Å; D92-Q96 PolarHBondContact O-N 3.42Å; D92-Q96 PolarHBondContact O-NE2 3.04Å; D92-H97 PolarHBondContact N-O 2.74Å; D92-I99 HydrophobicContact CB-CD1 3.98Å; D92-I99 HydrophobicContact CB-CG1 4.25Å
93	D	93.8	Very high	95	Very high	54 Å²	54	54.2 Å²	54.2	29%	0.289	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-31.3	-177.4	-170.9	47	0	0	0	112.2	K78 Q96	K78-D93 HydrophobicContact CB-CB 3.59Å; K78-D93 HydrophobicContact CD-CB 4.45Å; K78-D93 WeakPolarHBondContact CD-OD2 3.19Å; K78-D93 IonicContact NZ-OD2 2.68Å; K78-D93 PolarHBondContact O-N 3.21Å; D93-Q96 PolarHBondContact O-NE2 3.26Å
94	V	92.3	Very high	94.9	Very high	125 Å²	125	54.2 Å²	54.2	76%	0.758	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-50.9	-173.4	-177.4	0	0	0	0	112.6	D92	D92-V94 VanDerWaalsContact C-N 3.27Å; D92-V94 PolarHBondContact O-N 3.16Å; D92-V94 PolarHBondContact OD2-N 3.01Å
95	S	93.5	Very high	94.9	Very high	77 Å²	77	58.2 Å²	58.2	54%	0.538	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-11.6	-176.5	62.1	0	0	0	0	114.1	D92 H97	D92-S95 VanDerWaalsContact CB-OG 3.32Å; D92-S95 WeakPolarHBondContact CB-OG 3.39Å; D92-S95 WeakPolarHBondContact OD2-CB 3.48Å; D92-S95 PolarHBondContact OD2-N 3.47Å; D92-S95 PolarHBondContact OD2-OG 3.21Å; S95-H97 PolarHBondContact O-N 3.2Å
96	Q	92.3	Very high	94.9	Very high	124 Å²	124	62.6 Å²	62.6	58%	0.579	32%	0.324	S	S	*	.			trans	57.5	11.2	-174.3	-58.7	-65.8	-54.7	0	0	114.4	D92 D93	D92-Q96 VanDerWaalsContact O-CA 3.22Å; D92-Q96 WeakPolarHBondContact O-CA 3.39Å; D92-Q96 PolarHBondContact O-N 3.42Å; D92-Q96 PolarHBondContact O-NE2 3.04Å; D93-Q96 PolarHBondContact O-NE2 3.26Å
97	H	94.6	Very high	95.1	Very high	134 Å²	134	58.6 Å²	58.6	62%	0.62	30%	0.303	S	S	*	.			trans	-72	141.6	177.7	-175.9	74.8	0	0	0	111.5	S91 D92 S95 I99	S91-H97 CarbonylContact C-O 3.56Å; S91-H97 VanDerWaalsContact CA-O 3.26Å; S91-H97 WeakPolarHBondContact CA-O 3.41Å; D92-H97 PolarHBondContact N-O 2.74Å; S95-H97 PolarHBondContact O-N 3.2Å; H97-I99 PolarHBondContact O-N 3.46Å
98	L	95.5	Very high	95	Very high	71 Å²	71	58.9 Å²	58.9	37%	0.372	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	105.9	-179.5	-176.4	60.4	0	0	0	110.3	R89 V100 D101	R89-L98 HydrophobicContact CB-CD1 3.9Å; R89-L98 HydrophobicContact CG-CD1 4.08Å; L98-V100 WeakPolarHBondContact CD1-O 3.31Å; L98-D101 HydrophobicContact CD2-CB 4.03Å; L98-D101 HydrophobicContact CG-CB 4.47Å
99	I	95.5	Very high	95.1	Very high	57 Å²	57	61.6 Å²	61.6	29%	0.292	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-37.8	-178	-44.5	177.4	0	0	0	111.4	Y48 A79 V90 D92 H97	Y48-I99 HydrophobicContact CD1-CG2 4.13Å; Y48-I99 HydrophobicContact CE1-CG2 3.91Å; A79-I99 HydrophobicContact CB-CD1 4.39Å; V90-I99 HydrophobicContact CG1-CB 4.49Å; V90-I99 HydrophobicContact CG1-CD1 4.33Å; V90-I99 WeakPolarHBondContact O-CA 3.42Å; V90-I99 WeakPolarHBondContact O-CB 3.49Å; V90-I99 PolarHBondContact O-N 2.82Å; D92-I99 HydrophobicContact CB-CD1 3.98Å; D92-I99 HydrophobicContact CB-CG1 4.25Å; H97-I99 PolarHBondContact O-N 3.46Å
100	V	94.9	Very high	95.1	Very high	17 Å²	17	57.3 Å²	57.3	10%	0.103	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	128.9	-178.2	-172	0	0	0	0	109.2	Y48 R89 V90 L98 Q102	Y48-V100 HydrophobicContact CE1-CG2 3.98Å; R89-V100 WeakPolarHBondContact CA-O 3.37Å; V90-V100 HydrophobicContact CB-CB 3.94Å; V90-V100 HydrophobicContact CB-CG2 4.15Å; V90-V100 HydrophobicContact CG2-CB 3.94Å; V90-V100 HydrophobicContact CG2-CG2 4.26Å; V90-V100 PolarHBondContact N-O 3.29Å; V90-V100 PolarHBondContact O-N 3.22Å; L98-V100 WeakPolarHBondContact CD1-O 3.31Å; V100-Q102 HydrophobicContact CG1-CB 4.1Å
101	D	94.8	Very high	95.1	Very high	77 Å²	77	57.5 Å²	57.5	41%	0.412	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	105.4	165.9	-163.8	6.4	0	0	0	109	R89 L98	R89-D101 WeakPolarHBondContact CG-OD1 2.86Å; R89-D101 IonicContact CZ-OD1 2.91Å; R89-D101 IonicContact CZ-OD2 3Å; R89-D101 VanDerWaalsContact NE-CG 3.27Å; R89-D101 IonicContact NE-OD1 2.79Å; R89-D101 PolarHBondContact NE-OD1 2.84Å; R89-D101 IonicContact NE-OD2 3.89Å; R89-D101 PolarHBondContact NE-OD2 3.49Å; R89-D101 IonicContact NH2-OD1 2.84Å; R89-D101 IonicContact NH2-OD2 3.27Å; R89-D101 PolarHBondContact NH2-OD2 3Å; L98-D101 HydrophobicContact CD2-CB 4.03Å; L98-D101 HydrophobicContact CG-CB 4.47Å
102	Q	95.2	Very high	95	Very high	23 Å²	23	58.6 Å²	58.6	11%	0.107	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	105.2	-171.2	180	60.7	84.8	0	0	110.2	A87 L88 V100 K106 V107 Y122 C124	A87-Q102 CarbonylContact C-O 3.33Å; A87-Q102 WeakPolarHBondContact CA-O 3.37Å; L88-Q102 HydrophobicContact CB-CB 4.39Å; L88-Q102 PolarHBondContact N-O 3.21Å; L88-Q102 PolarHBondContact O-N 3.48Å; V100-Q102 HydrophobicContact CG1-CB 4.1Å; Q102-K106 VanDerWaalsContact NE2-CB 3.28Å; Q102-V107 HydrophobicContact CG-CG2 3.67Å; Q102-Y122 HydrophobicContact CG-CE2 3.92Å; Q102-C124 HydrophobicContact CG-CB 4.41Å; Q102-C124 PolarHBondContact OE1-SG 3.25Å
103	T	95.8	Very high	95	Very high	69 Å²	69	58 Å²	58	42%	0.423	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	139.7	175.5	54.8	0	0	0	0	111.4	D86 E105 K106	D86-T103 WeakPolarHBondContact O-CA 3.49Å; T103-E105 VanDerWaalsContact C-N 3.3Å; T103-E105 PolarHBondContact O-N 3.18Å; T103-K106 PolarHBondContact O-N 3.22Å; T103-K106 VanDerWaalsContact O-N 3.14Å; T103-K106 WeakPolarHBondContact OG1-CG 3.22Å
104	I	95	Very high	95	Very high	1 Å²	1	63 Å²	63	1%	0.005	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-60.3	-39.5	-174.4	-67.7	-76	0	0	0	111.4	D86 L88 K106 V107 A154 F155 C158	D86-I104 PolarHBondContact O-N 3.39Å; L88-I104 HydrophobicContact CD1-CD1 4.41Å; L88-I104 HydrophobicContact CD2-CD1 3.6Å; L88-I104 HydrophobicContact CG-CD1 3.69Å; I104-K106 PolarHBondContact O-N 3.36Å; I104-K106 VanDerWaalsContact O-N 3.08Å; I104-V107 PolarHBondContact O-N 3.27Å; I104-A154 HydrophobicContact CD1-CB 3.69Å; I104-A154 HydrophobicContact CG1-CB 4.35Å; I104-F155 HydrophobicContact CG2-CD1 3.55Å; I104-F155 HydrophobicContact CG2-CE1 3.96Å; I104-F155 HydrophobicContact CG2-CG 4.29Å; I104-C158 HydrophobicContact CB-CB 4.1Å; I104-C158 HydrophobicContact CG2-CB 3.46Å; I104-C158 VanDerWaalsContact CG2-CB 3.46Å
105	E	94.1	Very high	95	Very high	121 Å²	121	62.3 Å²	62.3	57%	0.565	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-57.9	-24	179	179.7	171.2	-138.3	0	0	114	T103 K162	T103-E105 VanDerWaalsContact C-N 3.3Å; T103-E105 PolarHBondContact O-N 3.18Å; E105-K162 IonicContact OE1-NZ 3.63Å; E105-K162 PolarHBondContact OE1-NZ 3.15Å
106	K	94.8	Very high	94.9	Very high	100 Å²	100	62.7 Å²	62.7	44%	0.435	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-88.3	-12.1	177.8	-65.9	-67.5	-176.5	-175	0	113.3	Q102 T103 I104 C124 R125	Q102-K106 VanDerWaalsContact NE2-CB 3.28Å; T103-K106 PolarHBondContact O-N 3.22Å; T103-K106 VanDerWaalsContact O-N 3.14Å; T103-K106 WeakPolarHBondContact OG1-CG 3.22Å; I104-K106 PolarHBondContact O-N 3.36Å; I104-K106 VanDerWaalsContact O-N 3.08Å; K106-C124 CarbonylContact O-C 3.59Å; K106-C124 VanDerWaalsContact O-CA 3.26Å; K106-C124 WeakPolarHBondContact O-CA 3.42Å; K106-C124 WeakPolarHBondContact O-CB 3.08Å; K106-R125 PolarHBondContact O-N 3.17Å
107	V	95.8	Very high	95	Very high	8 Å²	8	62.5 Å²	62.5	5%	0.048	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	126.6	177.4	-165.2	0	0	0	0	108.3	L88 Q102 I104 Y122 I123 C124 F155	L88-V107 HydrophobicContact CD1-CG2 4.24Å; Q102-V107 HydrophobicContact CG-CG2 3.67Å; I104-V107 PolarHBondContact O-N 3.27Å; V107-Y122 HydrophobicContact CG1-CD2 3.81Å; V107-Y122 HydrophobicContact CG1-CG 3.94Å; V107-Y122 HydrophobicContact CG2-CD2 4.42Å; V107-I123 CarbonylContact C-O 3.58Å; V107-I123 VanDerWaalsContact CG1-O 3.28Å; V107-I123 WeakPolarHBondContact CG1-O 3.36Å; V107-C124 HydrophobicContact CG2-CB 4.35Å; V107-F155 HydrophobicContact CB-CE1 3.86Å; V107-F155 HydrophobicContact CB-CZ 3.58Å; V107-F155 HydrophobicContact CG1-CE1 4.36Å; V107-F155 HydrophobicContact CG1-CE2 4.4Å; V107-F155 HydrophobicContact CG1-CZ 3.57Å; V107-F155 VanDerWaalsContact O-CE1 3.26Å; V107-F155 WeakPolarHBondContact O-CE1 3.41Å
108	S	95.4	Very high	95.1	Very high	18 Å²	18	59.6 Å²	59.6	13%	0.126	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-27.2	-175.7	50.2	0	0	0	0	113.5	S57 R58 I123 W132	S57-S108 WeakPolarHBondContact O-CB 3.4Å; S57-S108 PolarHBondContact O-OG 3.23Å; R58-S108 VanDerWaalsContact CZ-O 3.29Å; R58-S108 PolarHBondContact NE-O 3.05Å; R58-S108 PolarHBondContact NH2-O 3.46Å; S108-I123 PolarHBondContact N-O 3.26Å; S108-I123 PolarHBondContact OG-O 3.28Å; S108-I123 VanDerWaalsContact OG-O 3.11Å; S108-W132 WeakPolarHBondContact OG-CZ3 3.31Å
109	F	96.7	Very high	95.1	Very high	58 Å²	58	56.2 Å²	56.2	25%	0.254	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	147.5	-173.7	-176.2	-111.4	0	0	0	110.9	R58 G59 A111 Y122 I123	R58-F109 HydrophobicContact CB-CB 4.15Å; R58-F109 HydrophobicContact CB-CD2 4.23Å; R58-F109 HydrophobicContact CB-CG 4.09Å; R58-F109 HydrophobicContact CG-CB 3.96Å; R58-F109 HydrophobicContact CG-CD2 4.48Å; R58-F109 HydrophobicContact CG-CG 4.36Å; G59-F109 VanDerWaalsContact C-CE1 3.48Å; F109-A111 HydrophobicContact CE1-CB 3.7Å; F109-A111 HydrophobicContact CZ-CB 4.03Å; F109-Y122 CarbonylContact O-C 3.54Å; F109-Y122 VanDerWaalsContact O-CA 3.28Å; F109-Y122 WeakPolarHBondContact O-CA 3.16Å; F109-Y122 WeakPolarHBondContact O-CB 3.36Å; F109-I123 HydrophobicContact CD1-CD1 4.27Å; F109-I123 PolarHBondContact O-N 2.96Å
110	C	96.7	Very high	95.2	Very high	27 Å²	27	53.5 Å²	53.5	18%	0.182	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	145.9	169.7	64.2	0	0	0	0	110.2	F120 A121 V151 F155	C110-F120 HydrophobicContact CB-CE2 4Å; C110-F120 HydrophobicContact CB-CZ 4.17Å; C110-A121 WeakPolarHBondContact CA-O 3.23Å; C110-V151 HydrophobicContact CB-CG1 4.15Å; C110-F155 HydrophobicContact CB-CE2 4.24Å
111	A	96.7	Very high	95.3	Very high	5 Å²	5	52.7 Å²	52.7	4%	0.041	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	148.1	178.2	0	0	0	0	0	112.9	M60 C63 F109 A121	M60-A111 HydrophobicContact CG-CB 4.43Å; C63-A111 HydrophobicContact CB-CB 4.35Å; F109-A111 HydrophobicContact CE1-CB 3.7Å; F109-A111 HydrophobicContact CZ-CB 4.03Å; A111-A121 PolarHBondContact N-O 3.38Å; A111-A121 PolarHBondContact O-N 2.95Å
112	P	96.2	Very high	95.4	Very high	46 Å²	46	49 Å²	49	30%	0.299	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	158.1	163.3	33.5	-33.3	0	0	0	110.9	E145 S148	P112-E145 HydrophobicContact CB-CG 4.17Å; P112-E145 HydrophobicContact CG-CG 4.44Å; P112-S148 WeakPolarHBondContact CD-OG 3.43Å
113	D	95.6	Very high	95.5	Very high	7 Å²	7	47.9 Å²	47.9	4%	0.037	23%	0.232	C	C	.	.			trans	-88.1	106.1	176.1	-179.7	-20.8	0	0	0	110.4	I67 R71 N115 H116 G119	I67-D113 HydrophobicContact CD1-CB 3.8Å; R71-D113 IonicContact CZ-OD2 2.68Å; R71-D113 IonicContact NH1-OD2 3.86Å; R71-D113 PolarHBondContact NH1-OD2 3.37Å; R71-D113 IonicContact NH2-OD2 3.46Å; R71-D113 PolarHBondContact NH2-OD2 3.1Å; D113-N115 PolarHBondContact O-N 3.34Å; D113-N115 WeakPolarHBondContact OD1-CA 3.34Å; D113-N115 WeakPolarHBondContact OD1-CB 3.42Å; D113-N115 PolarHBondContact OD1-N 3.47Å; D113-H116 HydrophobicContact CB-CB 4.38Å; D113-H116 VanDerWaalsContact CG-ND1 3.31Å; D113-H116 CarbonylContact O-C 3.58Å; D113-H116 PolarHBondContact O-N 2.79Å; D113-H116 IonicContact OD1-CG 3.87Å; D113-H116 PolarHBondContact OD1-N 3.18Å; D113-H116 IonicContact OD1-ND1 3.51Å; D113-H116 PolarHBondContact OD1-ND1 3.24Å; D113-H116 IonicContact OD2-CE1 3.27Å; D113-H116 IonicContact OD2-CG 3.7Å; D113-H116 IonicContact OD2-ND1 3.58Å; D113-H116 PolarHBondContact OD2-ND1 3.45Å; D113-G119 PolarHBondContact N-O 2.92Å
114	R	93.2	Very high	95.6	Very high	159 Å²	159	44.7 Å²	44.7	60%	0.6	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.9	178.8	179.4	177.1	48.3	142.5	2.1	113.7	E64	E64-R114 VanDerWaalsContact CD-NH2 3.3Å; E64-R114 VanDerWaalsContact OE1-CB 3.26Å; E64-R114 WeakPolarHBondContact OE1-CB 3.45Å; E64-R114 IonicContact OE1-CZ 2.7Å; E64-R114 VanDerWaalsContact OE1-CZ 3.27Å; E64-R114 IonicContact OE1-NE 2.73Å; E64-R114 PolarHBondContact OE1-NE 3.29Å; E64-R114 IonicContact OE1-NH2 3.68Å; E64-R114 PolarHBondContact OE1-NH2 2.73Å; E64-R114 IonicContact OE2-CZ 3.93Å; E64-R114 IonicContact OE2-NH2 3.41Å; E64-R114 PolarHBondContact OE2-NH2 3.01Å
115	N	92.2	Very high	95.6	Very high	110 Å²	110	48.8 Å²	48.8	59%	0.588	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-15.3	175.4	-61.7	127.9	0	0	0	112.5	D113	D113-N115 PolarHBondContact O-N 3.34Å; D113-N115 WeakPolarHBondContact OD1-CA 3.34Å; D113-N115 WeakPolarHBondContact OD1-CB 3.42Å; D113-N115 PolarHBondContact OD1-N 3.47Å
116	H	92.5	Very high	95.7	Very high	84 Å²	84	45.4 Å²	45.4	39%	0.389	21%	0.213	S	C	.	.			trans	-147.3	104.9	-177	-47.5	75.8	0	0	0	110.6	R71 D113 K118 G119	R71-H116 PolarHBondContact NH1-CE1 3.2Å; R71-H116 PolarHBondContact NH1-ND1 3.12Å; R71-H116 VanDerWaalsContact NH1-ND1 3.14Å; R71-H116 VanDerWaalsContact NH2-CB 3.35Å; R71-H116 PolarHBondContact NH2-ND1 2.86Å; D113-H116 HydrophobicContact CB-CB 4.38Å; D113-H116 VanDerWaalsContact CG-ND1 3.31Å; D113-H116 CarbonylContact O-C 3.58Å; D113-H116 PolarHBondContact O-N 2.79Å; D113-H116 IonicContact OD1-CG 3.87Å; D113-H116 PolarHBondContact OD1-N 3.18Å; D113-H116 IonicContact OD1-ND1 3.51Å; D113-H116 PolarHBondContact OD1-ND1 3.24Å; D113-H116 IonicContact OD2-CE1 3.27Å; D113-H116 IonicContact OD2-CG 3.7Å; D113-H116 IonicContact OD2-ND1 3.58Å; D113-H116 PolarHBondContact OD2-ND1 3.45Å; H116-K118 PolarHBondContact O-N 3.2Å; H116-G119 PolarHBondContact O-N 3.49Å
117	E	94.3	Very high	95.3	Very high	120 Å²	120	43.4 Å²	43.4	56%	0.561	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45.7	-26.3	177.6	-167.3	-138	128.8	0	0	114.8	S143 G144	E117-S143 PolarHBondContact O-OG 2.83Å; E117-G144 PolarHBondContact O-N 3.3Å
118	K	95.7	Very high	95	Very high	73 Å²	73	47.2 Å²	47.2	32%	0.317	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-7.6	179.2	-53.1	-54.7	-179.9	-169.1	0	114.7	H116 L138 A139 E142	H116-K118 PolarHBondContact O-N 3.2Å; K118-L138 CarbonylContact O-C 3.47Å; K118-L138 VanDerWaalsContact O-CA 3.29Å; K118-L138 WeakPolarHBondContact O-CA 3.41Å; K118-A139 HydrophobicContact CB-CB 4.49Å; K118-A139 PolarHBondContact O-N 3.15Å; K118-E142 WeakPolarHBondContact CD-O 3.4Å; K118-E142 WeakPolarHBondContact CE-O 3.35Å; K118-E142 PolarHBondContact NZ-O 3.3Å
119	G	96	Very high	94.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	137.1	179.6	0	0	0	0	0	112.3	D113 H116	D113-G119 PolarHBondContact N-O 2.92Å; H116-G119 PolarHBondContact O-N 3.49Å
120	F	97	Very high	94.6	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	139.4	175.5	170.9	-114.9	0	0	0	109.1	L81 C110 Y122 F137 L147 S148 V151	L81-F120 HydrophobicContact CD2-CD1 4.36Å; L81-F120 HydrophobicContact CD2-CE1 4.13Å; C110-F120 HydrophobicContact CB-CE2 4Å; C110-F120 HydrophobicContact CB-CZ 4.17Å; F120-Y122 HydrophobicContact CE1-CD1 4.31Å; F120-F137 HydrophobicContact CB-CB 4.49Å; F120-F137 HydrophobicContact CD1-CB 4.32Å; F120-F137 AromaticContact CD1-CD2 3.94Å; F120-F137 HydrophobicContact CD1-CD2 3.94Å; F120-F137 HydrophobicContact CD1-CG 4.4Å; F120-F137 HydrophobicContact CE1-CD2 4.36Å; F120-F137 PolarHBondContact N-O 3.16Å; F120-F137 PolarHBondContact O-N 2.86Å; F120-L147 HydrophobicContact CB-CB 4.21Å; F120-L147 HydrophobicContact CB-CD1 3.85Å; F120-L147 HydrophobicContact CD1-CB 3.86Å; F120-L147 HydrophobicContact CD1-CD1 3.99Å; F120-L147 HydrophobicContact CD2-CB 4.1Å; F120-L147 HydrophobicContact CE1-CB 4.27Å; F120-L147 HydrophobicContact CE2-CB 4.49Å; F120-L147 HydrophobicContact CG-CB 3.77Å; F120-L147 HydrophobicContact CG-CD1 4.09Å; F120-S148 VanDerWaalsContact CD2-OG 3.25Å; F120-S148 WeakPolarHBondContact CD2-OG 3.47Å; F120-S148 WeakPolarHBondContact CE2-OG 3.35Å; F120-V151 HydrophobicContact CE1-CG2 4.19Å; F120-V151 HydrophobicContact CZ-CB 4.13Å; F120-V151 HydrophobicContact CZ-CG1 4.49Å; F120-V151 HydrophobicContact CZ-CG2 3.76Å
121	A	97.2	Very high	94.6	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	156.9	173.1	0	0	0	0	0	112.6	C63 I67 C110 A111 H135	C63-A121 HydrophobicContact CB-CB 4.12Å; I67-A121 HydrophobicContact CD1-CB 3.77Å; I67-A121 HydrophobicContact CG1-CB 3.82Å; C110-A121 WeakPolarHBondContact CA-O 3.23Å; A111-A121 PolarHBondContact N-O 3.38Å; A111-A121 PolarHBondContact O-N 2.95Å; A121-H135 WeakPolarHBondContact CA-O 3.44Å; A121-H135 WeakPolarHBondContact CB-O 3.46Å
122	Y	97.9	Very high	94.6	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	153.9	168	65.6	-109.2	0	0	0	111.1	L88 Q102 V107 F109 F120 C124 C134 H135 F137	L88-Y122 HydrophobicContact CD1-CD1 3.75Å; L88-Y122 HydrophobicContact CD1-CE1 3.64Å; L88-Y122 HydrophobicContact CD1-CG 4.39Å; Q102-Y122 HydrophobicContact CG-CE2 3.92Å; V107-Y122 HydrophobicContact CG1-CD2 3.81Å; V107-Y122 HydrophobicContact CG1-CG 3.94Å; V107-Y122 HydrophobicContact CG2-CD2 4.42Å; F109-Y122 CarbonylContact O-C 3.54Å; F109-Y122 VanDerWaalsContact O-CA 3.28Å; F109-Y122 WeakPolarHBondContact O-CA 3.16Å; F109-Y122 WeakPolarHBondContact O-CB 3.36Å; F120-Y122 HydrophobicContact CE1-CD1 4.31Å; Y122-C124 HydrophobicContact CD2-CB 4.19Å; Y122-C124 HydrophobicContact CE2-CB 4.13Å; Y122-C134 CarbonylContact O-C 3.6Å; Y122-C134 VanDerWaalsContact O-CA 3.32Å; Y122-C134 WeakPolarHBondContact O-CA 3.26Å; Y122-H135 HydrophobicContact CD2-CB 4.12Å; Y122-H135 HydrophobicContact CE1-CB 4.09Å; Y122-H135 HydrophobicContact CE2-CB 3.63Å; Y122-H135 AromaticContact CE2-CD2 3.82Å; Y122-H135 AromaticContact CE2-CG 3.72Å; Y122-H135 AromaticContact CZ-CG 3.86Å; Y122-H135 PolarHBondContact N-O 3.21Å; Y122-H135 VanDerWaalsContact N-O 3.15Å; Y122-H135 PolarHBondContact O-N 3.3Å; Y122-F137 AromaticContact CD1-CE2 3.91Å; Y122-F137 HydrophobicContact CD1-CE2 3.91Å; Y122-F137 AromaticContact CE1-CE2 3.51Å; Y122-F137 HydrophobicContact CE1-CE2 3.51Å; Y122-F137 AromaticContact CE1-CZ 3.91Å; Y122-F137 HydrophobicContact CE1-CZ 3.91Å
123	I	97.6	Very high	94.6	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.8	171.8	-57.4	173	0	0	0	107.3	V54 V62 V107 S108 F109 W132 M133 C134	V54-I123 HydrophobicContact CG2-CG2 3.97Å; V62-I123 HydrophobicContact CB-CD1 4.4Å; V62-I123 HydrophobicContact CG1-CD1 4.09Å; V107-I123 CarbonylContact C-O 3.58Å; V107-I123 VanDerWaalsContact CG1-O 3.28Å; V107-I123 WeakPolarHBondContact CG1-O 3.36Å; S108-I123 PolarHBondContact N-O 3.26Å; S108-I123 PolarHBondContact OG-O 3.28Å; S108-I123 VanDerWaalsContact OG-O 3.11Å; F109-I123 HydrophobicContact CD1-CD1 4.27Å; F109-I123 PolarHBondContact O-N 2.96Å; I123-W132 HydrophobicContact CG2-CB 4.18Å; I123-W132 HydrophobicContact CG2-CE3 4.13Å; I123-M133 WeakPolarHBondContact CA-O 3.4Å; I123-C134 HydrophobicContact CG1-CB 4.27Å
124	C	96.8	Very high	94.7	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.007	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	158.6	176.7	63.2	0	0	0	0	111.8	Q102 K106 V107 Y122 M133	Q102-C124 HydrophobicContact CG-CB 4.41Å; Q102-C124 PolarHBondContact OE1-SG 3.25Å; K106-C124 CarbonylContact O-C 3.59Å; K106-C124 VanDerWaalsContact O-CA 3.26Å; K106-C124 WeakPolarHBondContact O-CA 3.42Å; K106-C124 WeakPolarHBondContact O-CB 3.08Å; V107-C124 HydrophobicContact CG2-CB 4.35Å; Y122-C124 HydrophobicContact CD2-CB 4.19Å; Y122-C124 HydrophobicContact CE2-CB 4.13Å; C124-M133 PolarHBondContact N-O 3.49Å; C124-M133 PolarHBondContact O-N 3.43Å; C124-M133 PolarHBondContact SG-O 3.01Å
125	R	95.9	Very high	94.8	Very high	88 Å²	88	55.9 Å²	55.9	33%	0.332	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	109.6	173.2	-167.2	63.9	171.1	160.3	6.8	109.6	K106 G127 R130 R131 W132	K106-R125 PolarHBondContact O-N 3.17Å; R125-G127 PolarHBondContact O-N 3.39Å; R125-R130 PolarHBondContact NH1-O 3.1Å; R125-R130 PolarHBondContact NH2-O 3.14Å; R125-R131 VanDerWaalsContact NH1-C 3.3Å; R125-R131 PolarHBondContact NH1-O 3.37Å; R125-W132 HydrophobicContact CB-CE3 3.93Å; R125-W132 HydrophobicContact CB-CH2 4.14Å; R125-W132 HydrophobicContact CB-CZ3 3.58Å; R125-W132 HydrophobicContact CG-CE3 4.45Å; R125-W132 HydrophobicContact CG-CH2 4.37Å; R125-W132 HydrophobicContact CG-CZ3 4.2Å
126	D	94.7	Very high	95.1	Very high	49 Å²	49	50.6 Å²	50.6	26%	0.262	25%	0.253	S	S	.	.			trans	-70.4	130.3	169.5	175.8	28.3	0	0	0	110	A128 T129 R130 R131 M133	D126-A128 PolarHBondContact OD1-N 3.18Å; D126-T129 VanDerWaalsContact OD2-CB 3.23Å; D126-T129 WeakPolarHBondContact OD2-CB 3.26Å; D126-T129 VanDerWaalsContact OD2-CG2 3.25Å; D126-T129 WeakPolarHBondContact OD2-CG2 3.48Å; D126-T129 PolarHBondContact OD2-N 3.01Å; D126-T129 PolarHBondContact OD2-OG1 3.36Å; D126-R130 PolarHBondContact O-N 3.28Å; D126-R131 PolarHBondContact N-O 3.28Å; D126-M133 HydrophobicContact CB-CG 3.87Å
127	G	87.5	Confident	95.3	Very high	58 Å²	58	46.6 Å²	46.6	60%	0.598	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-28.8	176.9	0	0	0	0	0	113.3	R125	R125-G127 PolarHBondContact O-N 3.39Å
128	A	89.7	Confident	95.4	Very high	88 Å²	88	42.5 Å²	42.5	73%	0.727	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-59.2	-177.1	0	0	0	0	0	111.3	D126 R130	D126-A128 PolarHBondContact OD1-N 3.18Å; A128-R130 PolarHBondContact O-N 3.3Å
129	T	91.5	Very high	95.4	Very high	74 Å²	74	39.5 Å²	39.5	45%	0.454	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-12.2	-176.2	64	0	0	0	0	114.5	D126 R131	D126-T129 VanDerWaalsContact OD2-CB 3.23Å; D126-T129 WeakPolarHBondContact OD2-CB 3.26Å; D126-T129 VanDerWaalsContact OD2-CG2 3.25Å; D126-T129 WeakPolarHBondContact OD2-CG2 3.48Å; D126-T129 PolarHBondContact OD2-N 3.01Å; D126-T129 PolarHBondContact OD2-OG1 3.36Å; T129-R131 PolarHBondContact O-N 3.43Å; T129-R131 PolarHBondContact OG1-N 3.1Å
130	R	91.9	Very high	95.4	Very high	200 Å²	200	43.1 Å²	43.1	76%	0.755	23%	0.227	S	C	*	.			trans	55	30.1	-171	-52.3	-176.9	179.4	-150.7	0.9	113.5	R125 D126 A128	R125-R130 PolarHBondContact NH1-O 3.1Å; R125-R130 PolarHBondContact NH2-O 3.14Å; D126-R130 PolarHBondContact O-N 3.28Å; A128-R130 PolarHBondContact O-N 3.3Å
131	R	95.6	Very high	95.2	Very high	120 Å²	120	49.5 Å²	49.5	45%	0.453	25%	0.254	S	S	.	.	S	Bend	trans	-107.8	168.7	175.2	-65.8	158.3	-177.4	-110.7	2.3	110.5	E53 R125 D126 T129	E53-R131 VanDerWaalsContact CD-CD 3.47Å; E53-R131 HydrophobicContact CG-CB 4.27Å; E53-R131 WeakPolarHBondContact OE1-CD 3.21Å; E53-R131 WeakPolarHBondContact OE1-CG 3.44Å; E53-R131 IonicContact OE1-CZ 2.69Å; E53-R131 IonicContact OE1-NE 3.5Å; E53-R131 IonicContact OE1-NH1 2.74Å; E53-R131 PolarHBondContact OE1-NH1 3.19Å; E53-R131 WeakPolarHBondContact OE2-CD 3.37Å; E53-R131 IonicContact OE2-CZ 3.74Å; E53-R131 IonicContact OE2-NE 3.65Å; E53-R131 IonicContact OE2-NH1 2.71Å; E53-R131 PolarHBondContact OE2-NH1 3.48Å; R125-R131 VanDerWaalsContact NH1-C 3.3Å; R125-R131 PolarHBondContact NH1-O 3.37Å; D126-R131 PolarHBondContact N-O 3.28Å; T129-R131 PolarHBondContact O-N 3.43Å; T129-R131 PolarHBondContact OG1-N 3.1Å
132	W	96.8	Very high	95	Very high	66 Å²	66	51.7 Å²	51.7	25%	0.25	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	133.7	168.6	-62.8	105.9	0	0	0	108.8	V54 S57 S108 I123 R125	V54-W132 HydrophobicContact CG2-CB 3.78Å; V54-W132 PolarHBondContact N-O 3.46Å; V54-W132 WeakPolarHBondContact O-CB 3.48Å; S57-W132 VanDerWaalsContact CB-CE2 3.49Å; S57-W132 VanDerWaalsContact CB-CZ2 3.45Å; S108-W132 WeakPolarHBondContact OG-CZ3 3.31Å; I123-W132 HydrophobicContact CG2-CB 4.18Å; I123-W132 HydrophobicContact CG2-CE3 4.13Å; R125-W132 HydrophobicContact CB-CE3 3.93Å; R125-W132 HydrophobicContact CB-CH2 4.14Å; R125-W132 HydrophobicContact CB-CZ3 3.58Å; R125-W132 HydrophobicContact CG-CE3 4.45Å; R125-W132 HydrophobicContact CG-CH2 4.37Å; R125-W132 HydrophobicContact CG-CZ3 4.2Å
133	M	96.6	Very high	94.8	Very high	30 Å²	30	52.5 Å²	52.5	15%	0.148	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	127.7	-178.7	-62.7	-57.3	-65.9	0	0	109.3	N51 E53 I123 C124 D126	N51-M133 HydrophobicContact CB-CE 4.22Å; E53-M133 HydrophobicContact CB-SD 4.08Å; I123-M133 WeakPolarHBondContact CA-O 3.4Å; C124-M133 PolarHBondContact N-O 3.49Å; C124-M133 PolarHBondContact O-N 3.43Å; C124-M133 PolarHBondContact SG-O 3.01Å; D126-M133 HydrophobicContact CB-CG 3.87Å
134	C	97.2	Very high	94.7	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	122.1	171.4	-171.9	0	0	0	0	109.6	N51 I52 V54 A66 Y122 I123	N51-C134 CarbonylContact C-O 3.56Å; N51-C134 WeakPolarHBondContact CA-O 3.4Å; I52-C134 HydrophobicContact CG2-CB 4.2Å; I52-C134 PolarHBondContact N-O 3.05Å; I52-C134 PolarHBondContact O-N 3.09Å; V54-C134 HydrophobicContact CG1-CB 3.65Å; V54-C134 HydrophobicContact CG2-CB 4.17Å; A66-C134 HydrophobicContact CB-CB 3.82Å; A66-C134 WeakPolarHBondContact CB-SG 3.25Å; Y122-C134 CarbonylContact O-C 3.6Å; Y122-C134 VanDerWaalsContact O-CA 3.32Å; Y122-C134 WeakPolarHBondContact O-CA 3.26Å; I123-C134 HydrophobicContact CG1-CB 4.27Å
135	H	96.9	Very high	94.6	Very high	12 Å²	12	57.5 Å²	57.5	6%	0.056	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	129.2	176.7	-72.8	-114.7	0	0	0	109.6	Y48 N51 A121 Y122 F137	Y48-H135 HydrophobicContact CE2-CB 4.43Å; Y48-H135 AromaticContact CE2-ND1 3.96Å; Y48-H135 AromaticContact CZ-ND1 3.9Å; Y48-H135 PolarHBondContact OH-CE1 2.93Å; Y48-H135 PolarHBondContact OH-ND1 3.38Å; N51-H135 PolarHBondContact ND2-CE1 3.48Å; A121-H135 WeakPolarHBondContact CA-O 3.44Å; A121-H135 WeakPolarHBondContact CB-O 3.46Å; Y122-H135 HydrophobicContact CD2-CB 4.12Å; Y122-H135 HydrophobicContact CE1-CB 4.09Å; Y122-H135 HydrophobicContact CE2-CB 3.63Å; Y122-H135 AromaticContact CE2-CD2 3.82Å; Y122-H135 AromaticContact CE2-CG 3.72Å; Y122-H135 AromaticContact CZ-CG 3.86Å; Y122-H135 PolarHBondContact N-O 3.21Å; Y122-H135 VanDerWaalsContact N-O 3.15Å; Y122-H135 PolarHBondContact O-N 3.3Å; H135-F137 HydrophobicContact CB-CE2 3.86Å; H135-F137 HydrophobicContact CB-CZ 4.22Å
136	A	97	Very high	94.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	139.1	-171.3	0	0	0	0	0	113.4	Y48 L49 G50 I67 L70	Y48-A136 WeakPolarHBondContact CD2-O 3.21Å; L49-A136 HydrophobicContact CB-CB 4.04Å; L49-A136 WeakPolarHBondContact CB-O 3.47Å; L49-A136 HydrophobicContact CD1-CB 4.01Å; L49-A136 PolarHBondContact N-O 2.97Å; G50-A136 PolarHBondContact O-N 2.99Å; I67-A136 HydrophobicContact CB-CB 4.32Å; I67-A136 HydrophobicContact CG1-CB 3.8Å; I67-A136 HydrophobicContact CG2-CB 4.34Å; L70-A136 HydrophobicContact CD1-CB 3.6Å
137	F	97.2	Very high	94.7	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	153.3	-174.7	-56.1	-89.3	0	0	0	111.8	V46 K47 Y48 V90 F120 Y122 H135	V46-F137 HydrophobicContact CG2-CD1 4.01Å; K47-F137 CarbonylContact O-C 3.55Å; K47-F137 WeakPolarHBondContact O-CA 3.28Å; Y48-F137 AromaticContact CD2-CD1 3.85Å; Y48-F137 HydrophobicContact CD2-CD1 3.85Å; Y48-F137 AromaticContact CD2-CE1 3.39Å; Y48-F137 HydrophobicContact CD2-CE1 3.39Å; Y48-F137 AromaticContact CD2-CZ 3.83Å; Y48-F137 HydrophobicContact CD2-CZ 3.83Å; Y48-F137 AromaticContact CE2-CE1 3.97Å; Y48-F137 HydrophobicContact CE2-CE1 3.97Å; Y48-F137 AromaticContact CE2-CZ 3.93Å; Y48-F137 HydrophobicContact CE2-CZ 3.93Å; Y48-F137 HydrophobicContact CG-CE1 4.16Å; V90-F137 HydrophobicContact CG1-CE1 4.16Å; V90-F137 HydrophobicContact CG2-CE1 3.64Å; V90-F137 HydrophobicContact CG2-CZ 3.81Å; F120-F137 HydrophobicContact CB-CB 4.49Å; F120-F137 HydrophobicContact CD1-CB 4.32Å; F120-F137 AromaticContact CD1-CD2 3.94Å; F120-F137 HydrophobicContact CD1-CD2 3.94Å; F120-F137 HydrophobicContact CD1-CG 4.4Å; F120-F137 HydrophobicContact CE1-CD2 4.36Å; F120-F137 PolarHBondContact N-O 3.16Å; F120-F137 PolarHBondContact O-N 2.86Å; Y122-F137 AromaticContact CD1-CE2 3.91Å; Y122-F137 HydrophobicContact CD1-CE2 3.91Å; Y122-F137 AromaticContact CE1-CE2 3.51Å; Y122-F137 HydrophobicContact CE1-CE2 3.51Å; Y122-F137 AromaticContact CE1-CZ 3.91Å; Y122-F137 HydrophobicContact CE1-CZ 3.91Å; H135-F137 HydrophobicContact CB-CE2 3.86Å; H135-F137 HydrophobicContact CB-CZ 4.22Å
138	L	96.4	Very high	95	Very high	34 Å²	34	50 Å²	50	18%	0.178	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	115.7	168	-60.3	172.5	0	0	0	109.5	V46 K47 L49 K118	V46-L138 CarbonylContact C-O 3.6Å; V46-L138 VanDerWaalsContact CA-O 3.29Å; V46-L138 WeakPolarHBondContact CA-O 3.22Å; K47-L138 HydrophobicContact CB-CB 4.34Å; K47-L138 PolarHBondContact N-O 2.93Å; K47-L138 PolarHBondContact O-N 3.18Å; L49-L138 HydrophobicContact CD1-CD1 4.19Å; L49-L138 HydrophobicContact CD1-CD2 4.2Å; L49-L138 HydrophobicContact CD1-CG 3.86Å; L49-L138 HydrophobicContact CD2-CD1 4.12Å; L49-L138 HydrophobicContact CG-CD1 4.3Å; L49-L138 HydrophobicContact CG-CG 4.23Å; K118-L138 CarbonylContact O-C 3.47Å; K118-L138 VanDerWaalsContact O-CA 3.29Å; K118-L138 WeakPolarHBondContact O-CA 3.41Å
139	A	96.4	Very high	95.3	Very high	10 Å²	10	49 Å²	49	8%	0.083	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	135.1	173.4	0	0	0	0	0	111	K118 E142 L147	K118-A139 HydrophobicContact CB-CB 4.49Å; K118-A139 PolarHBondContact O-N 3.15Å; A139-E142 HydrophobicContact CB-CB 4.47Å; A139-E142 VanDerWaalsContact CB-O 3.26Å; A139-E142 WeakPolarHBondContact CB-O 3.42Å; A139-L147 HydrophobicContact CB-CD1 4Å
140	V	95.7	Very high	95.5	Very high	76 Å²	76	45.5 Å²	45.5	46%	0.461	21%	0.205	S	C	.	.	S	Bend	trans	-90.1	-37.4	179.9	177.3	0	0	0	0	111.9	Q45 K47	Q45-V140 HydrophobicContact CB-CB 4.29Å; Q45-V140 WeakPolarHBondContact O-CB 3.41Å; Q45-V140 PolarHBondContact O-N 3.01Å; K47-V140 HydrophobicContact CG-CG2 3.84Å
141	K	92.6	Very high	95.7	Very high	133 Å²	133	36 Å²	36	58%	0.578	17%	0.169	S	C	*	.	S	Bend	trans	-111.9	-44	-179.7	-70.1	170.8	170.2	164.9	0	112.1
142	E	92.6	Very high	95.7	Very high	47 Å²	47	31.8 Å²	31.8	22%	0.22	16%	0.163	C	C	.	.	S	Bend	trans	-89.5	179	-168.1	-50.4	-45.4	139.6	0	0	113.9	F44 K118 A139 R146	F44-E142 HydrophobicContact CD1-CG 4.14Å; K118-E142 WeakPolarHBondContact CD-O 3.4Å; K118-E142 WeakPolarHBondContact CE-O 3.35Å; K118-E142 PolarHBondContact NZ-O 3.3Å; A139-E142 HydrophobicContact CB-CB 4.47Å; A139-E142 VanDerWaalsContact CB-O 3.26Å; A139-E142 WeakPolarHBondContact CB-O 3.42Å; E142-R146 HydrophobicContact CB-CB 4.49Å; E142-R146 IonicContact OE1-NH1 3.52Å; E142-R146 PolarHBondContact OE1-NH1 3.2Å; E142-R146 IonicContact OE2-CZ 2.77Å; E142-R146 IonicContact OE2-NH1 3.65Å; E142-R146 PolarHBondContact OE2-NH1 2.86Å
143	S	94.5	Very high	95.7	Very high	16 Å²	16	29.4 Å²	29.4	11%	0.112	16%	0.156	C	C	.	.			trans	-83.2	150.9	161.5	170.4	0	0	0	0	110.2	E117 E145 R146 L147	E117-S143 PolarHBondContact O-OG 2.83Å; S143-E145 PolarHBondContact O-N 2.69Å; S143-E145 WeakPolarHBondContact OG-CB 3.29Å; S143-E145 WeakPolarHBondContact OG-CG 3.28Å; S143-E145 PolarHBondContact OG-N 2.87Å; S143-E145 PolarHBondContact OG-OE2 2.85Å; S143-R146 PolarHBondContact O-N 2.97Å; S143-L147 PolarHBondContact O-N 2.85Å
144	G	94.9	Very high	95.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-22.2	168.2	0	0	0	0	0	112.9	E117 L147 S148	E117-G144 PolarHBondContact O-N 3.3Å; G144-L147 PolarHBondContact O-N 3.41Å; G144-S148 WeakPolarHBondContact O-CB 3.32Å; G144-S148 PolarHBondContact O-N 3.25Å; G144-S148 PolarHBondContact O-OG 3.35Å
145	E	95.4	Very high	95.6	Very high	106 Å²	106	30.4 Å²	30.4	50%	0.495	16%	0.16	S	C	.	.	H	α-helix	trans	-66.1	-41.5	171.9	-58.5	157.1	131.5	0	0	111.1	P112 S143 L147 S148 H149	P112-E145 HydrophobicContact CB-CG 4.17Å; P112-E145 HydrophobicContact CG-CG 4.44Å; S143-E145 PolarHBondContact O-N 2.69Å; S143-E145 WeakPolarHBondContact OG-CB 3.29Å; S143-E145 WeakPolarHBondContact OG-CG 3.28Å; S143-E145 PolarHBondContact OG-N 2.87Å; S143-E145 PolarHBondContact OG-OE2 2.85Å; E145-L147 VanDerWaalsContact C-N 3.33Å; E145-L147 PolarHBondContact O-N 3.05Å; E145-S148 CarbonylContact O-C 3.54Å; E145-S148 WeakPolarHBondContact O-CA 3.43Å; E145-S148 WeakPolarHBondContact O-CB 3.44Å; E145-S148 PolarHBondContact O-N 3.23Å; E145-S148 VanDerWaalsContact O-N 3.12Å; E145-H149 PolarHBondContact O-N 2.85Å
146	R	95.1	Very high	95.6	Very high	21 Å²	21	32.6 Å²	32.6	8%	0.079	18%	0.18	C	C	.	.	H	α-helix	trans	-64.7	-38	176.4	-177.2	176.5	173.5	-161.5	-3.9	111.5	Q29 D33 F44 E142 S143 S148 H149 A150	Q29-R146 VanDerWaalsContact CD-CZ 3.46Å; D33-R146 IonicContact OD1-NH2 2.72Å; D33-R146 PolarHBondContact OD1-NH2 3.39Å; D33-R146 IonicContact OD2-CZ 2.74Å; D33-R146 IonicContact OD2-NE 3.2Å; D33-R146 PolarHBondContact OD2-NE 2.86Å; D33-R146 IonicContact OD2-NH2 3.51Å; D33-R146 PolarHBondContact OD2-NH2 3.37Å; F44-R146 HydrophobicContact CE1-CG 4.33Å; E142-R146 HydrophobicContact CB-CB 4.49Å; E142-R146 IonicContact OE1-NH1 3.52Å; E142-R146 PolarHBondContact OE1-NH1 3.2Å; E142-R146 IonicContact OE2-CZ 2.77Å; E142-R146 IonicContact OE2-NH1 3.65Å; E142-R146 PolarHBondContact OE2-NH1 2.86Å; S143-R146 PolarHBondContact O-N 2.97Å; R146-S148 VanDerWaalsContact C-N 3.35Å; R146-H149 PolarHBondContact O-N 3.34Å; R146-A150 WeakPolarHBondContact O-CB 3.39Å; R146-A150 PolarHBondContact O-N 3.49Å
147	L	96.1	Very high	95.5	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-41.2	171.7	-57.9	-177	0	0	0	111.4	F44 V46 F120 A139 S143 G144 E145 A150 V151	F44-L147 HydrophobicContact CB-CD2 3.47Å; F44-L147 VanDerWaalsContact CB-CD2 3.47Å; F44-L147 HydrophobicContact CD1-CD2 3.76Å; F44-L147 HydrophobicContact CD2-CD2 3.61Å; F44-L147 HydrophobicContact CE1-CD2 4.37Å; F44-L147 HydrophobicContact CE2-CD2 4.24Å; F44-L147 HydrophobicContact CG-CD2 3.32Å; V46-L147 HydrophobicContact CG1-CD1 3.87Å; F120-L147 HydrophobicContact CB-CB 4.21Å; F120-L147 HydrophobicContact CB-CD1 3.85Å; F120-L147 HydrophobicContact CD1-CB 3.86Å; F120-L147 HydrophobicContact CD1-CD1 3.99Å; F120-L147 HydrophobicContact CD2-CB 4.1Å; F120-L147 HydrophobicContact CE1-CB 4.27Å; F120-L147 HydrophobicContact CE2-CB 4.49Å; F120-L147 HydrophobicContact CG-CB 3.77Å; F120-L147 HydrophobicContact CG-CD1 4.09Å; A139-L147 HydrophobicContact CB-CD1 4Å; S143-L147 PolarHBondContact O-N 2.85Å; G144-L147 PolarHBondContact O-N 3.41Å; E145-L147 VanDerWaalsContact C-N 3.33Å; E145-L147 PolarHBondContact O-N 3.05Å; L147-A150 PolarHBondContact O-N 2.96Å; L147-V151 WeakPolarHBondContact O-CG2 3.45Å; L147-V151 PolarHBondContact O-N 2.75Å
148	S	95.5	Very high	95.3	Very high	17 Å²	17	35.5 Å²	35.5	12%	0.119	20%	0.197	C	C	.	.	H	α-helix	trans	-64.1	-41.6	177.3	-54.7	0	0	0	0	112	P112 F120 G144 E145 R146 G152	P112-S148 WeakPolarHBondContact CD-OG 3.43Å; F120-S148 VanDerWaalsContact CD2-OG 3.25Å; F120-S148 WeakPolarHBondContact CD2-OG 3.47Å; F120-S148 WeakPolarHBondContact CE2-OG 3.35Å; G144-S148 WeakPolarHBondContact O-CB 3.32Å; G144-S148 PolarHBondContact O-N 3.25Å; G144-S148 PolarHBondContact O-OG 3.35Å; E145-S148 CarbonylContact O-C 3.54Å; E145-S148 WeakPolarHBondContact O-CA 3.43Å; E145-S148 WeakPolarHBondContact O-CB 3.44Å; E145-S148 PolarHBondContact O-N 3.23Å; E145-S148 VanDerWaalsContact O-N 3.12Å; R146-S148 VanDerWaalsContact C-N 3.35Å; S148-G152 PolarHBondContact O-N 3.48Å
149	H	95.4	Very high	95.1	Very high	66 Å²	66	38.5 Å²	38.5	31%	0.306	21%	0.213	S	C	.	.	H	α-helix	trans	-59.8	-53.8	173.7	-169.4	70.2	0	0	0	110.6	E34 E145 R146 V151 G152 C153	E34-H149 IonicContact OE1-CE1 2.93Å; E34-H149 IonicContact OE1-NE2 3.05Å; E34-H149 PolarHBondContact OE1-NE2 3.32Å; E145-H149 PolarHBondContact O-N 2.85Å; R146-H149 PolarHBondContact O-N 3.34Å; H149-V151 VanDerWaalsContact C-N 3.32Å; H149-V151 PolarHBondContact O-N 2.91Å; H149-G152 CarbonylContact O-C 3.55Å; H149-G152 WeakPolarHBondContact O-CA 3.47Å; H149-G152 PolarHBondContact O-N 2.71Å; H149-C153 PolarHBondContact O-N 3.33Å; H149-C153 PolarHBondContact O-SG 2.92Å
150	A	96.5	Very high	95	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-56.1	-42.7	180	0	0	0	0	0	113.2	I37 F44 V83 R146 L147 C153 A154	I37-A150 HydrophobicContact CD1-CB 3.66Å; I37-A150 WeakPolarHBondContact CD1-O 3.46Å; F44-A150 HydrophobicContact CE2-CB 3.59Å; F44-A150 HydrophobicContact CZ-CB 3.69Å; V83-A150 HydrophobicContact CG1-CB 4.43Å; R146-A150 WeakPolarHBondContact O-CB 3.39Å; R146-A150 PolarHBondContact O-N 3.49Å; L147-A150 PolarHBondContact O-N 2.96Å; A150-C153 PolarHBondContact O-N 2.74Å; A150-A154 PolarHBondContact O-N 3.26Å; A150-A154 VanDerWaalsContact O-N 3.09Å
151	V	96.4	Very high	94.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-70.3	-34.7	175.8	176.1	0	0	0	0	111.6	V83 L88 C110 F120 L147 H149 A154 F155	V83-V151 HydrophobicContact CG1-CG2 4.27Å; V83-V151 HydrophobicContact CG2-CG2 4.2Å; L88-V151 HydrophobicContact CD1-CG1 4.01Å; L88-V151 HydrophobicContact CD1-CG2 4.23Å; L88-V151 HydrophobicContact CD2-CG1 4.28Å; L88-V151 HydrophobicContact CD2-CG2 3.75Å; C110-V151 HydrophobicContact CB-CG1 4.15Å; F120-V151 HydrophobicContact CE1-CG2 4.19Å; F120-V151 HydrophobicContact CZ-CB 4.13Å; F120-V151 HydrophobicContact CZ-CG1 4.49Å; F120-V151 HydrophobicContact CZ-CG2 3.76Å; L147-V151 WeakPolarHBondContact O-CG2 3.45Å; L147-V151 PolarHBondContact O-N 2.75Å; H149-V151 VanDerWaalsContact C-N 3.32Å; H149-V151 PolarHBondContact O-N 2.91Å; V151-A154 PolarHBondContact O-N 3.07Å; V151-F155 HydrophobicContact CG1-CD2 4Å; V151-F155 HydrophobicContact CG1-CE2 3.76Å; V151-F155 WeakPolarHBondContact O-CD2 3.38Å; V151-F155 PolarHBondContact O-N 3.38Å
152	G	95.7	Very high	94.8	Very high	32 Å²	32	42.4 Å²	42.4	33%	0.33	22%	0.224	S	C	.	.	H	α-helix	trans	-59.3	-40.8	169.4	0	0	0	0	0	113.7	S148 H149 F155 A156	S148-G152 PolarHBondContact O-N 3.48Å; H149-G152 CarbonylContact O-C 3.55Å; H149-G152 WeakPolarHBondContact O-CA 3.47Å; H149-G152 PolarHBondContact O-N 2.71Å; G152-F155 WeakPolarHBondContact O-CB 3.33Å; G152-F155 PolarHBondContact O-N 3.45Å; G152-A156 PolarHBondContact O-N 3.46Å
153	C	95.7	Very high	94.7	Very high	15 Å²	15	43.9 Å²	43.9	10%	0.101	23%	0.23	C	C	.	.	H	α-helix	trans	-66.3	-41.1	175	-54.6	0	0	0	0	111.6	E34 I37 H149 A150 F155 A156 I157	E34-C153 HydrophobicContact CG-CB 4.2Å; E34-C153 WeakPolarHBondContact CG-SG 3.42Å; I37-C153 HydrophobicContact CD1-CB 3.97Å; H149-C153 PolarHBondContact O-N 3.33Å; H149-C153 PolarHBondContact O-SG 2.92Å; A150-C153 PolarHBondContact O-N 2.74Å; C153-F155 VanDerWaalsContact C-N 3.34Å; C153-A156 PolarHBondContact O-N 2.83Å; C153-I157 WeakPolarHBondContact O-CD1 3.5Å; C153-I157 WeakPolarHBondContact O-CG1 3.43Å; C153-I157 PolarHBondContact O-N 2.93Å; C153-I157 VanDerWaalsContact O-N 3.15Å
154	A	96.6	Very high	94.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63	-39.2	173.9	0	0	0	0	0	112.2	I37 V83 I104 A150 V151 I157 C158	I37-A154 HydrophobicContact CG2-CB 3.98Å; V83-A154 HydrophobicContact CG1-CB 3.92Å; I104-A154 HydrophobicContact CD1-CB 3.69Å; I104-A154 HydrophobicContact CG1-CB 4.35Å; A150-A154 PolarHBondContact O-N 3.26Å; A150-A154 VanDerWaalsContact O-N 3.09Å; V151-A154 PolarHBondContact O-N 3.07Å; A154-I157 PolarHBondContact O-N 3.05Å; A154-C158 WeakPolarHBondContact O-CB 3.34Å; A154-C158 PolarHBondContact O-N 3.27Å
155	F	95.9	Very high	94.5	Very high	51 Å²	51	58.1 Å²	58.1	22%	0.224	28%	0.282	C	S	.	.	H	α-helix	trans	-59.6	-45.9	171.8	-83.9	-57.6	0	0	0	113	I104 V107 C110 V151 G152 C153 I157 C158 L159	I104-F155 HydrophobicContact CG2-CD1 3.55Å; I104-F155 HydrophobicContact CG2-CE1 3.96Å; I104-F155 HydrophobicContact CG2-CG 4.29Å; V107-F155 HydrophobicContact CB-CE1 3.86Å; V107-F155 HydrophobicContact CB-CZ 3.58Å; V107-F155 HydrophobicContact CG1-CE1 4.36Å; V107-F155 HydrophobicContact CG1-CE2 4.4Å; V107-F155 HydrophobicContact CG1-CZ 3.57Å; V107-F155 VanDerWaalsContact O-CE1 3.26Å; V107-F155 WeakPolarHBondContact O-CE1 3.41Å; C110-F155 HydrophobicContact CB-CE2 4.24Å; V151-F155 HydrophobicContact CG1-CD2 4Å; V151-F155 HydrophobicContact CG1-CE2 3.76Å; V151-F155 WeakPolarHBondContact O-CD2 3.38Å; V151-F155 PolarHBondContact O-N 3.38Å; G152-F155 WeakPolarHBondContact O-CB 3.33Å; G152-F155 PolarHBondContact O-N 3.45Å; C153-F155 VanDerWaalsContact C-N 3.34Å; F155-I157 PolarHBondContact O-N 3.49Å; F155-C158 PolarHBondContact O-N 3.47Å; F155-L159 WeakPolarHBondContact O-CB 3.22Å; F155-L159 PolarHBondContact O-N 2.86Å
156	A	95.7	Very high	94.2	Very high	58 Å²	58	57.5 Å²	57.5	48%	0.479	28%	0.279	S	S	.	.	H	α-helix	trans	-59.9	-46.4	179.6	0	0	0	0	0	111.6	G152 C153 C158 L159 E160	G152-A156 PolarHBondContact O-N 3.46Å; C153-A156 PolarHBondContact O-N 2.83Å; A156-C158 PolarHBondContact O-N 2.95Å; A156-L159 PolarHBondContact O-N 3.11Å; A156-E160 WeakPolarHBondContact O-CB 3.4Å; A156-E160 PolarHBondContact O-N 2.88Å
157	I	94.5	Very high	94	Very high	38 Å²	38	63.6 Å²	63.6	20%	0.195	30%	0.302	C	S	.	.	H	α-helix	trans	-62	-44.1	176.8	-63.8	158.4	0	0	0	111	I37 K38 C153 A154 F155 K161	I37-I157 HydrophobicContact CG2-CD1 3.87Å; K38-I157 HydrophobicContact CB-CD1 4.47Å; K38-I157 HydrophobicContact CG-CD1 3.68Å; K38-I157 HydrophobicContact CG-CG1 4.29Å; C153-I157 WeakPolarHBondContact O-CD1 3.5Å; C153-I157 WeakPolarHBondContact O-CG1 3.43Å; C153-I157 PolarHBondContact O-N 2.93Å; C153-I157 VanDerWaalsContact O-N 3.15Å; A154-I157 PolarHBondContact O-N 3.05Å; F155-I157 PolarHBondContact O-N 3.49Å; I157-K161 WeakPolarHBondContact O-CB 3.47Å; I157-K161 PolarHBondContact O-N 3.29Å
158	C	94.4	Very high	93.6	Very high	23 Å²	23	67.2 Å²	67.2	16%	0.155	32%	0.321	C	S	.	.	H	α-helix	trans	-63.5	-43	178.4	-166.6	0	0	0	0	111.9	G85 I104 A154 F155 A156 K161 K162	G85-C158 WeakPolarHBondContact O-CB 3.26Å; I104-C158 HydrophobicContact CB-CB 4.1Å; I104-C158 HydrophobicContact CG2-CB 3.46Å; I104-C158 VanDerWaalsContact CG2-CB 3.46Å; A154-C158 WeakPolarHBondContact O-CB 3.34Å; A154-C158 PolarHBondContact O-N 3.27Å; F155-C158 PolarHBondContact O-N 3.47Å; A156-C158 PolarHBondContact O-N 2.95Å; C158-K161 PolarHBondContact O-N 3.48Å; C158-K162 VanDerWaalsContact O-CB 3.31Å; C158-K162 WeakPolarHBondContact O-CB 3.5Å; C158-K162 PolarHBondContact O-N 3.48Å
159	L	92.8	Very high	93.1	Very high	98 Å²	98	68.9 Å²	68.9	51%	0.513	34%	0.336	S	S	.	.	H	α-helix	trans	-67	-43.4	178.4	-177.4	62	0	0	0	111.9	F155 A156 K162 Q163	F155-L159 WeakPolarHBondContact O-CB 3.22Å; F155-L159 PolarHBondContact O-N 2.86Å; A156-L159 PolarHBondContact O-N 3.11Å; L159-K162 PolarHBondContact O-N 2.7Å; L159-Q163 HydrophobicContact CD1-CG 4.33Å; L159-Q163 WeakPolarHBondContact O-CB 3.23Å; L159-Q163 WeakPolarHBondContact O-CG 3.15Å; L159-Q163 PolarHBondContact O-N 2.91Å
160	E	93.7	Very high	92.3	Very high	136 Å²	136	71.1 Å²	71.1	64%	0.636	35%	0.349	S	S	*	.	H	α-helix	trans	-61	-48.1	174.8	-173.2	-173.5	167.3	0	0	111	A156 K162 Q163 R164	A156-E160 WeakPolarHBondContact O-CB 3.4Å; A156-E160 PolarHBondContact O-N 2.88Å; E160-K162 VanDerWaalsContact C-N 3.28Å; E160-K162 PolarHBondContact O-N 3.35Å; E160-Q163 PolarHBondContact O-N 2.84Å; E160-R164 VanDerWaalsContact O-CB 3.31Å; E160-R164 WeakPolarHBondContact O-CB 3.45Å; E160-R164 PolarHBondContact O-N 2.84Å
161	K	92.1	Very high	91.2	Very high	90 Å²	90	77.9 Å²	77.9	39%	0.391	38%	0.381	S	S	.	.	H	α-helix	trans	-60.2	-36	177.1	-172.6	177.1	-173.4	178.2	0	112.3	D86 I157 C158 R165	D86-K161 IonicContact OD1-NZ 3.27Å; D86-K161 PolarHBondContact OD1-NZ 3.5Å; D86-K161 IonicContact OD2-NZ 3.41Å; D86-K161 PolarHBondContact OD2-NZ 2.98Å; I157-K161 WeakPolarHBondContact O-CB 3.47Å; I157-K161 PolarHBondContact O-N 3.29Å; C158-K161 PolarHBondContact O-N 3.48Å; K161-R165 PolarHBondContact O-N 3.14Å
162	K	90.8	Very high	89.7	Confident	75 Å²	75	82.3 Å²	82.3	33%	0.326	40%	0.404	S	S	.	.	H	α-helix	trans	-72	-51.8	174.9	179.9	163.5	-179.2	164.8	0	112	E105 C158 L159 E160 R164 R165 E166	E105-K162 IonicContact OE1-NZ 3.63Å; E105-K162 PolarHBondContact OE1-NZ 3.15Å; C158-K162 VanDerWaalsContact O-CB 3.31Å; C158-K162 WeakPolarHBondContact O-CB 3.5Å; C158-K162 PolarHBondContact O-N 3.48Å; L159-K162 PolarHBondContact O-N 2.7Å; E160-K162 VanDerWaalsContact C-N 3.28Å; E160-K162 PolarHBondContact O-N 3.35Å; K162-R164 VanDerWaalsContact C-N 3.26Å; K162-R164 PolarHBondContact O-N 2.96Å; K162-R165 WeakPolarHBondContact O-CB 3.21Å; K162-R165 PolarHBondContact O-N 3.34Å; K162-E166 WeakPolarHBondContact CE-OE1 3.3Å; K162-E166 HydrophobicContact CG-CG 4.42Å; K162-E166 WeakPolarHBondContact CG-OE1 3.32Å; K162-E166 WeakPolarHBondContact O-CG 3.41Å; K162-E166 PolarHBondContact O-N 2.95Å
163	Q	92.1	Very high	88.2	Confident	77 Å²	77	87.1 Å²	87.1	36%	0.36	42%	0.418	S	S	.	.	H	α-helix	trans	-60.9	-33.6	177.6	-77.5	-167.5	27.1	0	0	113.1	L159 E160 R167	L159-Q163 HydrophobicContact CD1-CG 4.33Å; L159-Q163 WeakPolarHBondContact O-CB 3.23Å; L159-Q163 WeakPolarHBondContact O-CG 3.15Å; L159-Q163 PolarHBondContact O-N 2.91Å; E160-Q163 PolarHBondContact O-N 2.84Å; Q163-R167 WeakPolarHBondContact O-CB 3.42Å; Q163-R167 WeakPolarHBondContact O-CG 3.46Å; Q163-R167 PolarHBondContact O-N 2.95Å
164	R	92.7	Very high	86.4	Confident	154 Å²	154	90.1 Å²	90.1	58%	0.581	44%	0.444	S	S	*	.	H	α-helix	trans	-61.3	-53.9	170	169	165.7	-75.1	-72.8	5.8	110.3	E160 K162 E166 R167 D168	E160-R164 VanDerWaalsContact O-CB 3.31Å; E160-R164 WeakPolarHBondContact O-CB 3.45Å; E160-R164 PolarHBondContact O-N 2.84Å; K162-R164 VanDerWaalsContact C-N 3.26Å; K162-R164 PolarHBondContact O-N 2.96Å; R164-E166 VanDerWaalsContact C-N 3.27Å; R164-E166 PolarHBondContact O-N 3.08Å; R164-R167 PolarHBondContact O-N 2.7Å; R164-R167 VanDerWaalsContact O-N 3.15Å; R164-D168 WeakPolarHBondContact CG-OD2 3.39Å; R164-D168 IonicContact NH1-OD1 2.75Å; R164-D168 PolarHBondContact NH1-OD1 2.58Å; R164-D168 IonicContact NH1-OD2 2.65Å; R164-D168 WeakPolarHBondContact O-CB 3.43Å; R164-D168 PolarHBondContact O-N 2.7Å
165	R	90.8	Very high	84.4	Confident	162 Å²	162	93.1 Å²	93.1	61%	0.611	47%	0.465	S	S	*	.	H	α-helix	trans	-58.7	-38	178.4	-171.4	-173.8	-63.3	139.3	-0.8	112.6	K161 K162 A169	K161-R165 PolarHBondContact O-N 3.14Å; K162-R165 WeakPolarHBondContact O-CB 3.21Å; K162-R165 PolarHBondContact O-N 3.34Å; R165-A169 WeakPolarHBondContact O-CB 3.26Å; R165-A169 PolarHBondContact O-N 3.22Å
166	E	89.9	Confident	82.6	Confident	93 Å²	93	96.6 Å²	96.6	44%	0.435	49%	0.486	S	S	.	.	H	α-helix	trans	-66.2	-42.3	176.8	-72.3	165.4	170.1	0	0	111.5	K162 R164 L170	K162-E166 WeakPolarHBondContact CE-OE1 3.3Å; K162-E166 HydrophobicContact CG-CG 4.42Å; K162-E166 WeakPolarHBondContact CG-OE1 3.32Å; K162-E166 WeakPolarHBondContact O-CG 3.41Å; K162-E166 PolarHBondContact O-N 2.95Å; R164-E166 VanDerWaalsContact C-N 3.27Å; R164-E166 PolarHBondContact O-N 3.08Å; E166-L170 WeakPolarHBondContact O-CB 3.19Å; E166-L170 VanDerWaalsContact O-CG 3.25Å; E166-L170 WeakPolarHBondContact O-CG 3.32Å; E166-L170 PolarHBondContact O-N 2.89Å
167	R	90.6	Very high	80.7	Confident	149 Å²	149	102 Å²	102	56%	0.562	51%	0.506	S	S	*	.	H	α-helix	trans	-68.9	-44.5	173.4	-74	-178.1	175.6	95.3	-2	112.9	Q163 R164 A169 L170 Q171	Q163-R167 WeakPolarHBondContact O-CB 3.42Å; Q163-R167 WeakPolarHBondContact O-CG 3.46Å; Q163-R167 PolarHBondContact O-N 2.95Å; R164-R167 PolarHBondContact O-N 2.7Å; R164-R167 VanDerWaalsContact O-N 3.15Å; R167-A169 VanDerWaalsContact C-N 3.26Å; R167-A169 PolarHBondContact O-N 3.1Å; R167-L170 PolarHBondContact O-N 2.73Å; R167-Q171 WeakPolarHBondContact O-CB 3.22Å; R167-Q171 PolarHBondContact O-N 2.77Å
168	D	88.8	Confident	78.9	Confident	77 Å²	77	109 Å²	109	41%	0.412	53%	0.53	S	S	.	.	H	α-helix	trans	-63.8	-33.4	179.1	-62.1	-17.2	0	0	0	110.9	R164 L172	R164-D168 WeakPolarHBondContact CG-OD2 3.39Å; R164-D168 IonicContact NH1-OD1 2.75Å; R164-D168 PolarHBondContact NH1-OD1 2.58Å; R164-D168 IonicContact NH1-OD2 2.65Å; R164-D168 WeakPolarHBondContact O-CB 3.43Å; R164-D168 PolarHBondContact O-N 2.7Å; D168-L172 PolarHBondContact O-N 3.26Å
169	A	83.8	Confident	76.8	Confident	52 Å²	52	113 Å²	113	43%	0.43	56%	0.556	S	S	.	*	H	α-helix	trans	-72.2	-48.7	171.8	0	0	0	0	0	112.1	R165 R167 Q171 L172 E173	R165-A169 WeakPolarHBondContact O-CB 3.26Å; R165-A169 PolarHBondContact O-N 3.22Å; R167-A169 VanDerWaalsContact C-N 3.26Å; R167-A169 PolarHBondContact O-N 3.1Å; A169-Q171 PolarHBondContact O-N 3.35Å; A169-L172 VanDerWaalsContact O-CB 3.25Å; A169-L172 WeakPolarHBondContact O-CB 3.28Å; A169-L172 PolarHBondContact O-N 2.79Å; A169-E173 PolarHBondContact O-N 3Å
170	L	78.3	Confident	74.9	Confident	112 Å²	112	112 Å²	112	59%	0.586	55%	0.554	S	S	*	*	H	α-helix	trans	-61	-31.6	177	-74.9	169.7	0	0	0	112.5	E166 R167 L172 E173 A174	E166-L170 WeakPolarHBondContact O-CB 3.19Å; E166-L170 VanDerWaalsContact O-CG 3.25Å; E166-L170 WeakPolarHBondContact O-CG 3.32Å; E166-L170 PolarHBondContact O-N 2.89Å; R167-L170 PolarHBondContact O-N 2.73Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.27Å; L170-E173 PolarHBondContact O-N 2.86Å; L170-A174 WeakPolarHBondContact O-CB 3.42Å; L170-A174 PolarHBondContact O-N 2.95Å
171	Q	73.5	Confident	73	Confident	143 Å²	143	112.4 Å²	112.4	67%	0.668	55%	0.554	S	S	*	*	H	α-helix	trans	-69.6	-26.9	174.6	-171.7	170.2	26.5	0	0	112.8	R167 A169	R167-Q171 WeakPolarHBondContact O-CB 3.22Å; R167-Q171 PolarHBondContact O-N 2.77Å; A169-Q171 PolarHBondContact O-N 3.35Å
172	L	65.5	Low	71.1	Confident	93 Å²	93	110.7 Å²	110.7	49%	0.487	56%	0.557	S	S	.	*	H	α-helix	trans	-69.8	-48.4	173.5	-153.3	74.7	0	0	0	110.2	D168 A169 L170 S175 F181	D168-L172 PolarHBondContact O-N 3.26Å; A169-L172 VanDerWaalsContact O-CB 3.25Å; A169-L172 WeakPolarHBondContact O-CB 3.28Å; A169-L172 PolarHBondContact O-N 2.79Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.27Å; L172-S175 PolarHBondContact O-N 3.03Å; L172-S175 PolarHBondContact O-OG 3.16Å; L172-F181 HydrophobicContact CD2-CE2 4.42Å; L172-F181 HydrophobicContact CD2-CZ 3.71Å; L172-F181 HydrophobicContact CG-CE2 4.24Å; L172-F181 HydrophobicContact CG-CZ 4Å
173	E	63.2	Low	69.4	Low	133 Å²	133	118 Å²	118	62%	0.621	58%	0.583	S	S	*	*	H	α-helix	trans	-70.8	-35	179.3	-52.2	-63.7	113.7	0	0	112.5	A169 L170 S175	A169-E173 PolarHBondContact O-N 3Å; L170-E173 PolarHBondContact O-N 2.86Å; E173-S175 PolarHBondContact O-N 2.85Å
174	A	58.2	Low	67.7	Low	79 Å²	79	121.5 Å²	121.5	65%	0.653	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	3.7	178	0	0	0	0	0	114.1	L170 D176	L170-A174 WeakPolarHBondContact O-CB 3.42Å; L170-A174 PolarHBondContact O-N 2.95Å; A174-D176 VanDerWaalsContact C-N 3.34Å
175	S	55.5	Low	65.8	Low	62 Å²	62	116.2 Å²	116.2	43%	0.434	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.8	11.6	174.2	70.4	0	0	0	0	113.9	L172 E173 D177 R178	L172-S175 PolarHBondContact O-N 3.03Å; L172-S175 PolarHBondContact O-OG 3.16Å; E173-S175 PolarHBondContact O-N 2.85Å; S175-D177 VanDerWaalsContact C-N 3.26Å; S175-D177 PolarHBondContact O-N 3.17Å; S175-R178 PolarHBondContact O-N 2.87Å; S175-R178 VanDerWaalsContact O-N 3.16Å
176	D	57.7	Low	64.3	Low	124 Å²	124	114.1 Å²	114.1	66%	0.663	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-11.8	-173.4	-144.6	27	0	0	0	114.8	A174 R178	A174-D176 VanDerWaalsContact C-N 3.34Å; D176-R178 PolarHBondContact O-N 3.03Å
177	D	56.6	Low	62.8	Low	171 Å²	171	119.1 Å²	119.1	91%	0.914	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-9.4	165.7	-81.3	-35.7	0	0	0	113.1	S175	S175-D177 VanDerWaalsContact C-N 3.26Å; S175-D177 PolarHBondContact O-N 3.17Å
178	R	55.7	Low	61.3	Low	185 Å²	185	121.7 Å²	121.7	70%	0.698	64%	0.643	S	S	*	*	S	Bend	trans	-149.5	109.1	164.9	-169.4	-173.2	-177.4	-152.3	1.6	110.7	S175 D176 T180	S175-R178 PolarHBondContact O-N 2.87Å; S175-R178 VanDerWaalsContact O-N 3.16Å; D176-R178 PolarHBondContact O-N 3.03Å; R178-T180 VanDerWaalsContact C-N 3.26Å; R178-T180 WeakPolarHBondContact CG-OG1 3.36Å; R178-T180 PolarHBondContact O-N 3.34Å; R178-T180 PolarHBondContact O-OG1 3.29Å
179	P	51.2	Low	60.1	Low	108 Å²	108	123.6 Å²	123.6	70%	0.701	66%	0.66	S	S	*	*			trans	-68.7	75.9	-173	27.3	-35.9	0	0	0	113.2	F181	P179-F181 VanDerWaalsContact C-N 3.34Å
180	T	52.6	Low	59.3	Low	76 Å²	76	122.3 Å²	122.3	47%	0.466	65%	0.649	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.3	15.3	-171.1	-41.2	0	0	0	0	111.5	R178 A182	R178-T180 VanDerWaalsContact C-N 3.26Å; R178-T180 WeakPolarHBondContact CG-OG1 3.36Å; R178-T180 PolarHBondContact O-N 3.34Å; R178-T180 PolarHBondContact O-OG1 3.29Å; T180-A182 CarbonylContact O-C 3.55Å; T180-A182 PolarHBondContact O-N 3.29Å; T180-A182 VanDerWaalsContact O-N 3.07Å
181	F	53.4	Low	59	Low	145 Å²	145	120.5 Å²	120.5	64%	0.636	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-11.1	164.7	-102.6	-81.2	0	0	0	113.1	L172 P179 R183	L172-F181 HydrophobicContact CD2-CE2 4.42Å; L172-F181 HydrophobicContact CD2-CZ 3.71Å; L172-F181 HydrophobicContact CG-CE2 4.24Å; L172-F181 HydrophobicContact CG-CZ 4Å; P179-F181 VanDerWaalsContact C-N 3.34Å; F181-R183 PolarHBondContact O-N 2.92Å
182	A	52.3	Low	59.1	Low	55 Å²	55	119.6 Å²	119.6	46%	0.455	64%	0.641	S	S	.	*			trans	-60.4	75.2	151.5	0	0	0	0	0	111.6	T180 V184	T180-A182 CarbonylContact O-C 3.55Å; T180-A182 PolarHBondContact O-N 3.29Å; T180-A182 VanDerWaalsContact O-N 3.07Å; A182-V184 VanDerWaalsContact C-N 3.34Å; A182-V184 WeakPolarHBondContact O-CG2 3.37Å; A182-V184 PolarHBondContact O-N 3.09Å
183	R	55	Low	59.7	Low	229 Å²	229	118.4 Å²	118.4	86%	0.864	65%	0.645	S	S	*	*			trans	-50.4	105.3	151	169.5	-178.6	-77.7	160.8	-3	106.2	F181 G185	F181-R183 PolarHBondContact O-N 2.92Å; R183-G185 PolarHBondContact O-N 2.91Å
184	V	57.1	Low	60	Low	149 Å²	149	116.6 Å²	116.6	90%	0.903	64%	0.637	S	S	*	*			trans	-63	96.1	-166	-175.2	0	0	0	0	110.1	A182	A182-V184 VanDerWaalsContact C-N 3.34Å; A182-V184 WeakPolarHBondContact O-CG2 3.37Å; A182-V184 PolarHBondContact O-N 3.09Å
185	G	52.9	Low	60.7	Low	44 Å²	44	119.1 Å²	119.1	45%	0.454	63%	0.629	S	S	.	*			trans	-143.7	121.7	-175.8	0	0	0	0	0	108.8	R183 F187	R183-G185 PolarHBondContact O-N 2.91Å; G185-F187 PolarHBondContact O-N 2.89Å
186	S	57.8	Low	61.7	Low	117 Å²	117	122.7 Å²	122.7	82%	0.818	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	26.9	-163.7	-166.8	0	0	0	0	116.7
187	F	59.8	Low	62.7	Low	198 Å²	198	124.3 Å²	124.3	87%	0.868	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.8	11.5	-168.8	-65.2	-74.2	0	0	0	114.5	G185	G185-F187 PolarHBondContact O-N 2.89Å
188	R	57.7	Low	63.5	Low	203 Å²	203	119.6 Å²	119.6	77%	0.766	63%	0.625	S	S	*	*	S	Bend	trans	-96.9	124.1	167.1	-70.2	-171.3	180	-86.9	4.4	109.1	A190	R188-A190 PolarHBondContact O-N 2.91Å
189	P	63.7	Low	64.1	Low	118 Å²	118	114.4 Å²	114.4	77%	0.766	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-60.8	133	168.7	-20.8	32.8	0	0	0	110	T191	P189-T191 PolarHBondContact O-N 2.9Å
190	A	66.8	Low	65	Low	24 Å²	24	116.4 Å²	116.4	20%	0.198	62%	0.616	C	S	.	*	P	Polyproline II helix	trans	-54.1	137.3	179.8	0	0	0	0	0	111.5	R188 E194 R195 T202	R188-A190 PolarHBondContact O-N 2.91Å; A190-E194 HydrophobicContact CB-CB 3.99Å; A190-R195 HydrophobicContact CB-CG 4.3Å; A190-R195 VanDerWaalsContact O-CZ 3.27Å; A190-R195 PolarHBondContact O-NE 2.89Å; A190-R195 PolarHBondContact O-NH2 3.22Å; A190-T202 HydrophobicContact CB-CG2 3.52Å
191	T	73.5	Confident	65.6	Low	74 Å²	74	116.7 Å²	116.7	45%	0.454	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-63.3	166.2	175.4	61.2	0	0	0	0	111.6	P189 A193 E194 R195	P189-T191 PolarHBondContact O-N 2.9Å; T191-A193 PolarHBondContact O-N 3.42Å; T191-E194 VanDerWaalsContact CB-OE2 3.28Å; T191-E194 WeakPolarHBondContact CB-OE2 3.46Å; T191-E194 WeakPolarHBondContact CG2-OE2 3.48Å; T191-E194 PolarHBondContact N-OE2 3.14Å; T191-E194 PolarHBondContact O-N 3.48Å; T191-E194 WeakPolarHBondContact OG1-CG 3.25Å; T191-E194 PolarHBondContact OG1-N 3.1Å; T191-E194 PolarHBondContact OG1-OE2 2.84Å; T191-R195 WeakPolarHBondContact O-CG 3.49Å; T191-R195 PolarHBondContact O-N 3.43Å; T191-R195 VanDerWaalsContact O-N 3.15Å
192	L	75.3	Confident	65.7	Low	124 Å²	124	111.8 Å²	111.8	65%	0.649	60%	0.603	S	S	*	*	H	α-helix	trans	-64.6	-30.1	177.3	-165.9	147.5	0	0	0	111.6	L196	L192-L196 HydrophobicContact CD2-CD1 3.69Å; L192-L196 HydrophobicContact CD2-CG 4.36Å; L192-L196 WeakPolarHBondContact O-CG 3.48Å; L192-L196 PolarHBondContact O-N 2.72Å
193	A	76.9	Confident	66.2	Low	69 Å²	69	114.3 Å²	114.3	57%	0.57	61%	0.608	S	S	*	*	H	α-helix	trans	-68.8	-45.4	173.6	0	0	0	0	0	112.6	T191 R195 L196 L197	T191-A193 PolarHBondContact O-N 3.42Å; A193-R195 VanDerWaalsContact C-N 3.32Å; A193-R195 PolarHBondContact O-N 3.07Å; A193-L196 PolarHBondContact O-N 3.48Å; A193-L196 VanDerWaalsContact O-N 3.14Å; A193-L197 PolarHBondContact O-N 2.93Å
194	E	70.1	Confident	66.4	Low	94 Å²	94	109 Å²	109	44%	0.439	60%	0.601	S	S	.	*	H	α-helix	trans	-59.1	-43	175.4	-76	161.6	107.4	0	0	111.8	A190 T191 L196 L197 D198	A190-E194 HydrophobicContact CB-CB 3.99Å; T191-E194 VanDerWaalsContact CB-OE2 3.28Å; T191-E194 WeakPolarHBondContact CB-OE2 3.46Å; T191-E194 WeakPolarHBondContact CG2-OE2 3.48Å; T191-E194 PolarHBondContact N-OE2 3.14Å; T191-E194 PolarHBondContact O-N 3.48Å; T191-E194 WeakPolarHBondContact OG1-CG 3.25Å; T191-E194 PolarHBondContact OG1-N 3.1Å; T191-E194 PolarHBondContact OG1-OE2 2.84Å; E194-L196 VanDerWaalsContact C-N 3.26Å; E194-L196 PolarHBondContact O-N 2.83Å; E194-L197 PolarHBondContact O-N 3.49Å; E194-D198 PolarHBondContact O-N 3.48Å; E194-D198 VanDerWaalsContact O-N 3.08Å
195	R	73.9	Confident	66.6	Low	132 Å²	132	108 Å²	108	50%	0.498	59%	0.594	S	S	.	*	H	α-helix	trans	-64.5	-25.6	176.7	-68.7	178.9	-127.1	167.2	-0.3	114.2	A190 T191 A193 P199 T202	A190-R195 HydrophobicContact CB-CG 4.3Å; A190-R195 VanDerWaalsContact O-CZ 3.27Å; A190-R195 PolarHBondContact O-NE 2.89Å; A190-R195 PolarHBondContact O-NH2 3.22Å; T191-R195 WeakPolarHBondContact O-CG 3.49Å; T191-R195 PolarHBondContact O-N 3.43Å; T191-R195 VanDerWaalsContact O-N 3.15Å; A193-R195 VanDerWaalsContact C-N 3.32Å; A193-R195 PolarHBondContact O-N 3.07Å; R195-P199 WeakPolarHBondContact O-CA 3.37Å; R195-T202 HydrophobicContact CB-CG2 4.37Å; R195-T202 HydrophobicContact CG-CG2 3.73Å
196	L	75.8	Confident	67	Low	137 Å²	137	112.2 Å²	112.2	72%	0.717	61%	0.606	S	S	*	*	H	α-helix	trans	-84.3	-31	174.7	-76.8	171.7	0	0	0	112.4	L192 A193 E194	L192-L196 HydrophobicContact CD2-CD1 3.69Å; L192-L196 HydrophobicContact CD2-CG 4.36Å; L192-L196 WeakPolarHBondContact O-CG 3.48Å; L192-L196 PolarHBondContact O-N 2.72Å; A193-L196 PolarHBondContact O-N 3.48Å; A193-L196 VanDerWaalsContact O-N 3.14Å; E194-L196 VanDerWaalsContact C-N 3.26Å; E194-L196 PolarHBondContact O-N 2.83Å
197	L	77.8	Confident	67.1	Low	158 Å²	158	112.2 Å²	112.2	83%	0.827	60%	0.604	S	S	*	*	H	α-helix	trans	-78	-43.5	-177.4	-175.1	63	0	0	0	112.5	A193 E194	A193-L197 PolarHBondContact O-N 2.93Å; E194-L197 PolarHBondContact O-N 3.49Å
198	D	74.9	Confident	67	Low	72 Å²	72	108.5 Å²	108.5	39%	0.385	60%	0.597	S	S	.	*			trans	-144.4	100.4	167.1	177.6	-1.1	0	0	0	109.4	E194 Q200 S201	E194-D198 PolarHBondContact O-N 3.48Å; E194-D198 VanDerWaalsContact O-N 3.08Å; D198-Q200 PolarHBondContact O-N 2.75Å; D198-Q200 WeakPolarHBondContact OD1-CA 3.47Å; D198-Q200 WeakPolarHBondContact OD1-CB 3.44Å; D198-Q200 PolarHBondContact OD1-N 3.31Å; D198-S201 PolarHBondContact O-N 3.02Å; D198-S201 PolarHBondContact O-OG 2.88Å; D198-S201 PolarHBondContact OD1-N 3.23Å; D198-S201 VanDerWaalsContact OD1-N 3.11Å; D198-S201 WeakPolarHBondContact OD2-CB 3.19Å; D198-S201 PolarHBondContact OD2-N 3.19Å
199	P	68.6	Low	66.7	Low	77 Å²	77	104.4 Å²	104.4	50%	0.5	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63	-31.1	178.3	25.7	-33.7	0	0	0	112.2	R195 T202	R195-P199 WeakPolarHBondContact O-CA 3.37Å; P199-T202 PolarHBondContact O-N 2.92Å; P199-T202 PolarHBondContact O-OG1 3.28Å
200	Q	69.5	Low	66.1	Low	150 Å²	150	108.2 Å²	108.2	70%	0.701	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-71.4	-35.2	-178	-55.3	-160.6	-94.9	0	0	112.1	D198 T202 I203	D198-Q200 PolarHBondContact O-N 2.75Å; D198-Q200 WeakPolarHBondContact OD1-CA 3.47Å; D198-Q200 WeakPolarHBondContact OD1-CB 3.44Å; D198-Q200 PolarHBondContact OD1-N 3.31Å; Q200-T202 PolarHBondContact O-N 3.23Å; Q200-T202 VanDerWaalsContact O-N 3.09Å; Q200-I203 PolarHBondContact O-N 3.2Å; Q200-I203 VanDerWaalsContact O-N 3.16Å
201	S	64	Low	64.9	Low	81 Å²	81	112.3 Å²	112.3	57%	0.566	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-57	-23.5	172.1	75.4	0	0	0	0	113.7	D198	D198-S201 PolarHBondContact O-N 3.02Å; D198-S201 PolarHBondContact O-OG 2.88Å; D198-S201 PolarHBondContact OD1-N 3.23Å; D198-S201 VanDerWaalsContact OD1-N 3.11Å; D198-S201 WeakPolarHBondContact OD2-CB 3.19Å; D198-S201 PolarHBondContact OD2-N 3.19Å
202	T	57.4	Low	63.5	Low	43 Å²	43	116.5 Å²	116.5	26%	0.264	65%	0.648	S	S	.	*	G	3₁₀ helix	trans	-100.4	-2.7	-176.3	73.2	0	0	0	0	114	A190 R195 P199 Q200 V204	A190-T202 HydrophobicContact CB-CG2 3.52Å; R195-T202 HydrophobicContact CB-CG2 4.37Å; R195-T202 HydrophobicContact CG-CG2 3.73Å; P199-T202 PolarHBondContact O-N 2.92Å; P199-T202 PolarHBondContact O-OG1 3.28Å; Q200-T202 PolarHBondContact O-N 3.23Å; Q200-T202 VanDerWaalsContact O-N 3.09Å; T202-V204 PolarHBondContact O-N 3.23Å
203	I	62	Low	62	Low	107 Å²	107	117.7 Å²	117.7	55%	0.549	66%	0.655	S	S	.	*			trans	-74.8	110.8	173.1	-62.1	174.3	0	0	0	108.3	Q200 V205	Q200-I203 PolarHBondContact O-N 3.2Å; Q200-I203 VanDerWaalsContact O-N 3.16Å; I203-V205 PolarHBondContact O-N 3.29Å
204	V	59.9	Low	60.4	Low	119 Å²	119	120.3 Å²	120.3	72%	0.721	66%	0.664	S	S	*	*			trans	-61.6	118.2	162.8	178	0	0	0	0	107.3	T202 D206	T202-V204 PolarHBondContact O-N 3.23Å; V204-D206 VanDerWaalsContact C-N 3.32Å; V204-D206 PolarHBondContact O-N 3.45Å
205	V	61	Low	59.1	Low	127 Å²	127	121 Å²	121	77%	0.77	68%	0.68	S	S	*	*			trans	-74.4	88.6	179.9	-178.2	0	0	0	0	109.1	I203	I203-V205 PolarHBondContact O-N 3.29Å
206	D	59.9	Low	57.8	Low	132 Å²	132	120.7 Å²	120.7	71%	0.706	70%	0.698	S	S	*	*			trans	-58.7	130.6	166.2	-79.4	-37.2	0	0	0	109.5	V204 V208	V204-D206 VanDerWaalsContact C-N 3.32Å; V204-D206 PolarHBondContact O-N 3.45Å; D206-V208 PolarHBondContact O-N 3.42Å; D206-V208 VanDerWaalsContact O-N 3.15Å
207	P	60.1	Low	56.2	Low	118 Å²	118	120.4 Å²	120.4	77%	0.766	70%	0.702	S	S	*	*			trans	-68.7	115.5	-174.5	26.1	-33.5	0	0	0	111
208	V	57.6	Low	54.5	Low	119 Å²	119	118.3 Å²	118.3	72%	0.721	70%	0.7	S	S	*	*			trans	-49.5	122.3	-176.7	177.9	0	0	0	0	111.8	D206 K210	D206-V208 PolarHBondContact O-N 3.42Å; D206-V208 VanDerWaalsContact O-N 3.15Å; V208-K210 PolarHBondContact O-N 2.9Å
209	P	51.2	Low	52.9	Low	118 Å²	118	120.4 Å²	120.4	77%	0.766	72%	0.718	S	S	*	*			trans	-70.7	103.2	176.1	28.6	-33.5	0	0	0	109.8	S211	P209-S211 PolarHBondContact O-N 2.97Å
210	K	50.9	Low	51.6	Low	197 Å²	197	122.7 Å²	122.7	86%	0.857	73%	0.73	S	S	*	*			trans	-71.5	96.7	174.8	-70.2	-175.9	179.1	179.4	0	110	V208	V208-K210 PolarHBondContact O-N 2.9Å
211	S	43.3	Very low	50	Low	110 Å²	110	121.3 Å²	121.3	77%	0.769	73%	0.733	S	S	*	*			trans	-61.5	134.6	163.7	50	0	0	0	0	110	P209	P209-S211 PolarHBondContact O-N 2.97Å
212	N	42.4	Very low	48.9	Very low	162 Å²	162	124.8 Å²	124.8	87%	0.866	74%	0.743	S	S	*	*			trans	-152.8	156.6	159.1	-113.5	-27	0	0	0	109.4
213	N	44.9	Very low	48.1	Very low	149 Å²	149	129.3 Å²	129.3	80%	0.797	77%	0.771	S	S	*	*			trans	-81.5	170.8	-152.7	-95.1	-32.4	0	0	0	116.6
214	T	43	Very low	47.1	Very low	124 Å²	124	134.7 Å²	134.7	76%	0.761	78%	0.784	S	S	*	*			trans	77.5	100	152.6	28.6	0	0	0	0	119.8
215	S	42.4	Very low	46.1	Very low	110 Å²	110	135.8 Å²	135.8	77%	0.769	79%	0.791	S	S	*	*				57.7	108.2	129.1	62.7	0	0	0	0	120.6
216	S	46.7	Very low	45.5	Very low	125 Å²	125	135.3 Å²	135.3	87%	0.874	79%	0.793	S	S	*	*				-152.4	152.9	128.5	50.1	0	0	0	0	110.3
217	T	43.4	Very low	44.9	Very low	131 Å²	131	134.2 Å²	134.2	80%	0.804	80%	0.796	S	S	*	*			trans	-105	125.7	-165.9	-49.8	0	0	0	0	112.4
218	S	41.9	Very low	44.3	Very low	113 Å²	113	133.5 Å²	133.5	79%	0.79	79%	0.791	S	S	*	*			trans	65.8	154.8	164.2	65	0	0	0	0	118.3
219	P	41.4	Very low	44.1	Very low	116 Å²	116	133.9 Å²	133.9	75%	0.753	79%	0.793	S	S	*	*			trans	-115.3	164.6	-159.6	41.2	-31.5	0	0	0	114.9
220	T	41.7	Very low	44	Very low	125 Å²	125	134.1 Å²	134.1	77%	0.767	79%	0.788	S	S	*	*				174.3	118.8	121.4	-73.2	0	0	0	0	111.7
221	T	35.1	Very low	44.1	Very low	122 Å²	122	131.5 Å²	131.5	75%	0.748	78%	0.779	S	S	*	*			trans	33.9	109.8	148.1	-45.1	0	0	0	0	120.6
222	I	40.3	Very low	44.7	Very low	153 Å²	153	134 Å²	134	79%	0.785	78%	0.782	S	S	*	*			trans	167.1	108.7	132.8	-83.9	151.7	0	0	0	110.2
223	T	41.2	Very low	45.6	Very low	138 Å²	138	129.8 Å²	129.8	85%	0.847	78%	0.776	S	S	*	*			trans	-174.9	140.6	154.7	7.8	0	0	0	0	107.5
224	R	41.1	Very low	46.6	Very low	221 Å²	221	125.8 Å²	125.8	83%	0.834	76%	0.764	S	S	*	*			cis	80.3	92.6	30.1	-77.4	-166.2	179.5	177.7	2.1	117
225	V	38	Very low	47.9	Very low	141 Å²	141	127.4 Å²	127.4	86%	0.855	77%	0.767	S	S	*	*			trans	43.4	106.2	135.1	-69.2	0	0	0	0	121.5
226	S	48.4	Very low	49.6	Very low	117 Å²	117	127.3 Å²	127.3	82%	0.818	76%	0.764	S	S	*	*			trans	-172.4	146.6	147.5	49.1	0	0	0	0	106.9
227	S	47.8	Very low	51.1	Low	110 Å²	110	131.6 Å²	131.6	77%	0.769	76%	0.761	S	S	*	*			cis	-178.3	156.9	-13.7	40.7	0	0	0	0	104.9
228	P	48.6	Very low	52.8	Low	102 Å²	102	131.7 Å²	131.7	66%	0.662	76%	0.763	S	S	*	*			trans	-97.2	152.2	-149.1	36.2	-36.6	0	0	0	116.8
229	V	53	Low	54.4	Low	127 Å²	127	134.8 Å²	134.8	77%	0.77	77%	0.765	S	S	*	*			trans	-89.5	101.6	161.3	177.5	0	0	0	0	108.6	H231	V229-H231 PolarHBondContact O-CE1 3.1Å; V229-H231 PolarHBondContact O-N 2.89Å; V229-H231 PolarHBondContact O-ND1 3.27Å
230	N	49	Very low	56.1	Low	123 Å²	123	132.1 Å²	132.1	66%	0.658	75%	0.753	S	S	*	*			trans	-76.1	114.5	-178.8	-67.9	-28.4	0	0	0	111.6	I232	N230-I232 HydrophobicContact CB-CD1 3.94Å; N230-I232 WeakPolarHBondContact O-CD1 3.15Å
231	H	53.7	Low	57.8	Low	143 Å²	143	129 Å²	129	66%	0.662	74%	0.736	S	S	*	*			trans	-94	97.7	160.6	3.8	-74.8	0	0	0	108.4	V229 G233 A234	V229-H231 PolarHBondContact O-CE1 3.1Å; V229-H231 PolarHBondContact O-N 2.89Å; V229-H231 PolarHBondContact O-ND1 3.27Å; H231-G233 PolarHBondContact O-N 3.06Å; H231-G233 VanDerWaalsContact O-N 3.13Å; H231-A234 HydrophobicContact CB-CB 4.46Å; H231-A234 PolarHBondContact O-N 3.42Å
232	I	55.4	Low	59.8	Low	162 Å²	162	128.3 Å²	128.3	83%	0.831	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	115.3	-175.4	-68.1	71.1	0	0	0	109.1	N230	N230-I232 HydrophobicContact CB-CD1 3.94Å; N230-I232 WeakPolarHBondContact O-CD1 3.15Å
233	G	60.2	Low	61.5	Low	73 Å²	73	125 Å²	125	75%	0.753	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	112	-14.8	174.8	0	0	0	0	0	115.9	H231 I235	H231-G233 PolarHBondContact O-N 3.06Å; H231-G233 VanDerWaalsContact O-N 3.13Å; G233-I235 PolarHBondContact O-N 2.86Å
234	A	66.4	Low	63.1	Low	66 Å²	66	124.6 Å²	124.6	55%	0.545	72%	0.715	S	S	.	*			trans	-84.4	91.3	-179.6	0	0	0	0	0	112.1	H231 P236	H231-A234 HydrophobicContact CB-CB 4.46Å; H231-A234 PolarHBondContact O-N 3.42Å; A234-P236 WeakPolarHBondContact O-CD 3.45Å
235	I	70.9	Confident	64.6	Low	157 Å²	157	119.7 Å²	119.7	81%	0.805	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-69.6	119.2	170.3	-58.4	175.4	0	0	0	108.6	G233	G233-I235 PolarHBondContact O-N 2.86Å
236	P	76.6	Confident	66.4	Low	109 Å²	109	120.1 Å²	120.1	71%	0.708	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-66.2	137.2	176.3	27.8	-33.8	0	0	0	110	A234	A234-P236 WeakPolarHBondContact O-CD 3.45Å
237	R	78.6	Confident	67.5	Low	215 Å²	215	125.8 Å²	125.8	81%	0.811	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-63.4	142.9	174.5	-70.8	-172.2	178	-157.2	-0.5	109.7	H239	R237-H239 PolarHBondContact O-CD2 3.16Å; R237-H239 VanDerWaalsContact O-CD2 3.28Å; R237-H239 PolarHBondContact O-N 3.36Å
238	P	80.2	Confident	68.4	Low	132 Å²	132	129.2 Å²	129.2	86%	0.857	70%	0.704	S	S	*	*			trans	-62.8	112	172.2	26.1	-33.2	0	0	0	109.4
239	H	74.4	Confident	69.2	Low	179 Å²	179	127.4 Å²	127.4	83%	0.829	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-72.9	139.7	171.8	-78.2	-104.3	0	0	0	109.6	R237	R237-H239 PolarHBondContact O-CD2 3.16Å; R237-H239 VanDerWaalsContact O-CD2 3.28Å; R237-H239 PolarHBondContact O-N 3.36Å
240	A	77.3	Confident	69.3	Low	60 Å²	60	126.7 Å²	126.7	50%	0.496	71%	0.705	S	S	.	*	P	Polyproline II helix	trans	-61.5	138.9	173.1	0	0	0	0	0	110.3	I244 I245	A240-I244 HydrophobicContact CB-CG2 3.73Å; A240-I245 HydrophobicContact CB-CD1 4.32Å; A240-I245 HydrophobicContact CB-CG1 4.29Å
241	S	78.5	Confident	69.8	Low	58 Å²	58	127.2 Å²	127.2	41%	0.406	71%	0.707	S	S	.	*	P	Polyproline II helix	trans	-62.9	143.8	179	59.2	0	0	0	0	110.5	S243 I244	S241-S243 PolarHBondContact O-N 3.47Å; S241-S243 VanDerWaalsContact O-N 3.08Å; S241-S243 PolarHBondContact OG-OG 3.33Å; S241-I244 WeakPolarHBondContact O-CG2 3.39Å; S241-I244 PolarHBondContact O-N 3.15Å
242	P	75.6	Confident	70.2	Confident	108 Å²	108	131.6 Å²	131.6	70%	0.701	72%	0.718	S	S	*	*	H	α-helix	trans	-56.6	-32.7	-177	20.1	-31.8	0	0	0	112.7	I244 I245 E246	P242-I244 PolarHBondContact O-N 3.23Å; P242-I244 VanDerWaalsContact O-N 3.16Å; P242-I245 PolarHBondContact O-N 2.98Å; P242-I245 VanDerWaalsContact O-N 3.09Å; P242-E246 PolarHBondContact O-N 3.15Å
243	S	76.4	Confident	70.4	Confident	83 Å²	83	128.9 Å²	128.9	58%	0.58	70%	0.704	S	S	*	*	H	α-helix	trans	-60.8	-15.2	173.8	53.9	0	0	0	0	116.3	S241	S241-S243 PolarHBondContact O-N 3.47Å; S241-S243 VanDerWaalsContact O-N 3.08Å; S241-S243 PolarHBondContact OG-OG 3.33Å
244	I	74.2	Confident	70.3	Confident	131 Å²	131	132.5 Å²	132.5	67%	0.672	70%	0.699	S	S	*	*	H	α-helix	trans	-103.9	-11.6	176.3	-140.7	172.1	0	0	0	112.4	A240 S241 P242	A240-I244 HydrophobicContact CB-CG2 3.73Å; S241-I244 WeakPolarHBondContact O-CG2 3.39Å; S241-I244 PolarHBondContact O-N 3.15Å; P242-I244 PolarHBondContact O-N 3.23Å; P242-I244 VanDerWaalsContact O-N 3.16Å
245	I	72.5	Confident	70.1	Confident	118 Å²	118	134.8 Å²	134.8	61%	0.605	71%	0.709	S	S	*	*	H	α-helix	trans	-91.7	-31.6	172.4	-56.9	171.6	0	0	0	109.7	A240 P242 R247	A240-I245 HydrophobicContact CB-CD1 4.32Å; A240-I245 HydrophobicContact CB-CG1 4.29Å; P242-I245 PolarHBondContact O-N 2.98Å; P242-I245 VanDerWaalsContact O-N 3.09Å; I245-R247 PolarHBondContact O-N 2.96Å
246	E	76.4	Confident	69.5	Low	149 Å²	149	136 Å²	136	70%	0.696	71%	0.708	S	S	*	*	S	Bend	trans	-57.5	103.2	168.8	-174.4	169.9	-159.2	0	0	110.2	P242 Q248	P242-E246 PolarHBondContact O-N 3.15Å; E246-Q248 PolarHBondContact O-N 3.25Å
247	R	71.8	Confident	68.5	Low	236 Å²	236	135.9 Å²	135.9	89%	0.891	70%	0.701	S	S	*	*			trans	-61.4	106.7	173.1	-72	-177.7	173.7	-169.4	-1.6	108.5	I245 G249	I245-R247 PolarHBondContact O-N 2.96Å; R247-G249 PolarHBondContact O-N 3.02Å
248	Q	67.2	Low	67.5	Low	182 Å²	182	133.7 Å²	133.7	85%	0.85	70%	0.7	S	S	*	*			trans	-53.1	114.5	168	-73.3	-160.8	-8.9	0	0	108.8	E246 S250	E246-Q248 PolarHBondContact O-N 3.25Å; Q248-S250 PolarHBondContact O-N 2.86Å
249	G	64.9	Low	66.5	Low	65 Å²	65	134.8 Å²	134.8	67%	0.67	69%	0.694	S	S	*	*			trans	-59.2	123.7	-178.7	0	0	0	0	0	109.2	R247 L251	R247-G249 PolarHBondContact O-N 3.02Å; G249-L251 PolarHBondContact O-N 3.14Å
250	S	55.8	Low	65.9	Low	111 Å²	111	133.1 Å²	133.1	78%	0.776	69%	0.691	S	S	*	*			trans	-47.3	114.7	-178.2	-179.5	0	0	0	0	110	Q248 R252	Q248-S250 PolarHBondContact O-N 2.86Å; S250-R252 WeakPolarHBondContact O-CG 3.3Å; S250-R252 PolarHBondContact O-N 3Å
251	L	58.3	Low	65	Low	135 Å²	135	132.2 Å²	132.2	71%	0.707	68%	0.68	S	S	*	*			trans	-65	99.6	-168.9	-104.4	166	0	0	0	109.9	G249 I253	G249-L251 PolarHBondContact O-N 3.14Å; L251-I253 HydrophobicContact CB-CD1 3.9Å; L251-I253 HydrophobicContact CB-CG1 4.02Å; L251-I253 HydrophobicContact CD1-CD1 4.29Å; L251-I253 HydrophobicContact CD2-CD1 4.15Å; L251-I253 HydrophobicContact CD2-CG1 3.96Å; L251-I253 HydrophobicContact CG-CD1 4.34Å; L251-I253 PolarHBondContact O-N 3.28Å
252	R	63	Low	64.1	Low	235 Å²	235	135.2 Å²	135.2	89%	0.887	70%	0.699	S	S	*	*			trans	-74.2	47.5	-177	-57.3	-171.8	-176.8	179.8	0.9	112.5	S250 F254	S250-R252 WeakPolarHBondContact O-CG 3.3Å; S250-R252 PolarHBondContact O-N 3Å; R252-F254 PolarHBondContact O-N 3.05Å
253	I	59.9	Low	63.3	Low	105 Å²	105	138 Å²	138	54%	0.538	70%	0.7	S	S	.	*			trans	-62.4	-25.5	-170.6	-68.8	167.8	0	0	0	112.7	L251 P255	L251-I253 HydrophobicContact CB-CD1 3.9Å; L251-I253 HydrophobicContact CB-CG1 4.02Å; L251-I253 HydrophobicContact CD1-CD1 4.29Å; L251-I253 HydrophobicContact CD2-CD1 4.15Å; L251-I253 HydrophobicContact CD2-CG1 3.96Å; L251-I253 HydrophobicContact CG-CD1 4.34Å; L251-I253 PolarHBondContact O-N 3.28Å; I253-P255 VanDerWaalsContact C-CD 3.44Å; I253-P255 WeakPolarHBondContact O-CD 3.43Å
254	F	57.9	Low	62.2	Low	148 Å²	148	140.9 Å²	140.9	65%	0.649	70%	0.702	S	S	*	*			trans	-118.3	71.6	-173.3	-60.8	-71.5	0	0	0	114	R252 K256 L257	R252-F254 PolarHBondContact O-N 3.05Å; F254-K256 PolarHBondContact O-N 2.85Å; F254-K256 VanDerWaalsContact O-N 3.07Å; F254-L257 HydrophobicContact CB-CB 4.15Å; F254-L257 HydrophobicContact CB-CD1 4.01Å; F254-L257 HydrophobicContact CD1-CD1 4.05Å; F254-L257 HydrophobicContact CG-CD1 4.14Å; F254-L257 PolarHBondContact O-N 2.83Å
255	P	60.9	Low	61.6	Low	115 Å²	115	143.3 Å²	143.3	75%	0.747	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-3.9	175.1	30	-36.2	0	0	0	114.1	I253	I253-P255 VanDerWaalsContact C-CD 3.44Å; I253-P255 WeakPolarHBondContact O-CD 3.43Å
256	K	59.2	Low	61.1	Low	183 Å²	183	142.1 Å²	142.1	80%	0.796	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-4.6	179.8	-72.7	-170.4	172.9	-174.4	0	115.4	F254 Q258	F254-K256 PolarHBondContact O-N 2.85Å; F254-K256 VanDerWaalsContact O-N 3.07Å; K256-Q258 PolarHBondContact O-N 2.79Å
257	L	55	Low	60.4	Low	105 Å²	105	143.5 Å²	143.5	55%	0.55	71%	0.709	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.9	-6.3	-178.5	-117.3	80.6	0	0	0	114.2	F254 E259 S261	F254-L257 HydrophobicContact CB-CB 4.15Å; F254-L257 HydrophobicContact CB-CD1 4.01Å; F254-L257 HydrophobicContact CD1-CD1 4.05Å; F254-L257 HydrophobicContact CG-CD1 4.14Å; F254-L257 PolarHBondContact O-N 2.83Å; L257-E259 VanDerWaalsContact C-N 3.33Å; L257-E259 PolarHBondContact O-N 2.87Å; L257-S261 WeakPolarHBondContact O-CB 3.38Å; L257-S261 PolarHBondContact O-N 2.95Å
258	Q	57.8	Low	60.1	Low	169 Å²	169	135.5 Å²	135.5	79%	0.79	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-26.6	-174.9	-161	173.5	-85.2	0	0	113.4	K256	K256-Q258 PolarHBondContact O-N 2.79Å
259	E	59.4	Low	59.7	Low	156 Å²	156	133.4 Å²	133.4	73%	0.729	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-25.1	179.7	-63.6	-60.9	116.6	0	0	113.4	L257	L257-E259 VanDerWaalsContact C-N 3.33Å; L257-E259 PolarHBondContact O-N 2.87Å
260	N	62.5	Low	60	Low	144 Å²	144	137.5 Å²	137.5	77%	0.77	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125	11.9	-169.8	-61.1	104.5	0	0	0	114.1
261	S	58	Low	60.5	Low	40 Å²	40	138.3 Å²	138.3	28%	0.28	67%	0.673	S	S	.	*			trans	-79.3	126	175.3	-166.8	0	0	0	0	110.8	L257 F263	L257-S261 WeakPolarHBondContact O-CB 3.38Å; L257-S261 PolarHBondContact O-N 2.95Å; S261-F263 PolarHBondContact O-N 2.9Å; S261-F263 PolarHBondContact OG-N 2.8Å
262	P	60.4	Low	61.2	Low	121 Å²	121	138.5 Å²	138.5	79%	0.786	67%	0.67	S	S	*	*	S	Bend	trans	-64.8	-22	172	27.1	-34	0	0	0	111.9	K264	P262-K264 PolarHBondContact O-N 2.64Å
263	F	57.7	Low	61.7	Low	166 Å²	166	129.5 Å²	129.5	73%	0.728	65%	0.651	S	S	*	*	S	Bend	trans	-84.3	62.6	172.8	-65.4	-77.1	0	0	0	111.6	S261 R265	S261-F263 PolarHBondContact O-N 2.9Å; S261-F263 PolarHBondContact OG-N 2.8Å; F263-R265 PolarHBondContact O-N 2.77Å; F263-R265 VanDerWaalsContact O-N 3.16Å
264	K	54.6	Low	62.3	Low	144 Å²	144	126.4 Å²	126.4	63%	0.626	64%	0.636	S	S	*	*			trans	-64.7	111.1	175.4	-131.1	170.9	174.5	-88.1	0	109.5	P262 D266	P262-K264 PolarHBondContact O-N 2.64Å; K264-D266 WeakPolarHBondContact CD-OD2 3.25Å; K264-D266 WeakPolarHBondContact CG-OD2 3.42Å; K264-D266 IonicContact NZ-OD2 3.11Å; K264-D266 PolarHBondContact NZ-OD2 3.02Å; K264-D266 PolarHBondContact O-N 3.01Å
265	R	60.8	Low	63.1	Low	183 Å²	183	123.3 Å²	123.3	69%	0.691	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	40.4	-177.6	-68.8	-175.9	171.7	83.6	-3	113.2	F263	F263-R265 PolarHBondContact O-N 2.77Å; F263-R265 VanDerWaalsContact O-N 3.16Å
266	D	61.8	Low	63.9	Low	92 Å²	92	121.3 Å²	121.3	49%	0.492	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88	-22.7	-177.1	-65.3	-20.1	0	0	0	112	K264	K264-D266 WeakPolarHBondContact CD-OD2 3.25Å; K264-D266 WeakPolarHBondContact CG-OD2 3.42Å; K264-D266 IonicContact NZ-OD2 3.11Å; K264-D266 PolarHBondContact NZ-OD2 3.02Å; K264-D266 PolarHBondContact O-N 3.01Å
267	L	61.4	Low	64.8	Low	179 Å²	179	114 Å²	114	94%	0.937	59%	0.59	S	S	*	*	S	Bend	trans	-86.5	-1.5	170.6	-65	175.7	0	0	0	113.9	L269	L267-L269 PolarHBondContact O-N 3.31Å
268	S	66.6	Low	65.8	Low	67 Å²	67	112.4 Å²	112.4	47%	0.469	58%	0.584	S	S	.	*	S	Bend	trans	-77.4	109.9	173	-61.5	0	0	0	0	110.1	R270	S268-R270 PolarHBondContact O-N 3.35Å
269	L	58.2	Low	66.7	Low	139 Å²	139	113.9 Å²	113.9	73%	0.728	58%	0.582	S	S	*	*			trans	-56.2	96.4	168.3	-90.5	165.3	0	0	0	110	L267 V274	L267-L269 PolarHBondContact O-N 3.31Å; L269-V274 HydrophobicContact CD2-CG2 4.47Å
270	R	70.5	Confident	67.6	Low	151 Å²	151	113.7 Å²	113.7	57%	0.57	58%	0.575	S	S	*	*			trans	-61.9	138.3	171.6	-67	174.1	173.1	79.5	-5.7	108	S268 E272 G273 V274	S268-R270 PolarHBondContact O-N 3.35Å; R270-E272 PolarHBondContact O-N 2.86Å; R270-E272 VanDerWaalsContact O-N 3.15Å; R270-G273 WeakPolarHBondContact O-CA 3.38Å; R270-G273 PolarHBondContact O-N 3.22Å; R270-V274 PolarHBondContact O-N 2.88Å
271	L	67.7	Low	68.3	Low	128 Å²	128	110.2 Å²	110.2	67%	0.67	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-56.3	-33.7	-179.8	-116.9	71.2	0	0	0	112.5	G273 N277	L271-G273 PolarHBondContact O-N 2.96Å; L271-N277 WeakPolarHBondContact O-CB 3.06Å; L271-N277 PolarHBondContact O-ND2 3.49Å
272	E	73	Confident	69.1	Low	139 Å²	139	110.2 Å²	110.2	65%	0.65	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-58.5	-29.9	172	-56	-54.6	127.4	0	0	114.1	R270 V278	R270-E272 PolarHBondContact O-N 2.86Å; R270-E272 VanDerWaalsContact O-N 3.15Å; E272-V278 WeakPolarHBondContact O-CG2 3.34Å
273	G	72.4	Confident	69.5	Low	46 Å²	46	106.3 Å²	106.3	47%	0.474	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-100.8	-0.7	-173.6	0	0	0	0	0	115	R270 L271	R270-G273 WeakPolarHBondContact O-CA 3.38Å; R270-G273 PolarHBondContact O-N 3.22Å; L271-G273 PolarHBondContact O-N 2.96Å
274	V	72.5	Confident	70.1	Confident	39 Å²	39	104.3 Å²	104.3	24%	0.236	54%	0.536	C	S	.	.			trans	-76.2	125	178	-169.1	0	0	0	0	108.9	L269 R270 S276 N277 V278	L269-V274 HydrophobicContact CD2-CG2 4.47Å; R270-V274 PolarHBondContact O-N 2.88Å; V274-S276 WeakPolarHBondContact CG1-OG 3.48Å; V274-S276 PolarHBondContact O-N 2.75Å; V274-N277 HydrophobicContact CB-CB 4.34Å; V274-N277 WeakPolarHBondContact O-CA 3.45Å; V274-N277 PolarHBondContact O-N 2.82Å; V274-V278 PolarHBondContact O-N 3.19Å
275	P	75.8	Confident	70.8	Confident	84 Å²	84	104.1 Å²	104.1	55%	0.545	54%	0.54	S	S	.	.	H	α-helix	trans	-56.1	-30.7	-174.7	-29.4	35.9	0	0	0	115	R279	P275-R279 WeakPolarHBondContact O-CB 3.35Å; P275-R279 VanDerWaalsContact O-CG 3.29Å; P275-R279 WeakPolarHBondContact O-CG 3.41Å; P275-R279 PolarHBondContact O-N 2.96Å
276	S	76.9	Confident	70.9	Confident	73 Å²	73	102 Å²	102	51%	0.51	54%	0.538	S	S	.	.	H	α-helix	trans	-69.3	-33	174.5	55.5	0	0	0	0	113.3	V274 R280	V274-S276 WeakPolarHBondContact CG1-OG 3.48Å; V274-S276 PolarHBondContact O-N 2.75Å; S276-R280 WeakPolarHBondContact O-CB 3.47Å; S276-R280 PolarHBondContact O-N 3.46Å; S276-R280 VanDerWaalsContact O-N 3.16Å
277	N	78.6	Confident	70.6	Confident	28 Å²	28	103.1 Å²	103.1	15%	0.15	55%	0.553	C	S	.	*	H	α-helix	trans	-82	-38.2	177.1	-157.5	39.5	0	0	0	111.4	L271 V274 R279 R280 L281	L271-N277 WeakPolarHBondContact O-CB 3.06Å; L271-N277 PolarHBondContact O-ND2 3.49Å; V274-N277 HydrophobicContact CB-CB 4.34Å; V274-N277 WeakPolarHBondContact O-CA 3.45Å; V274-N277 PolarHBondContact O-N 2.82Å; N277-R279 PolarHBondContact O-N 3.12Å; N277-R280 PolarHBondContact O-N 2.84Å; N277-R280 VanDerWaalsContact O-N 3.17Å; N277-R280 PolarHBondContact OD1-NH1 3.11Å; N277-L281 WeakPolarHBondContact O-CB 3.36Å; N277-L281 WeakPolarHBondContact O-CG 3.26Å; N277-L281 PolarHBondContact O-N 3.2Å
278	V	76.2	Confident	70.2	Confident	72 Å²	72	97.8 Å²	97.8	44%	0.436	54%	0.535	S	S	.	.	H	α-helix	trans	-57.7	-47.4	171	177.8	0	0	0	0	110.8	E272 V274 R280 L281 A282	E272-V278 WeakPolarHBondContact O-CG2 3.34Å; V274-V278 PolarHBondContact O-N 3.19Å; V278-R280 VanDerWaalsContact C-N 3.35Å; V278-R280 PolarHBondContact O-N 3.33Å; V278-L281 PolarHBondContact O-N 3.2Å; V278-A282 WeakPolarHBondContact O-CB 3.39Å; V278-A282 PolarHBondContact O-N 3.25Å
279	R	76.2	Confident	69.8	Low	200 Å²	200	100.6 Å²	100.6	76%	0.755	55%	0.551	S	S	*	*	H	α-helix	trans	-61.6	-39.4	174.6	-76.1	176.1	-179.2	167.1	0.6	112.7	P275 N277 G283	P275-R279 WeakPolarHBondContact O-CB 3.35Å; P275-R279 VanDerWaalsContact O-CG 3.29Å; P275-R279 WeakPolarHBondContact O-CG 3.41Å; P275-R279 PolarHBondContact O-N 2.96Å; N277-R279 PolarHBondContact O-N 3.12Å; R279-G283 PolarHBondContact O-N 2.78Å
280	R	77.3	Confident	69.7	Low	153 Å²	153	101.9 Å²	101.9	58%	0.577	56%	0.557	S	S	*	*	H	α-helix	trans	-65.4	-44.8	177.3	-168.7	-174	-66	136.1	-7.5	111.9	S276 N277 V278 G283 I284	S276-R280 WeakPolarHBondContact O-CB 3.47Å; S276-R280 PolarHBondContact O-N 3.46Å; S276-R280 VanDerWaalsContact O-N 3.16Å; N277-R280 PolarHBondContact O-N 2.84Å; N277-R280 VanDerWaalsContact O-N 3.17Å; N277-R280 PolarHBondContact OD1-NH1 3.11Å; V278-R280 VanDerWaalsContact C-N 3.35Å; V278-R280 PolarHBondContact O-N 3.33Å; R280-G283 PolarHBondContact O-N 3.3Å; R280-I284 HydrophobicContact CG-CD1 4.14Å; R280-I284 WeakPolarHBondContact O-CD1 3.3Å; R280-I284 VanDerWaalsContact O-CG1 3.26Å; R280-I284 WeakPolarHBondContact O-CG1 3.35Å; R280-I284 PolarHBondContact O-N 3.21Å
281	L	76.9	Confident	69.2	Low	71 Å²	71	98.6 Å²	98.6	37%	0.372	56%	0.562	S	S	.	*	H	α-helix	trans	-64.8	-43.2	176.3	-71.1	167.6	0	0	0	111.6	N277 V278 I284 I285	N277-L281 WeakPolarHBondContact O-CB 3.36Å; N277-L281 WeakPolarHBondContact O-CG 3.26Å; N277-L281 PolarHBondContact O-N 3.2Å; V278-L281 PolarHBondContact O-N 3.2Å; L281-I284 PolarHBondContact O-N 3.43Å; L281-I285 WeakPolarHBondContact O-CG1 3.37Å; L281-I285 PolarHBondContact O-N 3.35Å; L281-I285 VanDerWaalsContact O-N 3.08Å
282	A	75.8	Confident	68.4	Low	40 Å²	40	101.4 Å²	101.4	33%	0.331	57%	0.572	S	S	.	*	H	α-helix	trans	-60.9	-44.9	174.6	0	0	0	0	0	112.2	V278 I284 I285 Q286	V278-A282 WeakPolarHBondContact O-CB 3.39Å; V278-A282 PolarHBondContact O-N 3.25Å; A282-I284 PolarHBondContact O-N 3.16Å; A282-I285 PolarHBondContact O-N 3.36Å; A282-I285 VanDerWaalsContact O-N 3.16Å; A282-Q286 WeakPolarHBondContact O-CB 3.45Å; A282-Q286 PolarHBondContact O-N 3.03Å
283	G	68.5	Low	67.4	Low	38 Å²	38	103.1 Å²	103.1	39%	0.392	58%	0.58	S	S	.	*	H	α-helix	trans	-62.1	-39.3	176.4	0	0	0	0	0	113.4	R279 R280 I285 S287	R279-G283 PolarHBondContact O-N 2.78Å; R280-G283 PolarHBondContact O-N 3.3Å; G283-I285 VanDerWaalsContact C-N 3.31Å; G283-I285 PolarHBondContact O-N 2.83Å; G283-S287 PolarHBondContact O-N 3.05Å
284	I	70.2	Confident	66.2	Low	125 Å²	125	105.9 Å²	105.9	64%	0.641	59%	0.59	S	S	*	*	H	α-helix	trans	-63.6	-36.4	174.1	-71.4	164.1	0	0	0	111.6	R280 L281 A282	R280-I284 HydrophobicContact CG-CD1 4.14Å; R280-I284 WeakPolarHBondContact O-CD1 3.3Å; R280-I284 VanDerWaalsContact O-CG1 3.26Å; R280-I284 WeakPolarHBondContact O-CG1 3.35Å; R280-I284 PolarHBondContact O-N 3.21Å; L281-I284 PolarHBondContact O-N 3.43Å; A282-I284 PolarHBondContact O-N 3.16Å
285	I	69	Low	64.5	Low	139 Å²	139	112 Å²	112	71%	0.713	62%	0.621	S	S	*	*	H	α-helix	trans	-80	-35.3	-179.1	-67.1	168.6	0	0	0	112.3	L281 A282 G283	L281-I285 WeakPolarHBondContact O-CG1 3.37Å; L281-I285 PolarHBondContact O-N 3.35Å; L281-I285 VanDerWaalsContact O-N 3.08Å; A282-I285 PolarHBondContact O-N 3.36Å; A282-I285 VanDerWaalsContact O-N 3.16Å; G283-I285 VanDerWaalsContact C-N 3.31Å; G283-I285 PolarHBondContact O-N 2.83Å
286	Q	63.2	Low	63	Low	140 Å²	140	114.3 Å²	114.3	65%	0.654	63%	0.634	S	S	*	*	H	α-helix	trans	-92.5	-5.5	-171.9	-70.1	-174	-35.1	0	0	114.9	A282 A288	A282-Q286 WeakPolarHBondContact O-CB 3.45Å; A282-Q286 PolarHBondContact O-N 3.03Å; Q286-A288 PolarHBondContact O-N 3.03Å
287	S	55.1	Low	61.1	Low	115 Å²	115	119.6 Å²	119.6	80%	0.804	65%	0.65	S	S	*	*			trans	53.9	24.2	176.2	56.6	0	0	0	0	115.1	G283	G283-S287 PolarHBondContact O-N 3.05Å
288	A	54.7	Low	59.4	Low	67 Å²	67	128.1 Å²	128.1	55%	0.554	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-83.7	131	-177.1	0	0	0	0	0	111.2	Q286	Q286-A288 PolarHBondContact O-N 3.03Å
289	P	57.7	Low	57.5	Low	125 Å²	125	131.2 Å²	131.2	81%	0.812	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-66.5	144.9	174	28.9	-34.1	0	0	0	110.8
290	I	55.8	Low	55.7	Low	167 Å²	167	127.2 Å²	127.2	86%	0.856	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-74.2	127.8	173.3	-61	171.5	0	0	0	107.7
291	A	59	Low	53.8	Low	82 Å²	82	128.6 Å²	128.6	68%	0.678	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-84.4	137.2	169.9	0	0	0	0	0	110.2
292	E	51.4	Low	51.7	Low	187 Å²	187	134.8 Å²	134.8	87%	0.874	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-90.8	134.8	165.2	-64.1	179.8	135.6	0	0	108.4
293	E	52	Low	49.9	Very low	174 Å²	174	139 Å²	139	81%	0.813	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-100.2	136.4	170.8	-74.4	-70.3	153.4	0	0	108.7
294	P	46.7	Very low	48.4	Very low	105 Å²	105	140.4 Å²	140.4	68%	0.682	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-82.3	158.1	-169.5	33.1	-36.4	0	0	0	114
295	D	37.4	Very low	46.7	Very low	166 Å²	166	141 Å²	141	89%	0.888	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-59.8	154.1	172.1	-63.5	-69.2	0	0	0	112.9
296	T	45.3	Very low	45	Very low	134 Å²	134	143 Å²	143	82%	0.822	78%	0.784	S	S	*	*			trans	-145.5	123.2	166.1	-47.9	0	0	0	0	110.4
297	E	35.6	Very low	43.7	Very low	183 Å²	183	141.1 Å²	141.1	86%	0.855	78%	0.782	S	S	*	*			trans	-68.4	149.5	175.6	-56.6	173.7	106.1	0	0	111.5
298	F	42.9	Very low	42.8	Very low	208 Å²	208	144.5 Å²	144.5	91%	0.912	78%	0.783	S	S	*	*			trans	-152.3	156.4	142	-130.7	-86.7	0	0	0	114.3
299	E	37.9	Very low	42.1	Very low	136 Å²	136	147.4 Å²	147.4	64%	0.636	80%	0.799	S	S	*	*			trans	-72.8	149.4	-162.5	-166.9	-175	107	0	0	116	K301	E299-K301 IonicContact OE1-NZ 2.65Å; E299-K301 PolarHBondContact OE1-NZ 3.02Å
300	S	36.5	Very low	41.1	Very low	117 Å²	117	148.8 Å²	148.8	82%	0.818	80%	0.799	S	S	*	*			trans	-83	129.7	173.7	-71.1	0	0	0	0	113.5
301	K	38.6	Very low	40.3	Very low	181 Å²	181	149.8 Å²	149.8	79%	0.787	80%	0.8	S	S	*	*			trans	-135.3	142.8	163.7	-96.7	172.3	-178.7	107.2	0	112.7	E299	E299-K301 IonicContact OE1-NZ 2.65Å; E299-K301 PolarHBondContact OE1-NZ 3.02Å
302	K	33.5	Very low	39.2	Very low	202 Å²	202	156 Å²	156	88%	0.878	81%	0.806	S	S	*	*			trans	-125.7	119.6	-168.9	-177.4	-173.9	-172.6	179.9	0	109.8
303	P	37.2	Very low	38.7	Very low	128 Å²	128	153 Å²	153	83%	0.831	80%	0.803	S	S	*	*			trans	-101.5	163.2	170.1	36.5	-30.4	0	0	0	111.8
304	G	37	Very low	37.8	Very low	67 Å²	67	151.9 Å²	151.9	69%	0.691	80%	0.798	S	S	*	*			trans	-145.7	151.3	169.1	0	0	0	0	0	111.5
305	V	34.3	Very low	37.2	Very low	137 Å²	137	155.7 Å²	155.7	83%	0.83	80%	0.804	S	S	*	*			trans	44.2	109.6	153.1	-170.1	0	0	0	0	117.6
306	F	33.4	Very low	37.2	Very low	182 Å²	182	153.6 Å²	153.6	80%	0.798	80%	0.802	S	S	*	*				174.9	129.4	105.2	-160.6	-120.7	0	0	0	113.8
307	V	36.7	Very low	36.5	Very low	100 Å²	100	156.3 Å²	156.3	61%	0.606	81%	0.805	S	S	*	*			trans	45.4	103.8	147.5	176.8	0	0	0	0	121.5
308	K	34.6	Very low	36.4	Very low	187 Å²	187	155.2 Å²	155.2	81%	0.813	81%	0.805	S	S	*	*				50.7	110	109.2	-159.6	-172.4	-173.5	-174.2	0	120.3
309	S	40.3	Very low	35.8	Very low	128 Å²	128	152.2 Å²	152.2	90%	0.895	80%	0.803	S	S	*	*			trans	-142.8	167.3	145.5	-80.2	0	0	0	0	108.6
310	D	36.6	Very low	35.6	Very low	154 Å²	154	151 Å²	151	82%	0.824	81%	0.805	S	S	*	*			trans	-122.4	179.7	-162.5	-142.8	-35.2	0	0	0	114.1
311	E	39.4	Very low	35.3	Very low	187 Å²	187	149.9 Å²	149.9	87%	0.874	80%	0.803	S	S	*	*			trans	89.8	159.8	166.8	-59.8	-149.1	75.7	0	0	121.4
312	R	36	Very low	34.9	Very low	212 Å²	212	146.9 Å²	146.9	80%	0.8	80%	0.803	S	S	*	*			trans	-106.1	-176.5	-162	-116.5	175.1	160.1	165	-11.1	110.4
313	P	40.8	Very low	34.7	Very low	125 Å²	125	143.3 Å²	143.3	81%	0.812	80%	0.804	S	S	*	*			cis	-140.6	-162	28.8	40.2	-16.7	0	0	0	116.7
314	E	33.3	Very low	34.6	Very low	151 Å²	151	143.6 Å²	143.6	71%	0.706	80%	0.803	S	S	*	*			trans	-76.8	151.1	-162.2	-46.5	175.1	152.2	0	0	116.9
315	K	34.9	Very low	34.4	Very low	185 Å²	185	145.9 Å²	145.9	80%	0.804	81%	0.809	S	S	*	*				177.6	161.9	110.4	-99.9	172.5	-177	176.8	0	115.5
316	S	35.7	Very low	34.3	Very low	121 Å²	121	146.8 Å²	146.8	85%	0.846	81%	0.809	S	S	*	*			trans	68	153.9	159.4	39.4	0	0	0	0	119.5
317	E	31.8	Very low	34	Very low	191 Å²	191	149.9 Å²	149.9	89%	0.893	82%	0.815	S	S	*	*			trans	-81.7	145.9	-174.4	-59.9	150.7	102.8	0	0	112.6
318	L	33.5	Very low	33.9	Very low	161 Å²	161	150.2 Å²	150.2	84%	0.843	82%	0.822	S	S	*	*			trans	-148	139.6	151.4	-150.4	83.3	0	0	0	110.6
319	V	29.5	Very low	33.8	Very low	145 Å²	145	147 Å²	147	88%	0.879	82%	0.824	S	S	*	*			trans	-86.7	123	174.5	-178.2	0	0	0	0	108.9
320	T	33.3	Very low	33.5	Very low	110 Å²	110	146.1 Å²	146.1	68%	0.675	82%	0.817	S	S	*	*			trans	-147.4	132.1	169.8	-63.6	0	0	0	0	109.4
321	A	30.3	Very low	33.5	Very low	94 Å²	94	146.1 Å²	146.1	78%	0.777	82%	0.816	S	S	*	*			trans	-86.8	138.1	178.8	0	0	0	0	0	111
322	C	30.6	Very low	33.3	Very low	117 Å²	117	143.2 Å²	143.2	79%	0.791	81%	0.811	S	S	*	*			trans	-124.8	117.6	169.1	-72.1	0	0	0	0	109.6
323	S	30.1	Very low	33.2	Very low	127 Å²	127	139 Å²	139	89%	0.888	81%	0.808	S	S	*	*			trans	-78.4	124.3	175.1	-59.9	0	0	0	0	110.6
324	T	35	Very low	32.8	Very low	134 Å²	134	137.5 Å²	137.5	82%	0.822	81%	0.806	S	S	*	*			trans	-124.1	108.3	163.9	50.6	0	0	0	0	110
325	S	33.4	Very low	32.8	Very low	116 Å²	116	135.4 Å²	135.4	81%	0.811	81%	0.808	S	S	*	*			trans	-64.9	133.8	172.2	51.8	0	0	0	0	111.1
326	N	31.6	Very low	32.9	Very low	156 Å²	156	132.3 Å²	132.3	83%	0.834	81%	0.81	S	S	*	*			trans	-146.5	109.3	162.5	-141.2	-6.3	0	0	0	109.8
327	W	27.8	Very low	32.9	Very low	246 Å²	246	131.4 Å²	131.4	93%	0.932	80%	0.804	S	S	*	*			trans	-79.5	131.8	178.2	-70.7	-44.7	0	0	0	110.6
328	S	32.9	Very low	33.3	Very low	108 Å²	108	127.6 Å²	127.6	76%	0.755	80%	0.798	S	S	*	*			trans	-156.6	95.2	166.7	-80.6	0	0	0	0	110.2	S330	S328-S330 PolarHBondContact O-N 2.95Å
329	S	33.3	Very low	33.4	Very low	120 Å²	120	127.1 Å²	127.1	84%	0.839	80%	0.796	S	S	*	*			trans	-63.9	113.7	-176.5	-54.3	0	0	0	0	111.9
330	S	33.5	Very low	33.8	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	79%	0.794	S	S	*	*			trans	-95.8	94.1	175.5	-67.4	0	0	0	0	110.4	S328 V332	S328-S330 PolarHBondContact O-N 2.95Å; S330-V332 PolarHBondContact O-N 3.45Å
331	I	36.2	Very low	34.2	Very low	153 Å²	153	128.5 Å²	128.5	79%	0.785	80%	0.801	S	S	*	*			trans	-73.3	109.7	171.3	-64.6	178.1	0	0	0	108.8	V333	I331-V333 HydrophobicContact CG2-CG2 4.29Å
332	V	35.7	Very low	34.3	Very low	127 Å²	127	131.4 Å²	131.4	77%	0.77	80%	0.802	S	S	*	*			trans	-90	103.5	174.4	-178.8	0	0	0	0	108.9	S330 A334	S330-V332 PolarHBondContact O-N 3.45Å; V332-A334 PolarHBondContact O-N 3.42Å
333	V	34.5	Very low	34.8	Very low	122 Å²	122	134.3 Å²	134.3	74%	0.739	81%	0.806	S	S	*	*			trans	-77.2	115.1	171	-178.7	0	0	0	0	108.8	I331 S335	I331-V333 HydrophobicContact CG2-CG2 4.29Å; V333-S335 PolarHBondContact O-N 2.69Å
334	A	32.6	Very low	35.3	Very low	94 Å²	94	135.3 Å²	135.3	78%	0.777	80%	0.801	S	S	*	*			trans	-77.3	99.3	179.5	0	0	0	0	0	111.5	V332 S336	V332-A334 PolarHBondContact O-N 3.42Å; A334-S336 PolarHBondContact O-N 2.72Å
335	S	32.5	Very low	35.4	Very low	108 Å²	108	132 Å²	132	76%	0.755	79%	0.794	S	S	*	*			trans	-72.9	113.9	167.7	-66.6	0	0	0	0	110.5	V333 S337	V333-S335 PolarHBondContact O-N 2.69Å; S335-S337 PolarHBondContact O-N 2.75Å; S335-S337 VanDerWaalsContact O-N 3.1Å
336	S	36.6	Very low	35.5	Very low	119 Å²	119	134.3 Å²	134.3	83%	0.832	80%	0.796	S	S	*	*			trans	-77.6	90.8	-179	57.2	0	0	0	0	112.3	A334 S338	A334-S336 PolarHBondContact O-N 2.72Å; S336-S338 PolarHBondContact O-N 2.82Å
337	S	36.4	Very low	35.7	Very low	103 Å²	103	132.9 Å²	132.9	72%	0.72	79%	0.793	S	S	*	*			trans	-74.7	106.5	172.6	-62.2	0	0	0	0	111.5	S335 N339	S335-S337 PolarHBondContact O-N 2.75Å; S335-S337 VanDerWaalsContact O-N 3.1Å; S337-N339 PolarHBondContact O-N 3Å
338	S	39.3	Very low	36	Very low	110 Å²	110	127.5 Å²	127.5	77%	0.769	79%	0.787	S	S	*	*			trans	-80.8	94.1	176.7	57.1	0	0	0	0	111.9	S336	S336-S338 PolarHBondContact O-N 2.82Å
339	N	36.4	Very low	36	Very low	151 Å²	151	128.4 Å²	128.4	81%	0.807	79%	0.788	S	S	*	*			trans	-85.6	124.3	170	-75.1	-22.5	0	0	0	110.8	S337	S337-N339 PolarHBondContact O-N 3Å
340	L	38.1	Very low	36	Very low	161 Å²	161	128.1 Å²	128.1	84%	0.843	78%	0.781	S	S	*	*			trans	-111.1	121.6	169.9	-76.1	169.1	0	0	0	109.3
341	P	40.8	Very low	36.1	Very low	124 Å²	124	131 Å²	131	81%	0.805	78%	0.783	S	S	*	*			trans	-77.1	138.6	174	31.2	-32.9	0	0	0	111
342	I	34.3	Very low	35.9	Very low	155 Å²	155	128.7 Å²	128.7	80%	0.795	78%	0.78	S	S	*	*			trans	-82.6	133.2	174.1	-64.2	166.6	0	0	0	109.2
343	M	40.4	Very low	35.8	Very low	178 Å²	178	131.8 Å²	131.8	88%	0.877	78%	0.784	S	S	*	*			trans	-143.8	152.7	154.8	-133.6	-171.3	77.8	0	0	111.2
344	N	39.5	Very low	35.9	Very low	147 Å²	147	131.5 Å²	131.5	79%	0.786	78%	0.782	S	S	*	*			trans	-93.4	144.9	-163.2	-53.9	-38	0	0	0	112.6
345	G	37.4	Very low	36.2	Very low	66 Å²	66	132.9 Å²	132.9	68%	0.68	78%	0.783	S	S	*	*			trans	154.2	109.4	159	0	0	0	0	0	117.1
346	L	35.4	Very low	36.1	Very low	164 Å²	164	132.3 Å²	132.3	86%	0.859	78%	0.779	S	S	*	*			trans	52.2	98.8	152.6	-67.2	121.1	0	0	0	120.2
347	T	35.4	Very low	36.1	Very low	126 Å²	126	131.8 Å²	131.8	77%	0.773	78%	0.775	S	S	*	*				41.5	110.1	117.2	-38.7	0	0	0	0	119.6
348	V	35.4	Very low	36	Very low	133 Å²	133	135 Å²	135	81%	0.806	78%	0.778	S	S	*	*				-168.9	143.1	110.1	144.6	0	0	0	0	111.7
349	V	32.2	Very low	35.6	Very low	126 Å²	126	138.8 Å²	138.8	76%	0.764	78%	0.781	S	S	*	*			trans	-29.8	137	169.3	-174.7	0	0	0	0	116.6
350	T	33.7	Very low	35.3	Very low	114 Å²	114	137.3 Å²	137.3	70%	0.699	78%	0.778	S	S	*	*				177.3	118	118.6	-72.6	0	0	0	0	114.2
351	Q	36.5	Very low	35.2	Very low	170 Å²	170	133.4 Å²	133.4	79%	0.794	76%	0.764	S	S	*	*			trans	48.5	140.3	149.5	-62.5	171	9.3	0	0	122.5
352	S	31.7	Very low	34.8	Very low	105 Å²	105	134.6 Å²	134.6	73%	0.734	76%	0.764	S	S	*	*			trans	-81.8	144.6	171.1	53.4	0	0	0	0	113.2
353	F	33.1	Very low	35	Very low	192 Å²	192	136.3 Å²	136.3	84%	0.842	77%	0.766	S	S	*	*			trans	-127.3	137.9	159.3	-93.8	-90.8	0	0	0	111.1
354	V	37	Very low	34.6	Very low	116 Å²	116	135.1 Å²	135.1	70%	0.703	76%	0.763	S	S	*	*			trans	-116.3	123.7	177.4	-176.2	0	0	0	0	108	S356	V354-S356 PolarHBondContact O-N 3.25Å
355	P	37.9	Very low	34.6	Very low	123 Å²	123	135.4 Å²	135.4	80%	0.799	76%	0.764	S	S	*	*			trans	-83.9	75.6	-179.5	33.5	-34.3	0	0	0	111.6	S357	P355-S357 PolarHBondContact O-N 3.39Å
356	S	30.8	Very low	34.5	Very low	95 Å²	95	139.7 Å²	139.7	66%	0.664	77%	0.771	S	S	*	*			trans	-86.7	96.6	162.6	-66.9	0	0	0	0	109.6	V354	V354-S356 PolarHBondContact O-N 3.25Å
357	S	36.6	Very low	34.5	Very low	108 Å²	108	137.5 Å²	137.5	76%	0.755	77%	0.767	S	S	*	*			trans	-119.5	93.2	173.7	61.4	0	0	0	0	110.8	P355	P355-S357 PolarHBondContact O-N 3.39Å
358	H	33.4	Very low	34.6	Very low	170 Å²	170	140.8 Å²	140.8	79%	0.787	77%	0.77	S	S	*	*			trans	-68.3	134	166.4	-53.8	-98.5	0	0	0	108.5
359	F	31.6	Very low	34.6	Very low	190 Å²	190	140.6 Å²	140.6	83%	0.833	77%	0.769	S	S	*	*			trans	-133.1	87.2	171.1	-149.8	-87.4	0	0	0	110.4
360	T	30.7	Very low	34.9	Very low	121 Å²	121	140.3 Å²	140.3	74%	0.742	77%	0.773	S	S	*	*			trans	-82	117.6	168.7	45.2	0	0	0	0	109
361	S	36.6	Very low	34.9	Very low	79 Å²	79	144.6 Å²	144.6	55%	0.552	79%	0.785	S	S	*	*			trans	-118.5	88.6	170.7	60.1	0	0	0	0	109.6	F363	S361-F363 PolarHBondContact O-N 2.95Å
362	D	31.8	Very low	34.9	Very low	149 Å²	149	141.4 Å²	141.4	80%	0.797	79%	0.788	S	S	*	*			trans	-66.9	114.3	173.5	-65.2	-66.6	0	0	0	110.3
363	F	38.6	Very low	34.9	Very low	190 Å²	190	145.9 Å²	145.9	83%	0.833	80%	0.795	S	S	*	*			trans	-116.6	91.3	164.8	-83.9	-76.5	0	0	0	109	S361	S361-F363 PolarHBondContact O-N 2.95Å
364	N	31.7	Very low	35.2	Very low	153 Å²	153	144.2 Å²	144.2	82%	0.818	79%	0.793	S	S	*	*			trans	-93.4	115.2	173.6	-173.2	6.8	0	0	0	109
365	L	39.1	Very low	35.2	Very low	154 Å²	154	143.6 Å²	143.6	81%	0.806	79%	0.791	S	S	*	*			trans	-133.8	131.8	175.1	-125.6	80.3	0	0	0	109.5
366	D	34.6	Very low	34.9	Very low	156 Å²	156	143.6 Å²	143.6	83%	0.834	79%	0.794	S	S	*	*			trans	-63.6	134.7	-174.6	-92	-63	0	0	0	113.8
367	P	36.3	Very low	35.3	Very low	117 Å²	117	145.4 Å²	145.4	76%	0.76	80%	0.801	S	S	*	*			trans	-91.2	115.2	170.3	33.4	-30.2	0	0	0	111.7
368	K	38.5	Very low	35.6	Very low	195 Å²	195	148.7 Å²	148.7	85%	0.848	81%	0.808	S	S	*	*			trans	-152.8	133.7	165.2	-119.3	165.7	-171.7	167.6	0	114.5
369	T	34.9	Very low	36.1	Very low	129 Å²	129	145.8 Å²	145.8	79%	0.791	81%	0.807	S	S	*	*			trans	60	91.9	156.9	-46.2	0	0	0	0	118
370	S	38	Very low	36.6	Very low	121 Å²	121	142.8 Å²	142.8	85%	0.846	80%	0.799	S	S	*	*				-164.4	136.9	121.8	-81.8	0	0	0	0	110.3
371	Q	34.4	Very low	37.3	Very low	203 Å²	203	142.8 Å²	142.8	95%	0.949	80%	0.802	S	S	*	*			trans	-93.2	132.7	175.2	-72	177	-41.3	0	0	110.4
372	A	35.3	Very low	37.5	Very low	103 Å²	103	147.5 Å²	147.5	85%	0.851	81%	0.813	S	S	*	*			trans	-139.9	143.4	159.1	0	0	0	0	0	108
373	F	31.9	Very low	37.9	Very low	200 Å²	200	145 Å²	145	88%	0.877	81%	0.806	S	S	*	*			trans	-117.2	110.3	-159.4	-159	-85.2	0	0	0	110.6
374	I	39.6	Very low	37.9	Very low	156 Å²	156	140.6 Å²	140.6	80%	0.8	81%	0.805	S	S	*	*			trans	-136.7	123.6	174	-52.2	179.4	0	0	0	108.2
375	P	36.2	Very low	38.7	Very low	103 Å²	103	136.3 Å²	136.3	67%	0.669	79%	0.791	S	S	*	*			trans	-81.9	150.6	-177.8	32.9	-35	0	0	0	112.9
376	S	32.7	Very low	38.9	Very low	124 Å²	124	135.1 Å²	135.1	87%	0.867	79%	0.793	S	S	*	*			trans	-88.3	108.6	-176.9	-50.7	0	0	0	0	112.9
377	V	39.9	Very low	39.6	Very low	132 Å²	132	133.7 Å²	133.7	80%	0.8	78%	0.784	S	S	*	*			trans	-151.4	109.5	159.9	-94.5	0	0	0	0	110.9
378	I	41.1	Very low	40.3	Very low	178 Å²	178	132.8 Å²	132.8	91%	0.913	77%	0.772	S	S	*	*			trans	-154	131.1	148.7	-101.8	151.9	0	0	0	106.5
379	S	44.8	Very low	41.3	Very low	108 Å²	108	128 Å²	128	76%	0.755	76%	0.762	S	S	*	*			trans	-89.7	163.7	-174.1	50.3	0	0	0	0	113.1
380	D	42.2	Very low	42.6	Very low	127 Å²	127	124 Å²	124	68%	0.679	74%	0.742	S	S	*	*			trans	-45.5	115.9	-176.6	-161.9	-1.8	0	0	0	114.2	F382	D380-F382 VanDerWaalsContact C-N 3.29Å; D380-F382 PolarHBondContact O-N 2.96Å
381	P	45.6	Very low	43.9	Very low	122 Å²	122	122.4 Å²	122.4	79%	0.792	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	11.3	-165.7	33.5	-38.2	0	0	0	115.4
382	F	40.6	Very low	45.2	Very low	178 Å²	178	117.9 Å²	117.9	78%	0.781	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.4	18	-175.8	-131	-93.3	0	0	0	116.1	D380 A384	D380-F382 VanDerWaalsContact C-N 3.29Å; D380-F382 PolarHBondContact O-N 2.96Å; F382-A384 VanDerWaalsContact C-N 3.29Å; F382-A384 PolarHBondContact O-N 3.36Å
383	S	40.2	Very low	46.8	Very low	95 Å²	95	120.2 Å²	120.2	66%	0.664	70%	0.701	S	S	*	*			trans	-77.5	76.9	173.8	-164.6	0	0	0	0	111.6	A385	S383-A385 PolarHBondContact O-N 3.21Å
384	A	38.3	Very low	48.6	Very low	98 Å²	98	119.2 Å²	119.2	81%	0.81	69%	0.692	S	S	*	*			trans	-74	38	-176.8	0	0	0	0	0	114.5	F382	F382-A384 VanDerWaalsContact C-N 3.29Å; F382-A384 PolarHBondContact O-N 3.36Å
385	A	47.6	Very low	50.2	Low	63 Å²	63	117.4 Å²	117.4	52%	0.521	68%	0.679	S	S	.	*	S	Bend	trans	-81.1	138	169.3	0	0	0	0	0	110.1	S383 I387	S383-A385 PolarHBondContact O-N 3.21Å; A385-I387 PolarHBondContact O-N 3.42Å
386	P	43.9	Very low	51.9	Low	129 Å²	129	120.4 Å²	120.4	84%	0.838	68%	0.679	S	S	*	*			trans	-60.1	108.1	176.5	-24.9	34.9	0	0	0	111.7	N388	P386-N388 PolarHBondContact O-N 3.39Å
387	I	49.2	Very low	53.9	Low	127 Å²	127	121.5 Å²	121.5	65%	0.651	67%	0.67	S	S	*	*			trans	-71.1	101.6	-178.5	-57.5	179.1	0	0	0	108.9	A385 I392	A385-I387 PolarHBondContact O-N 3.42Å; I387-I392 HydrophobicContact CG2-CD1 4.06Å; I387-I392 HydrophobicContact CG2-CG1 3.98Å
388	N	51.8	Low	55.5	Low	97 Å²	97	120.8 Å²	120.8	52%	0.519	66%	0.659	S	S	.	*			trans	-62	127.4	170.5	-175.9	-31.7	0	0	0	109.1	P386 A390 T391	P386-N388 PolarHBondContact O-N 3.39Å; N388-A390 PolarHBondContact O-N 2.82Å; N388-A390 WeakPolarHBondContact OD1-CB 3.04Å; N388-A390 PolarHBondContact OD1-N 2.93Å; N388-A390 VanDerWaalsContact OD1-N 3.09Å; N388-T391 WeakPolarHBondContact O-CB 3.26Å; N388-T391 PolarHBondContact O-N 3.2Å; N388-T391 PolarHBondContact O-OG1 3.29Å
389	P	59.5	Low	57	Low	96 Å²	96	117.3 Å²	117.3	62%	0.623	64%	0.639	S	S	*	*	H	α-helix	trans	-58	-24.3	-176.8	21.6	-33.7	0	0	0	113.8	T391 I392	P389-T391 PolarHBondContact O-N 2.96Å; P389-I392 PolarHBondContact O-N 2.86Å
390	A	62.6	Low	58.3	Low	45 Å²	45	116.7 Å²	116.7	37%	0.372	63%	0.627	S	S	.	*	H	α-helix	trans	-62.2	-22.4	174	0	0	0	0	0	114	N388	N388-A390 PolarHBondContact O-N 2.82Å; N388-A390 WeakPolarHBondContact OD1-CB 3.04Å; N388-A390 PolarHBondContact OD1-N 2.93Å; N388-A390 VanDerWaalsContact OD1-N 3.09Å
391	T	65.4	Low	59.7	Low	86 Å²	86	117.6 Å²	117.6	53%	0.528	63%	0.627	S	S	.	*	H	α-helix	trans	-74.7	-37.6	177.6	-54.8	0	0	0	0	111.7	N388 P389 R394 H395	N388-T391 WeakPolarHBondContact O-CB 3.26Å; N388-T391 PolarHBondContact O-N 3.2Å; N388-T391 PolarHBondContact O-OG1 3.29Å; P389-T391 PolarHBondContact O-N 2.96Å; T391-R394 PolarHBondContact O-N 2.95Å; T391-H395 PolarHBondContact O-N 2.89Å
392	I	60.5	Low	60.7	Low	109 Å²	109	118.4 Å²	118.4	56%	0.559	62%	0.621	S	S	*	*	H	α-helix	trans	-65.5	-45	-177.5	-60	175.4	0	0	0	110.4	I387 P389 R394 H395 Y396	I387-I392 HydrophobicContact CG2-CD1 4.06Å; I387-I392 HydrophobicContact CG2-CG1 3.98Å; P389-I392 PolarHBondContact O-N 2.86Å; I392-R394 VanDerWaalsContact C-N 3.31Å; I392-R394 PolarHBondContact O-N 3.15Å; I392-H395 PolarHBondContact O-N 2.99Å; I392-Y396 PolarHBondContact O-N 2.79Å
393	Q	68.3	Low	61.7	Low	151 Å²	151	116.5 Å²	116.5	71%	0.706	61%	0.614	S	S	*	*	H	α-helix	trans	-61.4	-36.4	177.1	-72.8	-174.7	-26	0	0	112.9	Q397	Q393-Q397 WeakPolarHBondContact O-CB 3.29Å; Q393-Q397 PolarHBondContact O-N 3.49Å; Q393-Q397 VanDerWaalsContact O-N 3.1Å
394	R	71	Confident	62.6	Low	179 Å²	179	119.7 Å²	119.7	68%	0.675	62%	0.618	S	S	*	*	H	α-helix	trans	-66.9	-39.6	175.5	-79.5	-166.2	175.5	118.3	-2.6	112.9	T391 I392 Q397 M398	T391-R394 PolarHBondContact O-N 2.95Å; I392-R394 VanDerWaalsContact C-N 3.31Å; I392-R394 PolarHBondContact O-N 3.15Å; R394-Q397 PolarHBondContact O-N 3.28Å; R394-M398 WeakPolarHBondContact O-CG 3.29Å; R394-M398 PolarHBondContact O-N 2.76Å; R394-M398 VanDerWaalsContact O-N 3.1Å
395	H	72.2	Confident	63.4	Low	118 Å²	118	123 Å²	123	55%	0.546	62%	0.617	S	S	.	*	H	α-helix	trans	-63.1	-49.8	178	-157.1	-78.1	0	0	0	110.9	T391 I392 Q397 M398 E399	T391-H395 PolarHBondContact O-N 2.89Å; I392-H395 PolarHBondContact O-N 2.99Å; H395-Q397 VanDerWaalsContact C-N 3.27Å; H395-Q397 PolarHBondContact O-N 3.2Å; H395-M398 PolarHBondContact O-N 3.3Å; H395-M398 VanDerWaalsContact O-N 3.14Å; H395-E399 IonicContact CE1-OE2 2.69Å; H395-E399 IonicContact ND1-OE2 2.72Å; H395-E399 PolarHBondContact ND1-OE2 2.79Å; H395-E399 PolarHBondContact O-N 2.91Å
396	Y	71.9	Confident	63.6	Low	167 Å²	167	127.6 Å²	127.6	66%	0.655	63%	0.628	S	S	*	*	H	α-helix	trans	-58.9	-37.5	179.1	-164.6	-104	0	0	0	112.7	I392 E399 L400	I392-Y396 PolarHBondContact O-N 2.79Å; Y396-E399 PolarHBondContact O-N 2.84Å; Y396-L400 HydrophobicContact CD1-CD1 3.96Å; Y396-L400 HydrophobicContact CE1-CD1 3.65Å; Y396-L400 PolarHBondContact O-N 2.9Å
397	Q	74.9	Confident	63.8	Low	146 Å²	146	129.7 Å²	129.7	68%	0.682	63%	0.626	S	S	*	*	H	α-helix	trans	-71.7	-34	177.8	-170.3	168.6	69.9	0	0	113.4	Q393 R394 H395 Q401	Q393-Q397 WeakPolarHBondContact O-CB 3.29Å; Q393-Q397 PolarHBondContact O-N 3.49Å; Q393-Q397 VanDerWaalsContact O-N 3.1Å; R394-Q397 PolarHBondContact O-N 3.28Å; H395-Q397 VanDerWaalsContact C-N 3.27Å; H395-Q397 PolarHBondContact O-N 3.2Å; Q397-Q401 PolarHBondContact O-N 3.18Å
398	M	73.8	Confident	63.8	Low	117 Å²	117	132.3 Å²	132.3	58%	0.576	64%	0.636	S	S	*	*	H	α-helix	trans	-70.8	-36.9	172.5	-69.6	-165.7	-54.4	0	0	112.2	R394 H395 Q401 Q402	R394-M398 WeakPolarHBondContact O-CG 3.29Å; R394-M398 PolarHBondContact O-N 2.76Å; R394-M398 VanDerWaalsContact O-N 3.1Å; H395-M398 PolarHBondContact O-N 3.3Å; H395-M398 VanDerWaalsContact O-N 3.14Å; M398-Q401 PolarHBondContact O-N 2.96Å; M398-Q401 VanDerWaalsContact O-N 3.17Å; M398-Q402 PolarHBondContact O-N 3.01Å
399	E	71.9	Confident	63.5	Low	105 Å²	105	135.2 Å²	135.2	49%	0.491	65%	0.65	S	S	.	*	H	α-helix	trans	-65.9	-43.2	-178.5	-154.7	168.4	146.4	0	0	111.7	H395 Y396 Q401 Q402 Q403	H395-E399 IonicContact CE1-OE2 2.69Å; H395-E399 IonicContact ND1-OE2 2.72Å; H395-E399 PolarHBondContact ND1-OE2 2.79Å; H395-E399 PolarHBondContact O-N 2.91Å; Y396-E399 PolarHBondContact O-N 2.84Å; E399-Q401 VanDerWaalsContact C-N 3.3Å; E399-Q401 PolarHBondContact O-N 3.34Å; E399-Q402 PolarHBondContact O-N 3.02Å; E399-Q403 PolarHBondContact O-N 2.63Å
400	L	72.3	Confident	62.5	Low	96 Å²	96	137.5 Å²	137.5	50%	0.503	66%	0.662	S	S	.	*	H	α-helix	trans	-59.1	-36.4	170	-92.6	161.7	0	0	0	113.3	Y396	Y396-L400 HydrophobicContact CD1-CD1 3.96Å; Y396-L400 HydrophobicContact CE1-CD1 3.65Å; Y396-L400 PolarHBondContact O-N 2.9Å
401	Q	71.4	Confident	61.4	Low	145 Å²	145	138.5 Å²	138.5	68%	0.678	68%	0.676	S	S	*	*	H	α-helix	trans	-74.3	-31.6	179.2	-171.1	165.6	86.2	0	0	112.4	Q397 M398 E399	Q397-Q401 PolarHBondContact O-N 3.18Å; M398-Q401 PolarHBondContact O-N 2.96Å; M398-Q401 VanDerWaalsContact O-N 3.17Å; E399-Q401 VanDerWaalsContact C-N 3.3Å; E399-Q401 PolarHBondContact O-N 3.34Å
402	Q	66.9	Low	60.2	Low	140 Å²	140	140.2 Å²	140.2	65%	0.654	69%	0.692	S	S	*	*	H	α-helix	trans	-75.5	-28.5	-178.6	-151.5	177.3	121.1	0	0	113.2	M398 E399	M398-Q402 PolarHBondContact O-N 3.01Å; E399-Q402 PolarHBondContact O-N 3.02Å
403	Q	61.1	Low	59.2	Low	138 Å²	138	139.5 Å²	139.5	65%	0.645	70%	0.697	S	S	*	*	H	α-helix	trans	-68.5	-30.7	175.1	-71.7	-168.1	9.7	0	0	113.4	E399 Q405 H406	E399-Q403 PolarHBondContact O-N 2.63Å; Q403-Q405 PolarHBondContact O-N 3.32Å; Q403-H406 PolarHBondContact O-N 3.38Å
404	Q	60	Low	57.7	Low	162 Å²	162	139.8 Å²	139.8	76%	0.757	70%	0.702	S	S	*	*	H	α-helix	trans	-71.7	-24.2	-177.3	-75.3	-169.6	13	0	0	114.4
405	Q	54.4	Low	56.2	Low	168 Å²	168	139.1 Å²	139.1	79%	0.785	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-80.5	-12.6	179.4	-69.3	-165.8	-5.8	0	0	114.3	Q403	Q403-Q405 PolarHBondContact O-N 3.32Å
406	H	52.3	Low	54.5	Low	159 Å²	159	138.1 Å²	138.1	74%	0.736	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-90.2	6.9	-174.5	-86.9	91.7	0	0	0	115.6	Q403	Q403-H406 PolarHBondContact O-N 3.38Å
407	Q	48.2	Very low	53	Low	172 Å²	172	134.7 Å²	134.7	80%	0.804	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-106.4	11.7	-176.8	-69.8	-166.6	11.7	0	0	116.1
408	Q	49	Very low	51.4	Low	183 Å²	183	137.8 Å²	137.8	86%	0.855	73%	0.729	S	S	*	*	S	Bend	trans	-119.2	10.8	-173.7	-79.7	-167.1	-27	0	0	117.2
409	I	45.2	Very low	49.9	Very low	158 Å²	158	136.5 Å²	136.5	81%	0.81	74%	0.737	S	S	*	*			trans	-128.9	59.8	-176.4	-41.6	-177.4	0	0	0	113.3
410	T	38.7	Very low	48.8	Very low	143 Å²	143	136.8 Å²	136.8	88%	0.877	75%	0.748	S	S	*	*			trans	-150.3	108	164.1	36.2	0	0	0	0	111.8
411	G	40	Very low	47.3	Very low	66 Å²	66	140.1 Å²	140.1	68%	0.68	76%	0.763	S	S	*	*			trans	165.8	121.3	170.2	0	0	0	0	0	116.1
412	S	40.4	Very low	45.6	Very low	122 Å²	122	137.4 Å²	137.4	85%	0.853	77%	0.765	S	S	*	*			trans	58	163.2	164.9	70	0	0	0	0	120.1
413	S	38.4	Very low	44.3	Very low	95 Å²	95	137.7 Å²	137.7	66%	0.664	78%	0.777	S	S	*	*				-167.7	134.8	-64.6	48.9	0	0	0	0	113.4
414	L	38.4	Very low	43	Very low	157 Å²	157	137.3 Å²	137.3	82%	0.822	78%	0.783	S	S	*	*			trans	72.5	150.6	150.9	-62.3	162.7	0	0	0	121.2
415	L	38.5	Very low	41.9	Very low	165 Å²	165	134.9 Å²	134.9	86%	0.864	78%	0.784	S	S	*	*			trans	70.2	143.7	162.2	-61	138.5	0	0	0	118.1
416	S	36.1	Very low	41	Very low	97 Å²	97	132.9 Å²	132.9	68%	0.678	78%	0.783	S	S	*	*			cis	-160	143.9	-21.1	-163	0	0	0	0	113.4
417	S	40.8	Very low	40.4	Very low	95 Å²	95	132.7 Å²	132.7	66%	0.664	79%	0.786	S	S	*	*			trans	14.7	120.7	156.5	66.4	0	0	0	0	123.1
418	K	42	Very low	39.8	Very low	210 Å²	210	129.4 Å²	129.4	91%	0.913	78%	0.782	S	S	*	*				176.4	166.2	103.6	-99.5	176.8	177	175.2	0	113.4
419	A	41.7	Very low	39.3	Very low	91 Å²	91	126.4 Å²	126.4	75%	0.752	78%	0.782	S	S	*	*			trans	-146.7	-166.5	-179	0	0	0	0	0	108.5
420	P	49.7	Very low	39.1	Very low	110 Å²	110	125.2 Å²	125.2	71%	0.714	78%	0.782	S	S	*	*			cis	-140	-158	-4.5	36.3	-12.1	0	0	0	114.8
421	M	39.4	Very low	39.6	Very low	167 Å²	167	123.9 Å²	123.9	82%	0.823	78%	0.775	S	S	*	*			trans	87.4	119	163.2	-42.1	-135.4	89.9	0	0	116.5
422	A	37.3	Very low	39.8	Very low	87 Å²	87	127 Å²	127	72%	0.719	78%	0.781	S	S	*	*				77.5	145.7	94.4	0	0	0	0	0	113.5
423	V	38.4	Very low	39.8	Very low	147 Å²	147	126.2 Å²	126.2	89%	0.891	78%	0.776	S	S	*	*			cis	-143.4	-178.9	25.1	-146.9	0	0	0	0	111.6
424	V	34.7	Very low	40.6	Very low	129 Å²	129	126.9 Å²	126.9	78%	0.782	78%	0.778	S	S	*	*			trans	-82.4	138	179.5	177.3	0	0	0	0	112.5
425	S	35.7	Very low	40.8	Very low	111 Å²	111	128.3 Å²	128.3	78%	0.776	78%	0.778	S	S	*	*				174.4	138	129.9	-79.4	0	0	0	0	116.1
426	T	36	Very low	41.1	Very low	126 Å²	126	127.2 Å²	127.2	77%	0.773	77%	0.773	S	S	*	*			trans	-12.9	143.4	151.2	-35.2	0	0	0	0	119.7
427	I	39.5	Very low	41.5	Very low	156 Å²	156	126.6 Å²	126.6	80%	0.8	78%	0.782	S	S	*	*				160.6	143.6	127.7	-80.8	156.9	0	0	0	111.5
428	S	35	Very low	41.7	Very low	103 Å²	103	125.5 Å²	125.5	72%	0.72	79%	0.785	S	S	*	*			trans	-62.5	151.8	-178.8	63.8	0	0	0	0	116.5
429	S	40.3	Very low	42.1	Very low	120 Å²	120	121.8 Å²	121.8	84%	0.839	78%	0.782	S	S	*	*			trans	-164.5	144.4	130.9	22.6	0	0	0	0	113.6
430	T	40.7	Very low	42.4	Very low	132 Å²	132	123.3 Å²	123.3	81%	0.81	78%	0.784	S	S	*	*			trans	-90.4	173	158.6	45.6	0	0	0	0	108.3
431	P	48.2	Very low	42.2	Very low	115 Å²	115	126.1 Å²	126.1	75%	0.747	79%	0.792	S	S	*	*			cis	-137	-165.7	26.1	42.4	-19.6	0	0	0	113.5
432	T	44	Very low	42.4	Very low	131 Å²	131	122.4 Å²	122.4	80%	0.804	79%	0.788	S	S	*	*				-173	149.1	74.4	-52.6	0	0	0	0	110.2
433	S	42	Very low	42.7	Very low	107 Å²	107	123 Å²	123	75%	0.748	79%	0.792	S	S	*	*			trans	-135.9	166.2	171.2	64	0	0	0	0	111.5
434	P	54.5	Low	43	Very low	109 Å²	109	121.7 Å²	121.7	71%	0.708	79%	0.787	S	S	*	*			trans	-140.6	154.4	151.2	36.9	-22.5	0	0	0	115.7
435	F	42.2	Very low	43.2	Very low	187 Å²	187	121.9 Å²	121.9	82%	0.82	79%	0.788	S	S	*	*			trans	68	142.4	152.4	-89.7	-126.1	0	0	0	120.5
436	L	45.4	Very low	43.2	Very low	142 Å²	142	124.3 Å²	124.3	74%	0.743	79%	0.792	S	S	*	*			cis	-166.6	136.6	-25.5	-156.3	77.1	0	0	0	111.7
437	G	43.8	Very low	43.3	Very low	84 Å²	84	124.1 Å²	124.1	87%	0.866	80%	0.796	S	S	*	*			trans	72.2	154.2	165.9	0	0	0	0	0	116.7
438	G	45.6	Very low	43	Very low	71 Å²	71	124.4 Å²	124.4	73%	0.732	80%	0.797	S	S	*	*			cis	-157.7	172.1	-4.4	0	0	0	0	0	111
439	P	50.6	Low	43	Very low	133 Å²	133	126.4 Å²	126.4	86%	0.864	80%	0.8	S	S	*	*			trans	-91.8	162.3	-158.1	35	-37.2	0	0	0	117.1
440	P	46.7	Very low	42.7	Very low	122 Å²	122	126.1 Å²	126.1	79%	0.792	79%	0.793	S	S	*	*			trans	-104.2	152.6	-175.5	39.1	-34.2	0	0	0	115.4
441	I	47.1	Very low	42.5	Very low	169 Å²	169	130.2 Å²	130.2	87%	0.867	80%	0.796	S	S	*	*			trans	-140.4	127.2	169.5	-66.3	-174.8	0	0	0	112.9
442	A	41.9	Very low	42	Very low	90 Å²	90	131.4 Å²	131.4	74%	0.744	80%	0.796	S	S	*	*			trans	30.6	131.5	150.8	0	0	0	0	0	125.1
443	A	44.7	Very low	41.6	Very low	98 Å²	98	130.4 Å²	130.4	81%	0.81	79%	0.794	S	S	*	*			trans	83.7	152.8	133.4	0	0	0	0	0	120.9
444	P	43.9	Very low	41.3	Very low	120 Å²	120	130.3 Å²	130.3	78%	0.779	79%	0.793	S	S	*	*			trans	-120.4	162.3	-157.8	41.3	-28.8	0	0	0	115.9
445	T	39.7	Very low	40.8	Very low	133 Å²	133	130.8 Å²	130.8	82%	0.816	80%	0.796	S	S	*	*			trans	-157.3	140.2	149	-79.9	0	0	0	0	111.6
446	L	35.3	Very low	40.5	Very low	163 Å²	163	133.5 Å²	133.5	85%	0.853	80%	0.801	S	S	*	*			trans	-11.5	127.7	167.8	-54.7	169.1	0	0	0	118.6
447	S	37.6	Very low	40.1	Very low	122 Å²	122	130.9 Å²	130.9	85%	0.853	80%	0.8	S	S	*	*				-166.3	151	127.1	30.4	0	0	0	0	114.4
448	I	34.9	Very low	39.8	Very low	162 Å²	162	132.6 Å²	132.6	83%	0.831	79%	0.794	S	S	*	*			trans	-40.8	132.9	175.3	-61.2	151.3	0	0	0	114.2
449	N	35	Very low	39.3	Very low	144 Å²	144	135.1 Å²	135.1	77%	0.77	80%	0.795	S	S	*	*			trans	-158.3	158.3	139.4	-128.8	-24.6	0	0	0	115.6
450	T	33.5	Very low	38.9	Very low	115 Å²	115	138.5 Å²	138.5	71%	0.706	79%	0.792	S	S	*	*			trans	-74.9	132.8	-171.5	-58.2	0	0	0	0	114.4
451	Y	36.2	Very low	38.9	Very low	218 Å²	218	138.3 Å²	138.3	86%	0.855	79%	0.791	S	S	*	*			trans	-130.5	107.4	154.6	-66.5	-92	0	0	0	106
452	N	37.5	Very low	38.3	Very low	140 Å²	140	138.5 Å²	138.5	75%	0.749	79%	0.788	S	S	*	*				65.3	128.9	63.2	-159.9	18.6	0	0	0	112.9
453	S	35.3	Very low	38	Very low	110 Å²	110	142.5 Å²	142.5	77%	0.769	79%	0.793	S	S	*	*			trans	-85.6	132.7	-163.8	-56.6	0	0	0	0	112.9
454	S	35.4	Very low	37.6	Very low	105 Å²	105	144.5 Å²	144.5	73%	0.734	79%	0.786	S	S	*	*			trans	-113.5	109.8	170.6	-66.9	0	0	0	0	110.6
455	P	44.4	Very low	37.1	Very low	119 Å²	119	148.2 Å²	148.2	77%	0.773	79%	0.793	S	S	*	*			trans	-75.8	132.9	168.4	31	-31.8	0	0	0	110	A457	P455-A457 PolarHBondContact O-N 3.34Å
456	W	36	Very low	36.8	Very low	244 Å²	244	150 Å²	150	92%	0.924	79%	0.789	S	S	*	*			trans	-75.5	87.5	173.5	-62.1	-56.3	0	0	0	110.8	V458	W456-V458 PolarHBondContact O-N 3Å
457	A	36.3	Very low	36.7	Very low	86 Å²	86	149.5 Å²	149.5	71%	0.711	79%	0.787	S	S	*	*			trans	-68.4	109.8	166.4	0	0	0	0	0	109.5	P455 T459	P455-A457 PolarHBondContact O-N 3.34Å; A457-T459 PolarHBondContact O-N 3.48Å
458	V	38.3	Very low	36.7	Very low	121 Å²	121	152.9 Å²	152.9	73%	0.733	79%	0.787	S	S	*	*			trans	-78.7	98.7	172	177.8	0	0	0	0	108.4	W456 Y460	W456-V458 PolarHBondContact O-N 3Å; V458-Y460 PolarHBondContact O-N 3.15Å
459	T	35.6	Very low	36.8	Very low	124 Å²	124	150.2 Å²	150.2	76%	0.761	78%	0.782	S	S	*	*			trans	-68.9	111.5	175.1	-57	0	0	0	0	110.3	A457	A457-T459 PolarHBondContact O-N 3.48Å
460	Y	40.9	Very low	36.7	Very low	204 Å²	204	150.8 Å²	150.8	80%	0.8	78%	0.784	S	S	*	*			trans	-66.3	136.1	166	-74	-90.1	0	0	0	110	V458 Q462	V458-Y460 PolarHBondContact O-N 3.15Å; Y460-Q462 PolarHBondContact O-N 3.05Å; Y460-Q462 VanDerWaalsContact O-N 3.16Å
461	P	47.2	Very low	36.8	Very low	118 Å²	118	151.9 Å²	151.9	77%	0.766	78%	0.784	S	S	*	*			trans	-69.4	113.2	175.2	27.9	-32.9	0	0	0	110.1	M463	P461-M463 PolarHBondContact O-N 2.93Å; P461-M463 VanDerWaalsContact O-N 3.17Å
462	Q	34.5	Very low	36.6	Very low	173 Å²	173	149.7 Å²	149.7	81%	0.808	78%	0.782	S	S	*	*			trans	-62	114.9	171.6	-176.2	-177.5	13.5	0	0	109.4	Y460 Q464	Y460-Q462 PolarHBondContact O-N 3.05Å; Y460-Q462 VanDerWaalsContact O-N 3.16Å; Q462-Q464 PolarHBondContact O-N 3.14Å
463	M	35.7	Very low	36.6	Very low	173 Å²	173	153.4 Å²	153.4	85%	0.852	79%	0.787	S	S	*	*			trans	-66.2	104	172.8	-80.9	-92.8	71	0	0	109.7	P461 Q465	P461-M463 PolarHBondContact O-N 2.93Å; P461-M463 VanDerWaalsContact O-N 3.17Å; M463-Q465 PolarHBondContact O-N 3.43Å
464	Q	35.9	Very low	36.5	Very low	141 Å²	141	154.6 Å²	154.6	66%	0.659	79%	0.785	S	S	*	*			trans	-65.9	119.7	170.3	-75.4	-173.9	-23.3	0	0	109.6	Q462 F466	Q462-Q464 PolarHBondContact O-N 3.14Å; Q464-F466 VanDerWaalsContact C-N 3.27Å; Q464-F466 HydrophobicContact CB-CD2 4.19Å; Q464-F466 HydrophobicContact CB-CE2 4.25Å; Q464-F466 PolarHBondContact O-N 2.72Å
465	Q	33.9	Very low	36.6	Very low	197 Å²	197	154.7 Å²	154.7	92%	0.921	79%	0.785	S	S	*	*			trans	-75.7	75.7	-175.1	-165.8	172.4	7.3	0	0	110.6	M463 N467	M463-Q465 PolarHBondContact O-N 3.43Å; Q465-N467 PolarHBondContact O-N 2.74Å
466	F	33.9	Very low	36.3	Very low	171 Å²	171	155.5 Å²	155.5	75%	0.75	78%	0.783	S	S	*	*			trans	-66.5	99.8	-179.9	-98.9	-83.8	0	0	0	111.5	Q464 K468	Q464-F466 VanDerWaalsContact C-N 3.27Å; Q464-F466 HydrophobicContact CB-CD2 4.19Å; Q464-F466 HydrophobicContact CB-CE2 4.25Å; Q464-F466 PolarHBondContact O-N 2.72Å; F466-K468 PolarHBondContact O-N 2.77Å
467	N	33.4	Very low	36.4	Very low	152 Å²	152	151.3 Å²	151.3	81%	0.813	78%	0.778	S	S	*	*			trans	-62.2	100.9	173.8	-173.1	1.1	0	0	0	110.2	Q465 S469	Q465-N467 PolarHBondContact O-N 2.74Å; N467-S469 PolarHBondContact O-N 3.05Å
468	K	36.4	Very low	36.6	Very low	194 Å²	194	152.8 Å²	152.8	84%	0.843	78%	0.78	S	S	*	*			trans	-83.6	103.1	177	-81.4	-161.9	172.1	-171	0	110.8	F466	F466-K468 PolarHBondContact O-N 2.77Å
469	S	38.6	Very low	36.6	Very low	105 Å²	105	151.9 Å²	151.9	73%	0.734	78%	0.779	S	S	*	*			trans	-62.2	149.9	165	47.5	0	0	0	0	111.9	N467	N467-S469 PolarHBondContact O-N 3.05Å
470	I	32.2	Very low	36.7	Very low	156 Å²	156	151 Å²	151	80%	0.8	78%	0.778	S	S	*	*			trans	-71.5	128.6	-178.2	-65.1	160.5	0	0	0	110.3
471	I	36.2	Very low	36.8	Very low	138 Å²	138	147.4 Å²	147.4	71%	0.708	78%	0.78	S	S	*	*			trans	-133.5	127.2	153.4	-62.9	-175.6	0	0	0	108	Y473	I471-Y473 HydrophobicContact CG2-CD2 4.04Å; I471-Y473 HydrophobicContact CG2-CE2 3.71Å
472	Q	31.1	Very low	36.4	Very low	172 Å²	172	148.3 Å²	148.3	80%	0.804	78%	0.783	S	S	*	*			trans	-79	140.5	174.2	-59.9	162.3	-91	0	0	110.2
473	Y	36.6	Very low	36.7	Very low	219 Å²	219	143.9 Å²	143.9	86%	0.859	78%	0.784	S	S	*	*			trans	-134.9	144.2	151.8	-86.9	-72.5	0	0	0	110.9	I471	I471-Y473 HydrophobicContact CG2-CD2 4.04Å; I471-Y473 HydrophobicContact CG2-CE2 3.71Å
474	N	34.6	Very low	36.6	Very low	135 Å²	135	141.3 Å²	141.3	72%	0.722	78%	0.778	S	S	*	*			trans	-96.5	145.1	-165.2	-177.5	41.6	0	0	0	112	N476	N474-N476 PolarHBondContact ND2-OD1 2.81Å
475	S	37.4	Very low	36.8	Very low	106 Å²	106	142.9 Å²	142.9	74%	0.741	79%	0.788	S	S	*	*			trans	-131.3	105.2	175.5	56.5	0	0	0	0	110.8
476	N	36.9	Very low	36.8	Very low	137 Å²	137	140.4 Å²	140.4	73%	0.733	78%	0.781	S	S	*	*			trans	-82.9	138	178.4	-71.3	-9.2	0	0	0	111.7	N474	N474-N476 PolarHBondContact ND2-OD1 2.81Å
477	L	39.1	Very low	36.9	Very low	155 Å²	155	138.3 Å²	138.3	81%	0.812	79%	0.787	S	S	*	*			trans	-76.7	159.8	163.6	-100	68.2	0	0	0	111.4
478	P	40.8	Very low	36.8	Very low	117 Å²	117	139.9 Å²	139.9	76%	0.76	79%	0.79	S	S	*	*				-131.5	124.1	105.8	7	15.2	0	0	0	111.8
479	S	38.2	Very low	36.9	Very low	103 Å²	103	137.2 Å²	137.2	72%	0.72	79%	0.79	S	S	*	*				83.1	123.8	78.2	75.7	0	0	0	0	115
480	S	36.6	Very low	36.6	Very low	105 Å²	105	139 Å²	139	73%	0.734	79%	0.791	S	S	*	*			trans	-84.8	-178	178.2	54.7	0	0	0	0	113.5
481	P	44.2	Very low	36.6	Very low	129 Å²	129	138.5 Å²	138.5	84%	0.838	79%	0.789	S	S	*	*				-141.2	176.2	109.9	38.9	-26.3	0	0	0	116
482	T	37.3	Very low	36.5	Very low	136 Å²	136	137.6 Å²	137.6	83%	0.834	79%	0.79	S	S	*	*			trans	-90.3	160.7	-171.7	47	0	0	0	0	115.6
483	G	41.5	Very low	36.7	Very low	80 Å²	80	139.9 Å²	139.9	83%	0.825	79%	0.793	S	S	*	*			trans	-157.7	122.8	162	0	0	0	0	0	112.6
484	T	34.1	Very low	37.2	Very low	120 Å²	120	134.6 Å²	134.6	74%	0.736	79%	0.786	S	S	*	*			trans	-123.9	142.3	-172.5	-42.6	0	0	0	0	110.6
485	M	39.8	Very low	37.5	Very low	174 Å²	174	133 Å²	133	86%	0.857	79%	0.785	S	S	*	*			trans	-169.4	151.2	143.7	-103.7	-43.8	111.1	0	0	114.4
486	N	33.4	Very low	37.6	Very low	145 Å²	145	135.5 Å²	135.5	78%	0.775	79%	0.79	S	S	*	*			trans	-78.4	159.2	177.7	-73.5	-33	0	0	0	113.6
487	S	36.4	Very low	37.7	Very low	126 Å²	126	132.1 Å²	132.1	88%	0.881	79%	0.787	S	S	*	*				169.2	163	109.4	-73.9	0	0	0	0	114.9
488	Q	31.6	Very low	37.8	Very low	185 Å²	185	130.8 Å²	130.8	86%	0.864	79%	0.786	S	S	*	*			trans	-86.2	147.7	-173.8	-56.9	158.3	-44.3	0	0	113.9
489	T	38.9	Very low	37.7	Very low	139 Å²	139	132.6 Å²	132.6	85%	0.853	79%	0.788	S	S	*	*				173.5	135.4	128	34.5	0	0	0	0	107.9
490	N	31.2	Very low	37.7	Very low	142 Å²	142	137.9 Å²	137.9	76%	0.759	80%	0.798	S	S	*	*			cis	105.5	136.6	23.5	-157.8	18.7	0	0	0	113
491	L	31.8	Very low	37.6	Very low	146 Å²	146	138.8 Å²	138.8	76%	0.764	80%	0.804	S	S	*	*			trans	68.6	151.6	-178.2	-84.2	64.1	0	0	0	116.7
492	T	34.6	Very low	37.3	Very low	118 Å²	118	136.5 Å²	136.5	72%	0.724	80%	0.804	S	S	*	*			cis	-153.7	163.2	4.6	-108.2	0	0	0	0	113.3
493	Y	36.4	Very low	37.3	Very low	221 Å²	221	134.8 Å²	134.8	87%	0.867	80%	0.798	S	S	*	*			trans	-84.6	-153	176.4	-72.7	-92.1	0	0	0	112.4
494	P	46.8	Very low	37.2	Very low	108 Å²	108	136.5 Å²	136.5	70%	0.701	79%	0.792	S	S	*	*			cis	-146.2	168.2	-5.6	45.5	-25.6	0	0	0	120.8
495	S	39.8	Very low	37.4	Very low	100 Å²	100	138.1 Å²	138.1	70%	0.699	80%	0.797	S	S	*	*			trans	45.1	126.9	138	69.6	0	0	0	0	125.8
496	N	39.4	Very low	37.6	Very low	159 Å²	159	135.7 Å²	135.7	85%	0.85	79%	0.794	S	S	*	*				-168.8	169.2	119	-106.3	-76.4	0	0	0	108.7
497	G	39.6	Very low	37.7	Very low	66 Å²	66	139.7 Å²	139.7	68%	0.68	80%	0.798	S	S	*	*			cis	155.1	146.8	-5.1	0	0	0	0	0	109.9
498	V	41.9	Very low	37.6	Very low	128 Å²	128	139.2 Å²	139.2	78%	0.776	80%	0.795	S	S	*	*			cis	-154.5	149.8	-2.8	149.9	0	0	0	0	110.4
499	L	37.8	Very low	38.2	Very low	154 Å²	154	134.8 Å²	134.8	81%	0.806	78%	0.784	S	S	*	*			trans	1.1	135.2	163.8	-56.5	170.2	0	0	0	122.7
500	K	39.1	Very low	38.2	Very low	215 Å²	215	132.7 Å²	132.7	94%	0.935	78%	0.775	S	S	*	*				-174.3	167.8	107.9	-102.7	173.3	-178.2	178.4	0	113.7
501	S	34	Very low	38.7	Very low	123 Å²	123	135 Å²	135	86%	0.86	78%	0.784	S	S	*	*			trans	-116	159.2	-172.8	53.7	0	0	0	0	113.3
502	G	37.4	Very low	39	Very low	81 Å²	81	131.3 Å²	131.3	84%	0.835	78%	0.781	S	S	*	*			trans	175.3	115	174.5	0	0	0	0	0	116.6
503	S	37.4	Very low	39.2	Very low	100 Å²	100	133.9 Å²	133.9	70%	0.699	79%	0.789	S	S	*	*			trans	-41	147.8	174.3	-167	0	0	0	0	119.8
504	T	39.4	Very low	39.4	Very low	117 Å²	117	128.7 Å²	128.7	72%	0.718	78%	0.78	S	S	*	*			trans	59.8	127	143.5	46.8	0	0	0	0	123.4
505	N	39.7	Very low	39	Very low	154 Å²	154	134.2 Å²	134.2	82%	0.824	79%	0.789	S	S	*	*			trans	4.6	159.9	137.4	-54.3	-0.3	0	0	0	121
506	P	43.1	Very low	39	Very low	123 Å²	123	133.1 Å²	133.1	80%	0.799	79%	0.794	S	S	*	*			cis	-127.4	-168.9	-5.3	39.1	-22.1	0	0	0	113.1
507	W	36.5	Very low	39	Very low	229 Å²	229	136.6 Å²	136.6	87%	0.867	80%	0.795	S	S	*	*			trans	-134.1	122.2	161.7	-153.1	-57.4	0	0	0	112.5	S509	W507-S509 PolarHBondContact NE1-OG 2.81Å
508	S	33.3	Very low	39	Very low	116 Å²	116	140.5 Å²	140.5	81%	0.811	80%	0.8	S	S	*	*			trans	-133.4	138.6	163.3	-77.1	0	0	0	0	108.8
509	S	44.7	Very low	39	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	80%	0.795	S	S	*	*			trans	-165.1	148.7	176.8	-69.1	0	0	0	0	109.1	W507	W507-S509 PolarHBondContact NE1-OG 2.81Å
510	S	39.1	Very low	39.1	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	79%	0.793	S	S	*	*			cis	-174.9	178.1	-23.5	50.3	0	0	0	0	106.4
511	M	40.3	Very low	38.8	Very low	190 Å²	190	134.9 Å²	134.9	94%	0.936	79%	0.789	S	S	*	*			trans	71.5	130.7	-176.2	-40.5	-77	-163.8	0	0	114.7
512	G	38.9	Very low	39.2	Very low	69 Å²	69	136.1 Å²	136.1	71%	0.711	79%	0.792	S	S	*	*			cis	173.8	160	-11.8	0	0	0	0	0	115
513	L	39	Very low	39	Very low	171 Å²	171	137.9 Å²	137.9	90%	0.895	78%	0.782	S	S	*	*			trans	75.2	122.7	156	-68.2	167.7	0	0	0	122.1
514	V	40.7	Very low	38.8	Very low	112 Å²	112	142.5 Å²	142.5	68%	0.679	78%	0.784	S	S	*	*			trans	96.2	110.7	134	165.9	0	0	0	0	120.7
515	Y	38.2	Very low	38.5	Very low	225 Å²	225	145.2 Å²	145.2	88%	0.882	79%	0.789	S	S	*	*			trans	34	131	146.9	-62.3	-112.6	0	0	0	119.2
516	G	40	Very low	38.1	Very low	77 Å²	77	142.5 Å²	142.5	79%	0.794	79%	0.787	S	S	*	*			cis	170.4	-158	9.5	0	0	0	0	0	109.6
517	R	39	Very low	38	Very low	232 Å²	232	142.3 Å²	142.3	88%	0.875	79%	0.789	S	S	*	*			cis	-170.1	93.3	-7.6	176.3	-147.3	169.1	-145.2	-0.9	111.8
518	N	39	Very low	38	Very low	147 Å²	147	136.9 Å²	136.9	79%	0.786	79%	0.786	S	S	*	*			trans	65.1	157.2	147.3	-123.2	-3.6	0	0	0	118.8
519	V	42.8	Very low	38.7	Very low	111 Å²	111	136.8 Å²	136.8	67%	0.673	78%	0.783	S	S	*	*			cis	-152.2	160.3	12.7	-152.5	0	0	0	0	112.1
520	S	39.2	Very low	38.4	Very low	109 Å²	109	137.8 Å²	137.8	76%	0.762	79%	0.79	S	S	*	*			trans	70	130.9	142.7	54.5	0	0	0	0	124.3
521	N	33.9	Very low	38.5	Very low	159 Å²	159	138 Å²	138	85%	0.85	79%	0.792	S	S	*	*			trans	-73.7	162.9	161.8	-59.7	-33.6	0	0	0	113.3
522	T	41.8	Very low	38.7	Very low	150 Å²	150	137.1 Å²	137.1	92%	0.92	79%	0.79	S	S	*	*			trans	-145.4	159.6	133.3	4.7	0	0	0	0	111.6
523	N	32.9	Very low	38.8	Very low	118 Å²	118	139 Å²	139	63%	0.631	79%	0.789	S	S	*	*			trans	-103.7	167.5	-177.7	-177	26.8	0	0	0	110.8
524	W	32.4	Very low	39	Very low	196 Å²	196	136.3 Å²	136.3	74%	0.742	78%	0.782	S	S	*	*			trans	139.2	116.8	134.8	-75.6	110.5	0	0	0	117.3
525	Q	33.2	Very low	39.1	Very low	175 Å²	175	137.5 Å²	137.5	82%	0.818	79%	0.79	S	S	*	*			trans	69.3	161.2	141.1	-104.3	164.2	-34.2	0	0	120.8
526	A	31.9	Very low	39.1	Very low	96 Å²	96	134.7 Å²	134.7	79%	0.793	79%	0.789	S	S	*	*			trans	-129.8	149.3	-167.8	0	0	0	0	0	111.7
527	S	41.6	Very low	39.2	Very low	120 Å²	120	138.8 Å²	138.8	84%	0.839	79%	0.792	S	S	*	*			trans	-150.7	133.6	164.4	44.6	0	0	0	0	110.9
528	S	35.7	Very low	40.1	Very low	114 Å²	114	133 Å²	133	80%	0.797	79%	0.785	S	S	*	*			trans	-109	-177	171.6	-52	0	0	0	0	107.5
529	P	47.5	Very low	40.6	Very low	114 Å²	114	131.9 Å²	131.9	74%	0.74	79%	0.785	S	S	*	*			cis	-146.1	-163	12.7	44.4	-23.5	0	0	0	116.5
530	S	39.8	Very low	40.9	Very low	112 Å²	112	135.4 Å²	135.4	78%	0.783	79%	0.794	S	S	*	*			trans	80.2	144.7	164.5	80.9	0	0	0	0	117
531	S	40.1	Very low	41.6	Very low	102 Å²	102	135.7 Å²	135.7	71%	0.713	79%	0.793	S	S	*	*			cis	-149.3	140.9	9.4	44.9	0	0	0	0	115.9
532	L	44.9	Very low	42.2	Very low	171 Å²	171	135.2 Å²	135.2	90%	0.895	79%	0.791	S	S	*	*			trans	70.2	155.2	151	-62.3	171.2	0	0	0	122.3
533	P	40.2	Very low	42.1	Very low	109 Å²	109	134.5 Å²	134.5	71%	0.708	79%	0.791	S	S	*	*			trans	-135.7	-178.4	-156.6	44.1	-25.8	0	0	0	116.9
534	P	43.4	Very low	42.7	Very low	114 Å²	114	136.9 Å²	136.9	74%	0.74	80%	0.802	S	S	*	*			trans	-127	124.5	135.9	35.3	-25	0	0	0	111.5
535	T	42.9	Very low	43.3	Very low	137 Å²	137	132.2 Å²	132.2	84%	0.84	80%	0.799	S	S	*	*				91.5	132.2	90.1	-56.3	0	0	0	0	112.9
536	L	39.4	Very low	44.4	Very low	166 Å²	166	128.5 Å²	128.5	87%	0.869	79%	0.785	S	S	*	*			trans	-81	145.3	-163.7	-69.8	143	0	0	0	114.5
537	L	42.2	Very low	45.9	Very low	163 Å²	163	128.4 Å²	128.4	85%	0.853	78%	0.776	S	S	*	*			trans	-120.4	146.9	154.1	-80	169.5	0	0	0	108.9
538	P	56.6	Low	46.5	Very low	111 Å²	111	131.2 Å²	131.2	72%	0.721	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-74.8	158.8	-177.2	31.5	-35.7	0	0	0	112.8
539	P	49.3	Very low	47.4	Very low	122 Å²	122	131.1 Å²	131.1	79%	0.792	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-70.1	157.6	177.7	30.7	-36.1	0	0	0	112.7
540	E	49.8	Very low	47.9	Very low	186 Å²	186	132.6 Å²	132.6	87%	0.869	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-64.1	141.7	172.6	-68.8	-163.9	124	0	0	111.8
541	P	54.2	Low	49.1	Very low	115 Å²	115	129.3 Å²	129.3	75%	0.747	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-79.7	140.1	168.9	32.8	-32.8	0	0	0	111.1
542	D	45.3	Very low	50	Low	149 Å²	149	132 Å²	132	80%	0.797	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-56.2	145.5	-179.1	-67.2	-76	0	0	0	113.8	L544	D542-L544 PolarHBondContact O-N 2.84Å
543	C	40.5	Very low	50.6	Low	135 Å²	135	127.9 Å²	127.9	91%	0.912	73%	0.726	S	S	*	*	S	Bend	trans	-77.5	51.1	-174.4	53.9	0	0	0	0	114.3
544	L	44.8	Very low	51.6	Low	167 Å²	167	128.4 Å²	128.4	87%	0.874	72%	0.722	S	S	*	*			trans	-143.2	48.1	-179.9	-156.7	72.3	0	0	0	113.6	D542	D542-L544 PolarHBondContact O-N 2.84Å
545	S	46.4	Very low	52.5	Low	98 Å²	98	133.3 Å²	133.3	69%	0.685	73%	0.726	S	S	*	*			trans	-95.5	129.3	173.3	-38	0	0	0	0	111.2
546	D	56.2	Low	53.2	Low	98 Å²	98	129.8 Å²	129.8	52%	0.524	71%	0.711	S	S	.	*			trans	-74.2	127.9	177.6	-168.5	-35.7	0	0	0	111	F548 D549	D546-F548 PolarHBondContact O-N 2.68Å; D546-F548 VanDerWaalsContact O-N 3.12Å; D546-F548 WeakPolarHBondContact OD1-CB 3.41Å; D546-F548 WeakPolarHBondContact OD1-CD2 3.4Å; D546-F548 PolarHBondContact OD1-N 3.46Å; D546-D549 PolarHBondContact O-N 2.78Å
547	P	64	Low	54.2	Low	93 Å²	93	127.1 Å²	127.1	60%	0.604	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-4.8	176.9	29.2	-37.1	0	0	0	114.9
548	F	54	Low	54.7	Low	180 Å²	180	123 Å²	123	79%	0.789	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	1.8	177	-60.5	-71.9	0	0	0	114.6	D546	D546-F548 PolarHBondContact O-N 2.68Å; D546-F548 VanDerWaalsContact O-N 3.12Å; D546-F548 WeakPolarHBondContact OD1-CB 3.41Å; D546-F548 WeakPolarHBondContact OD1-CD2 3.4Å; D546-F548 PolarHBondContact OD1-N 3.46Å
549	D	53.7	Low	54.1	Low	111 Å²	111	120.9 Å²	120.9	59%	0.594	69%	0.689	S	S	*	*			trans	-70.3	132.3	176.4	-163.1	-9.3	0	0	0	111.2	D546 G551 W552	D546-D549 PolarHBondContact O-N 2.78Å; D549-G551 PolarHBondContact O-N 2.73Å; D549-W552 WeakPolarHBondContact O-CB 3.37Å; D549-W552 PolarHBondContact O-N 2.95Å
550	L	57.9	Low	53.6	Low	145 Å²	145	121.6 Å²	121.6	76%	0.759	69%	0.691	S	S	*	*	H	α-helix	trans	-61	-34	-170.8	-74.3	165.2	0	0	0	112.2	W552 V553	L550-W552 PolarHBondContact O-N 3.05Å; L550-W552 VanDerWaalsContact O-N 3.16Å; L550-V553 PolarHBondContact O-N 2.78Å
551	G	66.1	Low	53	Low	43 Å²	43	118 Å²	118	44%	0.443	69%	0.687	S	S	.	*	H	α-helix	trans	-64.7	-14.4	176.1	0	0	0	0	0	114.6	D549 R555	D549-G551 PolarHBondContact O-N 2.73Å; G551-R555 VanDerWaalsContact O-CB 3.29Å; G551-R555 WeakPolarHBondContact O-CB 3.18Å; G551-R555 PolarHBondContact O-N 3.26Å
552	W	58.3	Low	52	Low	158 Å²	158	120.2 Å²	120.2	60%	0.598	69%	0.693	S	S	*	*	H	α-helix	trans	-72.1	-37.9	174.5	-167.2	90	0	0	0	111.9	D549 L550 R555 A556	D549-W552 WeakPolarHBondContact O-CB 3.37Å; D549-W552 PolarHBondContact O-N 2.95Å; L550-W552 PolarHBondContact O-N 3.05Å; L550-W552 VanDerWaalsContact O-N 3.16Å; W552-R555 PolarHBondContact O-N 2.85Å; W552-A556 HydrophobicContact CE3-CB 4.34Å; W552-A556 HydrophobicContact CZ3-CB 4.29Å; W552-A556 WeakPolarHBondContact O-CB 3.35Å; W552-A556 PolarHBondContact O-N 3.15Å
553	V	57.9	Low	51.7	Low	85 Å²	85	120.3 Å²	120.3	52%	0.515	70%	0.699	S	S	.	*	H	α-helix	trans	-66.6	-47	179.5	175	0	0	0	0	110.8	L550 R555 A556 T557	L550-V553 PolarHBondContact O-N 2.78Å; V553-R555 PolarHBondContact O-N 3.09Å; V553-A556 PolarHBondContact O-N 2.68Å; V553-T557 WeakPolarHBondContact O-CB 3.45Å; V553-T557 PolarHBondContact O-N 2.74Å; V553-T557 PolarHBondContact O-OG1 3.06Å
554	D	60.3	Low	51.5	Low	120 Å²	120	119.1 Å²	119.1	64%	0.642	69%	0.692	S	S	*	*	H	α-helix	trans	-62.7	-43.2	177.3	-72.6	-28.4	0	0	0	111.1	A556 T557 A558	D554-A556 PolarHBondContact O-N 3.44Å; D554-T557 PolarHBondContact O-N 3.15Å; D554-A558 VanDerWaalsContact O-CB 3.23Å; D554-A558 WeakPolarHBondContact O-CB 3.46Å; D554-A558 PolarHBondContact O-N 3.21Å
555	R	62.2	Low	51.3	Low	217 Å²	217	117.1 Å²	117.1	82%	0.819	69%	0.692	S	S	*	*	H	α-helix	trans	-70.1	-30.9	179.1	-168.7	170.6	-67.1	179.5	1.2	113.5	G551 W552 V553 T557	G551-R555 VanDerWaalsContact O-CB 3.29Å; G551-R555 WeakPolarHBondContact O-CB 3.18Å; G551-R555 PolarHBondContact O-N 3.26Å; W552-R555 PolarHBondContact O-N 2.85Å; V553-R555 PolarHBondContact O-N 3.09Å; R555-T557 VanDerWaalsContact C-N 3.33Å
556	A	58.3	Low	50.8	Low	64 Å²	64	115.8 Å²	115.8	53%	0.529	69%	0.694	S	S	.	*	H	α-helix	trans	-72.8	-26.3	172.2	0	0	0	0	0	112.6	W552 V553 D554	W552-A556 HydrophobicContact CE3-CB 4.34Å; W552-A556 HydrophobicContact CZ3-CB 4.29Å; W552-A556 WeakPolarHBondContact O-CB 3.35Å; W552-A556 PolarHBondContact O-N 3.15Å; V553-A556 PolarHBondContact O-N 2.68Å; D554-A556 PolarHBondContact O-N 3.44Å
557	T	60	Low	49.9	Very low	110 Å²	110	120.6 Å²	120.6	68%	0.675	71%	0.713	S	S	*	*	H	α-helix	trans	-94.6	-29.3	-176.6	-48.4	0	0	0	0	112.8	V553 D554 R555 G559	V553-T557 WeakPolarHBondContact O-CB 3.45Å; V553-T557 PolarHBondContact O-N 2.74Å; V553-T557 PolarHBondContact O-OG1 3.06Å; D554-T557 PolarHBondContact O-N 3.15Å; R555-T557 VanDerWaalsContact C-N 3.33Å; T557-G559 PolarHBondContact O-N 3.48Å
558	A	53	Low	48.5	Very low	76 Å²	76	119.6 Å²	119.6	63%	0.628	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	10.2	-179.4	0	0	0	0	0	115.4	D554 V560	D554-A558 VanDerWaalsContact O-CB 3.23Å; D554-A558 WeakPolarHBondContact O-CB 3.46Å; D554-A558 PolarHBondContact O-N 3.21Å; A558-V560 VanDerWaalsContact C-N 3.29Å; A558-V560 PolarHBondContact O-N 3.33Å
559	G	43.3	Very low	47.9	Very low	66 Å²	66	119.2 Å²	119.2	68%	0.68	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-1.8	-174	0	0	0	0	0	116.7	T557	T557-G559 PolarHBondContact O-N 3.48Å
560	V	39.7	Very low	47.5	Very low	137 Å²	137	118.7 Å²	118.7	83%	0.83	73%	0.729	S	S	*	*	S	Bend	trans	-144.7	80.6	-174.8	-167.5	0	0	0	0	113.1	A558	A558-V560 VanDerWaalsContact C-N 3.29Å; A558-V560 PolarHBondContact O-N 3.33Å
561	S	37.4	Very low	46.6	Very low	112 Å²	112	119.7 Å²	119.7	78%	0.783	74%	0.735	S	S	*	*			trans	-163.5	142.7	156.4	37.9	0	0	0	0	114.5
562	N	33.2	Very low	45.7	Very low	161 Å²	161	122.6 Å²	122.6	86%	0.861	75%	0.746	S	S	*	*			trans	-44.1	139.8	-173.1	-56.4	-20.4	0	0	0	118.2
563	T	37.7	Very low	44.8	Very low	151 Å²	151	124.6 Å²	124.6	93%	0.926	76%	0.759	S	S	*	*				-139	160.4	125.3	47	0	0	0	0	110
564	S	38.1	Very low	43.9	Very low	109 Å²	109	128.9 Å²	128.9	76%	0.762	78%	0.779	S	S	*	*			trans	-112	139.7	-163.7	55.2	0	0	0	0	114.4
565	S	39.4	Very low	42.9	Very low	125 Å²	125	130.8 Å²	130.8	87%	0.874	79%	0.787	S	S	*	*				167.7	149.4	125.2	48.6	0	0	0	0	113.9
566	G	36.1	Very low	42	Very low	71 Å²	71	124.8 Å²	124.8	73%	0.732	78%	0.784	S	S	*	*			trans	86.9	115.6	151.7	0	0	0	0	0	118.8
567	Q	36.5	Very low	41.2	Very low	199 Å²	199	129.3 Å²	129.3	93%	0.93	80%	0.799	S	S	*	*			trans	35.8	110.3	147.2	-62.2	173.6	-26.8	0	0	117.6
568	G	35.9	Very low	40.3	Very low	71 Å²	71	127 Å²	127	73%	0.732	80%	0.797	S	S	*	*				88	107.9	75.4	0	0	0	0	0	110.3
569	I	40.9	Very low	39.8	Very low	172 Å²	172	129.3 Å²	129.3	88%	0.882	81%	0.809	S	S	*	*				-155.6	164	89.4	-85.1	150.5	0	0	0	110.6
570	S	45	Very low	40	Very low	101 Å²	101	129.7 Å²	129.7	71%	0.706	81%	0.813	S	S	*	*			trans	-62	142.1	-168.8	55.3	0	0	0	0	118.3
571	N	38.6	Very low	40.4	Very low	165 Å²	165	130.7 Å²	130.7	88%	0.882	81%	0.813	S	S	*	*			trans	-106.7	133.4	147.1	-85.9	-30.6	0	0	0	109.5
572	P	48.7	Very low	40.8	Very low	105 Å²	105	133.2 Å²	133.2	68%	0.682	82%	0.818	S	S	*	*			trans	-93.3	166.4	173	35.7	-33.2	0	0	0	113.4
573	F	38.4	Very low	41.4	Very low	200 Å²	200	133 Å²	133	88%	0.877	82%	0.815	S	S	*	*			trans	75.9	74.7	177.3	-71.7	-85	0	0	0	118.5
574	L	38.6	Very low	42.3	Very low	175 Å²	175	131 Å²	131	92%	0.916	81%	0.805	S	S	*	*				179	106.9	114	-97.1	166.9	0	0	0	110.1
575	I	38.9	Very low	42.7	Very low	159 Å²	159	133.1 Å²	133.1	82%	0.815	81%	0.807	S	S	*	*			trans	-136.8	131	165.2	-63.5	-178.4	0	0	0	107.8
576	A	44.1	Very low	43.3	Very low	92 Å²	92	131.3 Å²	131.3	76%	0.76	80%	0.795	S	S	*	*			trans	-111.3	134.8	164.2	0	0	0	0	0	108.6
577	N	42	Very low	43.9	Very low	159 Å²	159	135.1 Å²	135.1	85%	0.85	80%	0.799	S	S	*	*			trans	-159.9	152.4	164.2	-86	-33.7	0	0	0	105.6
578	G	41.5	Very low	44.6	Very low	60 Å²	60	129.1 Å²	129.1	62%	0.619	78%	0.783	S	S	*	*			cis	136.6	83.7	4.3	0	0	0	0	0	110
579	S	42.1	Very low	45.4	Very low	126 Å²	126	131.5 Å²	131.5	88%	0.881	79%	0.788	S	S	*	*			trans	33.8	115.6	162.5	56.1	0	0	0	0	119.4
580	G	48.2	Very low	45.9	Very low	74 Å²	74	128.1 Å²	128.1	76%	0.763	78%	0.78	S	S	*	*			trans	-161	133.1	162.1	0	0	0	0	0	110
581	D	46.6	Very low	46.5	Very low	157 Å²	157	129.7 Å²	129.7	84%	0.84	79%	0.785	S	S	*	*			trans	-94.4	-171.8	-168.8	-68.4	-80.2	0	0	0	113.9
582	D	46.3	Very low	47.2	Very low	165 Å²	165	133.8 Å²	133.8	88%	0.882	80%	0.798	S	S	*	*			trans	92.9	137.1	163	-68.6	-46.1	0	0	0	121.1
583	I	45.9	Very low	47.2	Very low	157 Å²	157	135.2 Å²	135.2	81%	0.805	80%	0.804	S	S	*	*			trans	-131.2	136.8	-164.5	-71.1	170.6	0	0	0	104.8
584	P	55.4	Low	47.6	Very low	110 Å²	110	131.8 Å²	131.8	71%	0.714	80%	0.8	S	S	*	*				-158.9	162.8	99.6	40	-20.2	0	0	0	119.2
585	N	47.7	Very low	48.1	Very low	152 Å²	152	129.4 Å²	129.4	81%	0.813	79%	0.794	S	S	*	*			trans	69.7	141.8	148.3	-88.3	-24.1	0	0	0	118.5
586	S	51.6	Low	48.7	Very low	88 Å²	88	127.6 Å²	127.6	62%	0.615	79%	0.793	S	S	*	*			cis	-159.9	160.8	22.5	47.1	0	0	0	0	113.4
587	N	48.1	Very low	48.9	Very low	151 Å²	151	129.9 Å²	129.9	81%	0.807	80%	0.795	S	S	*	*			trans	63.1	150.4	152.9	-62.2	-15.7	0	0	0	120.1
588	A	51.1	Low	49.4	Very low	73 Å²	73	127.9 Å²	127.9	60%	0.603	79%	0.791	S	S	*	*			cis	-172.9	145.2	-26.6	0	0	0	0	0	108.7
589	S	52.9	Low	50	Low	120 Å²	120	132.8 Å²	132.8	84%	0.839	80%	0.803	S	S	*	*			trans	58.6	159	157.4	49.7	0	0	0	0	118.7
590	S	52.3	Low	50.6	Low	102 Å²	102	133.3 Å²	133.3	71%	0.713	80%	0.797	S	S	*	*			cis	-165.9	140.2	-23.8	170.6	0	0	0	0	108
591	V	57.9	Low	50.8	Low	133 Å²	133	138.3 Å²	138.3	81%	0.806	80%	0.8	S	S	*	*			trans	23.8	99.8	154.8	-172.3	0	0	0	0	117.5
592	H	53.3	Low	51.1	Low	251 Å²	251	136.5 Å²	136.5	100%	1.162	80%	0.796	S	S	*	*				-156.7	0	111.6	-152.2	-49.6	0	0	0	110.3

Retrieved 592 of 592 residues in 158.6 ms (Link to these results)

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