A0A087XYY6_POEFO Loading...

ATP synthase subunit beta

Catalytic subunit beta, of the mitochondrial membrane ATP synthase complex (F(1)F(0) ATP synthase or Complex V) that produces ATP from ADP in the presence of a proton gradient across the membrane which is generated by electron transport complexes of the respiratory chain. ATP synthase complex consist of a soluble F(1) head domain - the catalytic core - and a membrane F(1) domain - the membrane proton channel. These two domains are linked by a central stalk rotating inside the F(1) region and a stationary peripheral stalk. During catalysis, ATP synthesis in the catalytic domain of F(1) is coupled via a rotary mechanism of the central stalk subunits to proton translocation. In vivo, can only synthesize ATP although its ATP hydrolase activity can be activated artificially in vitro. With the subunit alpha (ATP5F1A), forms the catalytic core in the F(1) domain. Produces ATP from ADP in the presence of a proton gradient across the membrane.

AlphaFold DB , UniProt , Accession A0A087XYY6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 517 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.4	Very low	28.9	Very low	233 Å²	233	132.7 Å²	132.7	100%	1.148	83%	0.832	S	S	*	*				0	134.6	0	-74.3	175.2	166.6	0	0	107.8
2	L	31.2	Very low	28.8	Very low	172 Å²	172	130.3 Å²	130.3	90%	0.901	83%	0.834	S	S	*	*			trans	45.9	122.4	155.8	-60.4	147.5	0	0	0	117.2
3	G	27.1	Very low	28.9	Very low	73 Å²	73	133.4 Å²	133.4	75%	0.753	84%	0.838	S	S	*	*			cis	78.7	139.3	40.5	0	0	0	0	0	110.6
4	A	31.5	Very low	28.8	Very low	93 Å²	93	138.2 Å²	138.2	77%	0.769	85%	0.845	S	S	*	*			cis	-170.7	-164.4	-5.5	0	0	0	0	0	108.3
5	V	31.5	Very low	28.9	Very low	144 Å²	144	135.1 Å²	135.1	87%	0.873	84%	0.839	S	S	*	*			trans	79.9	130.5	166.9	-166.7	0	0	0	0	116.3
6	G	27.3	Very low	28.7	Very low	57 Å²	57	137.5 Å²	137.5	59%	0.588	84%	0.844	S	S	*	*			cis	127.2	138.9	-10.9	0	0	0	0	0	115.5
7	R	31	Very low	28.7	Very low	246 Å²	246	141.2 Å²	141.2	93%	0.928	85%	0.845	S	S	*	*			trans	77.4	148.8	178.7	-53.2	179.3	176.3	-168	-2.2	114.3
8	C	25.7	Very low	29.1	Very low	113 Å²	113	140.4 Å²	140.4	76%	0.764	84%	0.844	S	S	*	*			cis	-164.9	173.8	-10	-108.6	0	0	0	0	107.8
9	C	27.5	Very low	29.1	Very low	112 Å²	112	136.9 Å²	136.9	76%	0.757	84%	0.84	S	S	*	*			cis	-152.7	-166.4	9.5	-139.7	0	0	0	0	114.2
10	T	27.4	Very low	29	Very low	136 Å²	136	136.9 Å²	136.9	83%	0.834	84%	0.839	S	S	*	*			trans	-70	151.5	-178.5	49	0	0	0	0	118.7
11	G	25.3	Very low	28.9	Very low	81 Å²	81	139 Å²	139	84%	0.835	84%	0.84	S	S	*	*			trans	-161.5	141.3	161.7	0	0	0	0	0	110.9
12	A	28.1	Very low	28.7	Very low	104 Å²	104	133.7 Å²	133.7	86%	0.86	82%	0.822	S	S	*	*			trans	-95.6	162.6	-158.8	0	0	0	0	0	116.7
13	L	29.5	Very low	28.4	Very low	170 Å²	170	133.3 Å²	133.3	89%	0.89	82%	0.82	S	S	*	*			trans	-40.6	137.9	165.7	-72.6	133	0	0	0	114.6
14	Q	27.5	Very low	28.4	Very low	201 Å²	201	139.6 Å²	139.6	94%	0.939	83%	0.827	S	S	*	*				-158.7	159	128.1	-113.3	168.8	7.3	0	0	112.4
15	A	31.5	Very low	28.1	Very low	91 Å²	91	139.1 Å²	139.1	75%	0.752	82%	0.823	S	S	*	*			trans	-86.2	155.9	-165.8	0	0	0	0	0	113.7
16	L	25.8	Very low	28.1	Very low	174 Å²	174	140.8 Å²	140.8	91%	0.911	83%	0.826	S	S	*	*			trans	-172.7	117.8	140.4	-100.4	154.6	0	0	0	111.4
17	K	28	Very low	28	Very low	200 Å²	200	143.5 Å²	143.5	87%	0.87	83%	0.831	S	S	*	*			trans	-112.7	159.4	148.1	-88.8	-173.5	178	-179	0	105.6
18	P	35.8	Very low	27.8	Very low	127 Å²	127	135.5 Å²	135.5	83%	0.825	83%	0.825	S	S	*	*			cis	-135.9	-177	23.1	41.1	-23.7	0	0	0	115.1
19	G	29.5	Very low	27.8	Very low	74 Å²	74	134.4 Å²	134.4	76%	0.763	82%	0.819	S	S	*	*			trans	129.7	61.8	150.4	0	0	0	0	0	118.5
20	V	27.6	Very low	27.8	Very low	137 Å²	137	135.2 Å²	135.2	83%	0.83	82%	0.822	S	S	*	*			trans	-140.7	123.3	151.9	-175.3	0	0	0	0	108.4
21	Q	26.6	Very low	27.8	Very low	182 Å²	182	132.8 Å²	132.8	85%	0.85	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-76.4	127.2	166.2	-71.2	176	-20.2	0	0	108.4
22	P	27.4	Very low	28.3	Very low	120 Å²	120	135.2 Å²	135.2	78%	0.779	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70.1	135.4	169.2	29.6	-31.9	0	0	0	109.2	K24	P22-K24 PolarHBondContact O-N 2.62Å
23	L	25.2	Very low	28.7	Very low	164 Å²	164	136.7 Å²	136.7	86%	0.859	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-55.6	139.5	175.4	-75.5	92.4	0	0	0	110.5	A25	L23-A25 PolarHBondContact O-N 3.33Å
24	K	26	Very low	29.1	Very low	206 Å²	206	133 Å²	133	90%	0.896	80%	0.796	S	S	*	*			trans	-61.9	100.2	159.4	-84.4	-176.3	171.9	-178.1	0	108.1	P22 L26	P22-K24 PolarHBondContact O-N 2.62Å; K24-L26 PolarHBondContact O-N 2.62Å; K24-L26 VanDerWaalsContact O-N 3.16Å
25	A	27.2	Very low	29.9	Very low	83 Å²	83	133 Å²	133	69%	0.686	79%	0.787	S	S	*	*			trans	-66.2	110.9	167	0	0	0	0	0	108.6	L23 V27	L23-A25 PolarHBondContact O-N 3.33Å; A25-V27 VanDerWaalsContact C-N 3.3Å; A25-V27 HydrophobicContact CB-CG2 4.18Å; A25-V27 PolarHBondContact O-N 3.43Å
26	L	30.1	Very low	31.2	Very low	179 Å²	179	132 Å²	132	94%	0.937	76%	0.764	S	S	*	*			trans	-67.8	89.6	165.2	-83.9	154.9	0	0	0	108.3	K24	K24-L26 PolarHBondContact O-N 2.62Å; K24-L26 VanDerWaalsContact O-N 3.16Å
27	V	25.9	Very low	32.7	Very low	114 Å²	114	128 Å²	128	69%	0.691	74%	0.744	S	S	*	*			trans	-105.7	74.2	166.9	-171.8	0	0	0	0	108.1	A25 S29	A25-V27 VanDerWaalsContact C-N 3.3Å; A25-V27 HydrophobicContact CB-CG2 4.18Å; A25-V27 PolarHBondContact O-N 3.43Å; V27-S29 PolarHBondContact O-N 3.07Å
28	G	26.7	Very low	34.5	Very low	78 Å²	78	120.5 Å²	120.5	80%	0.804	71%	0.71	S	S	*	*			trans	-84	81.5	162.1	0	0	0	0	0	109.2
29	S	24.3	Very low	35.9	Very low	89 Å²	89	117.3 Å²	117.3	62%	0.622	69%	0.688	S	S	*	*			trans	-86.7	136	166.4	-66.5	0	0	0	0	109.2	V27 A31	V27-S29 PolarHBondContact O-N 3.07Å; S29-A31 PolarHBondContact O-N 3.31Å
30	P	29.3	Very low	36.8	Very low	129 Å²	129	116.7 Å²	116.7	84%	0.838	68%	0.676	S	S	*	*			trans	-78.5	70.1	179.8	33.3	-35.4	0	0	0	111	V32	P30-V32 PolarHBondContact O-N 3Å
31	A	26.8	Very low	37.8	Very low	85 Å²	85	114.8 Å²	114.8	70%	0.702	67%	0.666	S	S	*	*			trans	-90.9	72.1	172.4	0	0	0	0	0	109.9	S29	S29-A31 PolarHBondContact O-N 3.31Å
32	V	35	Very low	38.5	Very low	132 Å²	132	109.9 Å²	109.9	80%	0.8	66%	0.657	S	S	*	*			trans	-114.5	-8.7	-177.5	-175.7	0	0	0	0	112.7	P30	P30-V32 PolarHBondContact O-N 3Å
33	L	37.1	Very low	39	Very low	135 Å²	135	108.9 Å²	108.9	71%	0.707	66%	0.659	S	S	*	*	S	Bend	trans	-110	83.9	171.5	-68.1	168.7	0	0	0	109
34	S	37.6	Very low	39.7	Very low	93 Å²	93	104.9 Å²	104.9	65%	0.65	65%	0.65	S	S	*	*	S	Bend	trans	-162.6	-11.7	179.1	-172.4	0	0	0	0	117.5
35	R	44.7	Very low	40.5	Very low	202 Å²	202	98.2 Å²	98.2	76%	0.762	63%	0.633	S	S	*	*			trans	-136.4	141	-176.9	-71.1	-172.6	173.6	172.7	-1.5	112.9	D37	R35-D37 VanDerWaalsContact CB-OD1 3.27Å; R35-D37 WeakPolarHBondContact CB-OD1 3.08Å; R35-D37 PolarHBondContact O-N 2.6Å
36	R	58	Low	41.5	Very low	68 Å²	68	99.5 Å²	99.5	26%	0.257	64%	0.637	S	S	.	*			trans	-70.5	76.1	168.4	-64.9	-176.7	-173.8	138.1	9.9	108.3	Y38 A157 E158 E280 D284	R36-Y38 HydrophobicContact CB-CD2 4.42Å; R36-Y38 HydrophobicContact CB-CE2 3.76Å; R36-Y38 WeakPolarHBondContact O-CD2 3.44Å; R36-Y38 WeakPolarHBondContact O-CE2 3.19Å; R36-Y38 PolarHBondContact O-N 3.5Å; R36-Y38 VanDerWaalsContact O-N 3.07Å; R36-A157 HydrophobicContact CG-CB 4.21Å; R36-E158 PolarHBondContact NH2-O 3.39Å; R36-E280 IonicContact CZ-OE1 2.95Å; R36-E280 IonicContact NE-OE1 3.27Å; R36-E280 IonicContact NH1-OE1 3.98Å; R36-E280 IonicContact NH2-OE1 2.71Å; R36-E280 PolarHBondContact NH2-OE1 2.91Å; R36-D284 WeakPolarHBondContact CD-OD2 3.3Å; R36-D284 IonicContact CZ-OD2 2.86Å; R36-D284 IonicContact NE-OD2 3.22Å; R36-D284 IonicContact NH1-OD1 2.88Å; R36-D284 IonicContact NH1-OD2 3.67Å; R36-D284 PolarHBondContact NH1-OD2 3.04Å
37	D	57.9	Low	43.2	Very low	92 Å²	92	94.5 Å²	94.5	49%	0.492	61%	0.614	S	S	.	*			trans	-81.4	90.1	-176.4	-72.3	-22.2	0	0	0	110.1	R35 V39 R122	R35-D37 VanDerWaalsContact CB-OD1 3.27Å; R35-D37 WeakPolarHBondContact CB-OD1 3.08Å; R35-D37 PolarHBondContact O-N 2.6Å; D37-V39 HydrophobicContact CB-CG2 4.06Å; D37-V39 WeakPolarHBondContact O-CG2 3.3Å; D37-V39 PolarHBondContact O-N 3.49Å; D37-R122 PolarHBondContact O-NH2 2.93Å
38	Y	65.4	Low	45.7	Very low	42 Å²	42	90.2 Å²	90.2	17%	0.165	59%	0.59	C	S	.	*			trans	-70.6	101	167.1	-57.4	-90	0	0	0	108.6	R36 V125 A153 E280 Y281 Q285	R36-Y38 HydrophobicContact CB-CD2 4.42Å; R36-Y38 HydrophobicContact CB-CE2 3.76Å; R36-Y38 WeakPolarHBondContact O-CD2 3.44Å; R36-Y38 WeakPolarHBondContact O-CE2 3.19Å; R36-Y38 PolarHBondContact O-N 3.5Å; R36-Y38 VanDerWaalsContact O-N 3.07Å; Y38-V125 HydrophobicContact CD1-CG2 4.23Å; Y38-A153 HydrophobicContact CD1-CB 4.08Å; Y38-A153 HydrophobicContact CE1-CB 4.11Å; Y38-E280 PolarHBondContact OH-O 3.16Å; Y38-Y281 AromaticContact CD1-CD2 3.8Å; Y38-Y281 HydrophobicContact CD1-CD2 3.8Å; Y38-Y281 AromaticContact CE1-CD2 3.72Å; Y38-Y281 HydrophobicContact CE1-CD2 3.72Å; Y38-Y281 HydrophobicContact CE1-CG 4.33Å; Y38-Q285 HydrophobicContact CD1-CG 4.15Å; Y38-Q285 HydrophobicContact CD2-CG 4.03Å; Y38-Q285 HydrophobicContact CE1-CG 4.07Å; Y38-Q285 HydrophobicContact CE2-CG 3.95Å; Y38-Q285 HydrophobicContact CG-CG 4.12Å
39	V	65.3	Low	48.6	Very low	59 Å²	59	89.8 Å²	89.8	36%	0.358	57%	0.572	S	S	.	*	B	Isolated β-bridge	trans	-113.8	147.1	-177.7	-162.9	0	0	0	0	109.2	D37 A42 T152	D37-V39 HydrophobicContact CB-CG2 4.06Å; D37-V39 WeakPolarHBondContact O-CG2 3.3Å; D37-V39 PolarHBondContact O-N 3.49Å; V39-A42 HydrophobicContact CG1-CB 4.5Å; V39-T152 PolarHBondContact N-O 3.35Å; V39-T152 PolarHBondContact O-N 2.92Å
40	A	49.4	Very low	51.9	Low	62 Å²	62	85.6 Å²	85.6	51%	0.512	54%	0.543	S	S	.	.			trans	-49.9	151	159.7	0	0	0	0	0	110.4	A42 K150	A40-A42 PolarHBondContact O-N 3.07Å; A40-K150 WeakPolarHBondContact CA-O 3.13Å
41	P	46.8	Very low	55	Low	96 Å²	96	85.5 Å²	85.5	62%	0.623	53%	0.526	S	S	*	.			trans	-56.7	102.9	177.9	22.5	-33.2	0	0	0	110.4	K150	P41-K150 WeakPolarHBondContact CD-O 3.36Å
42	A	42.3	Very low	58.3	Low	79 Å²	79	81.6 Å²	81.6	65%	0.653	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-94	141.7	-171.8	0	0	0	0	0	110.8	V39 A40	V39-A42 HydrophobicContact CG1-CB 4.5Å; A40-A42 PolarHBondContact O-N 3.07Å
43	A	38.3	Very low	61.2	Low	100 Å²	100	78.3 Å²	78.3	83%	0.826	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-64.8	143.7	176.1	0	0	0	0	0	111.2	A45	A43-A45 PolarHBondContact O-N 3.08Å
44	A	39.6	Very low	63.9	Low	80 Å²	80	72.9 Å²	72.9	66%	0.661	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-53.3	125.6	-174.9	0	0	0	0	0	112.9
45	A	43.5	Very low	66.7	Low	65 Å²	65	70.8 Å²	70.8	54%	0.537	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-76.7	161.9	168.4	0	0	0	0	0	110.6	A43 V47	A43-A45 PolarHBondContact O-N 3.08Å; A45-V47 PolarHBondContact O-N 3.15Å
46	S	48.3	Very low	68.9	Low	111 Å²	111	65.7 Å²	65.7	78%	0.776	42%	0.418	S	S	*	.			trans	-21.5	107	-170.5	54.8	0	0	0	0	116.5	A48	S46-A48 PolarHBondContact O-N 3.19Å
47	V	64.3	Low	70.5	Confident	74 Å²	74	64.9 Å²	64.9	45%	0.448	43%	0.431	S	S	.	.			trans	-74.2	89	-176.6	-172.5	0	0	0	0	111	A45 T49 L115	A45-V47 PolarHBondContact O-N 3.15Å; V47-T49 HydrophobicContact CG1-CG2 4.16Å; V47-T49 PolarHBondContact O-N 3.38Å; V47-L115 HydrophobicContact CG1-CB 3.89Å; V47-L115 HydrophobicContact CG1-CD1 4.34Å; V47-L115 HydrophobicContact CG1-CD2 3.76Å; V47-L115 HydrophobicContact CG1-CG 4.18Å
48	A	78.3	Confident	72.2	Confident	23 Å²	23	61.1 Å²	61.1	19%	0.19	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-65.3	124	164	0	0	0	0	0	108.4	S46 F64 D116	S46-A48 PolarHBondContact O-N 3.19Å; A48-F64 HydrophobicContact CB-CD1 4.07Å; A48-F64 HydrophobicContact CB-CE1 4.15Å; A48-D116 HydrophobicContact CB-CB 4.11Å; A48-D116 PolarHBondContact O-N 3.46Å
49	T	88.8	Confident	73.6	Confident	70 Å²	70	59.3 Å²	59.3	43%	0.429	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	119.1	-179.5	60.9	0	0	0	0	111	V47 V114 L115	V47-T49 HydrophobicContact CG1-CG2 4.16Å; V47-T49 PolarHBondContact O-N 3.38Å; T49-V114 CarbonylContact C-O 3.58Å; T49-V114 WeakPolarHBondContact CA-O 3.31Å; T49-L115 HydrophobicContact CG2-CD2 3.89Å
50	G	92.4	Very high	75.1	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.01	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	173.4	172.1	0	0	0	0	0	112.9	Q63 K113 V114	G50-Q63 CarbonylContact C-O 3.43Å; G50-Q63 WeakPolarHBondContact CA-O 3.37Å; G50-K113 WeakPolarHBondContact O-CA 3.41Å; G50-V114 PolarHBondContact N-O 3.05Å; G50-V114 PolarHBondContact O-N 3.22Å
51	R	94.9	Very high	77.3	Confident	127 Å²	127	54.2 Å²	54.2	48%	0.479	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	138.7	175.5	-55.3	-179	-152.4	177.2	11.4	110.3	V53 V62 Q63 D65 Q112	R51-V53 PolarHBondContact O-N 3.2Å; R51-V62 WeakPolarHBondContact O-CA 3.46Å; R51-Q63 PolarHBondContact N-O 3.37Å; R51-Q63 PolarHBondContact O-N 2.9Å; R51-D65 IonicContact CZ-OD2 2.75Å; R51-D65 IonicContact NE-OD2 3.63Å; R51-D65 IonicContact NH2-OD1 3.71Å; R51-D65 IonicContact NH2-OD2 3.64Å; R51-D65 PolarHBondContact NH2-OD2 2.73Å; R51-Q112 WeakPolarHBondContact CA-O 3.21Å
52	I	96.3	Very high	79.7	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.015	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	124.2	177.5	-60.5	-177.9	0	0	0	110.1	V55 V60 V77 L108 R110 G111 Q112 V114	I52-V55 HydrophobicContact CG2-CG2 3.69Å; I52-V60 HydrophobicContact CD1-CG1 4.1Å; I52-V60 HydrophobicContact CG1-CG1 4.06Å; I52-V60 HydrophobicContact CG2-CG1 3.87Å; I52-V77 HydrophobicContact CD1-CG1 4.23Å; I52-L108 HydrophobicContact CD1-CB 4.43Å; I52-L108 HydrophobicContact CD1-CD1 4.22Å; I52-L108 HydrophobicContact CD1-CD2 3.8Å; I52-L108 HydrophobicContact CD1-CG 4.39Å; I52-R110 CarbonylContact O-C 3.53Å; I52-R110 WeakPolarHBondContact O-CA 3.27Å; I52-G111 PolarHBondContact O-N 3.28Å; I52-Q112 HydrophobicContact CD1-CB 4.17Å; I52-Q112 HydrophobicContact CG1-CB 4.5Å; I52-Q112 PolarHBondContact N-O 2.75Å; I52-V114 HydrophobicContact CD1-CG2 4.22Å; I52-V114 HydrophobicContact CG1-CG2 3.64Å
53	V	95.8	Very high	82.2	Confident	63 Å²	63	49.5 Å²	49.5	38%	0.382	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-43	176.5	-179.8	0	0	0	0	111.1	R51 D61 Q63 R110	R51-V53 PolarHBondContact O-N 3.2Å; V53-D61 PolarHBondContact N-O 3.46Å; V53-Q63 HydrophobicContact CG2-CB 3.48Å; V53-Q63 VanDerWaalsContact CG2-CB 3.48Å; V53-R110 VanDerWaalsContact O-CD 3.23Å; V53-R110 WeakPolarHBondContact O-CD 3.4Å; V53-R110 WeakPolarHBondContact O-CG 3.36Å; V53-R110 PolarHBondContact O-NE 3.42Å
54	A	94.5	Very high	84.9	Confident	21 Å²	21	44.9 Å²	44.9	17%	0.174	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	153.7	178.6	0	0	0	0	0	112.1	D61	A54-D61 HydrophobicContact CB-CB 4.21Å; A54-D61 PolarHBondContact N-O 3.37Å; A54-D61 PolarHBondContact O-N 3.24Å
55	V	95.1	Very high	87.1	Confident	49 Å²	49	45.6 Å²	45.6	30%	0.297	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	123.8	174.5	-178.8	0	0	0	0	106.5	I52 V60 L108	I52-V55 HydrophobicContact CG2-CG2 3.69Å; V55-V60 HydrophobicContact CG1-CG2 4.38Å; V55-V60 HydrophobicContact CG2-CG1 4.35Å; V55-V60 HydrophobicContact CG2-CG2 4.47Å; V55-L108 HydrophobicContact CG1-CD1 4.39Å; V55-L108 HydrophobicContact CG2-CB 3.96Å; V55-L108 HydrophobicContact CG2-CD1 4.15Å
56	I	92.4	Very high	88.8	Confident	94 Å²	94	50.8 Å²	50.8	48%	0.482	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	89.6	-176.1	-53.5	178.3	0	0	0	107.4	A58 V59	I56-A58 PolarHBondContact O-N 2.91Å; I56-V59 PolarHBondContact N-O 3.14Å; I56-V59 PolarHBondContact O-N 3.17Å
57	G	91.2	Very high	90.5	Very high	52 Å²	52	48.5 Å²	48.5	54%	0.536	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	-125.4	-172.1	0	0	0	0	0	111.1	V59 T105	G57-V59 VanDerWaalsContact C-N 3.28Å; G57-V59 PolarHBondContact O-N 3.01Å; G57-T105 WeakPolarHBondContact O-CB 3.29Å; G57-T105 WeakPolarHBondContact O-CG2 3.37Å; G57-T105 PolarHBondContact O-OG1 3.03Å
58	A	92.8	Very high	91.7	Very high	13 Å²	13	48.1 Å²	48.1	11%	0.107	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	0.5	176.7	0	0	0	0	0	114.4	I56 A101 P264 P265 L310	I56-A58 PolarHBondContact O-N 2.91Å; A58-A101 WeakPolarHBondContact O-CB 3.49Å; A58-A101 PolarHBondContact O-N 2.85Å; A58-P264 HydrophobicContact CB-CB 4.38Å; A58-P265 HydrophobicContact CB-CG 4.3Å; A58-L310 HydrophobicContact CB-CD1 4.09Å
59	V	95.5	Very high	92.3	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.018	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	132.9	177.7	166.4	0	0	0	0	110.4	I56 G57 R98 T99 L310 L311	I56-V59 PolarHBondContact N-O 3.14Å; I56-V59 PolarHBondContact O-N 3.17Å; G57-V59 VanDerWaalsContact C-N 3.28Å; G57-V59 PolarHBondContact O-N 3.01Å; V59-R98 HydrophobicContact CG1-CG 3.6Å; V59-T99 WeakPolarHBondContact CA-O 3.35Å; V59-L310 HydrophobicContact CG2-CB 3.6Å; V59-L311 HydrophobicContact CG2-CD2 4.31Å
60	V	96.4	Very high	92.5	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	123.3	-179.8	-177.3	0	0	0	0	109.1	I52 V55 V62 L86 T99 T105 L108	I52-V60 HydrophobicContact CD1-CG1 4.1Å; I52-V60 HydrophobicContact CG1-CG1 4.06Å; I52-V60 HydrophobicContact CG2-CG1 3.87Å; V55-V60 HydrophobicContact CG1-CG2 4.38Å; V55-V60 HydrophobicContact CG2-CG1 4.35Å; V55-V60 HydrophobicContact CG2-CG2 4.47Å; V60-V62 HydrophobicContact CG1-CG2 4Å; V60-L86 HydrophobicContact CB-CD1 4.13Å; V60-L86 HydrophobicContact CB-CD2 4.4Å; V60-L86 HydrophobicContact CG1-CD1 3.98Å; V60-L86 HydrophobicContact CG2-CD2 4.11Å; V60-T99 PolarHBondContact N-O 3.25Å; V60-T99 WeakPolarHBondContact O-CA 3.4Å; V60-T99 WeakPolarHBondContact O-CB 3.47Å; V60-T99 PolarHBondContact O-N 3.38Å; V60-T99 PolarHBondContact O-OG1 3.05Å; V60-T105 HydrophobicContact CG2-CG2 3.85Å; V60-L108 HydrophobicContact CG2-CD1 3.8Å
61	D	96.6	Very high	92.6	Very high	15 Å²	15	50.9 Å²	50.9	8%	0.08	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.2	175.1	-68.6	-20.8	0	0	0	109	V53 A54 T96 V97 R98	V53-D61 PolarHBondContact N-O 3.46Å; A54-D61 HydrophobicContact CB-CB 4.21Å; A54-D61 PolarHBondContact N-O 3.37Å; A54-D61 PolarHBondContact O-N 3.24Å; D61-T96 HydrophobicContact CB-CG2 4.1Å; D61-V97 WeakPolarHBondContact CA-O 3.27Å; D61-R98 WeakPolarHBondContact OD1-CA 3.32Å; D61-R98 WeakPolarHBondContact OD1-CB 3.32Å; D61-R98 VanDerWaalsContact OD1-CG 3.23Å; D61-R98 WeakPolarHBondContact OD1-CG 3.44Å; D61-R98 IonicContact OD1-CZ 3.53Å; D61-R98 IonicContact OD1-NE 3.89Å; D61-R98 PolarHBondContact OD1-NE 2.85Å; D61-R98 IonicContact OD1-NH2 2.77Å; D61-R98 IonicContact OD2-CZ 2.8Å; D61-R98 IonicContact OD2-NE 3.6Å; D61-R98 IonicContact OD2-NH2 3.56Å; D61-R98 PolarHBondContact OD2-NH2 3.44Å
62	V	96.4	Very high	92.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125.2	-174.6	-174.8	0	0	0	0	109.3	R51 V60 F64 L75 L86 T96 V97 T99 V114	R51-V62 WeakPolarHBondContact O-CA 3.46Å; V60-V62 HydrophobicContact CG1-CG2 4Å; V62-F64 HydrophobicContact CB-CE2 4.11Å; V62-F64 HydrophobicContact CG1-CD2 4.17Å; V62-F64 HydrophobicContact CG1-CE2 3.54Å; V62-F64 HydrophobicContact CG1-CZ 4.05Å; V62-L75 HydrophobicContact CG2-CD1 4.49Å; V62-L86 HydrophobicContact CG2-CD1 4.09Å; V62-T96 WeakPolarHBondContact O-CA 3.43Å; V62-V97 HydrophobicContact CB-CG2 4.07Å; V62-V97 PolarHBondContact N-O 3.3Å; V62-V97 WeakPolarHBondContact O-CG2 3.32Å; V62-V97 PolarHBondContact O-N 3.45Å; V62-T99 HydrophobicContact CG2-CG2 4.28Å; V62-V114 HydrophobicContact CG1-CB 3.87Å; V62-V114 HydrophobicContact CG1-CG1 4.14Å; V62-V114 HydrophobicContact CG1-CG2 3.97Å; V62-V114 HydrophobicContact CG2-CG2 4.17Å
63	Q	95.8	Very high	92.4	Very high	76 Å²	76	47.8 Å²	47.8	36%	0.355	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	135.8	176.6	-176.9	171.7	48.8	0	0	110.9	G50 R51 V53 E94 N95	G50-Q63 CarbonylContact C-O 3.43Å; G50-Q63 WeakPolarHBondContact CA-O 3.37Å; R51-Q63 PolarHBondContact N-O 3.37Å; R51-Q63 PolarHBondContact O-N 2.9Å; V53-Q63 HydrophobicContact CG2-CB 3.48Å; V53-Q63 VanDerWaalsContact CG2-CB 3.48Å; Q63-E94 PolarHBondContact NE2-O 3.49Å; Q63-N95 WeakPolarHBondContact CA-O 3.17Å
64	F	94.1	Very high	92.4	Very high	3 Å²	3	45 Å²	45	1%	0.013	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	137.5	177.9	-74.8	-98.4	0	0	0	110.3	A48 V62 P69 L75 N95 V97 D116	A48-F64 HydrophobicContact CB-CD1 4.07Å; A48-F64 HydrophobicContact CB-CE1 4.15Å; V62-F64 HydrophobicContact CB-CE2 4.11Å; V62-F64 HydrophobicContact CG1-CD2 4.17Å; V62-F64 HydrophobicContact CG1-CE2 3.54Å; V62-F64 HydrophobicContact CG1-CZ 4.05Å; F64-P69 HydrophobicContact CD1-CG 4.23Å; F64-P69 HydrophobicContact CD2-CG 4.29Å; F64-P69 HydrophobicContact CE1-CG 3.72Å; F64-P69 HydrophobicContact CE2-CG 3.8Å; F64-P69 HydrophobicContact CZ-CG 3.5Å; F64-P69 VanDerWaalsContact CZ-CG 3.5Å; F64-L75 HydrophobicContact CE2-CD1 4.08Å; F64-L75 HydrophobicContact CZ-CD1 3.92Å; F64-L75 HydrophobicContact CZ-CD2 4.14Å; F64-N95 PolarHBondContact N-O 3.28Å; F64-N95 WeakPolarHBondContact O-CB 2.98Å; F64-N95 PolarHBondContact O-ND2 2.67Å; F64-V97 HydrophobicContact CD2-CG2 4.18Å; F64-V97 HydrophobicContact CE2-CG2 3.74Å; F64-D116 HydrophobicContact CE1-CB 4.35Å
65	D	85.7	Confident	92.4	Very high	94 Å²	94	44 Å²	44	50%	0.503	25%	0.254	S	S	.	.	S	Bend	trans	-74.4	-28.3	-179.8	-67.3	-40.5	0	0	0	111.6	R51	R51-D65 IonicContact CZ-OD2 2.75Å; R51-D65 IonicContact NE-OD2 3.63Å; R51-D65 IonicContact NH2-OD1 3.71Å; R51-D65 IonicContact NH2-OD2 3.64Å; R51-D65 PolarHBondContact NH2-OD2 2.73Å
66	E	78.9	Confident	92.4	Very high	174 Å²	174	44.4 Å²	44.4	81%	0.813	25%	0.252	S	S	*	.	S	Bend	trans	-126.4	-101.2	-176	-63.3	-176.5	177	0	0	113.1
67	A	84.3	Confident	92.5	Very high	63 Å²	63	40.5 Å²	40.5	52%	0.521	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-77.9	130.3	-175.1	0	0	0	0	0	111.9
68	L	89.6	Confident	92.5	Very high	67 Å²	67	40.4 Å²	40.4	35%	0.351	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-78.2	123.6	170.7	-82.9	163.5	0	0	0	110.3	V97	L68-V97 HydrophobicContact CD2-CG1 3.48Å; L68-V97 VanDerWaalsContact CD2-CG1 3.48Å
69	P	91.4	Very high	92	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-62.2	142	172.4	-23.9	35.2	0	0	0	111.7	F64 N73 L75 V88 H91 D116	F64-P69 HydrophobicContact CD1-CG 4.23Å; F64-P69 HydrophobicContact CD2-CG 4.29Å; F64-P69 HydrophobicContact CE1-CG 3.72Å; F64-P69 HydrophobicContact CE2-CG 3.8Å; F64-P69 HydrophobicContact CZ-CG 3.5Å; F64-P69 VanDerWaalsContact CZ-CG 3.5Å; P69-N73 HydrophobicContact CB-CB 4.23Å; P69-L75 HydrophobicContact CB-CD2 3.98Å; P69-L75 HydrophobicContact CG-CD2 3.82Å; P69-V88 HydrophobicContact CB-CG2 4.25Å; P69-H91 PolarHBondContact O-CE1 2.82Å; P69-H91 PolarHBondContact O-NE2 3.33Å; P69-D116 HydrophobicContact CB-CB 4.5Å; P69-D116 WeakPolarHBondContact CB-OD2 3.37Å; P69-D116 HydrophobicContact CG-CB 3.94Å
70	P	92.2	Very high	91.6	Very high	68 Å²	68	46.6 Å²	46.6	44%	0.442	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-53.4	158.5	171.5	-27.8	35.3	0	0	0	113.9	N73 V88	P70-N73 WeakPolarHBondContact O-CB 3.47Å; P70-N73 PolarHBondContact O-N 3.47Å; P70-V88 WeakPolarHBondContact O-CB 3.27Å; P70-V88 WeakPolarHBondContact O-CG1 3.48Å
71	I	93.9	Very high	90.9	Very high	82 Å²	82	55.3 Å²	55.3	42%	0.421	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	145.1	168.4	-53.6	177.5	0	0	0	108.4	N73	I71-N73 VanDerWaalsContact C-N 3.27Å; I71-N73 PolarHBondContact O-N 3.4Å
72	L	94.5	Very high	90.5	Very high	56 Å²	56	57.1 Å²	57.1	29%	0.293	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	-1.7	-173	-45.9	179.5	0	0	0	116.1	V88 P120 H156	L72-V88 PolarHBondContact N-O 3.16Å; L72-P120 VanDerWaalsContact O-CA 3.25Å; L72-P120 WeakPolarHBondContact O-CA 3.43Å; L72-P120 WeakPolarHBondContact O-CB 3.29Å; L72-H156 HydrophobicContact CD1-CB 4.11Å
73	N	94	Very high	90.2	Very high	10 Å²	10	62.4 Å²	62.4	5%	0.053	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	146.5	171.1	-95.4	30.6	0	0	0	111.9	P69 P70 I71 E87 V88 D116 G118 A119	P69-N73 HydrophobicContact CB-CB 4.23Å; P70-N73 WeakPolarHBondContact O-CB 3.47Å; P70-N73 PolarHBondContact O-N 3.47Å; I71-N73 VanDerWaalsContact C-N 3.27Å; I71-N73 PolarHBondContact O-N 3.4Å; N73-E87 WeakPolarHBondContact O-CA 3.41Å; N73-V88 HydrophobicContact CB-CG2 4.42Å; N73-V88 PolarHBondContact O-N 3.27Å; N73-D116 PolarHBondContact ND2-OD1 2.93Å; N73-G118 VanDerWaalsContact ND2-C 3.25Å; N73-G118 WeakPolarHBondContact ND2-CA 3.28Å; N73-A119 WeakPolarHBondContact CA-O 3.44Å; N73-A119 PolarHBondContact ND2-N 3.12Å
74	A	95.3	Very high	90.2	Very high	5 Å²	5	58.8 Å²	58.8	4%	0.041	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	135.5	169.7	0	0	0	0	0	110.6	V85 L86 T117 A119 I121	A74-V85 HydrophobicContact CB-CG1 3.93Å; A74-L86 CarbonylContact C-O 3.48Å; A74-L86 WeakPolarHBondContact CA-O 3.17Å; A74-T117 HydrophobicContact CB-CG2 4.42Å; A74-T117 WeakPolarHBondContact O-CB 3.25Å; A74-T117 WeakPolarHBondContact O-CG2 3.48Å; A74-T117 PolarHBondContact O-N 2.81Å; A74-T117 VanDerWaalsContact O-N 3.12Å; A74-T117 PolarHBondContact O-OG1 2.95Å; A74-A119 PolarHBondContact N-O 2.93Å; A74-I121 HydrophobicContact CB-CB 4.48Å; A74-I121 HydrophobicContact CB-CG1 3.75Å
75	L	94.9	Very high	90.3	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	145.5	172.3	-40.3	178.5	0	0	0	109.9	V62 F64 P69 V85 L86 V88 V97 T99 V114 L115 D116	V62-L75 HydrophobicContact CG2-CD1 4.49Å; F64-L75 HydrophobicContact CE2-CD1 4.08Å; F64-L75 HydrophobicContact CZ-CD1 3.92Å; F64-L75 HydrophobicContact CZ-CD2 4.14Å; P69-L75 HydrophobicContact CB-CD2 3.98Å; P69-L75 HydrophobicContact CG-CD2 3.82Å; L75-V85 CarbonylContact O-C 3.5Å; L75-V85 WeakPolarHBondContact O-CA 3.31Å; L75-L86 HydrophobicContact CB-CB 4.37Å; L75-L86 PolarHBondContact N-O 2.74Å; L75-L86 PolarHBondContact O-N 3.36Å; L75-V88 HydrophobicContact CD1-CG2 3.93Å; L75-V88 HydrophobicContact CD2-CG2 3.99Å; L75-V88 HydrophobicContact CG-CG2 3.92Å; L75-V97 HydrophobicContact CD1-CG2 4.3Å; L75-T99 HydrophobicContact CD1-CG2 3.79Å; L75-V114 HydrophobicContact CB-CG1 3.51Å; L75-V114 HydrophobicContact CD1-CG1 3.91Å; L75-V114 HydrophobicContact CG-CG1 4.35Å; L75-L115 CarbonylContact C-O 3.57Å; L75-L115 WeakPolarHBondContact CA-O 3.21Å; L75-D116 HydrophobicContact CD2-CB 3.92Å
76	E	94.9	Very high	90.8	Very high	57 Å²	57	54.4 Å²	54.4	27%	0.266	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.1	178.5	-65.1	-168.1	157	0	0	111.9	R83 V114 L115 T117	E76-R83 IonicContact OE1-CZ 3.7Å; E76-R83 IonicContact OE1-NE 3.47Å; E76-R83 PolarHBondContact OE1-NE 3.05Å; E76-R83 IonicContact OE1-NH2 3.32Å; E76-R83 PolarHBondContact OE1-NH2 3.32Å; E76-V114 CarbonylContact O-C 3.54Å; E76-V114 WeakPolarHBondContact O-CA 3.35Å; E76-L115 PolarHBondContact N-O 3.07Å; E76-L115 PolarHBondContact O-N 3.23Å; E76-T117 HydrophobicContact CG-CG2 3.87Å
77	V	94	Very high	91.7	Very high	11 Å²	11	46.1 Å²	46.1	7%	0.067	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	122.9	176.8	-172.4	0	0	0	0	110.3	I52 L84 L86 L108 Q112 V114	I52-V77 HydrophobicContact CD1-CG1 4.23Å; V77-L84 HydrophobicContact CB-CB 4.33Å; V77-L84 HydrophobicContact CB-CD2 4.32Å; V77-L84 HydrophobicContact CG2-CB 4.39Å; V77-L84 HydrophobicContact CG2-CD2 3.87Å; V77-L84 HydrophobicContact CG2-CG 4.06Å; V77-L84 PolarHBondContact N-O 2.9Å; V77-L84 VanDerWaalsContact N-O 3.08Å; V77-L86 HydrophobicContact CG2-CD1 3.63Å; V77-L86 HydrophobicContact CG2-CD2 4.32Å; V77-L86 HydrophobicContact CG2-CG 3.85Å; V77-L108 HydrophobicContact CG1-CD2 3.81Å; V77-Q112 HydrophobicContact CG1-CG 3.87Å; V77-V114 HydrophobicContact CG2-CG2 4.31Å
78	T	90.8	Very high	92.2	Very high	51 Å²	51	43.1 Å²	43.1	31%	0.313	24%	0.244	S	C	.	.	S	Bend	trans	-84.8	153.4	-178.6	63.7	0	0	0	0	113	Q112 K113 L115	T78-Q112 PolarHBondContact O-NE2 3.07Å; T78-K113 PolarHBondContact N-O 2.86Å; T78-K113 WeakPolarHBondContact OG1-CB 3.48Å; T78-K113 PolarHBondContact OG1-O 3.32Å; T78-L115 HydrophobicContact CG2-CD1 3.67Å; T78-L115 HydrophobicContact CG2-CD2 3.96Å; T78-L115 HydrophobicContact CG2-CG 3.56Å
79	G	83.6	Confident	92.5	Very high	81 Å²	81	40.7 Å²	40.7	84%	0.835	23%	0.234	S	C	*	.	S	Bend	trans	75.8	37.6	174.5	0	0	0	0	0	114.1
80	R	86.2	Confident	92.6	Very high	64 Å²	64	43 Å²	43	24%	0.242	25%	0.245	C	C	.	.			trans	-123.5	152.8	169.2	-65.4	179	68.5	91.1	-6.9	109.1	S82 G104 E106	R80-S82 VanDerWaalsContact CB-O 3.25Å; R80-S82 WeakPolarHBondContact CB-O 3.29Å; R80-G104 PolarHBondContact NH2-O 3.29Å; R80-G104 VanDerWaalsContact NH2-O 3.09Å; R80-E106 PolarHBondContact NH1-O 3.11Å; R80-E106 PolarHBondContact NH2-O 3.02Å
81	D	82.1	Confident	92.7	Very high	183 Å²	183	43.8 Å²	43.8	98%	0.979	24%	0.242	S	C	*	.	S	Bend	trans	-75.4	-36.5	175.1	-58.4	-43.2	0	0	0	111.7
82	S	87.1	Confident	92.6	Very high	53 Å²	53	43.6 Å²	43.6	37%	0.371	24%	0.241	S	C	.	.	S	Bend	trans	-92.4	143.9	168.5	71.8	0	0	0	0	111.6	R80 L84	R80-S82 VanDerWaalsContact CB-O 3.25Å; R80-S82 WeakPolarHBondContact CB-O 3.29Å; S82-L84 PolarHBondContact O-N 3.01Å
83	R	92.1	Very high	92.4	Very high	111 Å²	111	42.9 Å²	42.9	42%	0.419	25%	0.248	S	C	.	.			trans	-75.3	107.2	177.7	-174.2	-166.9	-178.6	-158.8	-4.1	110.1	E76 V85 E139	E76-R83 IonicContact OE1-CZ 3.7Å; E76-R83 IonicContact OE1-NE 3.47Å; E76-R83 PolarHBondContact OE1-NE 3.05Å; E76-R83 IonicContact OE1-NH2 3.32Å; E76-R83 PolarHBondContact OE1-NH2 3.32Å; R83-V85 HydrophobicContact CG-CG2 4.41Å; R83-E139 WeakPolarHBondContact CD-OE1 3.3Å; R83-E139 IonicContact CZ-OE1 3.81Å; R83-E139 IonicContact NE-OE1 2.83Å; R83-E139 IonicContact NH1-OE1 3.69Å; R83-E139 PolarHBondContact NH1-OE1 3.25Å
84	L	94.4	Very high	92.2	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	28%	0.283	C	S	.	.			trans	-97.7	115.7	174.3	176.9	63.1	0	0	0	111	V77 S82 L86 A101 D103 L108	V77-L84 HydrophobicContact CB-CB 4.33Å; V77-L84 HydrophobicContact CB-CD2 4.32Å; V77-L84 HydrophobicContact CG2-CB 4.39Å; V77-L84 HydrophobicContact CG2-CD2 3.87Å; V77-L84 HydrophobicContact CG2-CG 4.06Å; V77-L84 PolarHBondContact N-O 2.9Å; V77-L84 VanDerWaalsContact N-O 3.08Å; S82-L84 PolarHBondContact O-N 3.01Å; L84-L86 HydrophobicContact CD1-CD2 4.25Å; L84-L86 HydrophobicContact CD2-CD2 4.19Å; L84-L86 HydrophobicContact CG-CD2 4.04Å; L84-A101 HydrophobicContact CD1-CB 4.22Å; L84-D103 HydrophobicContact CD1-CB 3.76Å; L84-D103 WeakPolarHBondContact CD1-O 3.43Å; L84-L108 HydrophobicContact CD2-CD1 3.94Å; L84-L108 HydrophobicContact CD2-CD2 3.82Å; L84-L108 HydrophobicContact CD2-CG 4.18Å
85	V	96.3	Very high	92	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.024	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	136.9	172.2	-176.4	0	0	0	0	110	A74 L75 R83 M102 I121 I137	A74-V85 HydrophobicContact CB-CG1 3.93Å; L75-V85 CarbonylContact O-C 3.5Å; L75-V85 WeakPolarHBondContact O-CA 3.31Å; R83-V85 HydrophobicContact CG-CG2 4.41Å; V85-M102 HydrophobicContact CB-CB 4.48Å; V85-M102 HydrophobicContact CB-CG 4.35Å; V85-M102 HydrophobicContact CG1-CG 4.5Å; V85-M102 WeakPolarHBondContact O-CB 3.38Å; V85-M102 PolarHBondContact O-N 2.95Å; V85-I121 HydrophobicContact CG1-CD1 4.3Å; V85-I121 HydrophobicContact CG1-CG1 4.12Å; V85-I137 HydrophobicContact CB-CG2 4.03Å; V85-I137 HydrophobicContact CG1-CG2 4.43Å; V85-I137 HydrophobicContact CG2-CD1 3.95Å; V85-I137 HydrophobicContact CG2-CG2 4Å
86	L	96.4	Very high	92	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	133.6	174.1	-49.9	177.4	0	0	0	109.1	V60 V62 A74 L75 V77 L84 T99 I100 A101 V114	V60-L86 HydrophobicContact CB-CD1 4.13Å; V60-L86 HydrophobicContact CB-CD2 4.4Å; V60-L86 HydrophobicContact CG1-CD1 3.98Å; V60-L86 HydrophobicContact CG2-CD2 4.11Å; V62-L86 HydrophobicContact CG2-CD1 4.09Å; A74-L86 CarbonylContact C-O 3.48Å; A74-L86 WeakPolarHBondContact CA-O 3.17Å; L75-L86 HydrophobicContact CB-CB 4.37Å; L75-L86 PolarHBondContact N-O 2.74Å; L75-L86 PolarHBondContact O-N 3.36Å; V77-L86 HydrophobicContact CG2-CD1 3.63Å; V77-L86 HydrophobicContact CG2-CD2 4.32Å; V77-L86 HydrophobicContact CG2-CG 3.85Å; L84-L86 HydrophobicContact CD1-CD2 4.25Å; L84-L86 HydrophobicContact CD2-CD2 4.19Å; L84-L86 HydrophobicContact CG-CD2 4.04Å; L86-T99 HydrophobicContact CB-CG2 4.46Å; L86-I100 CarbonylContact C-O 3.56Å; L86-I100 WeakPolarHBondContact CA-O 3.36Å; L86-A101 HydrophobicContact CD2-CB 3.74Å; L86-V114 HydrophobicContact CD1-CG1 4.49Å
87	E	96.9	Very high	92.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131	173.8	-172.4	-170.1	94.9	0	0	110.8	N73 A89 T99 I100 M102 H156 R270	N73-E87 WeakPolarHBondContact O-CA 3.41Å; E87-A89 PolarHBondContact O-N 3.21Å; E87-T99 CarbonylContact O-C 3.59Å; E87-T99 WeakPolarHBondContact O-CA 3.34Å; E87-T99 VanDerWaalsContact O-CB 3.29Å; E87-T99 WeakPolarHBondContact O-CB 3.32Å; E87-I100 PolarHBondContact N-O 3.32Å; E87-I100 PolarHBondContact O-N 2.87Å; E87-M102 HydrophobicContact CB-CE 3.9Å; E87-H156 IonicContact OE1-NE2 2.77Å; E87-H156 IonicContact OE2-CD2 3.38Å; E87-H156 IonicContact OE2-CE1 3.72Å; E87-H156 IonicContact OE2-NE2 3.69Å; E87-H156 PolarHBondContact OE2-NE2 2.74Å; E87-R270 VanDerWaalsContact CD-NE 3.25Å; E87-R270 IonicContact OE1-CZ 3.92Å; E87-R270 IonicContact OE1-NE 3.62Å; E87-R270 PolarHBondContact OE1-NE 3.36Å; E87-R270 IonicContact OE1-NH2 3.55Å; E87-R270 PolarHBondContact OE1-NH2 3.46Å; E87-R270 WeakPolarHBondContact OE2-CD 3.07Å; E87-R270 IonicContact OE2-CZ 3.37Å; E87-R270 IonicContact OE2-NE 2.7Å; E87-R270 PolarHBondContact OE2-NE 3.05Å
88	V	96.3	Very high	92.2	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	117	177.1	-179.9	0	0	0	0	111.2	P69 P70 L72 N73 L75 V97 T99	P69-V88 HydrophobicContact CB-CG2 4.25Å; P70-V88 WeakPolarHBondContact O-CB 3.27Å; P70-V88 WeakPolarHBondContact O-CG1 3.48Å; L72-V88 PolarHBondContact N-O 3.16Å; N73-V88 HydrophobicContact CB-CG2 4.42Å; N73-V88 PolarHBondContact O-N 3.27Å; L75-V88 HydrophobicContact CD1-CG2 3.93Å; L75-V88 HydrophobicContact CD2-CG2 3.99Å; L75-V88 HydrophobicContact CG-CG2 3.92Å; V88-V97 HydrophobicContact CG1-CB 4.01Å; V88-V97 HydrophobicContact CG1-CG1 4.18Å; V88-V97 HydrophobicContact CG2-CG2 4.29Å; V88-T99 HydrophobicContact CG2-CG2 4.09Å
89	A	94.4	Very high	92.5	Very high	16 Å²	16	50.6 Å²	50.6	13%	0.132	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-36.1	-176.7	0	0	0	0	0	113.8	E87 R98 I100 L311	E87-A89 PolarHBondContact O-N 3.21Å; A89-R98 PolarHBondContact N-O 3.15Å; A89-I100 HydrophobicContact CB-CD1 3.69Å; A89-I100 HydrophobicContact CB-CG1 3.96Å; A89-L311 HydrophobicContact CB-CD1 4.26Å; A89-L311 HydrophobicContact CB-CD2 3.92Å
90	Q	93.9	Very high	93.1	Very high	50 Å²	50	47 Å²	47	23%	0.234	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	156.8	178.2	61.3	-174.3	30.2	0	0	112	L92 R98	Q90-L92 HydrophobicContact CG-CD2 4.25Å; Q90-R98 HydrophobicContact CG-CB 3.67Å; Q90-R98 HydrophobicContact CG-CG 4.27Å; Q90-R98 PolarHBondContact N-O 3.43Å; Q90-R98 PolarHBondContact O-N 3.38Å
91	H	95.4	Very high	93.6	Very high	84 Å²	84	44 Å²	44	39%	0.389	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	129.2	171.4	-62.1	174.7	0	0	0	109.3	P69	P69-H91 PolarHBondContact O-CE1 2.82Å; P69-H91 PolarHBondContact O-NE2 3.33Å
92	L	91.7	Very high	94.2	Very high	78 Å²	78	35.7 Å²	35.7	41%	0.408	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-20.9	-176.7	-63.5	-179.1	0	0	0	113.6	Q90 T96 R98	Q90-L92 HydrophobicContact CG-CD2 4.25Å; L92-T96 HydrophobicContact CD1-CG2 4.1Å; L92-T96 PolarHBondContact N-O 2.88Å; L92-R98 HydrophobicContact CD1-CB 4.15Å; L92-R98 HydrophobicContact CD2-CB 4.23Å; L92-R98 HydrophobicContact CG-CB 4.1Å
93	G	89.6	Confident	94.5	Very high	42 Å²	42	36.3 Å²	36.3	43%	0.433	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	103.5	176.5	-164.2	0	0	0	0	0	111.6	N95 T96	G93-N95 PolarHBondContact O-N 2.87Å; G93-N95 VanDerWaalsContact O-N 3.12Å; G93-T96 WeakPolarHBondContact O-CB 3.32Å; G93-T96 PolarHBondContact O-N 2.62Å
94	E	89.3	Confident	94.5	Very high	169 Å²	169	32.4 Å²	32.4	79%	0.79	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.5	41.3	-179.6	-57.7	-171.2	165	0	0	113.8	Q63 T96	Q63-E94 PolarHBondContact NE2-O 3.49Å; E94-T96 PolarHBondContact O-N 3.42Å; E94-T96 PolarHBondContact O-OG1 3.2Å
95	N	92.2	Very high	94.5	Very high	68 Å²	68	33.6 Å²	33.6	36%	0.364	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	26.5	-172.5	-59.8	-2.7	0	0	0	115.2	Q63 F64 G93	Q63-N95 WeakPolarHBondContact CA-O 3.17Å; F64-N95 PolarHBondContact N-O 3.28Å; F64-N95 WeakPolarHBondContact O-CB 2.98Å; F64-N95 PolarHBondContact O-ND2 2.67Å; G93-N95 PolarHBondContact O-N 2.87Å; G93-N95 VanDerWaalsContact O-N 3.12Å
96	T	94.8	Very high	94.2	Very high	17 Å²	17	41.3 Å²	41.3	10%	0.104	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.4	178.9	-54.9	0	0	0	0	111	D61 V62 L92 G93 E94	D61-T96 HydrophobicContact CB-CG2 4.1Å; V62-T96 WeakPolarHBondContact O-CA 3.43Å; L92-T96 HydrophobicContact CD1-CG2 4.1Å; L92-T96 PolarHBondContact N-O 2.88Å; G93-T96 WeakPolarHBondContact O-CB 3.32Å; G93-T96 PolarHBondContact O-N 2.62Å; E94-T96 PolarHBondContact O-N 3.42Å; E94-T96 PolarHBondContact O-OG1 3.2Å
97	V	96.1	Very high	93.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	142.3	168.6	-59.3	0	0	0	0	110.1	D61 V62 F64 L68 L75 V88 T99	D61-V97 WeakPolarHBondContact CA-O 3.27Å; V62-V97 HydrophobicContact CB-CG2 4.07Å; V62-V97 PolarHBondContact N-O 3.3Å; V62-V97 WeakPolarHBondContact O-CG2 3.32Å; V62-V97 PolarHBondContact O-N 3.45Å; F64-V97 HydrophobicContact CD2-CG2 4.18Å; F64-V97 HydrophobicContact CE2-CG2 3.74Å; L68-V97 HydrophobicContact CD2-CG1 3.48Å; L68-V97 VanDerWaalsContact CD2-CG1 3.48Å; L75-V97 HydrophobicContact CD1-CG2 4.3Å; V88-V97 HydrophobicContact CG1-CB 4.01Å; V88-V97 HydrophobicContact CG1-CG1 4.18Å; V88-V97 HydrophobicContact CG2-CG2 4.29Å; V97-T99 HydrophobicContact CG2-CG2 3.82Å
98	R	96.6	Very high	93.7	Very high	42 Å²	42	45.7 Å²	45.7	16%	0.158	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	130.2	167.2	176.3	160.2	-66.2	164.5	2.3	109.3	V59 D61 A89 Q90 L92 L311	V59-R98 HydrophobicContact CG1-CG 3.6Å; D61-R98 WeakPolarHBondContact OD1-CA 3.32Å; D61-R98 WeakPolarHBondContact OD1-CB 3.32Å; D61-R98 VanDerWaalsContact OD1-CG 3.23Å; D61-R98 WeakPolarHBondContact OD1-CG 3.44Å; D61-R98 IonicContact OD1-CZ 3.53Å; D61-R98 IonicContact OD1-NE 3.89Å; D61-R98 PolarHBondContact OD1-NE 2.85Å; D61-R98 IonicContact OD1-NH2 2.77Å; D61-R98 IonicContact OD2-CZ 2.8Å; D61-R98 IonicContact OD2-NE 3.6Å; D61-R98 IonicContact OD2-NH2 3.56Å; D61-R98 PolarHBondContact OD2-NH2 3.44Å; A89-R98 PolarHBondContact N-O 3.15Å; Q90-R98 HydrophobicContact CG-CB 3.67Å; Q90-R98 HydrophobicContact CG-CG 4.27Å; Q90-R98 PolarHBondContact N-O 3.43Å; Q90-R98 PolarHBondContact O-N 3.38Å; L92-R98 HydrophobicContact CD1-CB 4.15Å; L92-R98 HydrophobicContact CD2-CB 4.23Å; L92-R98 HydrophobicContact CG-CB 4.1Å; R98-L311 HydrophobicContact CG-CD2 3.75Å; R98-L311 PolarHBondContact NH1-O 3.25Å
99	T	96.6	Very high	93.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	158.8	-175.6	71.4	0	0	0	0	111.9	V59 V60 V62 L75 L86 E87 V88 V97	V59-T99 WeakPolarHBondContact CA-O 3.35Å; V60-T99 PolarHBondContact N-O 3.25Å; V60-T99 WeakPolarHBondContact O-CA 3.4Å; V60-T99 WeakPolarHBondContact O-CB 3.47Å; V60-T99 PolarHBondContact O-N 3.38Å; V60-T99 PolarHBondContact O-OG1 3.05Å; V62-T99 HydrophobicContact CG2-CG2 4.28Å; L75-T99 HydrophobicContact CD1-CG2 3.79Å; L86-T99 HydrophobicContact CB-CG2 4.46Å; E87-T99 CarbonylContact O-C 3.59Å; E87-T99 WeakPolarHBondContact O-CA 3.34Å; E87-T99 VanDerWaalsContact O-CB 3.29Å; E87-T99 WeakPolarHBondContact O-CB 3.32Å; V88-T99 HydrophobicContact CG2-CG2 4.09Å; V97-T99 HydrophobicContact CG2-CG2 3.82Å
100	I	96.4	Very high	93.6	Very high	5 Å²	5	59.8 Å²	59.8	3%	0.026	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.3	176.3	-56.6	156.9	0	0	0	108	L86 E87 A89 M102 G266 V307 L311	L86-I100 CarbonylContact C-O 3.56Å; L86-I100 WeakPolarHBondContact CA-O 3.36Å; E87-I100 PolarHBondContact N-O 3.32Å; E87-I100 PolarHBondContact O-N 2.87Å; A89-I100 HydrophobicContact CB-CD1 3.69Å; A89-I100 HydrophobicContact CB-CG1 3.96Å; I100-M102 HydrophobicContact CB-CE 4.24Å; I100-M102 HydrophobicContact CG2-CE 4.05Å; I100-M102 WeakPolarHBondContact O-CE 3.44Å; I100-G266 VanDerWaalsContact CG2-CA 3.45Å; I100-V307 HydrophobicContact CD1-CG1 3.43Å; I100-V307 VanDerWaalsContact CD1-CG1 3.43Å; I100-V307 HydrophobicContact CG1-CG1 4.05Å; I100-V307 HydrophobicContact CG2-CG2 4.23Å; I100-L311 HydrophobicContact CG1-CD2 4.39Å
101	A	95.9	Very high	93.5	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	137.7	177.9	0	0	0	0	0	112.5	A58 L84 L86 D103 T105	A58-A101 WeakPolarHBondContact O-CB 3.49Å; A58-A101 PolarHBondContact O-N 2.85Å; L84-A101 HydrophobicContact CD1-CB 4.22Å; L86-A101 HydrophobicContact CD2-CB 3.74Å; A101-D103 WeakPolarHBondContact CB-O 3.47Å; A101-T105 HydrophobicContact CB-CG2 3.41Å; A101-T105 VanDerWaalsContact CB-CG2 3.41Å
102	M	95.4	Very high	93.4	Very high	10 Å²	10	57.3 Å²	57.3	5%	0.049	32%	0.32	C	S	.	.	S	Bend	trans	-90.1	-10.3	174.3	-59.1	-61.4	117.1	0	0	113.3	V85 E87 I100 I121 V136 I137 R270	V85-M102 HydrophobicContact CB-CB 4.48Å; V85-M102 HydrophobicContact CB-CG 4.35Å; V85-M102 HydrophobicContact CG1-CG 4.5Å; V85-M102 WeakPolarHBondContact O-CB 3.38Å; V85-M102 PolarHBondContact O-N 2.95Å; E87-M102 HydrophobicContact CB-CE 3.9Å; I100-M102 HydrophobicContact CB-CE 4.24Å; I100-M102 HydrophobicContact CG2-CE 4.05Å; I100-M102 WeakPolarHBondContact O-CE 3.44Å; M102-I121 HydrophobicContact CG-CD1 3.92Å; M102-I121 HydrophobicContact SD-CD1 4Å; M102-V136 HydrophobicContact CB-CG1 4.32Å; M102-V136 HydrophobicContact SD-CG2 4.5Å; M102-I137 HydrophobicContact CB-CG2 4.15Å; M102-I137 HydrophobicContact CG-CG2 4.22Å; M102-R270 HydrophobicContact CE-CG 4.32Å; M102-R270 HydrophobicContact SD-CB 4.36Å; M102-R270 HydrophobicContact SD-CG 4.14Å
103	D	94.3	Very high	93.5	Very high	66 Å²	66	60.1 Å²	60.1	35%	0.353	33%	0.329	S	S	.	.	S	Bend	trans	-142.6	175.5	176.7	-173.9	22.2	0	0	0	109.6	L84 A101 T105	L84-D103 HydrophobicContact CD1-CB 3.76Å; L84-D103 WeakPolarHBondContact CD1-O 3.43Å; A101-D103 WeakPolarHBondContact CB-O 3.47Å; D103-T105 PolarHBondContact O-N 3.01Å
104	G	92.3	Very high	93.7	Very high	28 Å²	28	58.1 Å²	58.1	29%	0.289	31%	0.308	S	S	.	.			trans	-54.5	126.2	-176.9	0	0	0	0	0	113.9	R80 E106	R80-G104 PolarHBondContact NH2-O 3.29Å; R80-G104 VanDerWaalsContact NH2-O 3.09Å; G104-E106 PolarHBondContact O-N 3.06Å
105	T	93.3	Very high	93.9	Very high	26 Å²	26	52.5 Å²	52.5	16%	0.16	28%	0.283	C	S	.	.			trans	-80.9	4.3	178.3	51.5	0	0	0	0	113.8	G57 V60 A101 D103 L108	G57-T105 WeakPolarHBondContact O-CB 3.29Å; G57-T105 WeakPolarHBondContact O-CG2 3.37Å; G57-T105 PolarHBondContact O-OG1 3.03Å; V60-T105 HydrophobicContact CG2-CG2 3.85Å; A101-T105 HydrophobicContact CB-CG2 3.41Å; A101-T105 VanDerWaalsContact CB-CG2 3.41Å; D103-T105 PolarHBondContact O-N 3.01Å; T105-L108 HydrophobicContact CG2-CD1 3.96Å; T105-L108 WeakPolarHBondContact O-CB 3.42Å; T105-L108 VanDerWaalsContact O-CG 3.28Å; T105-L108 WeakPolarHBondContact O-CG 3.44Å; T105-L108 PolarHBondContact O-N 3.28Å
106	E	90.9	Very high	94	Very high	167 Å²	167	50 Å²	50	78%	0.78	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	139.5	176.8	-63	176	177.6	0	0	111	R80 G104 L108	R80-E106 PolarHBondContact NH1-O 3.11Å; R80-E106 PolarHBondContact NH2-O 3.02Å; G104-E106 PolarHBondContact O-N 3.06Å; E106-L108 VanDerWaalsContact C-N 3.25Å; E106-L108 PolarHBondContact O-N 2.92Å
107	G	89.5	Confident	93.7	Very high	67 Å²	67	51.1 Å²	51.1	69%	0.691	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	5.6	-177.1	0	0	0	0	0	115.7
108	L	92.9	Very high	93.4	Very high	25 Å²	25	53.1 Å²	53.1	13%	0.131	30%	0.297	C	S	.	.			trans	-70.1	136.1	170.5	-71.6	-178.2	0	0	0	111.9	I52 V55 V60 V77 L84 T105 E106	I52-L108 HydrophobicContact CD1-CB 4.43Å; I52-L108 HydrophobicContact CD1-CD1 4.22Å; I52-L108 HydrophobicContact CD1-CD2 3.8Å; I52-L108 HydrophobicContact CD1-CG 4.39Å; V55-L108 HydrophobicContact CG1-CD1 4.39Å; V55-L108 HydrophobicContact CG2-CB 3.96Å; V55-L108 HydrophobicContact CG2-CD1 4.15Å; V60-L108 HydrophobicContact CG2-CD1 3.8Å; V77-L108 HydrophobicContact CG1-CD2 3.81Å; L84-L108 HydrophobicContact CD2-CD1 3.94Å; L84-L108 HydrophobicContact CD2-CD2 3.82Å; L84-L108 HydrophobicContact CD2-CG 4.18Å; T105-L108 HydrophobicContact CG2-CD1 3.96Å; T105-L108 WeakPolarHBondContact O-CB 3.42Å; T105-L108 VanDerWaalsContact O-CG 3.28Å; T105-L108 WeakPolarHBondContact O-CG 3.44Å; T105-L108 PolarHBondContact O-N 3.28Å; E106-L108 VanDerWaalsContact C-N 3.25Å; E106-L108 PolarHBondContact O-N 2.92Å
109	I	93.4	Very high	93.1	Very high	121 Å²	121	52 Å²	52	62%	0.621	30%	0.297	S	S	*	.			trans	-120.7	139.5	-178.3	-51.8	178.3	0	0	0	109.8	Q112	I109-Q112 WeakPolarHBondContact O-CB 3.49Å; I109-Q112 PolarHBondContact O-N 2.95Å; I109-Q112 VanDerWaalsContact O-N 3.12Å
110	R	94.7	Very high	93	Very high	191 Å²	191	53.2 Å²	53.2	72%	0.721	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	138	174.2	-60.8	-177.7	-174.6	-173.4	-0.1	110.5	I52 V53 Q112	I52-R110 CarbonylContact O-C 3.53Å; I52-R110 WeakPolarHBondContact O-CA 3.27Å; V53-R110 VanDerWaalsContact O-CD 3.23Å; V53-R110 WeakPolarHBondContact O-CD 3.4Å; V53-R110 WeakPolarHBondContact O-CG 3.36Å; V53-R110 PolarHBondContact O-NE 3.42Å; R110-Q112 VanDerWaalsContact C-N 3.31Å
111	G	92.3	Very high	92.9	Very high	46 Å²	46	53.3 Å²	53.3	47%	0.474	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	-6.6	-173	0	0	0	0	0	114.8	I52	I52-G111 PolarHBondContact O-N 3.28Å
112	Q	93.5	Very high	92.8	Very high	36 Å²	36	57.4 Å²	57.4	17%	0.168	32%	0.321	C	S	.	.			trans	-60.4	137.9	173.2	-175.3	167.2	13.1	0	0	110.6	R51 I52 V77 T78 I109 R110	R51-Q112 WeakPolarHBondContact CA-O 3.21Å; I52-Q112 HydrophobicContact CD1-CB 4.17Å; I52-Q112 HydrophobicContact CG1-CB 4.5Å; I52-Q112 PolarHBondContact N-O 2.75Å; V77-Q112 HydrophobicContact CG1-CG 3.87Å; T78-Q112 PolarHBondContact O-NE2 3.07Å; I109-Q112 WeakPolarHBondContact O-CB 3.49Å; I109-Q112 PolarHBondContact O-N 2.95Å; I109-Q112 VanDerWaalsContact O-N 3.12Å; R110-Q112 VanDerWaalsContact C-N 3.31Å
113	K	93.8	Very high	92.8	Very high	137 Å²	137	56.9 Å²	56.9	60%	0.596	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	135.2	-174.7	-67.7	-179.2	-178.9	-176.5	0	111.5	G50 T78	G50-K113 WeakPolarHBondContact O-CA 3.41Å; T78-K113 PolarHBondContact N-O 2.86Å; T78-K113 WeakPolarHBondContact OG1-CB 3.48Å; T78-K113 PolarHBondContact OG1-O 3.32Å
114	V	94.4	Very high	92.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137.7	177.6	-179	0	0	0	0	108.2	T49 G50 I52 V62 L75 E76 V77 L86	T49-V114 CarbonylContact C-O 3.58Å; T49-V114 WeakPolarHBondContact CA-O 3.31Å; G50-V114 PolarHBondContact N-O 3.05Å; G50-V114 PolarHBondContact O-N 3.22Å; I52-V114 HydrophobicContact CD1-CG2 4.22Å; I52-V114 HydrophobicContact CG1-CG2 3.64Å; V62-V114 HydrophobicContact CG1-CB 3.87Å; V62-V114 HydrophobicContact CG1-CG1 4.14Å; V62-V114 HydrophobicContact CG1-CG2 3.97Å; V62-V114 HydrophobicContact CG2-CG2 4.17Å; L75-V114 HydrophobicContact CB-CG1 3.51Å; L75-V114 HydrophobicContact CD1-CG1 3.91Å; L75-V114 HydrophobicContact CG-CG1 4.35Å; E76-V114 CarbonylContact O-C 3.54Å; E76-V114 WeakPolarHBondContact O-CA 3.35Å; V77-V114 HydrophobicContact CG2-CG2 4.31Å; L86-V114 HydrophobicContact CD1-CG1 4.49Å
115	L	93.3	Very high	92.9	Very high	51 Å²	51	53.3 Å²	53.3	27%	0.267	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	130.5	179	-50.3	-175.9	0	0	0	109.4	V47 T49 L75 E76 T78	V47-L115 HydrophobicContact CG1-CB 3.89Å; V47-L115 HydrophobicContact CG1-CD1 4.34Å; V47-L115 HydrophobicContact CG1-CD2 3.76Å; V47-L115 HydrophobicContact CG1-CG 4.18Å; T49-L115 HydrophobicContact CG2-CD2 3.89Å; L75-L115 CarbonylContact C-O 3.57Å; L75-L115 WeakPolarHBondContact CA-O 3.21Å; E76-L115 PolarHBondContact N-O 3.07Å; E76-L115 PolarHBondContact O-N 3.23Å; T78-L115 HydrophobicContact CG2-CD1 3.67Å; T78-L115 HydrophobicContact CG2-CD2 3.96Å; T78-L115 HydrophobicContact CG2-CG 3.56Å
116	D	92.7	Very high	92.8	Very high	14 Å²	14	52.1 Å²	52.1	8%	0.075	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	132.3	163.8	-175	14.1	0	0	0	109.8	A48 F64 P69 N73 L75 G118	A48-D116 HydrophobicContact CB-CB 4.11Å; A48-D116 PolarHBondContact O-N 3.46Å; F64-D116 HydrophobicContact CE1-CB 4.35Å; P69-D116 HydrophobicContact CB-CB 4.5Å; P69-D116 WeakPolarHBondContact CB-OD2 3.37Å; P69-D116 HydrophobicContact CG-CB 3.94Å; N73-D116 PolarHBondContact ND2-OD1 2.93Å; L75-D116 HydrophobicContact CD2-CB 3.92Å; D116-G118 VanDerWaalsContact C-N 3.31Å; D116-G118 PolarHBondContact OD1-N 3.35Å
117	T	89.6	Confident	92.9	Very high	42 Å²	42	46.5 Å²	46.5	26%	0.258	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-12.7	173.6	66.3	0	0	0	0	112.4	A74 E76 A119	A74-T117 HydrophobicContact CB-CG2 4.42Å; A74-T117 WeakPolarHBondContact O-CB 3.25Å; A74-T117 WeakPolarHBondContact O-CG2 3.48Å; A74-T117 PolarHBondContact O-N 2.81Å; A74-T117 VanDerWaalsContact O-N 3.12Å; A74-T117 PolarHBondContact O-OG1 2.95Å; E76-T117 HydrophobicContact CG-CG2 3.87Å; T117-A119 VanDerWaalsContact C-N 3.25Å; T117-A119 PolarHBondContact O-N 3.31Å; T117-A119 PolarHBondContact OG1-O 2.89Å; T117-A119 VanDerWaalsContact OG1-O 3.05Å
118	G	88.9	Confident	93	Very high	41 Å²	41	46.4 Å²	46.4	42%	0.423	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	78.7	1.7	-179	0	0	0	0	0	114.5	N73 D116	N73-G118 VanDerWaalsContact ND2-C 3.25Å; N73-G118 WeakPolarHBondContact ND2-CA 3.28Å; D116-G118 VanDerWaalsContact C-N 3.31Å; D116-G118 PolarHBondContact OD1-N 3.35Å
119	A	90.5	Very high	93	Very high	20 Å²	20	45.2 Å²	45.2	17%	0.165	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	167.1	180	0	0	0	0	0	111.6	N73 A74 T117	N73-A119 WeakPolarHBondContact CA-O 3.44Å; N73-A119 PolarHBondContact ND2-N 3.12Å; A74-A119 PolarHBondContact N-O 2.93Å; T117-A119 VanDerWaalsContact C-N 3.25Å; T117-A119 PolarHBondContact O-N 3.31Å; T117-A119 PolarHBondContact OG1-O 2.89Å; T117-A119 VanDerWaalsContact OG1-O 3.05Å
120	P	94.1	Very high	93	Very high	24 Å²	24	40.5 Å²	40.5	16%	0.156	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	168.1	164.9	-21.5	33.8	0	0	0	112.8	L72 R122 P154 H156	L72-P120 VanDerWaalsContact O-CA 3.25Å; L72-P120 WeakPolarHBondContact O-CA 3.43Å; L72-P120 WeakPolarHBondContact O-CB 3.29Å; P120-R122 WeakPolarHBondContact O-CG 3.48Å; P120-R122 PolarHBondContact O-N 2.93Å; P120-P154 HydrophobicContact CB-CB 4.12Å; P120-P154 HydrophobicContact CG-CB 4.37Å; P120-H156 HydrophobicContact CB-CB 4.39Å
121	I	94.9	Very high	92.8	Very high	7 Å²	7	31.4 Å²	31.4	4%	0.036	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-52.6	117	174.8	-59.6	175.1	0	0	0	108.9	A74 V85 M102 I123 I137 P154 I155	A74-I121 HydrophobicContact CB-CB 4.48Å; A74-I121 HydrophobicContact CB-CG1 3.75Å; V85-I121 HydrophobicContact CG1-CD1 4.3Å; V85-I121 HydrophobicContact CG1-CG1 4.12Å; M102-I121 HydrophobicContact CG-CD1 3.92Å; M102-I121 HydrophobicContact SD-CD1 4Å; I121-I123 HydrophobicContact CG2-CG2 4.3Å; I121-I137 HydrophobicContact CD1-CG2 4.49Å; I121-I137 HydrophobicContact CG2-CB 4.36Å; I121-I137 HydrophobicContact CG2-CG2 4.17Å; I121-P154 CarbonylContact O-C 3.57Å; I121-P154 WeakPolarHBondContact O-CA 3.32Å; I121-I155 HydrophobicContact CB-CD1 3.9Å; I121-I155 HydrophobicContact CB-CG1 4.09Å; I121-I155 HydrophobicContact CD1-CD1 4.04Å; I121-I155 HydrophobicContact CG1-CD1 4.42Å; I121-I155 HydrophobicContact CG2-CD1 4.31Å; I121-I155 HydrophobicContact CG2-CG2 4.39Å; I121-I155 PolarHBondContact O-N 2.71Å
122	R	93.7	Very high	93	Very high	86 Å²	86	30.3 Å²	30.3	33%	0.325	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	132.3	177.9	-58.3	-174	75.1	102.6	9.5	110.1	D37 P120 T152 A153	D37-R122 PolarHBondContact O-NH2 2.93Å; P120-R122 WeakPolarHBondContact O-CG 3.48Å; P120-R122 PolarHBondContact O-N 2.93Å; R122-T152 PolarHBondContact NE-OG1 3.1Å; R122-T152 PolarHBondContact NH2-O 3.28Å; R122-A153 WeakPolarHBondContact CA-O 3.45Å
123	I	95.3	Very high	93.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	155.9	-177.1	67.1	167.2	0	0	0	110.6	I121 V125 T152 A153 I155 T274 T277 V278	I121-I123 HydrophobicContact CG2-CG2 4.3Å; I123-V125 HydrophobicContact CD1-CG1 4.39Å; I123-V125 HydrophobicContact CG1-CG1 4.17Å; I123-T152 WeakPolarHBondContact O-CA 3Å; I123-T152 WeakPolarHBondContact O-CB 3.3Å; I123-A153 PolarHBondContact N-O 3.33Å; I123-A153 PolarHBondContact O-N 3.07Å; I123-A153 VanDerWaalsContact O-N 3.09Å; I123-I155 HydrophobicContact CD1-CG2 4.22Å; I123-I155 HydrophobicContact CG1-CG2 4.27Å; I123-I155 HydrophobicContact CG2-CG2 3.57Å; I123-T274 HydrophobicContact CD1-CG2 3.68Å; I123-T274 WeakPolarHBondContact CD1-O 3.28Å; I123-T274 HydrophobicContact CG2-CG2 4.15Å; I123-T277 HydrophobicContact CD1-CG2 3.95Å; I123-T277 HydrophobicContact CG1-CG2 4.17Å; I123-V278 HydrophobicContact CD1-CG2 3.87Å
124	P	95.3	Very high	93.1	Very high	18 Å²	18	22.7 Å²	22.7	12%	0.117	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	135.5	171.3	30.9	-33	0	0	0	110.3	M134 G138 I147 T149	P124-M134 HydrophobicContact CG-CE 4.3Å; P124-G138 WeakPolarHBondContact CD-O 3.48Å; P124-G138 WeakPolarHBondContact CG-O 3.3Å; P124-I147 HydrophobicContact CB-CB 4.45Å; P124-I147 HydrophobicContact CB-CG2 4.07Å; P124-I147 HydrophobicContact CG-CB 4.32Å; P124-I147 HydrophobicContact CG-CD1 4.2Å; P124-I147 HydrophobicContact CG-CG2 4.27Å; P124-T149 HydrophobicContact CB-CG2 3.33Å
125	V	94.4	Very high	93.2	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	154.7	175.1	-64.7	0	0	0	0	109.8	Y38 I123 T149 Q151 A153 T277 V278 Y281	Y38-V125 HydrophobicContact CD1-CG2 4.23Å; I123-V125 HydrophobicContact CD1-CG1 4.39Å; I123-V125 HydrophobicContact CG1-CG1 4.17Å; V125-T149 PolarHBondContact O-OG1 2.86Å; V125-Q151 HydrophobicContact CG2-CB 4.21Å; V125-Q151 PolarHBondContact N-O 2.94Å; V125-A153 HydrophobicContact CG1-CB 3.98Å; V125-A153 HydrophobicContact CG2-CB 4.08Å; V125-T277 HydrophobicContact CG1-CG2 4.42Å; V125-V278 HydrophobicContact CG1-CG2 4.43Å; V125-Y281 HydrophobicContact CB-CD2 3.95Å; V125-Y281 HydrophobicContact CB-CG 3.85Å; V125-Y281 HydrophobicContact CG2-CD2 3.57Å; V125-Y281 HydrophobicContact CG2-CE2 4.25Å; V125-Y281 HydrophobicContact CG2-CG 4.01Å
126	G	91.4	Very high	93.3	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.01	13%	0.125	C	C	.	.	S	Bend	trans	134.6	168.2	-178.3	0	0	0	0	0	113.3	E128 T129 Y281	G126-E128 PolarHBondContact O-N 2.91Å; G126-E128 VanDerWaalsContact O-N 3.08Å; G126-T129 PolarHBondContact O-N 3.38Å; G126-T129 PolarHBondContact O-OG1 3.04Å; G126-Y281 VanDerWaalsContact CA-CE1 3.47Å
127	P	91.6	Very high	93.4	Very high	49 Å²	49	21.8 Å²	21.8	32%	0.318	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-55.6	-25.2	171.7	-25.8	36.2	0	0	0	113.1	T129 L130 F282 E286	P127-T129 PolarHBondContact O-N 3.41Å; P127-T129 VanDerWaalsContact O-N 3.16Å; P127-L130 HydrophobicContact CB-CD1 4.21Å; P127-L130 VanDerWaalsContact O-CB 3.3Å; P127-L130 WeakPolarHBondContact O-CB 3.39Å; P127-L130 WeakPolarHBondContact O-CG 3.37Å; P127-L130 PolarHBondContact O-N 3.1Å; P127-F282 HydrophobicContact CG-CE1 4.44Å; P127-E286 VanDerWaalsContact CD-OE1 3.24Å; P127-E286 WeakPolarHBondContact CD-OE1 3.34Å; P127-E286 WeakPolarHBondContact CG-OE1 3.32Å
128	E	92	Very high	93.6	Very high	65 Å²	65	20.1 Å²	20.1	30%	0.304	12%	0.116	S	C	.	.	G	3₁₀ helix	trans	-65.4	-10.3	176	-57.2	92.5	161.3	0	0	113.7	G126 K150	G126-E128 PolarHBondContact O-N 2.91Å; G126-E128 VanDerWaalsContact O-N 3.08Å; E128-K150 IonicContact OE1-NZ 3.79Å; E128-K150 PolarHBondContact OE1-NZ 3.38Å
129	T	93.7	Very high	93.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-85.6	-10.9	171.1	71.2	0	0	0	0	113.6	G126 P127 R132 M134 I147	G126-T129 PolarHBondContact O-N 3.38Å; G126-T129 PolarHBondContact O-OG1 3.04Å; P127-T129 PolarHBondContact O-N 3.41Å; P127-T129 VanDerWaalsContact O-N 3.16Å; T129-R132 WeakPolarHBondContact O-CB 3.06Å; T129-R132 PolarHBondContact O-N 2.93Å; T129-M134 HydrophobicContact CG2-CE 3.67Å; T129-I147 HydrophobicContact CG2-CG2 4.18Å
130	L	92.6	Very high	94.1	Very high	22 Å²	22	22.3 Å²	22.3	12%	0.115	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	135.3	-176.8	-63.5	166.9	0	0	0	111.4	P127 R132 Y219 A255 F282	P127-L130 HydrophobicContact CB-CD1 4.21Å; P127-L130 VanDerWaalsContact O-CB 3.3Å; P127-L130 WeakPolarHBondContact O-CB 3.39Å; P127-L130 WeakPolarHBondContact O-CG 3.37Å; P127-L130 PolarHBondContact O-N 3.1Å; L130-R132 PolarHBondContact O-N 3.43Å; L130-Y219 HydrophobicContact CD1-CD1 3.68Å; L130-Y219 HydrophobicContact CD1-CE1 3.25Å; L130-Y219 HydrophobicContact CD1-CE2 4.23Å; L130-Y219 HydrophobicContact CD1-CG 4.35Å; L130-Y219 HydrophobicContact CD2-CD1 3.76Å; L130-Y219 HydrophobicContact CD2-CE1 4.23Å; L130-Y219 HydrophobicContact CD2-CG 4.11Å; L130-Y219 HydrophobicContact CG-CD1 4.4Å; L130-Y219 HydrophobicContact CG-CE1 4.4Å; L130-A255 HydrophobicContact CD2-CB 4.5Å; L130-F282 HydrophobicContact CD1-CZ 4.47Å; L130-F282 HydrophobicContact CD2-CE2 4.33Å; L130-F282 HydrophobicContact CD2-CZ 3.97Å; L130-F282 HydrophobicContact CG-CZ 4.13Å
131	G	91.7	Very high	94	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	9.7	-174.2	0	0	0	0	0	114.2	R144 V254	G131-R144 PolarHBondContact O-NH1 2.84Å; G131-V254 WeakPolarHBondContact CA-O 3.4Å; G131-V254 PolarHBondContact N-O 3.46Å
132	R	95	Very high	93.9	Very high	24 Å²	24	25 Å²	25	9%	0.091	13%	0.129	C	C	.	.			trans	-100.7	155.3	176.3	-53	-56.7	-54.9	-88.4	-4	111	T129 L130 D142 G145 P146 I147 L256	T129-R132 WeakPolarHBondContact O-CB 3.06Å; T129-R132 PolarHBondContact O-N 2.93Å; L130-R132 PolarHBondContact O-N 3.43Å; R132-D142 WeakPolarHBondContact CA-OD2 3.38Å; R132-D142 IonicContact CZ-OD1 2.68Å; R132-D142 IonicContact CZ-OD2 3.99Å; R132-D142 IonicContact NE-OD1 2.7Å; R132-D142 IonicContact NE-OD2 3.75Å; R132-D142 PolarHBondContact NE-OD2 2.84Å; R132-D142 IonicContact NH2-OD1 2.75Å; R132-D142 PolarHBondContact NH2-OD1 3.26Å; R132-D142 IonicContact NH2-OD2 3.52Å; R132-D142 PolarHBondContact NH2-OD2 3.06Å; R132-G145 PolarHBondContact NH2-O 3.24Å; R132-P146 PolarHBondContact NH1-O 3.43Å; R132-I147 HydrophobicContact CB-CD1 4.14Å; R132-I147 HydrophobicContact CB-CG1 4.49Å; R132-I147 HydrophobicContact CG-CD1 4.48Å; R132-I147 HydrophobicContact CG-CG1 4.37Å; R132-L256 PolarHBondContact O-N 3.05Å
133	I	95.5	Very high	93.8	Very high	13 Å²	13	30.3 Å²	30.3	7%	0.067	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125.1	166.6	-43	175.4	0	0	0	109	P140 I141 D142 Y236 L256 Y258	I133-P140 VanDerWaalsContact O-CA 3.29Å; I133-P140 WeakPolarHBondContact O-CA 3.42Å; I133-I141 HydrophobicContact CB-CG1 3.96Å; I133-I141 HydrophobicContact CG2-CD1 3.77Å; I133-I141 HydrophobicContact CG2-CG1 3.53Å; I133-I141 PolarHBondContact O-N 3.32Å; I133-D142 HydrophobicContact CB-CB 4Å; I133-D142 HydrophobicContact CD1-CB 4.12Å; I133-D142 HydrophobicContact CG1-CB 3.93Å; I133-D142 PolarHBondContact N-OD2 2.84Å; I133-Y236 HydrophobicContact CD1-CD1 4Å; I133-Y236 HydrophobicContact CD1-CD2 3.85Å; I133-Y236 HydrophobicContact CD1-CE1 4.09Å; I133-Y236 HydrophobicContact CD1-CE2 3.95Å; I133-Y236 HydrophobicContact CD1-CG 3.86Å; I133-Y236 HydrophobicContact CG1-CD2 4.15Å; I133-Y236 HydrophobicContact CG1-CE2 4.03Å; I133-L256 CarbonylContact C-O 3.57Å; I133-L256 WeakPolarHBondContact CA-O 3.49Å; I133-L256 HydrophobicContact CB-CB 4.38Å; I133-L256 HydrophobicContact CG1-CB 4.16Å; I133-L256 HydrophobicContact CG1-CD1 4Å; I133-L256 HydrophobicContact CG2-CB 4.2Å; I133-Y258 HydrophobicContact CD1-CE2 4.39Å; I133-Y258 HydrophobicContact CG2-CD2 3.46Å; I133-Y258 VanDerWaalsContact CG2-CD2 3.46Å; I133-Y258 HydrophobicContact CG2-CE2 3.94Å; I133-Y258 HydrophobicContact CG2-CG 4.05Å
134	M	95.6	Very high	93.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	152.9	174.3	65	176.6	69.7	0	0	112.7	P124 T129 E139 I147 L256 V257 Y258 T274 V278	P124-M134 HydrophobicContact CG-CE 4.3Å; T129-M134 HydrophobicContact CG2-CE 3.67Å; M134-E139 CarbonylContact C-O 3.57Å; M134-E139 VanDerWaalsContact CA-O 3.25Å; M134-E139 WeakPolarHBondContact CA-O 3.44Å; M134-I147 HydrophobicContact CB-CD1 4.21Å; M134-I147 HydrophobicContact CE-CD1 3.94Å; M134-L256 PolarHBondContact N-O 3.49Å; M134-V257 HydrophobicContact CG-CB 4.24Å; M134-V257 HydrophobicContact CG-CG1 4.15Å; M134-V257 HydrophobicContact CG-CG2 3.76Å; M134-V257 WeakPolarHBondContact O-CA 3.31Å; M134-V257 HydrophobicContact SD-CG2 3.97Å; M134-Y258 PolarHBondContact O-N 3.48Å; M134-T274 HydrophobicContact SD-CG2 4.3Å; M134-V278 HydrophobicContact CE-CG2 4.3Å; M134-V278 HydrophobicContact SD-CG2 4.09Å
135	N	95	Very high	93.5	Very high	28 Å²	28	35.7 Å²	35.7	15%	0.15	19%	0.186	C	C	.	.			trans	-85.9	-178.9	171.5	71.8	11.7	0	0	0	112.3	I137 G138 E139 I141 Y258	N135-I137 VanDerWaalsContact C-N 3.26Å; N135-I137 PolarHBondContact O-N 3.42Å; N135-I137 WeakPolarHBondContact OD1-CG1 3.4Å; N135-I137 PolarHBondContact OD1-N 3.13Å; N135-I137 VanDerWaalsContact OD1-N 3.1Å; N135-G138 PolarHBondContact O-N 3.47Å; N135-G138 PolarHBondContact OD1-N 3.27Å; N135-G138 VanDerWaalsContact OD1-N 3.12Å; N135-E139 PolarHBondContact N-O 2.88Å; N135-E139 PolarHBondContact OD1-N 3.36Å; N135-E139 PolarHBondContact OD1-O 3.5Å; N135-I141 HydrophobicContact CB-CG2 3.95Å; N135-Y258 WeakPolarHBondContact CA-O 3.42Å
136	V	95.3	Very high	93.3	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.024	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-31.8	-180	66	0	0	0	0	114.9	M102 A267 R270 V271 T274	M102-V136 HydrophobicContact CB-CG1 4.32Å; M102-V136 HydrophobicContact SD-CG2 4.5Å; V136-A267 HydrophobicContact CB-CB 4.34Å; V136-A267 HydrophobicContact CG1-CB 3.74Å; V136-R270 HydrophobicContact CG2-CB 3.54Å; V136-V271 HydrophobicContact CB-CB 4.33Å; V136-V271 HydrophobicContact CG2-CB 4.31Å; V136-T274 PolarHBondContact O-OG1 3.44Å
137	I	94.9	Very high	93.4	Very high	13 Å²	13	41.3 Å²	41.3	7%	0.067	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	7.9	177.7	61.5	172.5	0	0	0	113.4	V85 M102 I121 N135 E139	V85-I137 HydrophobicContact CB-CG2 4.03Å; V85-I137 HydrophobicContact CG1-CG2 4.43Å; V85-I137 HydrophobicContact CG2-CD1 3.95Å; V85-I137 HydrophobicContact CG2-CG2 4Å; M102-I137 HydrophobicContact CB-CG2 4.15Å; M102-I137 HydrophobicContact CG-CG2 4.22Å; I121-I137 HydrophobicContact CD1-CG2 4.49Å; I121-I137 HydrophobicContact CG2-CB 4.36Å; I121-I137 HydrophobicContact CG2-CG2 4.17Å; N135-I137 VanDerWaalsContact C-N 3.26Å; N135-I137 PolarHBondContact O-N 3.42Å; N135-I137 WeakPolarHBondContact OD1-CG1 3.4Å; N135-I137 PolarHBondContact OD1-N 3.13Å; N135-I137 VanDerWaalsContact OD1-N 3.1Å; I137-E139 HydrophobicContact CD1-CG 4.21Å; I137-E139 HydrophobicContact CG1-CG 4.09Å
138	G	93.4	Very high	93.2	Very high	7 Å²	7	43.5 Å²	43.5	7%	0.072	24%	0.238	C	C	.	.	S	Bend	trans	83	11.7	175	0	0	0	0	0	115.2	P124 N135	P124-G138 WeakPolarHBondContact CD-O 3.48Å; P124-G138 WeakPolarHBondContact CG-O 3.3Å; N135-G138 PolarHBondContact O-N 3.47Å; N135-G138 PolarHBondContact OD1-N 3.27Å; N135-G138 VanDerWaalsContact OD1-N 3.12Å
139	E	94.6	Very high	93	Very high	64 Å²	64	41.9 Å²	41.9	30%	0.299	23%	0.232	S	C	.	.			trans	-85.4	140.6	176.8	-66.2	178.1	163.9	0	0	111.1	R83 M134 N135 I137	R83-E139 WeakPolarHBondContact CD-OE1 3.3Å; R83-E139 IonicContact CZ-OE1 3.81Å; R83-E139 IonicContact NE-OE1 2.83Å; R83-E139 IonicContact NH1-OE1 3.69Å; R83-E139 PolarHBondContact NH1-OE1 3.25Å; M134-E139 CarbonylContact C-O 3.57Å; M134-E139 VanDerWaalsContact CA-O 3.25Å; M134-E139 WeakPolarHBondContact CA-O 3.44Å; N135-E139 PolarHBondContact N-O 2.88Å; N135-E139 PolarHBondContact OD1-N 3.36Å; N135-E139 PolarHBondContact OD1-O 3.5Å; I137-E139 HydrophobicContact CD1-CG 4.21Å; I137-E139 HydrophobicContact CG1-CG 4.09Å
140	P	95.3	Very high	92.5	Very high	44 Å²	44	48.8 Å²	48.8	29%	0.286	26%	0.262	S	S	.	.	B	Isolated β-bridge	trans	-70.9	133.3	178.7	26.6	-31	0	0	0	111.7	I133 G145 I147	I133-P140 VanDerWaalsContact O-CA 3.29Å; I133-P140 WeakPolarHBondContact O-CA 3.42Å; P140-G145 WeakPolarHBondContact CG-O 2.78Å; P140-I147 HydrophobicContact CB-CD1 4.18Å; P140-I147 HydrophobicContact CB-CG1 3.95Å; P140-I147 HydrophobicContact CG-CG1 4.19Å
141	I	93.4	Very high	92.4	Very high	70 Å²	70	50.5 Å²	50.5	36%	0.359	27%	0.27	S	S	.	.			trans	-115.7	15.2	176.8	63.1	172.6	0	0	0	112.7	I133 N135	I133-I141 HydrophobicContact CB-CG1 3.96Å; I133-I141 HydrophobicContact CG2-CD1 3.77Å; I133-I141 HydrophobicContact CG2-CG1 3.53Å; I133-I141 PolarHBondContact O-N 3.32Å; N135-I141 HydrophobicContact CB-CG2 3.95Å
142	D	92.2	Very high	92.4	Very high	18 Å²	18	51.6 Å²	51.6	10%	0.096	28%	0.276	C	S	.	.	S	Bend	trans	-99.9	10.9	-178.4	66	-1.8	0	0	0	114.1	R132 I133 R144	R132-D142 WeakPolarHBondContact CA-OD2 3.38Å; R132-D142 IonicContact CZ-OD1 2.68Å; R132-D142 IonicContact CZ-OD2 3.99Å; R132-D142 IonicContact NE-OD1 2.7Å; R132-D142 IonicContact NE-OD2 3.75Å; R132-D142 PolarHBondContact NE-OD2 2.84Å; R132-D142 IonicContact NH2-OD1 2.75Å; R132-D142 PolarHBondContact NH2-OD1 3.26Å; R132-D142 IonicContact NH2-OD2 3.52Å; R132-D142 PolarHBondContact NH2-OD2 3.06Å; I133-D142 HydrophobicContact CB-CB 4Å; I133-D142 HydrophobicContact CD1-CB 4.12Å; I133-D142 HydrophobicContact CG1-CB 3.93Å; I133-D142 PolarHBondContact N-OD2 2.84Å; D142-R144 WeakPolarHBondContact O-CG 3.49Å; D142-R144 PolarHBondContact O-N 3.36Å; D142-R144 PolarHBondContact OD1-N 2.66Å; D142-R144 IonicContact OD2-NH1 3.56Å
143	E	92.2	Very high	92.4	Very high	197 Å²	197	50.6 Å²	50.6	92%	0.921	27%	0.274	S	S	*	.	S	Bend	trans	55.6	7.5	-176.7	-58.2	-169.8	163.4	0	0	115.9	G145	E143-G145 PolarHBondContact O-N 3.3Å; E143-G145 VanDerWaalsContact O-N 3.17Å
144	R	90.5	Very high	92.4	Very high	94 Å²	94	50.9 Å²	50.9	36%	0.355	28%	0.276	S	S	.	.	S	Bend	trans	-89.2	28.9	-175.7	-70.5	160.5	68.2	-158	0.4	113.7	G131 D142 Y236	G131-R144 PolarHBondContact O-NH1 2.84Å; D142-R144 WeakPolarHBondContact O-CG 3.49Å; D142-R144 PolarHBondContact O-N 3.36Å; D142-R144 PolarHBondContact OD1-N 2.66Å; D142-R144 IonicContact OD2-NH1 3.56Å; R144-Y236 PolarHBondContact NH1-OH 2.96Å
145	G	92.3	Very high	92.4	Very high	37 Å²	37	50.9 Å²	50.9	38%	0.381	28%	0.276	S	S	.	.			trans	71.1	-173.1	-177.9	0	0	0	0	0	114.1	R132 P140 E143	R132-G145 PolarHBondContact NH2-O 3.24Å; P140-G145 WeakPolarHBondContact CG-O 2.78Å; E143-G145 PolarHBondContact O-N 3.3Å; E143-G145 VanDerWaalsContact O-N 3.17Å
146	P	92.3	Very high	92.4	Very high	100 Å²	100	51.2 Å²	51.2	65%	0.649	28%	0.277	S	S	*	.			trans	-66	152.5	-175	26.9	-34.8	0	0	0	113.4	R132 S148	R132-P146 PolarHBondContact NH1-O 3.43Å; P146-S148 PolarHBondContact O-N 3.02Å
147	I	91.9	Very high	92.1	Very high	19 Å²	19	52.2 Å²	52.2	10%	0.097	29%	0.285	C	S	.	.			trans	-82	103.6	169.2	-57.8	179	0	0	0	108	P124 T129 R132 M134 P140 T149	P124-I147 HydrophobicContact CB-CB 4.45Å; P124-I147 HydrophobicContact CB-CG2 4.07Å; P124-I147 HydrophobicContact CG-CB 4.32Å; P124-I147 HydrophobicContact CG-CD1 4.2Å; P124-I147 HydrophobicContact CG-CG2 4.27Å; T129-I147 HydrophobicContact CG2-CG2 4.18Å; R132-I147 HydrophobicContact CB-CD1 4.14Å; R132-I147 HydrophobicContact CB-CG1 4.49Å; R132-I147 HydrophobicContact CG-CD1 4.48Å; R132-I147 HydrophobicContact CG-CG1 4.37Å; M134-I147 HydrophobicContact CB-CD1 4.21Å; M134-I147 HydrophobicContact CE-CD1 3.94Å; P140-I147 HydrophobicContact CB-CD1 4.18Å; P140-I147 HydrophobicContact CB-CG1 3.95Å; P140-I147 HydrophobicContact CG-CG1 4.19Å; I147-T149 VanDerWaalsContact C-N 3.33Å; I147-T149 PolarHBondContact O-N 3.39Å
148	S	87	Confident	92	Very high	95 Å²	95	58.2 Å²	58.2	66%	0.664	31%	0.313	S	S	*	.			trans	-84.2	71.4	-175.6	-62.3	0	0	0	0	111.9	P146	P146-S148 PolarHBondContact O-N 3.02Å
149	T	87.9	Confident	92	Very high	30 Å²	30	59.6 Å²	59.6	18%	0.184	32%	0.324	C	S	.	.			trans	-88.5	158.9	174.8	-179.3	0	0	0	0	113.1	P124 V125 I147 Q151	P124-T149 HydrophobicContact CB-CG2 3.33Å; V125-T149 PolarHBondContact O-OG1 2.86Å; I147-T149 VanDerWaalsContact C-N 3.33Å; I147-T149 PolarHBondContact O-N 3.39Å; T149-Q151 VanDerWaalsContact CG2-O 3.24Å; T149-Q151 WeakPolarHBondContact CG2-O 3.28Å; T149-Q151 PolarHBondContact OG1-N 3.5Å; T149-Q151 PolarHBondContact OG1-O 3.22Å
150	K	84.8	Confident	91.9	Very high	146 Å²	146	57.1 Å²	57.1	64%	0.635	31%	0.313	S	S	*	.	S	Bend	trans	-88.6	-16	169.3	-60.9	167.1	-166.1	115	0	113.5	A40 P41 E128	A40-K150 WeakPolarHBondContact CA-O 3.13Å; P41-K150 WeakPolarHBondContact CD-O 3.36Å; E128-K150 IonicContact OE1-NZ 3.79Å; E128-K150 PolarHBondContact OE1-NZ 3.38Å
151	Q	89.8	Confident	91.8	Very high	57 Å²	57	61.7 Å²	61.7	27%	0.266	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	146.3	-169.8	-61.5	-172.3	18.4	0	0	112.5	V125 T149	V125-Q151 HydrophobicContact CG2-CB 4.21Å; V125-Q151 PolarHBondContact N-O 2.94Å; T149-Q151 VanDerWaalsContact CG2-O 3.24Å; T149-Q151 WeakPolarHBondContact CG2-O 3.28Å; T149-Q151 PolarHBondContact OG1-N 3.5Å; T149-Q151 PolarHBondContact OG1-O 3.22Å
152	T	92.4	Very high	91.7	Very high	23 Å²	23	67 Å²	67	14%	0.141	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	143.8	172.1	64.3	0	0	0	0	110.8	V39 R122 I123	V39-T152 PolarHBondContact N-O 3.35Å; V39-T152 PolarHBondContact O-N 2.92Å; R122-T152 PolarHBondContact NE-OG1 3.1Å; R122-T152 PolarHBondContact NH2-O 3.28Å; I123-T152 WeakPolarHBondContact O-CA 3Å; I123-T152 WeakPolarHBondContact O-CB 3.3Å
153	A	93.9	Very high	91.7	Very high	4 Å²	4	70.1 Å²	70.1	3%	0.033	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	143.9	178.4	0	0	0	0	0	110.7	Y38 R122 I123 V125 T277	Y38-A153 HydrophobicContact CD1-CB 4.08Å; Y38-A153 HydrophobicContact CE1-CB 4.11Å; R122-A153 WeakPolarHBondContact CA-O 3.45Å; I123-A153 PolarHBondContact N-O 3.33Å; I123-A153 PolarHBondContact O-N 3.07Å; I123-A153 VanDerWaalsContact O-N 3.09Å; V125-A153 HydrophobicContact CG1-CB 3.98Å; V125-A153 HydrophobicContact CG2-CB 4.08Å; A153-T277 HydrophobicContact CB-CG2 3.69Å
154	P	95.8	Very high	91.5	Very high	19 Å²	19	64.4 Å²	64.4	12%	0.123	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	142	172.8	30.9	-33.9	0	0	0	110.8	P120 I121 H156 T277	P120-P154 HydrophobicContact CB-CB 4.12Å; P120-P154 HydrophobicContact CG-CB 4.37Å; I121-P154 CarbonylContact O-C 3.57Å; I121-P154 WeakPolarHBondContact O-CA 3.32Å; P154-H156 PolarHBondContact O-N 3Å; P154-T277 WeakPolarHBondContact O-CG2 3.46Å
155	I	95.4	Very high	91.3	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.345	C	S	.	.	S	Bend	trans	-69.1	-23.2	178.1	68.4	175.5	0	0	0	113.4	I121 I123 R270 L273 T277 R334	I121-I155 HydrophobicContact CB-CD1 3.9Å; I121-I155 HydrophobicContact CB-CG1 4.09Å; I121-I155 HydrophobicContact CD1-CD1 4.04Å; I121-I155 HydrophobicContact CG1-CD1 4.42Å; I121-I155 HydrophobicContact CG2-CD1 4.31Å; I121-I155 HydrophobicContact CG2-CG2 4.39Å; I121-I155 PolarHBondContact O-N 2.71Å; I123-I155 HydrophobicContact CD1-CG2 4.22Å; I123-I155 HydrophobicContact CG1-CG2 4.27Å; I123-I155 HydrophobicContact CG2-CG2 3.57Å; I155-R270 HydrophobicContact CD1-CB 4.08Å; I155-R270 HydrophobicContact CD1-CG 4.39Å; I155-L273 HydrophobicContact CB-CB 4.24Å; I155-T277 WeakPolarHBondContact CA-OG1 3.47Å; I155-T277 PolarHBondContact O-OG1 3.02Å; I155-R334 PolarHBondContact O-NH1 3.18Å; I155-R334 PolarHBondContact O-NH2 2.74Å
156	H	94.2	Very high	91.1	Very high	35 Å²	35	63.1 Å²	63.1	16%	0.162	34%	0.341	C	S	.	.			trans	-94.1	117.9	176.3	-67.6	-67	0	0	0	109.4	L72 E87 P120 P154	L72-H156 HydrophobicContact CD1-CB 4.11Å; E87-H156 IonicContact OE1-NE2 2.77Å; E87-H156 IonicContact OE2-CD2 3.38Å; E87-H156 IonicContact OE2-CE1 3.72Å; E87-H156 IonicContact OE2-NE2 3.69Å; E87-H156 PolarHBondContact OE2-NE2 2.74Å; P120-H156 HydrophobicContact CB-CB 4.39Å; P154-H156 PolarHBondContact O-N 3Å
157	A	90.9	Very high	90.8	Very high	24 Å²	24	65 Å²	65	20%	0.198	35%	0.35	C	S	.	.			trans	-146.6	150.7	177.7	0	0	0	0	0	109.2	R36 R334	R36-A157 HydrophobicContact CG-CB 4.21Å; A157-R334 WeakPolarHBondContact O-CD 3.38Å
158	E	92.3	Very high	90.5	Very high	140 Å²	140	70.9 Å²	70.9	65%	0.654	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-69.6	155.6	172.3	-64.3	-58.8	147.5	0	0	111.4	R36	R36-E158 PolarHBondContact NH2-O 3.39Å
159	A	93.4	Very high	90.3	Very high	36 Å²	36	72.1 Å²	72.1	30%	0.298	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-62.4	154.3	168.4	0	0	0	0	0	111	E333 R334	A159-E333 HydrophobicContact CB-CB 4Å; A159-R334 HydrophobicContact CB-CG 4.35Å
160	P	92.5	Very high	90.3	Very high	12 Å²	12	75.3 Å²	75.3	8%	0.078	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-55.2	142.7	173	-24.2	35.2	0	0	0	111.9	M165 T336 T338	P160-M165 VanDerWaalsContact O-CE 3.27Å; P160-M165 WeakPolarHBondContact O-CE 3.17Å; P160-T336 HydrophobicContact CB-CG2 4.37Å; P160-T336 HydrophobicContact CG-CG2 3.68Å; P160-T338 HydrophobicContact CB-CG2 4.06Å; P160-T338 HydrophobicContact CG-CG2 3.91Å
161	E	92.7	Very high	90.6	Very high	139 Å²	139	70.5 Å²	70.5	65%	0.65	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-63.1	149.1	173.8	-70.4	-171.8	-171	0	0	110.9	T163 D164 M165	E161-T163 WeakPolarHBondContact CB-OG1 3.36Å; E161-T163 PolarHBondContact O-N 3.08Å; E161-T163 PolarHBondContact OE2-OG1 3.37Å; E161-D164 PolarHBondContact O-N 3.15Å; E161-M165 PolarHBondContact O-N 3.05Å
162	F	90.9	Very high	90.7	Very high	182 Å²	182	68.6 Å²	68.6	80%	0.798	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-30.9	175.3	178.9	-99.6	0	0	0	113.1	D164 M165	F162-D164 VanDerWaalsContact C-N 3.26Å; F162-D164 PolarHBondContact O-N 2.58Å; F162-M165 HydrophobicContact CD2-SD 4.31Å
163	T	91.9	Very high	90.6	Very high	83 Å²	83	69.8 Å²	69.8	51%	0.509	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-26.5	176.6	48	0	0	0	0	113.3	E161 K339	E161-T163 WeakPolarHBondContact CB-OG1 3.36Å; E161-T163 PolarHBondContact O-N 3.08Å; E161-T163 PolarHBondContact OE2-OG1 3.37Å; T163-K339 WeakPolarHBondContact O-CE 3.38Å; T163-K339 PolarHBondContact O-NZ 3.45Å
164	D	88.3	Confident	90.5	Very high	78 Å²	78	69.8 Å²	69.8	42%	0.417	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-5.8	-174.1	-80.4	-21.3	0	0	0	115	E161 F162 T338 K339	E161-D164 PolarHBondContact O-N 3.15Å; F162-D164 VanDerWaalsContact C-N 3.26Å; F162-D164 PolarHBondContact O-N 2.58Å; D164-T338 CarbonylContact O-C 3.45Å; D164-T338 VanDerWaalsContact O-CA 3.27Å; D164-T338 WeakPolarHBondContact O-CA 3.33Å; D164-K339 PolarHBondContact O-N 3.5Å; D164-K339 IonicContact OD1-NZ 3.4Å; D164-K339 PolarHBondContact OD1-NZ 3.12Å
165	M	87.4	Confident	90.4	Very high	62 Å²	62	69 Å²	69	31%	0.305	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-65.6	142.9	170.9	-61.4	179.3	-173.8	0	0	110.9	P160 E161 F162	P160-M165 VanDerWaalsContact O-CE 3.27Å; P160-M165 WeakPolarHBondContact O-CE 3.17Å; E161-M165 PolarHBondContact O-N 3.05Å; F162-M165 HydrophobicContact CD2-SD 4.31Å
166	S	87.6	Confident	90.4	Very high	42 Å²	42	69 Å²	69	29%	0.294	36%	0.359	S	S	.	.			trans	-81.6	149.7	167.6	-169.6	0	0	0	0	111	E168 T337	S166-E168 PolarHBondContact OG-N 3.12Å; S166-T337 PolarHBondContact N-O 2.82Å
167	V	86.4	Confident	90.5	Very high	140 Å²	140	67.3 Å²	67.3	85%	0.848	35%	0.352	S	S	*	.			trans	-103	-4.7	172.8	-62.7	0	0	0	0	112.6
168	E	84.8	Confident	90.7	Very high	142 Å²	142	66.2 Å²	66.2	66%	0.664	34%	0.343	S	S	*	.			trans	-80.1	123.3	-176.9	-66.6	175.8	158.8	0	0	110.5	S166	S166-E168 PolarHBondContact OG-N 3.12Å
169	Q	84	Confident	90.9	Very high	120 Å²	120	59.6 Å²	59.6	56%	0.561	31%	0.312	S	S	*	.			trans	-102.8	95.4	178	-68.6	-177.8	-25.3	0	0	109.3	I401	Q169-I401 HydrophobicContact CB-CD1 4.48Å; Q169-I401 HydrophobicContact CB-CG2 4.5Å
170	E	87.6	Confident	91	Very high	98 Å²	98	58 Å²	58	46%	0.458	30%	0.298	S	S	.	.			trans	-103.7	151.3	177.7	-59.8	-169.8	137.9	0	0	111.6	A186 K187	E170-A186 WeakPolarHBondContact O-CA 3.47Å; E170-K187 HydrophobicContact CB-CB 4.09Å; E170-K187 HydrophobicContact CB-CD 4.37Å; E170-K187 PolarHBondContact O-N 3.09Å; E170-K187 VanDerWaalsContact OE2-CD 3.31Å; E170-K187 WeakPolarHBondContact OE2-CD 3.12Å; E170-K187 IonicContact OE2-NZ 2.62Å
171	I	91.3	Very high	91.1	Very high	44 Å²	44	57.4 Å²	57.4	23%	0.226	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	125.1	172.3	-50.8	169.9	0	0	0	109.3	V173 P184 I396 V402 L473	I171-V173 HydrophobicContact CG2-CG2 4.48Å; I171-V173 PolarHBondContact O-N 2.79Å; I171-P184 HydrophobicContact CG2-CB 4.03Å; I171-I396 HydrophobicContact CG1-CD1 4.12Å; I171-V402 HydrophobicContact CD1-CB 4.31Å; I171-V402 HydrophobicContact CD1-CG1 3.78Å; I171-V402 HydrophobicContact CG1-CG1 4.3Å; I171-L473 HydrophobicContact CD1-CD2 4.34Å
172	L	90.5	Very high	91.3	Very high	18 Å²	18	50.9 Å²	50.9	9%	0.094	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	100.4	162.4	-179.7	65.9	0	0	0	109	T174 Y185 L291 T344	L172-T174 PolarHBondContact O-N 2.87Å; L172-Y185 PolarHBondContact N-O 2.8Å; L172-L291 HydrophobicContact CD2-CD2 4.19Å; L172-T344 HydrophobicContact CD2-CG2 3.77Å
173	V	91.8	Very high	91.5	Very high	48 Å²	48	42.2 Å²	42.2	29%	0.291	23%	0.226	S	C	.	.			trans	-67.6	118.4	174.9	-178.7	0	0	0	0	109.5	I171 D180 H216 L473	I171-V173 HydrophobicContact CG2-CG2 4.48Å; I171-V173 PolarHBondContact O-N 2.79Å; V173-D180 WeakPolarHBondContact CG1-OD2 3.29Å; V173-H216 PolarHBondContact O-NE2 2.95Å; V173-L473 HydrophobicContact CG1-CB 4.32Å; V173-L473 HydrophobicContact CG2-CB 4.48Å; V173-L473 HydrophobicContact CG2-CD2 4.35Å
174	T	91.6	Very high	91.7	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.018	20%	0.202	C	C	.	.			trans	-93.4	-19	-177.7	67.5	0	0	0	0	113.3	L172 I176 V179 D180 Y185 L208 N211	L172-T174 PolarHBondContact O-N 2.87Å; T174-I176 VanDerWaalsContact C-N 3.25Å; T174-I176 PolarHBondContact OG1-N 3.29Å; T174-V179 HydrophobicContact CG2-CG1 3.96Å; T174-D180 WeakPolarHBondContact CB-OD1 3.32Å; T174-D180 PolarHBondContact N-OD1 3.11Å; T174-D180 PolarHBondContact N-OD2 3.46Å; T174-D180 VanDerWaalsContact OG1-CG 3.29Å; T174-D180 PolarHBondContact OG1-OD1 2.89Å; T174-Y185 HydrophobicContact CG2-CD2 3.68Å; T174-Y185 HydrophobicContact CG2-CE2 4.15Å; T174-Y185 HydrophobicContact CG2-CG 4.31Å; T174-L208 HydrophobicContact CG2-CD2 3.74Å; T174-N211 VanDerWaalsContact O-CB 3.31Å; T174-N211 WeakPolarHBondContact O-CB 3.5Å; T174-N211 PolarHBondContact O-ND2 3.05Å; T174-N211 VanDerWaalsContact O-ND2 3.12Å
175	G	92.4	Very high	92	Very high	2 Å²	2	34.7 Å²	34.7	2%	0.021	18%	0.182	C	C	.	.	S	Bend	trans	77.9	7.2	-173.9	0	0	0	0	0	114	D180 Q455 V471	G175-D180 WeakPolarHBondContact CA-OD2 3.34Å; G175-D180 PolarHBondContact N-OD2 2.95Å; G175-Q455 PolarHBondContact O-NE2 2.84Å; G175-V471 WeakPolarHBondContact CA-O 3.48Å; G175-V471 PolarHBondContact O-N 2.79Å; G175-V471 VanDerWaalsContact O-N 3.09Å
176	I	95.4	Very high	92.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.			trans	-106.2	114.1	-178.1	-59.2	175.4	0	0	0	108.9	T174 V178 V179 D180 L204 E207 L208 P385 F457	T174-I176 VanDerWaalsContact C-N 3.25Å; T174-I176 PolarHBondContact OG1-N 3.29Å; I176-V178 HydrophobicContact CG2-CG1 4.08Å; I176-V178 PolarHBondContact O-N 2.84Å; I176-V179 HydrophobicContact CB-CB 4.24Å; I176-V179 HydrophobicContact CB-CG2 4.28Å; I176-V179 HydrophobicContact CG2-CB 4.31Å; I176-V179 HydrophobicContact CG2-CG2 3.95Å; I176-V179 PolarHBondContact O-N 2.8Å; I176-V179 VanDerWaalsContact O-N 3.11Å; I176-D180 WeakPolarHBondContact O-CB 3.2Å; I176-D180 PolarHBondContact O-N 3.33Å; I176-L204 HydrophobicContact CD1-CD1 3.62Å; I176-E207 HydrophobicContact CD1-CG 4.26Å; I176-L208 HydrophobicContact CD1-CD2 3.87Å; I176-L208 HydrophobicContact CD1-CG 4.19Å; I176-P385 HydrophobicContact CG2-CG 4.07Å; I176-F457 HydrophobicContact CD1-CE1 4.1Å; I176-F457 HydrophobicContact CD1-CZ 3.85Å; I176-F457 HydrophobicContact CG1-CE1 4.03Å; I176-F457 HydrophobicContact CG1-CZ 4.27Å; I176-F457 HydrophobicContact CG2-CE1 4.04Å; I176-F457 HydrophobicContact CG2-CZ 4.09Å
177	K	96.2	Very high	92.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-51.9	-47.3	-168.7	-69.5	-165.5	-55	-71.6	0	114.2	L181 F452 S454 V471 T476 F480 V499	K177-L181 WeakPolarHBondContact O-CB 3.24Å; K177-L181 PolarHBondContact O-N 3.34Å; K177-L181 VanDerWaalsContact O-N 3.07Å; K177-F452 HydrophobicContact CD-CE1 4.33Å; K177-F452 HydrophobicContact CD-CZ 4.13Å; K177-F452 WeakPolarHBondContact CE-O 3.46Å; K177-F452 PolarHBondContact NZ-O 2.7Å; K177-S454 PolarHBondContact NZ-O 2.61Å; K177-V471 HydrophobicContact CD-CB 4.39Å; K177-V471 HydrophobicContact CD-CG1 4.12Å; K177-V471 HydrophobicContact CD-CG2 4.15Å; K177-V471 HydrophobicContact CG-CB 3.88Å; K177-V471 HydrophobicContact CG-CG1 3.96Å; K177-V471 HydrophobicContact CG-CG2 3.96Å; K177-T476 HydrophobicContact CB-CG2 4.07Å; K177-T476 HydrophobicContact CG-CG2 4.19Å; K177-F480 HydrophobicContact CB-CE2 4.33Å; K177-F480 HydrophobicContact CD-CE2 4.46Å; K177-V499 PolarHBondContact NZ-O 3Å
178	V	95.9	Very high	92.3	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-69.4	-38	-178.4	60	0	0	0	0	113.1	I176 L182 P385 V387 L453	I176-V178 HydrophobicContact CG2-CG1 4.08Å; I176-V178 PolarHBondContact O-N 2.84Å; V178-L182 HydrophobicContact CG2-CD1 4.3Å; V178-L182 WeakPolarHBondContact O-CB 3.27Å; V178-L182 PolarHBondContact O-N 2.83Å; V178-L182 VanDerWaalsContact O-N 3.11Å; V178-P385 HydrophobicContact CG1-CG 3.76Å; V178-V387 HydrophobicContact CG1-CB 3.87Å; V178-V387 HydrophobicContact CG1-CG1 4.39Å; V178-V387 HydrophobicContact CG1-CG2 3.84Å; V178-V387 HydrophobicContact CG2-CB 3.79Å; V178-V387 HydrophobicContact CG2-CG1 3.71Å; V178-L453 HydrophobicContact CB-CB 4.41Å; V178-L453 HydrophobicContact CB-CD2 3.77Å; V178-L453 HydrophobicContact CG2-CD2 3.93Å
179	V	95.4	Very high	92.6	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.006	10%	0.104	C	C	.	.	H	α-helix	trans	-70	-56.8	178	176	0	0	0	0	109.3	T174 I176 L181 A183 P184 Y185	T174-V179 HydrophobicContact CG2-CG1 3.96Å; I176-V179 HydrophobicContact CB-CB 4.24Å; I176-V179 HydrophobicContact CB-CG2 4.28Å; I176-V179 HydrophobicContact CG2-CB 4.31Å; I176-V179 HydrophobicContact CG2-CG2 3.95Å; I176-V179 PolarHBondContact O-N 2.8Å; I176-V179 VanDerWaalsContact O-N 3.11Å; V179-L181 PolarHBondContact O-N 3.25Å; V179-A183 CarbonylContact O-C 3.52Å; V179-A183 PolarHBondContact O-N 3.21Å; V179-A183 VanDerWaalsContact O-N 3.08Å; V179-P184 WeakPolarHBondContact O-CA 3.39Å; V179-Y185 HydrophobicContact CG1-CD1 3.8Å; V179-Y185 HydrophobicContact CG1-CD2 4.1Å; V179-Y185 HydrophobicContact CG1-CE1 3.5Å; V179-Y185 HydrophobicContact CG1-CE2 3.82Å; V179-Y185 HydrophobicContact CG1-CG 4.09Å
180	D	95.4	Very high	93.1	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-61.8	-30.3	-176.2	-74.9	-6.7	0	0	0	112.8	V173 T174 G175 I176 H406 L473	V173-D180 WeakPolarHBondContact CG1-OD2 3.29Å; T174-D180 WeakPolarHBondContact CB-OD1 3.32Å; T174-D180 PolarHBondContact N-OD1 3.11Å; T174-D180 PolarHBondContact N-OD2 3.46Å; T174-D180 VanDerWaalsContact OG1-CG 3.29Å; T174-D180 PolarHBondContact OG1-OD1 2.89Å; G175-D180 WeakPolarHBondContact CA-OD2 3.34Å; G175-D180 PolarHBondContact N-OD2 2.95Å; I176-D180 WeakPolarHBondContact O-CB 3.2Å; I176-D180 PolarHBondContact O-N 3.33Å; D180-H406 PolarHBondContact O-CE1 3.13Å; D180-H406 PolarHBondContact O-NE2 3.1Å; D180-L473 HydrophobicContact CB-CD1 4.12Å
181	L	96.4	Very high	93.4	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-82.9	-52.3	177.6	-172.7	71.9	0	0	0	113.6	K177 V179 H406 V409 A410 V413 T476 I477 F480	K177-L181 WeakPolarHBondContact O-CB 3.24Å; K177-L181 PolarHBondContact O-N 3.34Å; K177-L181 VanDerWaalsContact O-N 3.07Å; V179-L181 PolarHBondContact O-N 3.25Å; L181-H406 PolarHBondContact O-NE2 3.44Å; L181-V409 HydrophobicContact CD1-CG1 4.17Å; L181-A410 HydrophobicContact CD1-CB 4.37Å; L181-A410 HydrophobicContact CG-CB 4.27Å; L181-A410 WeakPolarHBondContact O-CB 3.46Å; L181-V413 HydrophobicContact CD2-CG2 4.16Å; L181-T476 HydrophobicContact CB-CG2 4Å; L181-T476 HydrophobicContact CD1-CG2 4.49Å; L181-I477 HydrophobicContact CD1-CG1 4.4Å; L181-F480 HydrophobicContact CD2-CB 4.09Å; L181-F480 HydrophobicContact CD2-CD1 4.04Å; L181-F480 HydrophobicContact CD2-CD2 3.57Å; L181-F480 HydrophobicContact CD2-CE1 4.39Å; L181-F480 HydrophobicContact CD2-CE2 3.97Å; L181-F480 HydrophobicContact CD2-CG 3.62Å; L181-F480 HydrophobicContact CD2-CZ 4.36Å
182	L	96	Very high	93.6	Very high	2 Å²	2	8.5 Å²	8.5	1%	0.01	5%	0.048	C	C	.	.	H	α-helix	trans	-103.7	-32.4	-163.2	-57.9	-178.1	0	0	0	114	V178 P184 P389 A410 V413 Q414 L453	V178-L182 HydrophobicContact CG2-CD1 4.3Å; V178-L182 WeakPolarHBondContact O-CB 3.27Å; V178-L182 PolarHBondContact O-N 2.83Å; V178-L182 VanDerWaalsContact O-N 3.11Å; L182-P184 VanDerWaalsContact C-CD 3.47Å; L182-P389 HydrophobicContact CD1-CB 3.32Å; L182-A410 HydrophobicContact CD2-CB 4.03Å; L182-V413 HydrophobicContact CD1-CG1 4.25Å; L182-V413 HydrophobicContact CD2-CB 4.3Å; L182-V413 HydrophobicContact CD2-CG1 3.92Å; L182-Q414 HydrophobicContact CD2-CG 4.15Å; L182-L453 HydrophobicContact CD1-CD2 4.19Å
183	A	95.4	Very high	93.6	Very high	1 Å²	1	7.7 Å²	7.7	1%	0.008	4%	0.044	C	C	.	.	S	Bend	trans	-135	57.3	179.1	0	0	0	0	0	110.8	V179 Y185	V179-A183 CarbonylContact O-C 3.52Å; V179-A183 PolarHBondContact O-N 3.21Å; V179-A183 VanDerWaalsContact O-N 3.08Å; A183-Y185 WeakPolarHBondContact O-CD1 3.45Å; A183-Y185 WeakPolarHBondContact O-CE1 3.27Å
184	P	95.4	Very high	93.4	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.033	C	C	.	.	P	Polyproline II helix	trans	-60.2	142.6	-175	23.4	-34	0	0	0	111.1	I171 V179 L182 S394 I396 M397 V402	I171-P184 HydrophobicContact CG2-CB 4.03Å; V179-P184 WeakPolarHBondContact O-CA 3.39Å; L182-P184 VanDerWaalsContact C-CD 3.47Å; P184-S394 WeakPolarHBondContact O-CB 3.31Å; P184-S394 PolarHBondContact O-OG 3.17Å; P184-I396 HydrophobicContact CB-CD1 4.09Å; P184-I396 HydrophobicContact CG-CD1 4.22Å; P184-I396 HydrophobicContact CG-CG1 4.26Å; P184-I396 WeakPolarHBondContact O-CG1 3.28Å; P184-M397 WeakPolarHBondContact CD-SD 3.26Å; P184-M397 HydrophobicContact CG-CG 3.96Å; P184-M397 HydrophobicContact CG-SD 3.36Å; P184-M397 WeakPolarHBondContact CG-SD 3.49Å; P184-V402 HydrophobicContact CG-CG1 4.23Å
185	Y	94.3	Very high	92.9	Very high	2 Å²	2	7.7 Å²	7.7	1%	0.008	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	137.1	-177.2	-65.1	-9	0	0	0	110.6	L172 T174 V179 A183 I191 L208 A370 T372	L172-Y185 PolarHBondContact N-O 2.8Å; T174-Y185 HydrophobicContact CG2-CD2 3.68Å; T174-Y185 HydrophobicContact CG2-CE2 4.15Å; T174-Y185 HydrophobicContact CG2-CG 4.31Å; V179-Y185 HydrophobicContact CG1-CD1 3.8Å; V179-Y185 HydrophobicContact CG1-CD2 4.1Å; V179-Y185 HydrophobicContact CG1-CE1 3.5Å; V179-Y185 HydrophobicContact CG1-CE2 3.82Å; V179-Y185 HydrophobicContact CG1-CG 4.09Å; A183-Y185 WeakPolarHBondContact O-CD1 3.45Å; A183-Y185 WeakPolarHBondContact O-CE1 3.27Å; Y185-I191 HydrophobicContact CD1-CG1 3.62Å; Y185-I191 HydrophobicContact CD1-CG2 4.16Å; Y185-I191 HydrophobicContact CD2-CD1 4.22Å; Y185-I191 HydrophobicContact CD2-CG1 3.88Å; Y185-I191 HydrophobicContact CE1-CB 4.41Å; Y185-I191 HydrophobicContact CE1-CG1 3.9Å; Y185-I191 HydrophobicContact CE1-CG2 3.55Å; Y185-I191 HydrophobicContact CE2-CG1 4.14Å; Y185-I191 HydrophobicContact CE2-CG2 4.11Å; Y185-I191 HydrophobicContact CG-CD1 4.1Å; Y185-I191 HydrophobicContact CG-CG1 3.62Å; Y185-L208 HydrophobicContact CE2-CD1 4.16Å; Y185-L208 HydrophobicContact CE2-CD2 4.17Å; Y185-A370 HydrophobicContact CD1-CB 4.15Å; Y185-A370 HydrophobicContact CE1-CB 4.46Å; Y185-T372 WeakPolarHBondContact CE1-OG1 3.21Å; Y185-T372 PolarHBondContact OH-OG1 2.94Å
186	A	91.8	Very high	91.9	Very high	10 Å²	10	9.7 Å²	9.7	8%	0.083	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	140.1	172.8	0	0	0	0	0	110.3	E170 G188 G189 I396	E170-A186 WeakPolarHBondContact O-CA 3.47Å; A186-G188 PolarHBondContact O-N 2.73Å; A186-G189 PolarHBondContact O-N 3.48Å; A186-I396 HydrophobicContact CB-CD1 4.19Å; A186-I396 HydrophobicContact CB-CG1 4.43Å; A186-I396 HydrophobicContact CB-CG2 3.85Å
187	K	89.3	Confident	91	Very high	63 Å²	63	14 Å²	14	27%	0.274	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	116.8	174.5	-173.4	179.2	-176.8	173.8	0	110.6	E170 G189 D289 T337	E170-K187 HydrophobicContact CB-CB 4.09Å; E170-K187 HydrophobicContact CB-CD 4.37Å; E170-K187 PolarHBondContact O-N 3.09Å; E170-K187 VanDerWaalsContact OE2-CD 3.31Å; E170-K187 WeakPolarHBondContact OE2-CD 3.12Å; E170-K187 IonicContact OE2-NZ 2.62Å; K187-G189 PolarHBondContact O-N 3.16Å; K187-D289 WeakPolarHBondContact CE-OD1 3.5Å; K187-D289 WeakPolarHBondContact CE-OD2 3.43Å; K187-D289 IonicContact NZ-OD1 2.76Å; K187-D289 IonicContact NZ-OD2 2.72Å; K187-D289 PolarHBondContact NZ-OD2 3.16Å; K187-T337 PolarHBondContact O-OG1 3.03Å; K187-T337 VanDerWaalsContact O-OG1 3.06Å
188	G	87.8	Confident	90.1	Very high	7 Å²	7	17.5 Å²	17.5	7%	0.072	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	15.5	-171.6	0	0	0	0	0	115.3	A186 T337 I343 T344	A186-G188 PolarHBondContact O-N 2.73Å; G188-T337 VanDerWaalsContact CA-OG1 3.3Å; G188-T337 WeakPolarHBondContact CA-OG1 3.47Å; G188-I343 CarbonylContact C-O 3.58Å; G188-I343 WeakPolarHBondContact CA-O 3.21Å; G188-T344 WeakPolarHBondContact CA-OG1 3.37Å; G188-T344 PolarHBondContact N-OG1 3.28Å
189	G	91	Very high	89.6	Confident	3 Å²	3	17.5 Å²	17.5	3%	0.031	14%	0.141	C	C	.	.			trans	-77.9	171.6	171.7	0	0	0	0	0	113.1	A186 K187 S345 D369	A186-G189 PolarHBondContact O-N 3.48Å; K187-G189 PolarHBondContact O-N 3.16Å; G189-S345 PolarHBondContact O-N 3.09Å; G189-D369 WeakPolarHBondContact CA-OD2 3.36Å
190	K	94.4	Very high	89.1	Confident	15 Å²	15	18.5 Å²	18.5	7%	0.065	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	115.4	178.5	-63.9	150.4	-174.4	175.4	0	109.8	Q332 E333 I335 H367 L368 D369 A370	K190-Q332 WeakPolarHBondContact CE-O 3.41Å; K190-Q332 PolarHBondContact NZ-O 3.22Å; K190-E333 IonicContact NZ-OE1 2.83Å; K190-E333 PolarHBondContact NZ-OE1 2.6Å; K190-E333 IonicContact NZ-OE2 3.62Å; K190-I335 WeakPolarHBondContact CE-O 3.28Å; K190-I335 HydrophobicContact CG-CG2 3.98Å; K190-H367 WeakPolarHBondContact CB-O 3.38Å; K190-H367 HydrophobicContact CD-CB 4.22Å; K190-H367 WeakPolarHBondContact CD-O 3.39Å; K190-L368 HydrophobicContact CB-CD2 4.22Å; K190-D369 PolarHBondContact N-OD2 2.94Å; K190-D369 PolarHBondContact O-N 3.42Å; K190-A370 PolarHBondContact O-N 3.06Å
191	I	94.7	Very high	88.7	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.5	-178	-59.8	84.4	0	0	0	109.3	Y185 T344 S345 V346 Q347 A370	Y185-I191 HydrophobicContact CD1-CG1 3.62Å; Y185-I191 HydrophobicContact CD1-CG2 4.16Å; Y185-I191 HydrophobicContact CD2-CD1 4.22Å; Y185-I191 HydrophobicContact CD2-CG1 3.88Å; Y185-I191 HydrophobicContact CE1-CB 4.41Å; Y185-I191 HydrophobicContact CE1-CG1 3.9Å; Y185-I191 HydrophobicContact CE1-CG2 3.55Å; Y185-I191 HydrophobicContact CE2-CG1 4.14Å; Y185-I191 HydrophobicContact CE2-CG2 4.11Å; Y185-I191 HydrophobicContact CG-CD1 4.1Å; Y185-I191 HydrophobicContact CG-CG1 3.62Å; I191-T344 HydrophobicContact CD1-CG2 3.52Å; I191-S345 VanDerWaalsContact CD1-O 3.31Å; I191-S345 WeakPolarHBondContact CD1-O 3.31Å; I191-S345 PolarHBondContact N-O 3.48Å; I191-V346 HydrophobicContact CB-CG2 4.35Å; I191-V346 HydrophobicContact CD1-CG2 4.41Å; I191-Q347 PolarHBondContact O-N 2.92Å; I191-A370 WeakPolarHBondContact CA-O 3.38Å; I191-A370 HydrophobicContact CG1-CB 4.31Å
192	G	93.9	Very high	87.9	Confident	0 Å²	0	23 Å²	23	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.4	168.6	0	0	0	0	0	111.2	F194 A370 T371 T372	G192-F194 WeakPolarHBondContact O-CD2 3.28Å; G192-F194 WeakPolarHBondContact O-CE2 3.36Å; G192-A370 PolarHBondContact N-O 3.24Å; G192-T371 WeakPolarHBondContact O-CA 3.47Å; G192-T372 PolarHBondContact O-N 2.94Å
193	L	91.8	Very high	87.4	Confident	1 Å²	1	25 Å²	25	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	110.4	174.5	-176.3	60.2	0	0	0	109.8	K201 L204 I205 V346 Q347 A348 I349 T372 L374	L193-K201 HydrophobicContact CD2-CD 4.4Å; L193-K201 HydrophobicContact CD2-CG 3.51Å; L193-K201 HydrophobicContact CG-CG 3.93Å; L193-L204 HydrophobicContact CD1-CD2 3.77Å; L193-L204 HydrophobicContact CD2-CD2 4.26Å; L193-I205 HydrophobicContact CD2-CD1 4.15Å; L193-I205 HydrophobicContact CD2-CG1 3.96Å; L193-V346 HydrophobicContact CB-CG1 4.3Å; L193-V346 HydrophobicContact CD2-CG1 4.42Å; L193-Q347 PolarHBondContact N-O 2.66Å; L193-A348 WeakPolarHBondContact O-CA 3.02Å; L193-I349 PolarHBondContact O-N 3.42Å; L193-T372 WeakPolarHBondContact CA-O 3.24Å; L193-T372 HydrophobicContact CD1-CG2 3.82Å; L193-L374 HydrophobicContact CD1-CD1 3.9Å; L193-L374 HydrophobicContact CD1-CD2 4.43Å; L193-L374 HydrophobicContact CD1-CG 3.89Å; L193-L374 HydrophobicContact CG-CD1 4.4Å
194	F	87.7	Confident	87.2	Confident	18 Å²	18	25 Å²	25	8%	0.079	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	147.2	-178.5	-58.4	-95.8	0	0	0	110.2	G192 I349 V351 F365 L368 T371 T372 V373 L374	G192-F194 WeakPolarHBondContact O-CD2 3.28Å; G192-F194 WeakPolarHBondContact O-CE2 3.36Å; F194-I349 HydrophobicContact CD1-CB 4.02Å; F194-I349 HydrophobicContact CD1-CG2 4.06Å; F194-I349 HydrophobicContact CE1-CB 3.81Å; F194-I349 HydrophobicContact CE1-CD1 3.88Å; F194-I349 HydrophobicContact CE1-CG1 4.45Å; F194-I349 HydrophobicContact CE1-CG2 3.62Å; F194-I349 HydrophobicContact CE2-CD1 4.05Å; F194-I349 HydrophobicContact CZ-CB 4.3Å; F194-I349 HydrophobicContact CZ-CD1 3.49Å; F194-I349 VanDerWaalsContact CZ-CD1 3.49Å; F194-I349 HydrophobicContact CZ-CG1 4.49Å; F194-I349 HydrophobicContact CZ-CG2 4.38Å; F194-V351 HydrophobicContact CD1-CG2 3.9Å; F194-V351 HydrophobicContact CE1-CG2 4.16Å; F194-F365 HydrophobicContact CE1-CD1 4.39Å; F194-F365 AromaticContact CE1-CE1 3.35Å; F194-F365 HydrophobicContact CE1-CE1 3.35Å; F194-F365 AromaticContact CE1-CZ 3.68Å; F194-F365 HydrophobicContact CE1-CZ 3.68Å; F194-F365 AromaticContact CZ-CD1 3.95Å; F194-F365 HydrophobicContact CZ-CD1 3.95Å; F194-F365 AromaticContact CZ-CE1 3.32Å; F194-F365 HydrophobicContact CZ-CE1 3.32Å; F194-F365 AromaticContact CZ-CZ 3.94Å; F194-F365 HydrophobicContact CZ-CZ 3.94Å; F194-L368 HydrophobicContact CE2-CD1 4.39Å; F194-L368 HydrophobicContact CZ-CD1 4.2Å; F194-T371 HydrophobicContact CE2-CG2 3.85Å; F194-T371 HydrophobicContact CZ-CG2 4.45Å; F194-T372 PolarHBondContact N-O 3.45Å; F194-V373 HydrophobicContact CB-CG1 4.46Å; F194-V373 HydrophobicContact CB-CG2 4.33Å; F194-V373 HydrophobicContact CD2-CG2 4.22Å; F194-V373 HydrophobicContact CG-CG2 4.48Å; F194-L374 VanDerWaalsContact O-CB 3.28Å; F194-L374 WeakPolarHBondContact O-CB 3.1Å; F194-L374 WeakPolarHBondContact O-CG 3.25Å; F194-L374 PolarHBondContact O-N 3.08Å
195	G	79.9	Confident	86.8	Confident	33 Å²	33	25.1 Å²	25.1	34%	0.34	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	165.6	149.5	173.5	0	0	0	0	0	113.4
196	G	72.6	Confident	86.4	Confident	43 Å²	43	25.2 Å²	25.2	44%	0.443	19%	0.189	S	C	.	.			trans	-74.1	176.8	171.8	0	0	0	0	0	113	V199	G196-V199 VanDerWaalsContact O-CG2 3.28Å; G196-V199 WeakPolarHBondContact O-CG2 3.25Å
197	A	75.1	Confident	86.3	Confident	91 Å²	91	24.8 Å²	24.8	75%	0.752	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	140.5	169.6	0	0	0	0	0	111.1
198	G	78	Confident	86.3	Confident	73 Å²	73	22 Å²	22	75%	0.753	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.6	-7.5	174.5	0	0	0	0	0	116.8	G200	G198-G200 VanDerWaalsContact C-N 3.27Å; G198-G200 PolarHBondContact O-N 3.21Å
199	V	85.6	Confident	86.1	Confident	3 Å²	3	21.7 Å²	21.7	2%	0.018	17%	0.169	C	C	.	.	S	Bend	trans	-83.6	11.4	-175.2	-53.1	0	0	0	0	115.1	G196 L374 R376	G196-V199 VanDerWaalsContact O-CG2 3.28Å; G196-V199 WeakPolarHBondContact O-CG2 3.25Å; V199-L374 HydrophobicContact CB-CB 4.02Å; V199-L374 HydrophobicContact CG2-CB 3.38Å; V199-L374 HydrophobicContact CG2-CD1 3.85Å; V199-L374 HydrophobicContact CG2-CG 4.27Å; V199-R376 HydrophobicContact CG1-CB 4.2Å
200	G	85.8	Confident	85.8	Confident	21 Å²	21	21.9 Å²	21.9	22%	0.216	17%	0.17	C	C	.	.	S	Bend	trans	84.5	16.4	177.2	0	0	0	0	0	116.8	G198 T202 V203 L204	G198-G200 VanDerWaalsContact C-N 3.27Å; G198-G200 PolarHBondContact O-N 3.21Å; G200-T202 PolarHBondContact O-N 3.11Å; G200-V203 PolarHBondContact O-N 3.36Å; G200-V203 VanDerWaalsContact O-N 3.13Å; G200-L204 PolarHBondContact O-N 3.36Å
201	K	85	Confident	85.4	Confident	39 Å²	39	21.3 Å²	21.3	17%	0.17	17%	0.167	C	C	.	.	H	α-helix	trans	-50.7	-49.7	-178.2	-162.3	-161.8	78.5	-167.6	0	113.7	L193 L204 I205 D295 A348 L374	L193-K201 HydrophobicContact CD2-CD 4.4Å; L193-K201 HydrophobicContact CD2-CG 3.51Å; L193-K201 HydrophobicContact CG-CG 3.93Å; K201-L204 PolarHBondContact O-N 3.19Å; K201-I205 HydrophobicContact CG-CD1 4.35Å; K201-I205 WeakPolarHBondContact O-CG1 3.38Å; K201-I205 PolarHBondContact O-N 2.68Å; K201-D295 WeakPolarHBondContact CE-OD2 3.28Å; K201-D295 IonicContact NZ-OD1 3.93Å; K201-D295 PolarHBondContact NZ-OD1 3.19Å; K201-D295 IonicContact NZ-OD2 3.7Å; K201-D295 PolarHBondContact NZ-OD2 3.39Å; K201-A348 HydrophobicContact CD-CB 3.72Å; K201-L374 HydrophobicContact CB-CD1 3.99Å; K201-L374 HydrophobicContact CG-CD1 4.23Å
202	T	80.4	Confident	84.6	Confident	56 Å²	56	21.8 Å²	21.8	34%	0.344	17%	0.17	S	C	.	.	H	α-helix	trans	-63.4	-41.8	179.7	-46.8	0	0	0	0	111.9	G200 L204 I205 M206 L235	G200-T202 PolarHBondContact O-N 3.11Å; T202-L204 VanDerWaalsContact C-N 3.35Å; T202-L204 PolarHBondContact O-N 3.2Å; T202-I205 PolarHBondContact O-N 3.07Å; T202-M206 HydrophobicContact CG2-CE 4.49Å; T202-M206 WeakPolarHBondContact O-CG 3.48Å; T202-M206 PolarHBondContact O-N 3.39Å; T202-L235 HydrophobicContact CG2-CD1 3.75Å
203	V	86.4	Confident	83.6	Confident	44 Å²	44	22.7 Å²	22.7	27%	0.267	18%	0.178	S	C	.	.	H	α-helix	trans	-63.9	-41	178.7	-166.2	0	0	0	0	110.8	G200 M206 E207 F457 V459 A460	G200-V203 PolarHBondContact O-N 3.36Å; G200-V203 VanDerWaalsContact O-N 3.13Å; V203-M206 PolarHBondContact O-N 2.87Å; V203-E207 WeakPolarHBondContact O-CB 3.4Å; V203-E207 PolarHBondContact O-N 3.4Å; V203-F457 HydrophobicContact CG1-CD2 4.18Å; V203-V459 HydrophobicContact CG1-CG2 3.85Å; V203-A460 HydrophobicContact CG1-CB 4.2Å
204	L	90.2	Very high	82.8	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-64.4	-41.5	174.3	-178.4	64	0	0	0	112.2	I176 L193 G200 K201 T202 E207 L208 T372 L374 P385 F457	I176-L204 HydrophobicContact CD1-CD1 3.62Å; L193-L204 HydrophobicContact CD1-CD2 3.77Å; L193-L204 HydrophobicContact CD2-CD2 4.26Å; G200-L204 PolarHBondContact O-N 3.36Å; K201-L204 PolarHBondContact O-N 3.19Å; T202-L204 VanDerWaalsContact C-N 3.35Å; T202-L204 PolarHBondContact O-N 3.2Å; L204-E207 PolarHBondContact O-N 2.83Å; L204-L208 HydrophobicContact CG-CD1 4.22Å; L204-L208 WeakPolarHBondContact O-CB 3.38Å; L204-L208 VanDerWaalsContact O-CG 3.29Å; L204-L208 WeakPolarHBondContact O-CG 3.49Å; L204-L208 PolarHBondContact O-N 2.93Å; L204-T372 HydrophobicContact CD2-CG2 4.47Å; L204-L374 HydrophobicContact CD2-CD1 4.42Å; L204-L374 HydrophobicContact CD2-CD2 4.1Å; L204-P385 HydrophobicContact CD1-CB 4.33Å; L204-F457 HydrophobicContact CB-CE2 4.41Å; L204-F457 HydrophobicContact CD1-CE2 3.8Å; L204-F457 HydrophobicContact CD1-CZ 3.7Å
205	I	87.6	Confident	82.1	Confident	3 Å²	3	30.3 Å²	30.3	2%	0.015	22%	0.222	C	C	.	.	H	α-helix	trans	-61	-47	175.3	-74	165.8	0	0	0	111	L193 K201 T202 E207 L208 I209 F222 F293	L193-I205 HydrophobicContact CD2-CD1 4.15Å; L193-I205 HydrophobicContact CD2-CG1 3.96Å; K201-I205 HydrophobicContact CG-CD1 4.35Å; K201-I205 WeakPolarHBondContact O-CG1 3.38Å; K201-I205 PolarHBondContact O-N 2.68Å; T202-I205 PolarHBondContact O-N 3.07Å; I205-E207 PolarHBondContact O-N 3.39Å; I205-L208 PolarHBondContact O-N 3.37Å; I205-I209 HydrophobicContact CG2-CD1 4.01Å; I205-I209 WeakPolarHBondContact O-CG1 3.38Å; I205-I209 PolarHBondContact O-N 3.33Å; I205-F222 HydrophobicContact CG2-CD2 4.28Å; I205-F222 HydrophobicContact CG2-CE2 4.06Å; I205-F293 HydrophobicContact CB-CD1 4.2Å; I205-F293 HydrophobicContact CB-CE1 4.25Å; I205-F293 HydrophobicContact CG1-CD1 4.01Å; I205-F293 HydrophobicContact CG1-CE1 4.24Å; I205-F293 HydrophobicContact CG2-CD1 3.47Å; I205-F293 VanDerWaalsContact CG2-CD1 3.47Å; I205-F293 HydrophobicContact CG2-CE1 3.76Å; I205-F293 HydrophobicContact CG2-CG 3.99Å
206	M	85.4	Confident	81.6	Confident	4 Å²	4	33.2 Å²	33.2	2%	0.02	23%	0.227	C	C	.	.	H	α-helix	trans	-63.2	-40.8	177.6	-70.6	-166.8	-66.4	0	0	112.5	T202 V203 I209 N210 L235 E238 V459	T202-M206 HydrophobicContact CG2-CE 4.49Å; T202-M206 WeakPolarHBondContact O-CG 3.48Å; T202-M206 PolarHBondContact O-N 3.39Å; V203-M206 PolarHBondContact O-N 2.87Å; M206-I209 PolarHBondContact O-N 3.08Å; M206-N210 WeakPolarHBondContact O-CB 3.36Å; M206-N210 PolarHBondContact O-N 2.94Å; M206-L235 HydrophobicContact CG-CD1 3.63Å; M206-L235 HydrophobicContact SD-CD1 3.69Å; M206-E238 HydrophobicContact CE-CB 4.13Å; M206-E238 WeakPolarHBondContact CE-OE2 3.14Å; M206-E238 HydrophobicContact SD-CB 3.64Å; M206-V459 HydrophobicContact CB-CB 4.21Å; M206-V459 HydrophobicContact CB-CG1 4.05Å; M206-V459 HydrophobicContact CB-CG2 3.97Å
207	E	89.4	Confident	81.5	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-65.8	-39.4	176.5	-171	73.5	167.7	0	0	111.6	I176 V203 L204 I205 N210 N211 F457 Q458 V459	I176-E207 HydrophobicContact CD1-CG 4.26Å; V203-E207 WeakPolarHBondContact O-CB 3.4Å; V203-E207 PolarHBondContact O-N 3.4Å; L204-E207 PolarHBondContact O-N 2.83Å; I205-E207 PolarHBondContact O-N 3.39Å; E207-N210 PolarHBondContact O-N 3.42Å; E207-N211 WeakPolarHBondContact O-CB 3.03Å; E207-N211 VanDerWaalsContact O-CG 3.23Å; E207-N211 PolarHBondContact O-N 2.91Å; E207-N211 PolarHBondContact O-OD1 3.3Å; E207-F457 HydrophobicContact CB-CB 4.34Å; E207-F457 HydrophobicContact CB-CD1 4.47Å; E207-F457 HydrophobicContact CB-CD2 3.7Å; E207-F457 HydrophobicContact CB-CE2 3.99Å; E207-F457 HydrophobicContact CB-CG 3.96Å; E207-F457 HydrophobicContact CB-CZ 4.46Å; E207-F457 HydrophobicContact CG-CB 3.96Å; E207-F457 HydrophobicContact CG-CD1 3.71Å; E207-F457 HydrophobicContact CG-CD2 3.86Å; E207-F457 HydrophobicContact CG-CE1 4.05Å; E207-F457 HydrophobicContact CG-CE2 4.2Å; E207-F457 HydrophobicContact CG-CG 3.59Å; E207-F457 HydrophobicContact CG-CZ 4.26Å; E207-F457 VanDerWaalsContact OE1-CA 3.32Å; E207-F457 WeakPolarHBondContact OE1-CA 3.32Å; E207-Q458 VanDerWaalsContact CD-N 3.32Å; E207-Q458 PolarHBondContact OE1-N 3.31Å; E207-Q458 PolarHBondContact OE2-N 3.42Å; E207-V459 HydrophobicContact CB-CG2 3.99Å; E207-V459 WeakPolarHBondContact OE2-CG2 3.1Å; E207-V459 PolarHBondContact OE2-N 3.45Å
208	L	89.3	Confident	81.8	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-61.9	-42.8	173.8	-73.7	168.9	0	0	0	111.9	T174 I176 Y185 L204 I205 V212 F293 V346	T174-L208 HydrophobicContact CG2-CD2 3.74Å; I176-L208 HydrophobicContact CD1-CD2 3.87Å; I176-L208 HydrophobicContact CD1-CG 4.19Å; Y185-L208 HydrophobicContact CE2-CD1 4.16Å; Y185-L208 HydrophobicContact CE2-CD2 4.17Å; L204-L208 HydrophobicContact CG-CD1 4.22Å; L204-L208 WeakPolarHBondContact O-CB 3.38Å; L204-L208 VanDerWaalsContact O-CG 3.29Å; L204-L208 WeakPolarHBondContact O-CG 3.49Å; L204-L208 PolarHBondContact O-N 2.93Å; I205-L208 PolarHBondContact O-N 3.37Å; L208-V212 WeakPolarHBondContact O-CB 3.22Å; L208-V212 WeakPolarHBondContact O-CG2 3.5Å; L208-V212 PolarHBondContact O-N 2.94Å; L208-V212 VanDerWaalsContact O-N 3.1Å; L208-F293 HydrophobicContact CB-CE1 4.24Å; L208-F293 HydrophobicContact CB-CZ 4.03Å; L208-F293 HydrophobicContact CD1-CE1 4.48Å; L208-V346 HydrophobicContact CD1-CG1 4.38Å; L208-V346 HydrophobicContact CD1-CG2 4.38Å
209	I	84.8	Confident	82.3	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59	-50.2	172.9	-68	165.3	0	0	0	110.3	I205 M206 A213 M239 V244 F293	I205-I209 HydrophobicContact CG2-CD1 4.01Å; I205-I209 WeakPolarHBondContact O-CG1 3.38Å; I205-I209 PolarHBondContact O-N 3.33Å; M206-I209 PolarHBondContact O-N 3.08Å; I209-A213 WeakPolarHBondContact O-CB 3.37Å; I209-A213 PolarHBondContact O-N 3.15Å; I209-M239 HydrophobicContact CD1-CE 3.51Å; I209-V244 HydrophobicContact CG2-CG1 3.63Å; I209-F293 HydrophobicContact CB-CE2 4.48Å; I209-F293 HydrophobicContact CD1-CD2 4.01Å; I209-F293 HydrophobicContact CD1-CE2 3.88Å; I209-F293 HydrophobicContact CD1-CZ 4.32Å; I209-F293 HydrophobicContact CG1-CD2 3.84Å; I209-F293 HydrophobicContact CG1-CE1 4.4Å; I209-F293 HydrophobicContact CG1-CE2 3.19Å; I209-F293 HydrophobicContact CG1-CZ 3.52Å
210	N	84.9	Confident	82.6	Confident	8 Å²	8	27.1 Å²	27.1	4%	0.043	16%	0.161	C	C	.	.	H	α-helix	trans	-60	-50	-178.9	174.8	67.3	0	0	0	112.3	M206 E207 K214 Q458 V459	M206-N210 WeakPolarHBondContact O-CB 3.36Å; M206-N210 PolarHBondContact O-N 2.94Å; E207-N210 PolarHBondContact O-N 3.42Å; N210-K214 WeakPolarHBondContact O-CB 3.38Å; N210-K214 WeakPolarHBondContact O-CG 3.48Å; N210-K214 PolarHBondContact O-N 3.43Å; N210-K214 WeakPolarHBondContact OD1-CD 3.44Å; N210-K214 VanDerWaalsContact OD1-CE 3.25Å; N210-K214 WeakPolarHBondContact OD1-CE 3.33Å; N210-K214 PolarHBondContact OD1-NZ 2.86Å; N210-Q458 PolarHBondContact ND2-OE1 3.3Å; N210-V459 HydrophobicContact CB-CG1 3.97Å
211	N	85.1	Confident	83.1	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.011	15%	0.151	C	C	.	.	H	α-helix	trans	-69	-42.8	-174.3	-70.3	-0.9	0	0	0	111.6	T174 E207 K214 A215 L470	T174-N211 VanDerWaalsContact O-CB 3.31Å; T174-N211 WeakPolarHBondContact O-CB 3.5Å; T174-N211 PolarHBondContact O-ND2 3.05Å; T174-N211 VanDerWaalsContact O-ND2 3.12Å; E207-N211 WeakPolarHBondContact O-CB 3.03Å; E207-N211 VanDerWaalsContact O-CG 3.23Å; E207-N211 PolarHBondContact O-N 2.91Å; E207-N211 PolarHBondContact O-OD1 3.3Å; N211-K214 PolarHBondContact O-N 3.41Å; N211-A215 WeakPolarHBondContact O-CB 3.27Å; N211-A215 PolarHBondContact O-N 3.29Å; N211-L470 HydrophobicContact CB-CD1 4.07Å
212	V	77.8	Confident	83.5	Confident	11 Å²	11	24.5 Å²	24.5	7%	0.067	14%	0.144	C	C	.	.	H	α-helix	trans	-73	-37.2	179.3	173.9	0	0	0	0	111.7	L208 K214 A215 H216 G217 L291	L208-V212 WeakPolarHBondContact O-CB 3.22Å; L208-V212 WeakPolarHBondContact O-CG2 3.5Å; L208-V212 PolarHBondContact O-N 2.94Å; L208-V212 VanDerWaalsContact O-N 3.1Å; V212-K214 VanDerWaalsContact C-N 3.27Å; V212-K214 PolarHBondContact O-N 3.12Å; V212-A215 PolarHBondContact O-N 2.85Å; V212-H216 HydrophobicContact CG1-CB 4.17Å; V212-H216 WeakPolarHBondContact O-CA 3.45Å; V212-H216 PolarHBondContact O-N 2.84Å; V212-G217 PolarHBondContact O-N 2.75Å; V212-L291 HydrophobicContact CB-CD1 3.49Å; V212-L291 VanDerWaalsContact CB-CD1 3.49Å; V212-L291 HydrophobicContact CB-CG 4.42Å; V212-L291 HydrophobicContact CG1-CD1 3.61Å; V212-L291 HydrophobicContact CG1-CG 4.04Å; V212-L291 HydrophobicContact CG2-CD1 3.8Å
213	A	72.7	Confident	84.3	Confident	19 Å²	19	21.8 Å²	21.8	16%	0.157	13%	0.128	C	C	.	.	H	α-helix	trans	-62.4	-33.6	172.8	0	0	0	0	0	112.6	I209 G217 K253	I209-A213 WeakPolarHBondContact O-CB 3.37Å; I209-A213 PolarHBondContact O-N 3.15Å; A213-G217 WeakPolarHBondContact O-CA 3.34Å; A213-G217 PolarHBondContact O-N 3.15Å; A213-K253 HydrophobicContact CB-CB 4.25Å; A213-K253 HydrophobicContact CB-CG 4.29Å
214	K	75.1	Confident	84.6	Confident	119 Å²	119	19.7 Å²	19.7	52%	0.517	12%	0.115	S	C	.	.	H	α-helix	trans	-81.3	-39.1	177.4	-77.1	171.3	173	162.3	0	113.9	N210 N211 V212 Q458	N210-K214 WeakPolarHBondContact O-CB 3.38Å; N210-K214 WeakPolarHBondContact O-CG 3.48Å; N210-K214 PolarHBondContact O-N 3.43Å; N210-K214 WeakPolarHBondContact OD1-CD 3.44Å; N210-K214 VanDerWaalsContact OD1-CE 3.25Å; N210-K214 WeakPolarHBondContact OD1-CE 3.33Å; N210-K214 PolarHBondContact OD1-NZ 2.86Å; N211-K214 PolarHBondContact O-N 3.41Å; V212-K214 VanDerWaalsContact C-N 3.27Å; V212-K214 PolarHBondContact O-N 3.12Å; K214-Q458 VanDerWaalsContact NZ-CD 3.34Å
215	A	72.8	Confident	84.8	Confident	61 Å²	61	19.6 Å²	19.6	50%	0.504	11%	0.114	S	C	.	.	H	α-helix	trans	-87.9	-40.4	-174.9	0	0	0	0	0	113.6	N211 V212	N211-A215 WeakPolarHBondContact O-CB 3.27Å; N211-A215 PolarHBondContact O-N 3.29Å; V212-A215 PolarHBondContact O-N 2.85Å
216	H	69.1	Low	85	Confident	93 Å²	93	19.5 Å²	19.5	43%	0.431	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-10.3	-173.1	-57	-78.3	0	0	0	113.2	V173 V212 G218	V173-H216 PolarHBondContact O-NE2 2.95Å; V212-H216 HydrophobicContact CG1-CB 4.17Å; V212-H216 WeakPolarHBondContact O-CA 3.45Å; V212-H216 PolarHBondContact O-N 2.84Å; H216-G218 PolarHBondContact O-N 2.58Å; H216-G218 VanDerWaalsContact O-N 3.13Å
217	G	71.3	Confident	85	Confident	34 Å²	34	20.5 Å²	20.5	35%	0.351	12%	0.119	S	C	.	.			trans	76.1	-8.1	173.1	0	0	0	0	0	116.4	V212 A213 K253	V212-G217 PolarHBondContact O-N 2.75Å; A213-G217 WeakPolarHBondContact O-CA 3.34Å; A213-G217 PolarHBondContact O-N 3.15Å; G217-K253 PolarHBondContact O-NZ 2.78Å
218	G	80.5	Confident	85	Confident	7 Å²	7	26.4 Å²	26.4	7%	0.072	14%	0.141	C	C	.	.			trans	-66.5	175.7	-176.6	0	0	0	0	0	115.3	H216 D289	H216-G218 PolarHBondContact O-N 2.58Å; H216-G218 VanDerWaalsContact O-N 3.13Å; G218-D289 WeakPolarHBondContact CA-O 3.4Å
219	Y	89.3	Confident	84.9	Confident	40 Å²	40	29.6 Å²	29.6	16%	0.157	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	154	178.2	-65.5	-55.2	0	0	0	112.2	L130 K253 F282 Q288 V290 L291	L130-Y219 HydrophobicContact CD1-CD1 3.68Å; L130-Y219 HydrophobicContact CD1-CE1 3.25Å; L130-Y219 HydrophobicContact CD1-CE2 4.23Å; L130-Y219 HydrophobicContact CD1-CG 4.35Å; L130-Y219 HydrophobicContact CD2-CD1 3.76Å; L130-Y219 HydrophobicContact CD2-CE1 4.23Å; L130-Y219 HydrophobicContact CD2-CG 4.11Å; L130-Y219 HydrophobicContact CG-CD1 4.4Å; L130-Y219 HydrophobicContact CG-CE1 4.4Å; Y219-K253 HydrophobicContact CD1-CD 3.91Å; Y219-K253 HydrophobicContact CE1-CD 3.85Å; Y219-F282 AromaticContact CD2-CD1 3.53Å; Y219-F282 HydrophobicContact CD2-CD1 3.53Å; Y219-F282 AromaticContact CD2-CE1 3.71Å; Y219-F282 HydrophobicContact CD2-CE1 3.71Å; Y219-F282 HydrophobicContact CD2-CG 4.04Å; Y219-F282 HydrophobicContact CD2-CZ 4.35Å; Y219-F282 AromaticContact CE2-CD1 3.97Å; Y219-F282 HydrophobicContact CE2-CD1 3.97Å; Y219-F282 AromaticContact CE2-CE1 3.92Å; Y219-F282 HydrophobicContact CE2-CE1 3.92Å; Y219-F282 HydrophobicContact CG-CD1 4.45Å; Y219-F282 HydrophobicContact CG-CE1 4.46Å; Y219-Q288 VanDerWaalsContact CE2-NE2 3.27Å; Y219-V290 WeakPolarHBondContact O-CA 3.39Å; Y219-V290 WeakPolarHBondContact O-CG1 3.41Å; Y219-L291 PolarHBondContact O-N 2.79Å
220	S	92.2	Very high	85.2	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.014	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	147.7	173.6	-64	0	0	0	0	110.9	K253 V254 A255 L291	S220-K253 PolarHBondContact N-O 3.43Å; S220-V254 CarbonylContact O-C 3.56Å; S220-V254 VanDerWaalsContact O-CA 3.23Å; S220-V254 WeakPolarHBondContact O-CA 3.39Å; S220-A255 PolarHBondContact O-N 3.13Å; S220-L291 CarbonylContact C-O 3.58Å; S220-L291 VanDerWaalsContact CA-O 3.31Å; S220-L291 WeakPolarHBondContact CA-O 3.35Å
221	V	95	Very high	85.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.8	168.7	-175.1	0	0	0	0	107.9	A255 V257 G275 V278 A279 F282 V290 L291 L292 F293	V221-A255 WeakPolarHBondContact CA-O 3.47Å; V221-V257 HydrophobicContact CG1-CG2 4.28Å; V221-G275 WeakPolarHBondContact CG1-O 3.48Å; V221-V278 HydrophobicContact CG1-CB 4.25Å; V221-V278 HydrophobicContact CG1-CG1 4.3Å; V221-V278 HydrophobicContact CG2-CB 4.38Å; V221-V278 HydrophobicContact CG2-CG1 3.87Å; V221-A279 HydrophobicContact CB-CB 4.39Å; V221-A279 HydrophobicContact CG2-CB 4.02Å; V221-F282 HydrophobicContact CG2-CD2 4.39Å; V221-F282 HydrophobicContact CG2-CE2 4.47Å; V221-V290 HydrophobicContact CG2-CG1 4.35Å; V221-L291 PolarHBondContact N-O 3.06Å; V221-L292 HydrophobicContact CB-CD1 4.06Å; V221-L292 HydrophobicContact CG1-CD1 4.2Å; V221-F293 PolarHBondContact O-N 3.16Å
222	F	94.9	Very high	85.2	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.018	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117.5	175.8	-171.9	-78.4	0	0	0	109.7	I205 L235 V254 A255 L256 V257 Y258 F293 D295	I205-F222 HydrophobicContact CG2-CD2 4.28Å; I205-F222 HydrophobicContact CG2-CE2 4.06Å; F222-L235 HydrophobicContact CD1-CD2 4.29Å; F222-L235 HydrophobicContact CD2-CD2 4.06Å; F222-L235 HydrophobicContact CE1-CD2 3.86Å; F222-L235 HydrophobicContact CE2-CD2 3.6Å; F222-L235 HydrophobicContact CG-CD2 4.39Å; F222-L235 HydrophobicContact CZ-CD2 3.49Å; F222-L235 VanDerWaalsContact CZ-CD2 3.49Å; F222-V254 HydrophobicContact CB-CG2 4.42Å; F222-A255 PolarHBondContact N-O 3.34Å; F222-L256 HydrophobicContact CB-CD2 3.65Å; F222-L256 HydrophobicContact CG-CD2 4.33Å; F222-V257 PolarHBondContact O-N 2.99Å; F222-Y258 HydrophobicContact CD1-CD1 4.46Å; F222-Y258 AromaticContact CD1-CE1 3.76Å; F222-Y258 HydrophobicContact CD1-CE1 3.76Å; F222-Y258 AromaticContact CE1-CE1 3.86Å; F222-Y258 HydrophobicContact CE1-CE1 3.86Å; F222-F293 HydrophobicContact CB-CB 4.43Å; F222-F293 HydrophobicContact CD2-CB 3.58Å; F222-F293 HydrophobicContact CD2-CG 4.32Å; F222-F293 HydrophobicContact CE2-CB 4.17Å; F222-F293 HydrophobicContact CG-CB 4.24Å; F222-D295 HydrophobicContact CE1-CB 4.34Å; F222-D295 HydrophobicContact CE2-CB 4.32Å; F222-D295 HydrophobicContact CZ-CB 3.68Å
223	A	95.8	Very high	85.8	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	100.7	174	0	0	0	0	0	109.7	V225 V257 F293 D295	A223-V225 HydrophobicContact CB-CG2 4.38Å; A223-V225 PolarHBondContact O-N 2.7Å; A223-V257 CarbonylContact C-O 3.52Å; A223-V257 WeakPolarHBondContact CA-O 3.49Å; A223-F293 PolarHBondContact N-O 3.21Å; A223-D295 PolarHBondContact O-N 3.3Å
224	G	94.4	Very high	86.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	84.3	172.4	0	0	0	0	0	111.1	V257 G259 D295	G224-V257 PolarHBondContact N-O 2.82Å; G224-G259 PolarHBondContact O-N 2.8Å; G224-D295 CarbonylContact C-O 3.56Å; G224-D295 VanDerWaalsContact CA-O 3.25Å; G224-D295 WeakPolarHBondContact CA-O 3.41Å
225	V	94.3	Very high	87	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	105.3	178	-167.5	0	0	0	0	110.6	A223 E227 R268 V271 A272 I294 D295 N296 R299 F300	A223-V225 HydrophobicContact CB-CG2 4.38Å; A223-V225 PolarHBondContact O-N 2.7Å; V225-E227 VanDerWaalsContact C-N 3.28Å; V225-E227 PolarHBondContact O-N 3.05Å; V225-R268 WeakPolarHBondContact CG1-O 3.25Å; V225-V271 HydrophobicContact CB-CG1 4.1Å; V225-V271 HydrophobicContact CG1-CG1 3.87Å; V225-V271 HydrophobicContact CG2-CG1 4.07Å; V225-A272 HydrophobicContact CG2-CB 3.89Å; V225-I294 HydrophobicContact CG2-CG2 3.73Å; V225-D295 PolarHBondContact N-O 2.8Å; V225-N296 PolarHBondContact O-N 2.81Å; V225-N296 VanDerWaalsContact O-N 3.1Å; V225-R299 HydrophobicContact CG1-CB 4.09Å; V225-R299 WeakPolarHBondContact O-CB 3.48Å; V225-R299 WeakPolarHBondContact O-CG 3.44Å; V225-F300 HydrophobicContact CG1-CB 4Å
226	G	90.6	Very high	87.9	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.01	18%	0.18	C	C	.	.	S	Bend	trans	62.2	35.9	179.1	0	0	0	0	0	113	G259 M261	G226-G259 VanDerWaalsContact CA-O 3.31Å; G226-G259 WeakPolarHBondContact CA-O 3.34Å; G226-G259 PolarHBondContact N-O 3.37Å; G226-M261 WeakPolarHBondContact O-CG 3.21Å
227	E	85.4	Confident	88.8	Confident	25 Å²	25	36.6 Å²	36.6	12%	0.117	18%	0.179	C	C	.	.			trans	-82.1	156.4	178.2	-77.5	-55.4	126.3	0	0	112.7	V225 Q260 M261 D295 N296	V225-E227 VanDerWaalsContact C-N 3.28Å; V225-E227 PolarHBondContact O-N 3.05Å; E227-Q260 WeakPolarHBondContact O-CA 2.88Å; E227-M261 PolarHBondContact O-N 3.01Å; E227-D295 HydrophobicContact CG-CB 4.41Å; E227-D295 WeakPolarHBondContact CG-O 3.37Å; E227-D295 VanDerWaalsContact OE1-C 3.31Å; E227-N296 PolarHBondContact OE1-N 2.82Å
228	R	89.3	Confident	89.4	Confident	124 Å²	124	37.6 Å²	37.6	47%	0.468	18%	0.175	S	C	.	.			trans	-74	132.7	173.7	-60.7	-174	-171.2	75.2	-0.1	109.3	R230 E231 G232 M261	R228-R230 PolarHBondContact O-N 3.46Å; R228-R230 VanDerWaalsContact O-N 3.1Å; R228-E231 HydrophobicContact CB-CB 4.23Å; R228-E231 HydrophobicContact CB-CG 4.21Å; R228-E231 WeakPolarHBondContact CB-OE2 3.31Å; R228-E231 WeakPolarHBondContact CD-OE2 3.36Å; R228-E231 VanDerWaalsContact CG-OE2 3.31Å; R228-E231 WeakPolarHBondContact CG-OE2 3.21Å; R228-E231 IonicContact CZ-OE2 3.77Å; R228-E231 IonicContact NE-OE2 2.76Å; R228-E231 IonicContact NH1-OE1 2.96Å; R228-E231 PolarHBondContact NH1-OE1 2.98Å; R228-E231 IonicContact NH1-OE2 3.23Å; R228-E231 PolarHBondContact NH1-OE2 3.41Å; R228-E231 PolarHBondContact O-N 2.94Å; R228-G232 PolarHBondContact O-N 3.38Å; R228-M261 HydrophobicContact CG-SD 3.71Å
229	T	88.6	Confident	89.6	Confident	71 Å²	71	37.3 Å²	37.3	44%	0.436	17%	0.172	S	C	.	.	H	α-helix	trans	-50.4	-39	177	-45.5	0	0	0	0	112.6	N233 Q260	T229-N233 VanDerWaalsContact O-CB 3.25Å; T229-N233 WeakPolarHBondContact O-CB 3.39Å; T229-N233 PolarHBondContact O-N 3.07Å; T229-Q260 PolarHBondContact OG1-OE1 2.92Å
230	R	89.4	Confident	89.6	Confident	143 Å²	143	37.4 Å²	37.4	54%	0.54	18%	0.175	S	C	.	.	H	α-helix	trans	-61.2	-47.9	173.6	-173.8	-164.1	62.9	80.4	-2.8	112.2	R228 G232 N233 D234	R228-R230 PolarHBondContact O-N 3.46Å; R228-R230 VanDerWaalsContact O-N 3.1Å; R230-G232 PolarHBondContact O-N 3.45Å; R230-N233 WeakPolarHBondContact O-CB 3.21Å; R230-N233 PolarHBondContact O-N 2.9Å; R230-D234 WeakPolarHBondContact CG-OD2 3.45Å; R230-D234 IonicContact CZ-OD2 3.46Å; R230-D234 IonicContact NH1-OD2 2.75Å; R230-D234 PolarHBondContact NH1-OD2 2.83Å; R230-D234 WeakPolarHBondContact O-CB 3.39Å; R230-D234 PolarHBondContact O-N 3.37Å
231	E	84.1	Confident	89.2	Confident	55 Å²	55	44.2 Å²	44.2	26%	0.257	21%	0.206	S	C	.	.	H	α-helix	trans	-68.2	-36.6	-175.9	-72	158.9	-176.9	0	0	111.1	R228 L235	R228-E231 HydrophobicContact CB-CB 4.23Å; R228-E231 HydrophobicContact CB-CG 4.21Å; R228-E231 WeakPolarHBondContact CB-OE2 3.31Å; R228-E231 WeakPolarHBondContact CD-OE2 3.36Å; R228-E231 VanDerWaalsContact CG-OE2 3.31Å; R228-E231 WeakPolarHBondContact CG-OE2 3.21Å; R228-E231 IonicContact CZ-OE2 3.77Å; R228-E231 IonicContact NE-OE2 2.76Å; R228-E231 IonicContact NH1-OE1 2.96Å; R228-E231 PolarHBondContact NH1-OE1 2.98Å; R228-E231 IonicContact NH1-OE2 3.23Å; R228-E231 PolarHBondContact NH1-OE2 3.41Å; R228-E231 PolarHBondContact O-N 2.94Å; E231-L235 VanDerWaalsContact O-CB 3.24Å; E231-L235 WeakPolarHBondContact O-CB 3.07Å; E231-L235 PolarHBondContact O-N 3.4Å
232	G	87.4	Confident	88.3	Confident	5 Å²	5	46.2 Å²	46.2	5%	0.052	22%	0.22	C	C	.	.	H	α-helix	trans	-70.1	-32.7	171.7	0	0	0	0	0	114.3	R228 R230 Y236 Y258	R228-G232 PolarHBondContact O-N 3.38Å; R230-G232 PolarHBondContact O-N 3.45Å; G232-Y236 WeakPolarHBondContact O-CB 3.35Å; G232-Y236 PolarHBondContact O-N 3.46Å; G232-Y236 VanDerWaalsContact O-N 3.1Å; G232-Y258 WeakPolarHBondContact CA-OH 3.4Å; G232-Y258 PolarHBondContact O-OH 2.86Å
233	N	90.5	Very high	87.6	Confident	80 Å²	80	47.7 Å²	47.7	43%	0.428	24%	0.236	S	C	.	.	H	α-helix	trans	-67.9	-50.6	173.4	176.1	89.9	0	0	0	111.4	T229 R230 L235 Y236 H237	T229-N233 VanDerWaalsContact O-CB 3.25Å; T229-N233 WeakPolarHBondContact O-CB 3.39Å; T229-N233 PolarHBondContact O-N 3.07Å; R230-N233 WeakPolarHBondContact O-CB 3.21Å; R230-N233 PolarHBondContact O-N 2.9Å; N233-L235 VanDerWaalsContact C-N 3.32Å; N233-L235 PolarHBondContact O-N 3.49Å; N233-Y236 WeakPolarHBondContact O-CB 3.4Å; N233-Y236 PolarHBondContact O-N 3.03Å; N233-Y236 VanDerWaalsContact O-N 3.13Å; N233-H237 PolarHBondContact O-CD2 3.1Å; N233-H237 VanDerWaalsContact O-CD2 3.26Å; N233-H237 PolarHBondContact O-N 3.44Å
234	D	86.8	Confident	87	Confident	56 Å²	56	48.3 Å²	48.3	30%	0.299	24%	0.24	S	C	.	.	H	α-helix	trans	-60	-46.1	-179.6	-60.6	-11.2	0	0	0	109.6	R230 Y236 H237 E238	R230-D234 WeakPolarHBondContact CG-OD2 3.45Å; R230-D234 IonicContact CZ-OD2 3.46Å; R230-D234 IonicContact NH1-OD2 2.75Å; R230-D234 PolarHBondContact NH1-OD2 2.83Å; R230-D234 WeakPolarHBondContact O-CB 3.39Å; R230-D234 PolarHBondContact O-N 3.37Å; D234-Y236 PolarHBondContact O-N 3.22Å; D234-H237 PolarHBondContact O-N 2.99Å; D234-E238 WeakPolarHBondContact O-CB 3.33Å; D234-E238 WeakPolarHBondContact O-CG 3.35Å; D234-E238 PolarHBondContact O-N 2.72Å
235	L	85.9	Confident	86.7	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-58.7	-40.7	174.2	-178.3	60.3	0	0	0	113.3	T202 M206 F222 E231 N233 M239	T202-L235 HydrophobicContact CG2-CD1 3.75Å; M206-L235 HydrophobicContact CG-CD1 3.63Å; M206-L235 HydrophobicContact SD-CD1 3.69Å; F222-L235 HydrophobicContact CD1-CD2 4.29Å; F222-L235 HydrophobicContact CD2-CD2 4.06Å; F222-L235 HydrophobicContact CE1-CD2 3.86Å; F222-L235 HydrophobicContact CE2-CD2 3.6Å; F222-L235 HydrophobicContact CG-CD2 4.39Å; F222-L235 HydrophobicContact CZ-CD2 3.49Å; F222-L235 VanDerWaalsContact CZ-CD2 3.49Å; E231-L235 VanDerWaalsContact O-CB 3.24Å; E231-L235 WeakPolarHBondContact O-CB 3.07Å; E231-L235 PolarHBondContact O-N 3.4Å; N233-L235 VanDerWaalsContact C-N 3.32Å; N233-L235 PolarHBondContact O-N 3.49Å; L235-M239 HydrophobicContact CD1-CE 3.7Å; L235-M239 HydrophobicContact CD1-CG 4.27Å; L235-M239 HydrophobicContact CD2-CE 4.13Å; L235-M239 HydrophobicContact CG-CE 3.86Å; L235-M239 HydrophobicContact CG-SD 4.49Å; L235-M239 WeakPolarHBondContact O-CB 2.99Å; L235-M239 VanDerWaalsContact O-CG 3.25Å; L235-M239 WeakPolarHBondContact O-CG 3.38Å; L235-M239 PolarHBondContact O-N 2.95Å
236	Y	90.4	Very high	86.4	Confident	27 Å²	27	50.9 Å²	50.9	11%	0.106	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-42	177.4	177	-122.7	0	0	0	111.6	I133 R144 G232 N233 D234 M239 I240 I245 L256	I133-Y236 HydrophobicContact CD1-CD1 4Å; I133-Y236 HydrophobicContact CD1-CD2 3.85Å; I133-Y236 HydrophobicContact CD1-CE1 4.09Å; I133-Y236 HydrophobicContact CD1-CE2 3.95Å; I133-Y236 HydrophobicContact CD1-CG 3.86Å; I133-Y236 HydrophobicContact CG1-CD2 4.15Å; I133-Y236 HydrophobicContact CG1-CE2 4.03Å; R144-Y236 PolarHBondContact NH1-OH 2.96Å; G232-Y236 WeakPolarHBondContact O-CB 3.35Å; G232-Y236 PolarHBondContact O-N 3.46Å; G232-Y236 VanDerWaalsContact O-N 3.1Å; N233-Y236 WeakPolarHBondContact O-CB 3.4Å; N233-Y236 PolarHBondContact O-N 3.03Å; N233-Y236 VanDerWaalsContact O-N 3.13Å; D234-Y236 PolarHBondContact O-N 3.22Å; Y236-M239 PolarHBondContact O-N 3.48Å; Y236-I240 HydrophobicContact CD1-CD1 3.99Å; Y236-I240 HydrophobicContact CD2-CD1 4.21Å; Y236-I240 HydrophobicContact CE1-CD1 3.75Å; Y236-I240 HydrophobicContact CE2-CD1 3.98Å; Y236-I240 HydrophobicContact CE2-CG1 4.5Å; Y236-I240 HydrophobicContact CG-CD1 4.24Å; Y236-I240 WeakPolarHBondContact O-CD1 3.14Å; Y236-I240 VanDerWaalsContact O-CG1 3.29Å; Y236-I240 WeakPolarHBondContact O-CG1 3.33Å; Y236-I240 PolarHBondContact O-N 3.28Å; Y236-I240 VanDerWaalsContact O-N 3.12Å; Y236-I245 HydrophobicContact CD2-CD1 3.69Å; Y236-I245 HydrophobicContact CE2-CD1 3.91Å; Y236-I245 HydrophobicContact CE2-CG2 4.29Å; Y236-L256 HydrophobicContact CD2-CD1 3.61Å; Y236-L256 HydrophobicContact CE2-CD1 4.38Å; Y236-L256 HydrophobicContact CG-CD1 4.41Å
237	H	89.3	Confident	86.3	Confident	88 Å²	88	55.1 Å²	55.1	41%	0.407	28%	0.276	S	S	.	.	H	α-helix	trans	-69.4	-43.7	176.1	-75.3	-70.4	0	0	0	112.6	N233 D234 M239 I240 E241	N233-H237 PolarHBondContact O-CD2 3.1Å; N233-H237 VanDerWaalsContact O-CD2 3.26Å; N233-H237 PolarHBondContact O-N 3.44Å; D234-H237 PolarHBondContact O-N 2.99Å; H237-M239 VanDerWaalsContact C-N 3.28Å; H237-M239 PolarHBondContact O-N 2.87Å; H237-I240 WeakPolarHBondContact O-CB 3.24Å; H237-I240 PolarHBondContact O-N 3.09Å; H237-E241 WeakPolarHBondContact O-CG 3Å; H237-E241 PolarHBondContact O-N 2.7Å
238	E	82.9	Confident	86.2	Confident	55 Å²	55	63.6 Å²	63.6	26%	0.257	31%	0.312	S	S	.	.	H	α-helix	trans	-59.2	-38.5	174.1	-71.5	176.7	161.4	0	0	111.7	M206 D234 I240 E241 S242	M206-E238 HydrophobicContact CE-CB 4.13Å; M206-E238 WeakPolarHBondContact CE-OE2 3.14Å; M206-E238 HydrophobicContact SD-CB 3.64Å; D234-E238 WeakPolarHBondContact O-CB 3.33Å; D234-E238 WeakPolarHBondContact O-CG 3.35Å; D234-E238 PolarHBondContact O-N 2.72Å; E238-I240 VanDerWaalsContact C-N 3.35Å; E238-I240 PolarHBondContact O-N 3.33Å; E238-E241 PolarHBondContact O-N 2.77Å; E238-S242 VanDerWaalsContact O-CB 3.3Å; E238-S242 WeakPolarHBondContact O-CB 3.29Å; E238-S242 PolarHBondContact O-N 2.87Å; E238-S242 PolarHBondContact O-OG 2.94Å
239	M	86.1	Confident	85.8	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-68.4	-28.6	173.7	-75.7	-171.1	-176.7	0	0	113.8	I209 L235 Y236 H237 S242 G243 V244 I245 V254 L256	I209-M239 HydrophobicContact CD1-CE 3.51Å; L235-M239 HydrophobicContact CD1-CE 3.7Å; L235-M239 HydrophobicContact CD1-CG 4.27Å; L235-M239 HydrophobicContact CD2-CE 4.13Å; L235-M239 HydrophobicContact CG-CE 3.86Å; L235-M239 HydrophobicContact CG-SD 4.49Å; L235-M239 WeakPolarHBondContact O-CB 2.99Å; L235-M239 VanDerWaalsContact O-CG 3.25Å; L235-M239 WeakPolarHBondContact O-CG 3.38Å; L235-M239 PolarHBondContact O-N 2.95Å; Y236-M239 PolarHBondContact O-N 3.48Å; H237-M239 VanDerWaalsContact C-N 3.28Å; H237-M239 PolarHBondContact O-N 2.87Å; M239-S242 WeakPolarHBondContact CA-OG 3.44Å; M239-S242 PolarHBondContact O-OG 2.69Å; M239-G243 PolarHBondContact O-N 2.89Å; M239-V244 HydrophobicContact CB-CB 4.33Å; M239-V244 PolarHBondContact O-N 2.97Å; M239-I245 HydrophobicContact CB-CB 4.44Å; M239-I245 HydrophobicContact CB-CD1 3.73Å; M239-I245 HydrophobicContact CB-CG1 3.95Å; M239-I245 PolarHBondContact O-N 3.31Å; M239-I245 HydrophobicContact SD-CD1 3.98Å; M239-I245 HydrophobicContact SD-CG1 4.49Å; M239-V254 HydrophobicContact CE-CG2 4.47Å; M239-V254 HydrophobicContact SD-CG1 3.71Å; M239-V254 HydrophobicContact SD-CG2 4.35Å; M239-L256 HydrophobicContact CE-CD2 4.31Å; M239-L256 HydrophobicContact SD-CD2 3.93Å
240	I	87.9	Confident	85.4	Confident	42 Å²	42	66.5 Å²	66.5	22%	0.215	34%	0.34	C	S	.	.	H	α-helix	trans	-74.4	-45.7	173.1	-68.8	158.8	0	0	0	110.3	Y236 H237 E238 G243 I245 L247	Y236-I240 HydrophobicContact CD1-CD1 3.99Å; Y236-I240 HydrophobicContact CD2-CD1 4.21Å; Y236-I240 HydrophobicContact CE1-CD1 3.75Å; Y236-I240 HydrophobicContact CE2-CD1 3.98Å; Y236-I240 HydrophobicContact CE2-CG1 4.5Å; Y236-I240 HydrophobicContact CG-CD1 4.24Å; Y236-I240 WeakPolarHBondContact O-CD1 3.14Å; Y236-I240 VanDerWaalsContact O-CG1 3.29Å; Y236-I240 WeakPolarHBondContact O-CG1 3.33Å; Y236-I240 PolarHBondContact O-N 3.28Å; Y236-I240 VanDerWaalsContact O-N 3.12Å; H237-I240 WeakPolarHBondContact O-CB 3.24Å; H237-I240 PolarHBondContact O-N 3.09Å; E238-I240 VanDerWaalsContact C-N 3.35Å; E238-I240 PolarHBondContact O-N 3.33Å; I240-G243 PolarHBondContact O-N 3.36Å; I240-G243 VanDerWaalsContact O-N 3.13Å; I240-I245 HydrophobicContact CG1-CB 4Å; I240-I245 HydrophobicContact CG1-CG2 3.88Å; I240-L247 HydrophobicContact CD1-CD1 4.07Å; I240-L247 HydrophobicContact CD1-CD2 4.13Å; I240-L247 HydrophobicContact CD1-CG 4.3Å; I240-L247 HydrophobicContact CG1-CD1 4.48Å; I240-L247 HydrophobicContact CG1-CD2 4.29Å; I240-L247 HydrophobicContact CG1-CG 4.3Å; I240-L247 HydrophobicContact CG2-CD1 4.27Å; I240-L247 HydrophobicContact CG2-CG 4.41Å
241	E	83.9	Confident	85.1	Confident	144 Å²	144	63.3 Å²	63.3	67%	0.673	34%	0.336	S	S	*	.	H	α-helix	trans	-67	-38	-178.7	-70.3	-178.8	-175.6	0	0	112.5	H237 E238 G243	H237-E241 WeakPolarHBondContact O-CG 3Å; H237-E241 PolarHBondContact O-N 2.7Å; E238-E241 PolarHBondContact O-N 2.77Å; E241-G243 PolarHBondContact O-N 2.79Å
242	S	76.8	Confident	85.4	Confident	43 Å²	43	60.9 Å²	60.9	30%	0.301	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-5.2	173	58.5	0	0	0	0	114.3	E238 M239 V244	E238-S242 VanDerWaalsContact O-CB 3.3Å; E238-S242 WeakPolarHBondContact O-CB 3.29Å; E238-S242 PolarHBondContact O-N 2.87Å; E238-S242 PolarHBondContact O-OG 2.94Å; M239-S242 WeakPolarHBondContact CA-OG 3.44Å; M239-S242 PolarHBondContact O-OG 2.69Å; S242-V244 VanDerWaalsContact C-N 3.32Å; S242-V244 PolarHBondContact O-N 2.94Å
243	G	79.5	Confident	85.2	Confident	34 Å²	34	63.6 Å²	63.6	35%	0.351	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	10.7	177.6	0	0	0	0	0	115.5	M239 I240 E241 N246	M239-G243 PolarHBondContact O-N 2.89Å; I240-G243 PolarHBondContact O-N 3.36Å; I240-G243 VanDerWaalsContact O-N 3.13Å; E241-G243 PolarHBondContact O-N 2.79Å; G243-N246 PolarHBondContact O-ND2 3.12Å
244	V	83.1	Confident	85.2	Confident	14 Å²	14	59.8 Å²	59.8	9%	0.085	32%	0.316	C	S	.	.	S	Bend	trans	-69.5	-36.6	173.8	177.2	0	0	0	0	111	I209 M239 S242 K253 V254	I209-V244 HydrophobicContact CG2-CG1 3.63Å; M239-V244 HydrophobicContact CB-CB 4.33Å; M239-V244 PolarHBondContact O-N 2.97Å; S242-V244 VanDerWaalsContact C-N 3.32Å; S242-V244 PolarHBondContact O-N 2.94Å; V244-K253 PolarHBondContact O-N 2.98Å; V244-K253 VanDerWaalsContact O-N 3.12Å; V244-V254 HydrophobicContact CG1-CB 4.18Å; V244-V254 HydrophobicContact CG1-CG1 3.75Å
245	I	88.5	Confident	85.6	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	30%	0.301	C	S	.	.	S	Bend	trans	-109.3	118.1	170.7	-65.3	175.3	0	0	0	108.7	Y236 M239 I240 L247 V254 L256	Y236-I245 HydrophobicContact CD2-CD1 3.69Å; Y236-I245 HydrophobicContact CE2-CD1 3.91Å; Y236-I245 HydrophobicContact CE2-CG2 4.29Å; M239-I245 HydrophobicContact CB-CB 4.44Å; M239-I245 HydrophobicContact CB-CD1 3.73Å; M239-I245 HydrophobicContact CB-CG1 3.95Å; M239-I245 PolarHBondContact O-N 3.31Å; M239-I245 HydrophobicContact SD-CD1 3.98Å; M239-I245 HydrophobicContact SD-CG1 4.49Å; I240-I245 HydrophobicContact CG1-CB 4Å; I240-I245 HydrophobicContact CG1-CG2 3.88Å; I245-L247 HydrophobicContact CG2-CD2 4.07Å; I245-V254 HydrophobicContact CD1-CG1 3.75Å; I245-V254 HydrophobicContact CG1-CG1 3.39Å; I245-L256 HydrophobicContact CD1-CD1 3.74Å; I245-L256 HydrophobicContact CD1-CG 4.28Å
246	N	87.8	Confident	86	Confident	53 Å²	53	56.9 Å²	56.9	28%	0.283	30%	0.3	S	S	.	.			trans	-103.6	118.2	173.4	-71.8	-70.9	0	0	0	109.5	G243 K248 T251 S252	G243-N246 PolarHBondContact O-ND2 3.12Å; N246-K248 VanDerWaalsContact C-N 3.35Å; N246-T251 WeakPolarHBondContact CB-OG1 3.42Å; N246-T251 PolarHBondContact ND2-OG1 3.16Å; N246-S252 PolarHBondContact N-OG 3.38Å; N246-S252 PolarHBondContact O-OG 2.59Å; N246-S252 VanDerWaalsContact O-OG 3.08Å
247	L	87.8	Confident	86.3	Confident	89 Å²	89	55.6 Å²	55.6	47%	0.466	30%	0.295	S	S	.	.	S	Bend	trans	-78	-20.3	-179.1	-60.8	-178.6	0	0	0	113.5	I240 I245	I240-L247 HydrophobicContact CD1-CD1 4.07Å; I240-L247 HydrophobicContact CD1-CD2 4.13Å; I240-L247 HydrophobicContact CD1-CG 4.3Å; I240-L247 HydrophobicContact CG1-CD1 4.48Å; I240-L247 HydrophobicContact CG1-CD2 4.29Å; I240-L247 HydrophobicContact CG1-CG 4.3Å; I240-L247 HydrophobicContact CG2-CD1 4.27Å; I240-L247 HydrophobicContact CG2-CG 4.41Å; I245-L247 HydrophobicContact CG2-CD2 4.07Å
248	K	83.8	Confident	86.6	Confident	204 Å²	204	51.8 Å²	51.8	89%	0.887	28%	0.277	S	S	*	.	S	Bend	trans	-95.2	-35.2	-174.8	-62	177.6	-176.2	171.7	0	113.2	N246	N246-K248 VanDerWaalsContact C-N 3.35Å
249	D	81.2	Confident	87.2	Confident	106 Å²	106	49.2 Å²	49.2	57%	0.567	27%	0.265	S	S	*	.	S	Bend	trans	-123	156.5	-171	-59.7	-39.7	0	0	0	111.3	T251	D249-T251 HydrophobicContact CB-CG2 4.14Å; D249-T251 PolarHBondContact O-N 2.81Å
250	T	80.2	Confident	87.4	Confident	149 Å²	149	50.8 Å²	50.8	91%	0.914	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	27.7	177.2	61.8	0	0	0	0	113.3
251	T	84.2	Confident	87.5	Confident	76 Å²	76	52.7 Å²	52.7	47%	0.466	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-4.2	-176.4	52.1	0	0	0	0	113.5	N246 D249	N246-T251 WeakPolarHBondContact CB-OG1 3.42Å; N246-T251 PolarHBondContact ND2-OG1 3.16Å; D249-T251 HydrophobicContact CB-CG2 4.14Å; D249-T251 PolarHBondContact O-N 2.81Å
252	S	88.6	Confident	87.8	Confident	4 Å²	4	51.5 Å²	51.5	3%	0.028	28%	0.279	C	S	.	.			trans	-51.5	137.1	175	-66.2	0	0	0	0	112	N246	N246-S252 PolarHBondContact N-OG 3.38Å; N246-S252 PolarHBondContact O-OG 2.59Å; N246-S252 VanDerWaalsContact O-OG 3.08Å
253	K	84.1	Confident	88.6	Confident	63 Å²	63	51 Å²	51	27%	0.274	27%	0.273	S	S	.	.			trans	-109.5	-5.7	-175.1	-70.5	-62.4	-165.7	160.1	0	115.3	A213 G217 Y219 S220 V244	A213-K253 HydrophobicContact CB-CB 4.25Å; A213-K253 HydrophobicContact CB-CG 4.29Å; G217-K253 PolarHBondContact O-NZ 2.78Å; Y219-K253 HydrophobicContact CD1-CD 3.91Å; Y219-K253 HydrophobicContact CE1-CD 3.85Å; S220-K253 PolarHBondContact N-O 3.43Å; V244-K253 PolarHBondContact O-N 2.98Å; V244-K253 VanDerWaalsContact O-N 3.12Å
254	V	91	Very high	89.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.5	-177.1	66.8	0	0	0	0	111.6	G131 S220 F222 M239 V244 I245 L256	G131-V254 WeakPolarHBondContact CA-O 3.4Å; G131-V254 PolarHBondContact N-O 3.46Å; S220-V254 CarbonylContact O-C 3.56Å; S220-V254 VanDerWaalsContact O-CA 3.23Å; S220-V254 WeakPolarHBondContact O-CA 3.39Å; F222-V254 HydrophobicContact CB-CG2 4.42Å; M239-V254 HydrophobicContact CE-CG2 4.47Å; M239-V254 HydrophobicContact SD-CG1 3.71Å; M239-V254 HydrophobicContact SD-CG2 4.35Å; V244-V254 HydrophobicContact CG1-CB 4.18Å; V244-V254 HydrophobicContact CG1-CG1 3.75Å; I245-V254 HydrophobicContact CD1-CG1 3.75Å; I245-V254 HydrophobicContact CG1-CG1 3.39Å; V254-L256 HydrophobicContact CG1-CD2 4.41Å; V254-L256 HydrophobicContact CG2-CD2 3.87Å
255	A	94.3	Very high	89.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	134.8	164.3	0	0	0	0	0	109.7	L130 S220 V221 F222 V278	L130-A255 HydrophobicContact CD2-CB 4.5Å; S220-A255 PolarHBondContact O-N 3.13Å; V221-A255 WeakPolarHBondContact CA-O 3.47Å; F222-A255 PolarHBondContact N-O 3.34Å; A255-V278 HydrophobicContact CB-CG1 4.13Å
256	L	95.4	Very high	90.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	128.9	-179	-57.3	-178.1	0	0	0	110.5	R132 I133 M134 F222 Y236 M239 I245 V254	R132-L256 PolarHBondContact O-N 3.05Å; I133-L256 CarbonylContact C-O 3.57Å; I133-L256 WeakPolarHBondContact CA-O 3.49Å; I133-L256 HydrophobicContact CB-CB 4.38Å; I133-L256 HydrophobicContact CG1-CB 4.16Å; I133-L256 HydrophobicContact CG1-CD1 4Å; I133-L256 HydrophobicContact CG2-CB 4.2Å; M134-L256 PolarHBondContact N-O 3.49Å; F222-L256 HydrophobicContact CB-CD2 3.65Å; F222-L256 HydrophobicContact CG-CD2 4.33Å; Y236-L256 HydrophobicContact CD2-CD1 3.61Å; Y236-L256 HydrophobicContact CE2-CD1 4.38Å; Y236-L256 HydrophobicContact CG-CD1 4.41Å; M239-L256 HydrophobicContact CE-CD2 4.31Å; M239-L256 HydrophobicContact SD-CD2 3.93Å; I245-L256 HydrophobicContact CD1-CD1 3.74Å; I245-L256 HydrophobicContact CD1-CG 4.28Å; V254-L256 HydrophobicContact CG1-CD2 4.41Å; V254-L256 HydrophobicContact CG2-CD2 3.87Å
257	V	96.8	Very high	90.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	113.2	177.6	-173.6	0	0	0	0	107.8	M134 V221 F222 A223 G224 V271 T274 V278	M134-V257 HydrophobicContact CG-CB 4.24Å; M134-V257 HydrophobicContact CG-CG1 4.15Å; M134-V257 HydrophobicContact CG-CG2 3.76Å; M134-V257 WeakPolarHBondContact O-CA 3.31Å; M134-V257 HydrophobicContact SD-CG2 3.97Å; V221-V257 HydrophobicContact CG1-CG2 4.28Å; F222-V257 PolarHBondContact O-N 2.99Å; A223-V257 CarbonylContact C-O 3.52Å; A223-V257 WeakPolarHBondContact CA-O 3.49Å; G224-V257 PolarHBondContact N-O 2.82Å; V257-V271 HydrophobicContact CG1-CG2 3.72Å; V257-T274 HydrophobicContact CG1-CG2 3.43Å; V257-T274 VanDerWaalsContact CG1-CG2 3.43Å; V257-V278 HydrophobicContact CG2-CG2 4.5Å
258	Y	95.7	Very high	90.8	Very high	9 Å²	9	44.9 Å²	44.9	4%	0.035	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.8	-176.7	-69.2	-23.3	0	0	0	111.9	I133 M134 N135 F222 G232	I133-Y258 HydrophobicContact CD1-CE2 4.39Å; I133-Y258 HydrophobicContact CG2-CD2 3.46Å; I133-Y258 VanDerWaalsContact CG2-CD2 3.46Å; I133-Y258 HydrophobicContact CG2-CE2 3.94Å; I133-Y258 HydrophobicContact CG2-CG 4.05Å; M134-Y258 PolarHBondContact O-N 3.48Å; N135-Y258 WeakPolarHBondContact CA-O 3.42Å; F222-Y258 HydrophobicContact CD1-CD1 4.46Å; F222-Y258 AromaticContact CD1-CE1 3.76Å; F222-Y258 HydrophobicContact CD1-CE1 3.76Å; F222-Y258 AromaticContact CE1-CE1 3.86Å; F222-Y258 HydrophobicContact CE1-CE1 3.86Å; G232-Y258 WeakPolarHBondContact CA-OH 3.4Å; G232-Y258 PolarHBondContact O-OH 2.86Å
259	G	93.6	Very high	91.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	90.4	172.4	0	0	0	0	0	107.3	G224 G226 E263	G224-G259 PolarHBondContact O-N 2.8Å; G226-G259 VanDerWaalsContact CA-O 3.31Å; G226-G259 WeakPolarHBondContact CA-O 3.34Å; G226-G259 PolarHBondContact N-O 3.37Å; G259-E263 WeakPolarHBondContact CA-OE1 3.33Å; G259-E263 VanDerWaalsContact CA-OE2 3.3Å; G259-E263 WeakPolarHBondContact CA-OE2 3.3Å
260	Q	91.7	Very high	92	Very high	35 Å²	35	32.3 Å²	32.3	16%	0.164	17%	0.172	C	C	.	.			trans	-75.4	166	-159.8	-60.3	-175.8	-4.7	0	0	113.4	E227 T229 N262 E263	E227-Q260 WeakPolarHBondContact O-CA 2.88Å; T229-Q260 PolarHBondContact OG1-OE1 2.92Å; Q260-N262 WeakPolarHBondContact CB-OD1 3.41Å; Q260-N262 PolarHBondContact O-N 2.82Å; Q260-N262 PolarHBondContact OE1-OD1 3.33Å; Q260-E263 HydrophobicContact CB-CG 4.46Å; Q260-E263 PolarHBondContact N-OE1 2.83Å; Q260-E263 WeakPolarHBondContact O-CB 3.44Å; Q260-E263 PolarHBondContact O-N 3.32Å
261	M	90.4	Very high	92.7	Very high	82 Å²	82	25.2 Å²	25.2	40%	0.404	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.7	177.9	-74.7	-165.9	74.4	0	0	114.7	G226 E227 R228 E263	G226-M261 WeakPolarHBondContact O-CG 3.21Å; E227-M261 PolarHBondContact O-N 3.01Å; R228-M261 HydrophobicContact CG-SD 3.71Å; M261-E263 VanDerWaalsContact C-N 3.34Å
262	N	90.4	Very high	93.3	Very high	119 Å²	119	21.6 Å²	21.6	64%	0.636	11%	0.106	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-9.8	176.9	58.8	-65	0	0	0	113.6	Q260	Q260-N262 WeakPolarHBondContact CB-OD1 3.41Å; Q260-N262 PolarHBondContact O-N 2.82Å; Q260-N262 PolarHBondContact OE1-OD1 3.33Å
263	E	92.9	Very high	93.7	Very high	34 Å²	34	22 Å²	22	16%	0.159	11%	0.108	C	C	.	.	S	Bend	trans	-78.7	151	177.1	-70.1	174.2	-137	0	0	111.7	G259 Q260 M261 A267 R268	G259-E263 WeakPolarHBondContact CA-OE1 3.33Å; G259-E263 VanDerWaalsContact CA-OE2 3.3Å; G259-E263 WeakPolarHBondContact CA-OE2 3.3Å; Q260-E263 HydrophobicContact CB-CG 4.46Å; Q260-E263 PolarHBondContact N-OE1 2.83Å; Q260-E263 WeakPolarHBondContact O-CB 3.44Å; Q260-E263 PolarHBondContact O-N 3.32Å; M261-E263 VanDerWaalsContact C-N 3.34Å; E263-A267 HydrophobicContact CB-CB 3.99Å; E263-A267 WeakPolarHBondContact OE2-CB 3.36Å; E263-R268 PolarHBondContact O-NE 3.47Å; E263-R268 VanDerWaalsContact O-NE 3.13Å
264	P	94	Very high	94.3	Very high	24 Å²	24	19 Å²	19	16%	0.156	10%	0.095	C	C	.	.			trans	-59.3	155.9	179.1	26	-35.7	0	0	0	111.7	A58 G266 A267 R268	A58-P264 HydrophobicContact CB-CB 4.38Å; P264-G266 PolarHBondContact O-N 2.96Å; P264-A267 HydrophobicContact CG-CB 4.37Å; P264-A267 PolarHBondContact O-N 2.98Å; P264-R268 PolarHBondContact O-N 2.81Å
265	P	94.4	Very high	94.6	Very high	15 Å²	15	19 Å²	19	10%	0.097	10%	0.095	C	C	.	.	H	α-helix	trans	-60.8	-22.8	-178.3	25.1	-34.7	0	0	0	113.3	A58 A269 A303 E306 V307 L310	A58-P265 HydrophobicContact CB-CG 4.3Å; P265-A269 WeakPolarHBondContact O-CB 3.38Å; P265-A269 PolarHBondContact O-N 3.18Å; P265-A303 HydrophobicContact CB-CB 4.42Å; P265-E306 HydrophobicContact CB-CB 3.71Å; P265-E306 HydrophobicContact CG-CB 4.16Å; P265-V307 HydrophobicContact CB-CG2 4.08Å; P265-V307 HydrophobicContact CG-CG2 4.5Å; P265-L310 HydrophobicContact CG-CD1 4.4Å
266	G	94.3	Very high	94.7	Very high	1 Å²	1	19 Å²	19	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-58.8	-49.8	170.8	0	0	0	0	0	113.5	I100 P264 A269 R270	I100-G266 VanDerWaalsContact CG2-CA 3.45Å; P264-G266 PolarHBondContact O-N 2.96Å; G266-A269 PolarHBondContact O-N 3.23Å; G266-R270 WeakPolarHBondContact O-CG 3.23Å; G266-R270 PolarHBondContact O-N 3.38Å
267	A	94.7	Very high	94.7	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.2	-48.8	177.7	0	0	0	0	0	111.8	V136 E263 P264 A269 R270 V271	V136-A267 HydrophobicContact CB-CB 4.34Å; V136-A267 HydrophobicContact CG1-CB 3.74Å; E263-A267 HydrophobicContact CB-CB 3.99Å; E263-A267 WeakPolarHBondContact OE2-CB 3.36Å; P264-A267 HydrophobicContact CG-CB 4.37Å; P264-A267 PolarHBondContact O-N 2.98Å; A267-A269 PolarHBondContact O-N 2.8Å; A267-R270 PolarHBondContact O-N 3.29Å; A267-V271 PolarHBondContact O-N 2.69Å
268	R	94.8	Very high	94.7	Very high	22 Å²	22	19.3 Å²	19.3	8%	0.083	10%	0.097	C	C	.	.	H	α-helix	trans	-60.2	-32.3	177.4	-68.9	-174	-76.2	118.5	-6.4	112.9	V225 E263 P264 R270 A303 E306	V225-R268 WeakPolarHBondContact CG1-O 3.25Å; E263-R268 PolarHBondContact O-NE 3.47Å; E263-R268 VanDerWaalsContact O-NE 3.13Å; P264-R268 PolarHBondContact O-N 2.81Å; R268-R270 VanDerWaalsContact C-N 3.29Å; R268-R270 PolarHBondContact O-N 2.91Å; R268-A303 HydrophobicContact CB-CB 3.58Å; R268-E306 IonicContact CZ-OE1 2.68Å; R268-E306 IonicContact CZ-OE2 2.92Å; R268-E306 IonicContact NH1-OE1 3.34Å; R268-E306 PolarHBondContact NH1-OE1 2.88Å; R268-E306 IonicContact NH1-OE2 3.92Å; R268-E306 IonicContact NH2-OE1 2.91Å; R268-E306 PolarHBondContact NH2-OE1 2.8Å; R268-E306 IonicContact NH2-OE2 3.21Å; R268-E306 PolarHBondContact NH2-OE2 2.96Å
269	A	94.2	Very high	94.7	Very high	3 Å²	3	18.9 Å²	18.9	3%	0.025	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-0.3	175.7	0	0	0	0	0	114.4	P265 G266 A267 F300 A303 V307	P265-A269 WeakPolarHBondContact O-CB 3.38Å; P265-A269 PolarHBondContact O-N 3.18Å; G266-A269 PolarHBondContact O-N 3.23Å; A267-A269 PolarHBondContact O-N 2.8Å; A269-F300 WeakPolarHBondContact O-CE2 3.27Å; A269-A303 HydrophobicContact CB-CB 3.96Å; A269-V307 HydrophobicContact CB-CG2 4.4Å
270	R	95.8	Very high	94.8	Very high	43 Å²	43	19 Å²	19	16%	0.162	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.7	-24.9	-178.4	-67	-62.9	176.3	-93.5	0.5	114.5	E87 M102 V136 I155 G266 A267 R268 A272 L273 T274	E87-R270 VanDerWaalsContact CD-NE 3.25Å; E87-R270 IonicContact OE1-CZ 3.92Å; E87-R270 IonicContact OE1-NE 3.62Å; E87-R270 PolarHBondContact OE1-NE 3.36Å; E87-R270 IonicContact OE1-NH2 3.55Å; E87-R270 PolarHBondContact OE1-NH2 3.46Å; E87-R270 WeakPolarHBondContact OE2-CD 3.07Å; E87-R270 IonicContact OE2-CZ 3.37Å; E87-R270 IonicContact OE2-NE 2.7Å; E87-R270 PolarHBondContact OE2-NE 3.05Å; M102-R270 HydrophobicContact CE-CG 4.32Å; M102-R270 HydrophobicContact SD-CB 4.36Å; M102-R270 HydrophobicContact SD-CG 4.14Å; V136-R270 HydrophobicContact CG2-CB 3.54Å; I155-R270 HydrophobicContact CD1-CB 4.08Å; I155-R270 HydrophobicContact CD1-CG 4.39Å; G266-R270 WeakPolarHBondContact O-CG 3.23Å; G266-R270 PolarHBondContact O-N 3.38Å; A267-R270 PolarHBondContact O-N 3.29Å; R268-R270 VanDerWaalsContact C-N 3.29Å; R268-R270 PolarHBondContact O-N 2.91Å; R270-A272 PolarHBondContact O-N 2.94Å; R270-L273 WeakPolarHBondContact O-CA 3.23Å; R270-L273 VanDerWaalsContact O-CB 3.31Å; R270-L273 WeakPolarHBondContact O-CB 3.43Å; R270-L273 PolarHBondContact O-N 3.13Å; R270-T274 PolarHBondContact O-N 3Å; R270-T274 VanDerWaalsContact O-N 3.11Å; R270-T274 PolarHBondContact O-OG1 2.96Å
271	V	96.3	Very high	95	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-57	-33.2	179.9	65.8	0	0	0	0	113.8	V136 V225 V257 A267 L273 T274 G275	V136-V271 HydrophobicContact CB-CB 4.33Å; V136-V271 HydrophobicContact CG2-CB 4.31Å; V225-V271 HydrophobicContact CB-CG1 4.1Å; V225-V271 HydrophobicContact CG1-CG1 3.87Å; V225-V271 HydrophobicContact CG2-CG1 4.07Å; V257-V271 HydrophobicContact CG1-CG2 3.72Å; A267-V271 PolarHBondContact O-N 2.69Å; V271-L273 VanDerWaalsContact C-N 3.31Å; V271-L273 PolarHBondContact O-N 2.85Å; V271-T274 WeakPolarHBondContact O-CB 3.36Å; V271-T274 PolarHBondContact O-N 3.2Å; V271-G275 PolarHBondContact O-N 3.05Å
272	A	96.1	Very high	95.1	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-59.9	-40.6	172.6	0	0	0	0	0	112.2	V225 R270 L276 F300	V225-A272 HydrophobicContact CG2-CB 3.89Å; R270-A272 PolarHBondContact O-N 2.94Å; A272-L276 VanDerWaalsContact O-CB 3.26Å; A272-L276 WeakPolarHBondContact O-CB 3.5Å; A272-L276 PolarHBondContact O-N 3.08Å; A272-F300 HydrophobicContact CB-CD2 3.88Å; A272-F300 HydrophobicContact CB-CE2 4.39Å; A272-F300 HydrophobicContact CB-CG 4.48Å
273	L	96.8	Very high	95.3	Very high	13 Å²	13	8.8 Å²	8.8	7%	0.068	4%	0.042	C	C	.	.	H	α-helix	trans	-70.1	-33.7	176.4	-51.1	-177.7	0	0	0	111.5	I155 R270 V271 T277 M331	I155-L273 HydrophobicContact CB-CB 4.24Å; R270-L273 WeakPolarHBondContact O-CA 3.23Å; R270-L273 VanDerWaalsContact O-CB 3.31Å; R270-L273 WeakPolarHBondContact O-CB 3.43Å; R270-L273 PolarHBondContact O-N 3.13Å; V271-L273 VanDerWaalsContact C-N 3.31Å; V271-L273 PolarHBondContact O-N 2.85Å; L273-T277 VanDerWaalsContact O-CB 3.31Å; L273-T277 WeakPolarHBondContact O-CB 3.49Å; L273-T277 PolarHBondContact O-N 3.22Å; L273-T277 PolarHBondContact O-OG1 3.37Å; L273-M331 HydrophobicContact CD2-CB 3.95Å; L273-M331 HydrophobicContact CD2-CG 3.62Å
274	T	96.9	Very high	95.2	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-61.4	-53	174	-56	0	0	0	0	110.9	I123 M134 V136 V257 R270 V271 L276 T277 V278	I123-T274 HydrophobicContact CD1-CG2 3.68Å; I123-T274 WeakPolarHBondContact CD1-O 3.28Å; I123-T274 HydrophobicContact CG2-CG2 4.15Å; M134-T274 HydrophobicContact SD-CG2 4.3Å; V136-T274 PolarHBondContact O-OG1 3.44Å; V257-T274 HydrophobicContact CG1-CG2 3.43Å; V257-T274 VanDerWaalsContact CG1-CG2 3.43Å; R270-T274 PolarHBondContact O-N 3Å; R270-T274 VanDerWaalsContact O-N 3.11Å; R270-T274 PolarHBondContact O-OG1 2.96Å; V271-T274 WeakPolarHBondContact O-CB 3.36Å; V271-T274 PolarHBondContact O-N 3.2Å; T274-L276 PolarHBondContact O-N 3.47Å; T274-T277 PolarHBondContact O-N 3.47Å; T274-V278 PolarHBondContact O-N 2.92Å
275	G	96.5	Very high	95.1	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-61.8	-41.5	176.2	0	0	0	0	0	113.1	V221 V271 T277 V278 A279	V221-G275 WeakPolarHBondContact CG1-O 3.48Å; V271-G275 PolarHBondContact O-N 3.05Å; G275-T277 VanDerWaalsContact C-N 3.34Å; G275-T277 PolarHBondContact O-N 3.36Å; G275-V278 PolarHBondContact O-N 2.97Å; G275-A279 PolarHBondContact O-N 2.97Å
276	L	96.3	Very high	94.9	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-59.5	-42.8	174.1	-178.9	53.4	0	0	0	112.2	A272 T274 V278 A279 E280 L292 M331 R334 I335 I343	A272-L276 VanDerWaalsContact O-CB 3.26Å; A272-L276 WeakPolarHBondContact O-CB 3.5Å; A272-L276 PolarHBondContact O-N 3.08Å; T274-L276 PolarHBondContact O-N 3.47Å; L276-V278 VanDerWaalsContact C-N 3.32Å; L276-V278 PolarHBondContact O-N 3.2Å; L276-A279 CarbonylContact O-C 3.59Å; L276-A279 WeakPolarHBondContact O-CB 3.31Å; L276-A279 PolarHBondContact O-N 3.02Å; L276-A279 VanDerWaalsContact O-N 3.09Å; L276-E280 HydrophobicContact CD1-CG 4.07Å; L276-E280 HydrophobicContact CG-CG 4.34Å; L276-E280 WeakPolarHBondContact O-CG 3.35Å; L276-E280 PolarHBondContact O-N 3.05Å; L276-L292 HydrophobicContact CB-CD2 4.28Å; L276-L292 HydrophobicContact CD1-CD2 3.7Å; L276-M331 HydrophobicContact CD2-CG 3.97Å; L276-M331 HydrophobicContact CD2-SD 4.09Å; L276-R334 HydrophobicContact CD1-CB 4.44Å; L276-R334 HydrophobicContact CD2-CB 3.76Å; L276-R334 HydrophobicContact CG-CB 4.35Å; L276-I335 HydrophobicContact CD1-CG1 3.61Å; L276-I335 HydrophobicContact CD2-CG1 4.35Å; L276-I343 HydrophobicContact CD1-CD1 4.37Å
277	T	96.9	Very high	94.7	Very high	5 Å²	5	15.1 Å²	15.1	3%	0.031	8%	0.08	C	C	.	.	H	α-helix	trans	-65.5	-34	-179.9	-58.3	0	0	0	0	112.5	I123 V125 A153 P154 I155 L273 T274 G275 Y281 R334	I123-T277 HydrophobicContact CD1-CG2 3.95Å; I123-T277 HydrophobicContact CG1-CG2 4.17Å; V125-T277 HydrophobicContact CG1-CG2 4.42Å; A153-T277 HydrophobicContact CB-CG2 3.69Å; P154-T277 WeakPolarHBondContact O-CG2 3.46Å; I155-T277 WeakPolarHBondContact CA-OG1 3.47Å; I155-T277 PolarHBondContact O-OG1 3.02Å; L273-T277 VanDerWaalsContact O-CB 3.31Å; L273-T277 WeakPolarHBondContact O-CB 3.49Å; L273-T277 PolarHBondContact O-N 3.22Å; L273-T277 PolarHBondContact O-OG1 3.37Å; T274-T277 PolarHBondContact O-N 3.47Å; G275-T277 VanDerWaalsContact C-N 3.34Å; G275-T277 PolarHBondContact O-N 3.36Å; T277-Y281 PolarHBondContact O-N 2.97Å; T277-Y281 VanDerWaalsContact O-N 3.16Å; T277-R334 PolarHBondContact OG1-NH2 2.89Å
278	V	96.3	Very high	94.4	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.4	-43.3	170.5	178.1	0	0	0	0	110.8	I123 V125 M134 V221 A255 V257 T274 G275 L276 Y281 F282	I123-V278 HydrophobicContact CD1-CG2 3.87Å; V125-V278 HydrophobicContact CG1-CG2 4.43Å; M134-V278 HydrophobicContact CE-CG2 4.3Å; M134-V278 HydrophobicContact SD-CG2 4.09Å; V221-V278 HydrophobicContact CG1-CB 4.25Å; V221-V278 HydrophobicContact CG1-CG1 4.3Å; V221-V278 HydrophobicContact CG2-CB 4.38Å; V221-V278 HydrophobicContact CG2-CG1 3.87Å; A255-V278 HydrophobicContact CB-CG1 4.13Å; V257-V278 HydrophobicContact CG2-CG2 4.5Å; T274-V278 PolarHBondContact O-N 2.92Å; G275-V278 PolarHBondContact O-N 2.97Å; L276-V278 VanDerWaalsContact C-N 3.32Å; L276-V278 PolarHBondContact O-N 3.2Å; V278-Y281 PolarHBondContact O-N 3.44Å; V278-F282 HydrophobicContact CG1-CD2 4.34Å; V278-F282 HydrophobicContact CG1-CE2 3.79Å; V278-F282 VanDerWaalsContact O-CD2 3.23Å; V278-F282 WeakPolarHBondContact O-CD2 3.48Å; V278-F282 PolarHBondContact O-N 3.18Å
279	A	95.8	Very high	94.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-65.5	-39.2	176.5	0	0	0	0	0	112.7	V221 G275 L276 Y281 F282 R283 V290 L292 I343	V221-A279 HydrophobicContact CB-CB 4.39Å; V221-A279 HydrophobicContact CG2-CB 4.02Å; G275-A279 PolarHBondContact O-N 2.97Å; L276-A279 CarbonylContact O-C 3.59Å; L276-A279 WeakPolarHBondContact O-CB 3.31Å; L276-A279 PolarHBondContact O-N 3.02Å; L276-A279 VanDerWaalsContact O-N 3.09Å; A279-Y281 VanDerWaalsContact C-N 3.33Å; A279-Y281 PolarHBondContact O-N 3.08Å; A279-F282 PolarHBondContact O-N 3.43Å; A279-R283 PolarHBondContact O-N 2.96Å; A279-V290 HydrophobicContact CB-CG1 3.88Å; A279-L292 HydrophobicContact CB-CB 4.43Å; A279-L292 HydrophobicContact CB-CD1 4.32Å; A279-I343 HydrophobicContact CB-CD1 4.04Å; A279-I343 HydrophobicContact CB-CG1 4.36Å; A279-I343 HydrophobicContact CB-CG2 4.38Å
280	E	95.3	Very high	94	Very high	3 Å²	3	19.3 Å²	19.3	1%	0.014	10%	0.102	C	C	.	.	H	α-helix	trans	-65.4	-32.3	176.7	-70.8	-167.6	107	0	0	112.7	R36 Y38 L276 R283 D284 R334 I343	R36-E280 IonicContact CZ-OE1 2.95Å; R36-E280 IonicContact NE-OE1 3.27Å; R36-E280 IonicContact NH1-OE1 3.98Å; R36-E280 IonicContact NH2-OE1 2.71Å; R36-E280 PolarHBondContact NH2-OE1 2.91Å; Y38-E280 PolarHBondContact OH-O 3.16Å; L276-E280 HydrophobicContact CD1-CG 4.07Å; L276-E280 HydrophobicContact CG-CG 4.34Å; L276-E280 WeakPolarHBondContact O-CG 3.35Å; L276-E280 PolarHBondContact O-N 3.05Å; E280-R283 VanDerWaalsContact CG-NH2 3.34Å; E280-R283 PolarHBondContact O-N 2.98Å; E280-R283 IonicContact OE1-CZ 3.07Å; E280-R283 IonicContact OE1-NH1 2.66Å; E280-R283 IonicContact OE1-NH2 3.88Å; E280-R283 PolarHBondContact OE1-NH2 2.9Å; E280-D284 VanDerWaalsContact O-CB 3.22Å; E280-D284 WeakPolarHBondContact O-CB 3.48Å; E280-D284 PolarHBondContact O-N 3.28Å; E280-R334 IonicContact OE1-NE 2.65Å; E280-R334 IonicContact OE2-CZ 3.71Å; E280-R334 IonicContact OE2-NE 3.71Å; E280-R334 PolarHBondContact OE2-NE 3.12Å; E280-R334 IonicContact OE2-NH2 3.53Å; E280-R334 PolarHBondContact OE2-NH2 3.47Å; E280-I343 HydrophobicContact CB-CD1 4.44Å; E280-I343 HydrophobicContact CG-CD1 3.74Å
281	Y	95.1	Very high	93.9	Very high	22 Å²	22	17.7 Å²	17.7	9%	0.086	10%	0.096	C	C	.	.	H	α-helix	trans	-58.9	-50.3	169.9	171.2	-86.6	0	0	0	111.5	Y38 V125 G126 T277 V278 A279 R283 D284 Q285 E286	Y38-Y281 AromaticContact CD1-CD2 3.8Å; Y38-Y281 HydrophobicContact CD1-CD2 3.8Å; Y38-Y281 AromaticContact CE1-CD2 3.72Å; Y38-Y281 HydrophobicContact CE1-CD2 3.72Å; Y38-Y281 HydrophobicContact CE1-CG 4.33Å; V125-Y281 HydrophobicContact CB-CD2 3.95Å; V125-Y281 HydrophobicContact CB-CG 3.85Å; V125-Y281 HydrophobicContact CG2-CD2 3.57Å; V125-Y281 HydrophobicContact CG2-CE2 4.25Å; V125-Y281 HydrophobicContact CG2-CG 4.01Å; G126-Y281 VanDerWaalsContact CA-CE1 3.47Å; T277-Y281 PolarHBondContact O-N 2.97Å; T277-Y281 VanDerWaalsContact O-N 3.16Å; V278-Y281 PolarHBondContact O-N 3.44Å; A279-Y281 VanDerWaalsContact C-N 3.33Å; A279-Y281 PolarHBondContact O-N 3.08Å; Y281-R283 VanDerWaalsContact C-N 3.32Å; Y281-R283 PolarHBondContact O-N 2.95Å; Y281-D284 PolarHBondContact O-N 3.33Å; Y281-Q285 HydrophobicContact CD2-CB 4.06Å; Y281-Q285 HydrophobicContact CD2-CG 3.85Å; Y281-Q285 HydrophobicContact CE2-CB 3.82Å; Y281-Q285 HydrophobicContact CE2-CG 3.87Å; Y281-Q285 WeakPolarHBondContact O-CB 3.29Å; Y281-Q285 PolarHBondContact O-N 3.01Å; Y281-E286 HydrophobicContact CE1-CG 3.76Å; Y281-E286 VanDerWaalsContact CE1-OE1 3.28Å; Y281-E286 WeakPolarHBondContact CE1-OE1 3.13Å; Y281-E286 PolarHBondContact OH-OE1 3.17Å
282	F	93.6	Very high	93.8	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-65.2	-34.7	-179.5	-66.9	-60.8	0	0	0	112.4	P127 L130 Y219 V221 V278 A279 E286 G287 Q288 V290	P127-F282 HydrophobicContact CG-CE1 4.44Å; L130-F282 HydrophobicContact CD1-CZ 4.47Å; L130-F282 HydrophobicContact CD2-CE2 4.33Å; L130-F282 HydrophobicContact CD2-CZ 3.97Å; L130-F282 HydrophobicContact CG-CZ 4.13Å; Y219-F282 AromaticContact CD2-CD1 3.53Å; Y219-F282 HydrophobicContact CD2-CD1 3.53Å; Y219-F282 AromaticContact CD2-CE1 3.71Å; Y219-F282 HydrophobicContact CD2-CE1 3.71Å; Y219-F282 HydrophobicContact CD2-CG 4.04Å; Y219-F282 HydrophobicContact CD2-CZ 4.35Å; Y219-F282 AromaticContact CE2-CD1 3.97Å; Y219-F282 HydrophobicContact CE2-CD1 3.97Å; Y219-F282 AromaticContact CE2-CE1 3.92Å; Y219-F282 HydrophobicContact CE2-CE1 3.92Å; Y219-F282 HydrophobicContact CG-CD1 4.45Å; Y219-F282 HydrophobicContact CG-CE1 4.46Å; V221-F282 HydrophobicContact CG2-CD2 4.39Å; V221-F282 HydrophobicContact CG2-CE2 4.47Å; V278-F282 HydrophobicContact CG1-CD2 4.34Å; V278-F282 HydrophobicContact CG1-CE2 3.79Å; V278-F282 VanDerWaalsContact O-CD2 3.23Å; V278-F282 WeakPolarHBondContact O-CD2 3.48Å; V278-F282 PolarHBondContact O-N 3.18Å; A279-F282 PolarHBondContact O-N 3.43Å; F282-E286 HydrophobicContact CD1-CG 4.35Å; F282-E286 WeakPolarHBondContact CD1-OE2 3.46Å; F282-E286 CarbonylContact O-C 3.53Å; F282-E286 PolarHBondContact O-N 3.22Å; F282-G287 PolarHBondContact O-N 3.05Å; F282-G287 VanDerWaalsContact O-N 3.15Å; F282-Q288 PolarHBondContact O-N 3.34Å; F282-Q288 VanDerWaalsContact O-N 3.08Å; F282-V290 HydrophobicContact CB-CG2 3.52Å
283	R	93.7	Very high	93.7	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-66.9	-51.8	172.1	-172.3	-166.7	60.8	-146.1	-14.8	112.6	A279 E280 Y281 G287 R334 G341 I343	A279-R283 PolarHBondContact O-N 2.96Å; E280-R283 VanDerWaalsContact CG-NH2 3.34Å; E280-R283 PolarHBondContact O-N 2.98Å; E280-R283 IonicContact OE1-CZ 3.07Å; E280-R283 IonicContact OE1-NH1 2.66Å; E280-R283 IonicContact OE1-NH2 3.88Å; E280-R283 PolarHBondContact OE1-NH2 2.9Å; Y281-R283 VanDerWaalsContact C-N 3.32Å; Y281-R283 PolarHBondContact O-N 2.95Å; R283-G287 WeakPolarHBondContact O-CA 3.26Å; R283-G287 PolarHBondContact O-N 3.5Å; R283-R334 PolarHBondContact NH1-O 2.91Å; R283-G341 WeakPolarHBondContact CD-O 3.49Å; R283-G341 VanDerWaalsContact CG-O 3.3Å; R283-G341 WeakPolarHBondContact CG-O 3.22Å; R283-I343 HydrophobicContact CB-CD1 4.12Å; R283-I343 HydrophobicContact CB-CG1 3.94Å; R283-I343 HydrophobicContact CG-CG1 4.27Å
284	D	92.4	Very high	93.6	Very high	13 Å²	13	17.2 Å²	17.2	7%	0.07	9%	0.093	C	C	.	.	H	α-helix	trans	-91.8	-27.2	-163.9	-65.4	-27.5	0	0	0	114.3	R36 E280 Y281 K340	R36-D284 WeakPolarHBondContact CD-OD2 3.3Å; R36-D284 IonicContact CZ-OD2 2.86Å; R36-D284 IonicContact NE-OD2 3.22Å; R36-D284 IonicContact NH1-OD1 2.88Å; R36-D284 IonicContact NH1-OD2 3.67Å; R36-D284 PolarHBondContact NH1-OD2 3.04Å; E280-D284 VanDerWaalsContact O-CB 3.22Å; E280-D284 WeakPolarHBondContact O-CB 3.48Å; E280-D284 PolarHBondContact O-N 3.28Å; Y281-D284 PolarHBondContact O-N 3.33Å; D284-K340 VanDerWaalsContact O-CD 3.28Å; D284-K340 WeakPolarHBondContact O-CD 3.34Å; D284-K340 PolarHBondContact O-NZ 3.29Å
285	Q	91.8	Very high	93.3	Very high	94 Å²	94	17.5 Å²	17.5	44%	0.439	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-42.3	178.4	-65.1	-60.9	-32.8	0	0	112.2	Y38 Y281	Y38-Q285 HydrophobicContact CD1-CG 4.15Å; Y38-Q285 HydrophobicContact CD2-CG 4.03Å; Y38-Q285 HydrophobicContact CE1-CG 4.07Å; Y38-Q285 HydrophobicContact CE2-CG 3.95Å; Y38-Q285 HydrophobicContact CG-CG 4.12Å; Y281-Q285 HydrophobicContact CD2-CB 4.06Å; Y281-Q285 HydrophobicContact CD2-CG 3.85Å; Y281-Q285 HydrophobicContact CE2-CB 3.82Å; Y281-Q285 HydrophobicContact CE2-CG 3.87Å; Y281-Q285 WeakPolarHBondContact O-CB 3.29Å; Y281-Q285 PolarHBondContact O-N 3.01Å
286	E	90.1	Very high	92.9	Very high	60 Å²	60	18.3 Å²	18.3	28%	0.28	10%	0.099	S	C	.	.	S	Bend	trans	-94.5	-13	-177.6	-53.3	-159.2	168.3	0	0	113.8	P127 Y281 F282 Q288	P127-E286 VanDerWaalsContact CD-OE1 3.24Å; P127-E286 WeakPolarHBondContact CD-OE1 3.34Å; P127-E286 WeakPolarHBondContact CG-OE1 3.32Å; Y281-E286 HydrophobicContact CE1-CG 3.76Å; Y281-E286 VanDerWaalsContact CE1-OE1 3.28Å; Y281-E286 WeakPolarHBondContact CE1-OE1 3.13Å; Y281-E286 PolarHBondContact OH-OE1 3.17Å; F282-E286 HydrophobicContact CD1-CG 4.35Å; F282-E286 WeakPolarHBondContact CD1-OE2 3.46Å; F282-E286 CarbonylContact O-C 3.53Å; F282-E286 PolarHBondContact O-N 3.22Å; E286-Q288 VanDerWaalsContact C-N 3.29Å; E286-Q288 HydrophobicContact CB-CG 4.09Å; E286-Q288 PolarHBondContact O-N 3.39Å; E286-Q288 PolarHBondContact OE2-NE2 3.16Å
287	G	89.6	Confident	92.6	Very high	40 Å²	40	18.3 Å²	18.3	41%	0.412	10%	0.099	S	C	.	.			trans	65.9	31.2	178.1	0	0	0	0	0	113.3	F282 R283 K340	F282-G287 PolarHBondContact O-N 3.05Å; F282-G287 VanDerWaalsContact O-N 3.15Å; R283-G287 WeakPolarHBondContact O-CA 3.26Å; R283-G287 PolarHBondContact O-N 3.5Å; G287-K340 CarbonylContact C-O 3.38Å; G287-K340 WeakPolarHBondContact CA-O 3.5Å
288	Q	87.8	Confident	92.3	Very high	52 Å²	52	19 Å²	19	24%	0.243	10%	0.102	C	C	.	.			trans	-97	159	-178.1	-63.4	-162.3	26.2	0	0	112.5	Y219 F282 E286	Y219-Q288 VanDerWaalsContact CE2-NE2 3.27Å; F282-Q288 PolarHBondContact O-N 3.34Å; F282-Q288 VanDerWaalsContact O-N 3.08Å; E286-Q288 VanDerWaalsContact C-N 3.29Å; E286-Q288 HydrophobicContact CB-CG 4.09Å; E286-Q288 PolarHBondContact O-N 3.39Å; E286-Q288 PolarHBondContact OE2-NE2 3.16Å
289	D	89.1	Confident	92.1	Very high	60 Å²	60	21.4 Å²	21.4	32%	0.321	11%	0.111	S	C	.	.			trans	-84.8	120.6	165.1	-67.4	-43.7	0	0	0	109.1	K187 G218 S342	K187-D289 WeakPolarHBondContact CE-OD1 3.5Å; K187-D289 WeakPolarHBondContact CE-OD2 3.43Å; K187-D289 IonicContact NZ-OD1 2.76Å; K187-D289 IonicContact NZ-OD2 2.72Å; K187-D289 PolarHBondContact NZ-OD2 3.16Å; G218-D289 WeakPolarHBondContact CA-O 3.4Å; D289-S342 WeakPolarHBondContact OD1-CB 3.35Å; D289-S342 PolarHBondContact OD1-N 2.78Å; D289-S342 VanDerWaalsContact OD1-N 3.12Å; D289-S342 PolarHBondContact OD1-OG 2.95Å
290	V	92.3	Very high	92	Very high	1 Å²	1	22 Å²	22	1%	0.006	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	136.9	-169.7	-171	0	0	0	0	109.9	Y219 V221 A279 F282 S342 I343 T344	Y219-V290 WeakPolarHBondContact O-CA 3.39Å; Y219-V290 WeakPolarHBondContact O-CG1 3.41Å; V221-V290 HydrophobicContact CG2-CG1 4.35Å; A279-V290 HydrophobicContact CB-CG1 3.88Å; F282-V290 HydrophobicContact CB-CG2 3.52Å; V290-S342 PolarHBondContact N-O 3.37Å; V290-I343 HydrophobicContact CB-CG1 4.26Å; V290-I343 CarbonylContact O-C 3.59Å; V290-I343 WeakPolarHBondContact O-CA 3.27Å; V290-T344 PolarHBondContact O-N 2.82Å
291	L	93.1	Very high	91.9	Very high	8 Å²	8	22 Å²	22	4%	0.042	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	124.7	165.6	-77.9	172.1	0	0	0	110.8	L172 V212 Y219 S220 V221 F293 T344	L172-L291 HydrophobicContact CD2-CD2 4.19Å; V212-L291 HydrophobicContact CB-CD1 3.49Å; V212-L291 VanDerWaalsContact CB-CD1 3.49Å; V212-L291 HydrophobicContact CB-CG 4.42Å; V212-L291 HydrophobicContact CG1-CD1 3.61Å; V212-L291 HydrophobicContact CG1-CG 4.04Å; V212-L291 HydrophobicContact CG2-CD1 3.8Å; Y219-L291 PolarHBondContact O-N 2.79Å; S220-L291 CarbonylContact C-O 3.58Å; S220-L291 VanDerWaalsContact CA-O 3.31Å; S220-L291 WeakPolarHBondContact CA-O 3.35Å; V221-L291 PolarHBondContact N-O 3.06Å; L291-F293 HydrophobicContact CB-CD2 4.3Å; L291-F293 HydrophobicContact CB-CE2 3.57Å; L291-F293 HydrophobicContact CB-CZ 4.21Å; L291-F293 HydrophobicContact CD1-CE2 3.93Å; L291-F293 HydrophobicContact CD1-CZ 3.94Å; L291-F293 HydrophobicContact CD2-CZ 4.48Å; L291-F293 HydrophobicContact CG-CE2 4.28Å; L291-F293 HydrophobicContact CG-CZ 4.48Å; L291-T344 WeakPolarHBondContact CA-O 3.49Å; L291-T344 HydrophobicContact CD2-CG2 4.4Å
292	L	95.2	Very high	91.8	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	111.8	172.5	177.3	62.4	0	0	0	110.2	V221 L276 A279 I294 I335 I343 T344 S345 V346	V221-L292 HydrophobicContact CB-CD1 4.06Å; V221-L292 HydrophobicContact CG1-CD1 4.2Å; L276-L292 HydrophobicContact CB-CD2 4.28Å; L276-L292 HydrophobicContact CD1-CD2 3.7Å; A279-L292 HydrophobicContact CB-CB 4.43Å; A279-L292 HydrophobicContact CB-CD1 4.32Å; L292-I294 HydrophobicContact CD1-CG1 4.48Å; L292-I294 HydrophobicContact CD2-CD1 4.09Å; L292-I294 HydrophobicContact CD2-CG1 4.28Å; L292-I294 HydrophobicContact CG-CD1 4.35Å; L292-I294 HydrophobicContact CG-CG1 3.99Å; L292-I335 HydrophobicContact CD2-CD1 3.96Å; L292-I335 HydrophobicContact CD2-CG1 4.07Å; L292-I343 HydrophobicContact CB-CG2 3.64Å; L292-I343 HydrophobicContact CD2-CG2 4.2Å; L292-T344 PolarHBondContact N-O 3.04Å; L292-S345 CarbonylContact O-C 3.53Å; L292-S345 WeakPolarHBondContact O-CA 3.45Å; L292-V346 PolarHBondContact O-N 3Å
293	F	94.2	Very high	91.9	Very high	1 Å²	1	24 Å²	24	0%	0.004	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	126.8	172.7	-64.7	-87.9	0	0	0	109.4	I205 L208 I209 V221 F222 A223 L291 V346	I205-F293 HydrophobicContact CB-CD1 4.2Å; I205-F293 HydrophobicContact CB-CE1 4.25Å; I205-F293 HydrophobicContact CG1-CD1 4.01Å; I205-F293 HydrophobicContact CG1-CE1 4.24Å; I205-F293 HydrophobicContact CG2-CD1 3.47Å; I205-F293 VanDerWaalsContact CG2-CD1 3.47Å; I205-F293 HydrophobicContact CG2-CE1 3.76Å; I205-F293 HydrophobicContact CG2-CG 3.99Å; L208-F293 HydrophobicContact CB-CE1 4.24Å; L208-F293 HydrophobicContact CB-CZ 4.03Å; L208-F293 HydrophobicContact CD1-CE1 4.48Å; I209-F293 HydrophobicContact CB-CE2 4.48Å; I209-F293 HydrophobicContact CD1-CD2 4.01Å; I209-F293 HydrophobicContact CD1-CE2 3.88Å; I209-F293 HydrophobicContact CD1-CZ 4.32Å; I209-F293 HydrophobicContact CG1-CD2 3.84Å; I209-F293 HydrophobicContact CG1-CE1 4.4Å; I209-F293 HydrophobicContact CG1-CE2 3.19Å; I209-F293 HydrophobicContact CG1-CZ 3.52Å; V221-F293 PolarHBondContact O-N 3.16Å; F222-F293 HydrophobicContact CB-CB 4.43Å; F222-F293 HydrophobicContact CD2-CB 3.58Å; F222-F293 HydrophobicContact CD2-CG 4.32Å; F222-F293 HydrophobicContact CE2-CB 4.17Å; F222-F293 HydrophobicContact CG-CB 4.24Å; A223-F293 PolarHBondContact N-O 3.21Å; L291-F293 HydrophobicContact CB-CD2 4.3Å; L291-F293 HydrophobicContact CB-CE2 3.57Å; L291-F293 HydrophobicContact CB-CZ 4.21Å; L291-F293 HydrophobicContact CD1-CE2 3.93Å; L291-F293 HydrophobicContact CD1-CZ 3.94Å; L291-F293 HydrophobicContact CD2-CZ 4.48Å; L291-F293 HydrophobicContact CG-CE2 4.28Å; L291-F293 HydrophobicContact CG-CZ 4.48Å; F293-V346 WeakPolarHBondContact CA-O 3.44Å; F293-V346 HydrophobicContact CD1-CB 3.7Å; F293-V346 HydrophobicContact CD1-CG1 4.18Å; F293-V346 HydrophobicContact CD1-CG2 4.42Å; F293-V346 HydrophobicContact CE1-CB 3.66Å; F293-V346 HydrophobicContact CE1-CG1 4.1Å; F293-V346 HydrophobicContact CE1-CG2 3.91Å; F293-V346 HydrophobicContact CZ-CG2 4.47Å
294	I	93.8	Very high	91.9	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.01	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	106.8	174.8	-53.2	-177.7	0	0	0	107.7	V225 L292 I297 M331 I335 V346 Q347 A348	V225-I294 HydrophobicContact CG2-CG2 3.73Å; L292-I294 HydrophobicContact CD1-CG1 4.48Å; L292-I294 HydrophobicContact CD2-CD1 4.09Å; L292-I294 HydrophobicContact CD2-CG1 4.28Å; L292-I294 HydrophobicContact CG-CD1 4.35Å; L292-I294 HydrophobicContact CG-CG1 3.99Å; I294-I297 HydrophobicContact CG2-CB 4.24Å; I294-I297 HydrophobicContact CG2-CD1 4.3Å; I294-M331 HydrophobicContact CD1-CE 4.32Å; I294-M331 HydrophobicContact CD1-SD 4.12Å; I294-I335 HydrophobicContact CD1-CD1 3.99Å; I294-V346 PolarHBondContact N-O 2.9Å; I294-Q347 HydrophobicContact CB-CB 4.42Å; I294-Q347 HydrophobicContact CB-CG 4.22Å; I294-Q347 HydrophobicContact CD1-CG 4.23Å; I294-Q347 HydrophobicContact CG1-CG 4.37Å; I294-Q347 CarbonylContact O-C 3.45Å; I294-Q347 WeakPolarHBondContact O-CA 3.36Å; I294-A348 PolarHBondContact O-N 3.09Å
295	D	90.3	Very high	92	Very high	7 Å²	7	25.1 Å²	25.1	4%	0.037	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	109.8	174.5	-160.1	9.6	0	0	0	108.4	K201 F222 A223 G224 V225 E227 A348	K201-D295 WeakPolarHBondContact CE-OD2 3.28Å; K201-D295 IonicContact NZ-OD1 3.93Å; K201-D295 PolarHBondContact NZ-OD1 3.19Å; K201-D295 IonicContact NZ-OD2 3.7Å; K201-D295 PolarHBondContact NZ-OD2 3.39Å; F222-D295 HydrophobicContact CE1-CB 4.34Å; F222-D295 HydrophobicContact CE2-CB 4.32Å; F222-D295 HydrophobicContact CZ-CB 3.68Å; A223-D295 PolarHBondContact O-N 3.3Å; G224-D295 CarbonylContact C-O 3.56Å; G224-D295 VanDerWaalsContact CA-O 3.25Å; G224-D295 WeakPolarHBondContact CA-O 3.41Å; V225-D295 PolarHBondContact N-O 2.8Å; E227-D295 HydrophobicContact CG-CB 4.41Å; E227-D295 WeakPolarHBondContact CG-O 3.37Å; E227-D295 VanDerWaalsContact OE1-C 3.31Å; D295-A348 HydrophobicContact CB-CB 4.22Å; D295-A348 WeakPolarHBondContact OD1-CB 3.3Å
296	N	88.3	Confident	92.1	Very high	16 Å²	16	23.8 Å²	23.8	9%	0.086	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	cis	-118.7	133	0.5	-165.4	-70.4	0	0	0	111.1	V225 E227 F298 R299 A348 Y350	V225-N296 PolarHBondContact O-N 2.81Å; V225-N296 VanDerWaalsContact O-N 3.1Å; E227-N296 PolarHBondContact OE1-N 2.82Å; N296-F298 PolarHBondContact O-N 2.81Å; N296-F298 VanDerWaalsContact O-N 3.16Å; N296-F298 WeakPolarHBondContact OD1-CB 3.48Å; N296-F298 PolarHBondContact OD1-N 3.49Å; N296-R299 HydrophobicContact CB-CG 4.05Å; N296-R299 WeakPolarHBondContact O-CB 3.48Å; N296-R299 PolarHBondContact O-N 3Å; N296-A348 PolarHBondContact ND2-O 3.16Å; N296-A348 PolarHBondContact OD1-O 2.8Å; N296-A348 VanDerWaalsContact OD1-O 3.06Å; N296-Y350 PolarHBondContact ND2-N 3.32Å; N296-Y350 PolarHBondContact OD1-N 2.95Å; N296-Y350 VanDerWaalsContact OD1-N 3.09Å
297	I	90.7	Very high	92.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.4	-26	-177.9	-172.5	58	0	0	0	112.6	I294 R299 F300 T301 M328 M331 Q347 A348 I349 T364	I294-I297 HydrophobicContact CG2-CB 4.24Å; I294-I297 HydrophobicContact CG2-CD1 4.3Å; I297-R299 VanDerWaalsContact C-N 3.27Å; I297-R299 PolarHBondContact O-N 3.4Å; I297-F300 HydrophobicContact CD1-CB 4.11Å; I297-F300 HydrophobicContact CD1-CD1 4.17Å; I297-F300 HydrophobicContact CD1-CG 4.39Å; I297-F300 WeakPolarHBondContact O-CB 3.17Å; I297-F300 PolarHBondContact O-N 2.95Å; I297-T301 PolarHBondContact O-N 3.31Å; I297-M328 HydrophobicContact CD1-CE 4.13Å; I297-M328 HydrophobicContact CD1-SD 4.06Å; I297-M328 HydrophobicContact CG1-CE 3.97Å; I297-M328 HydrophobicContact CG1-SD 4.13Å; I297-M331 HydrophobicContact CD1-CE 3.31Å; I297-M331 HydrophobicContact CG1-CE 4.45Å; I297-Q347 HydrophobicContact CB-CB 4.48Å; I297-Q347 HydrophobicContact CG2-CB 4.31Å; I297-A348 PolarHBondContact N-O 2.92Å; I297-A348 VanDerWaalsContact N-O 3.09Å; I297-I349 HydrophobicContact CG2-CB 4.38Å; I297-I349 HydrophobicContact CG2-CG1 3.48Å; I297-I349 VanDerWaalsContact CG2-CG1 3.48Å; I297-T364 HydrophobicContact CG2-CG2 4.2Å
298	F	90.5	Very high	92.4	Very high	20 Å²	20	19.7 Å²	19.7	9%	0.088	10%	0.1	C	C	.	.	H	α-helix	trans	-62.1	-33.7	172.1	-179.8	-99.1	0	0	0	112.5	N296 F300 T301 Q302 Y320 Y350 P352 A360	N296-F298 PolarHBondContact O-N 2.81Å; N296-F298 VanDerWaalsContact O-N 3.16Å; N296-F298 WeakPolarHBondContact OD1-CB 3.48Å; N296-F298 PolarHBondContact OD1-N 3.49Å; F298-F300 VanDerWaalsContact C-N 3.34Å; F298-F300 PolarHBondContact O-N 3.42Å; F298-T301 WeakPolarHBondContact O-CB 3.25Å; F298-T301 PolarHBondContact O-N 2.78Å; F298-Q302 HydrophobicContact CE1-CB 4.23Å; F298-Q302 WeakPolarHBondContact O-CB 3.42Å; F298-Q302 PolarHBondContact O-N 2.68Å; F298-Y320 HydrophobicContact CE2-CE1 4.47Å; F298-Y320 WeakPolarHBondContact CE2-OH 3.43Å; F298-Y350 AromaticContact CD1-CD1 3.69Å; F298-Y350 HydrophobicContact CD1-CD1 3.69Å; F298-Y350 HydrophobicContact CD1-CG 4.48Å; F298-Y350 AromaticContact CE1-CD1 3.97Å; F298-Y350 HydrophobicContact CE1-CD1 3.97Å; F298-Y350 HydrophobicContact CE1-CE1 4.42Å; F298-Y350 HydrophobicContact CG-CD1 4.11Å; F298-P352 HydrophobicContact CD2-CG 4.02Å; F298-P352 HydrophobicContact CE1-CG 4.35Å; F298-P352 HydrophobicContact CE2-CG 3.28Å; F298-P352 HydrophobicContact CZ-CG 3.49Å; F298-P352 VanDerWaalsContact CZ-CG 3.49Å; F298-A360 HydrophobicContact CD2-CB 3.87Å; F298-A360 HydrophobicContact CE2-CB 3.77Å
299	R	92.1	Very high	92.7	Very high	51 Å²	51	20.3 Å²	20.3	19%	0.192	11%	0.113	C	C	.	.	H	α-helix	trans	-70.2	-29.9	179.8	-66.1	-67	-165.7	-150.4	-6	112.7	V225 N296 I297 Q302 A303	V225-R299 HydrophobicContact CG1-CB 4.09Å; V225-R299 WeakPolarHBondContact O-CB 3.48Å; V225-R299 WeakPolarHBondContact O-CG 3.44Å; N296-R299 HydrophobicContact CB-CG 4.05Å; N296-R299 WeakPolarHBondContact O-CB 3.48Å; N296-R299 PolarHBondContact O-N 3Å; I297-R299 VanDerWaalsContact C-N 3.27Å; I297-R299 PolarHBondContact O-N 3.4Å; R299-Q302 VanDerWaalsContact CD-OE1 3.31Å; R299-A303 VanDerWaalsContact O-CB 3.23Å; R299-A303 WeakPolarHBondContact O-CB 3.24Å; R299-A303 PolarHBondContact O-N 2.91Å
300	F	93.8	Very high	92.8	Very high	13 Å²	13	20.5 Å²	20.5	6%	0.057	11%	0.114	C	C	.	.	H	α-helix	trans	-60.1	-50.4	169.5	171.9	-102.3	0	0	0	110.3	V225 A269 A272 I297 F298 A303 G304 M328 M331	V225-F300 HydrophobicContact CG1-CB 4Å; A269-F300 WeakPolarHBondContact O-CE2 3.27Å; A272-F300 HydrophobicContact CB-CD2 3.88Å; A272-F300 HydrophobicContact CB-CE2 4.39Å; A272-F300 HydrophobicContact CB-CG 4.48Å; I297-F300 HydrophobicContact CD1-CB 4.11Å; I297-F300 HydrophobicContact CD1-CD1 4.17Å; I297-F300 HydrophobicContact CD1-CG 4.39Å; I297-F300 WeakPolarHBondContact O-CB 3.17Å; I297-F300 PolarHBondContact O-N 2.95Å; F298-F300 VanDerWaalsContact C-N 3.34Å; F298-F300 PolarHBondContact O-N 3.42Å; F300-A303 PolarHBondContact O-N 3.34Å; F300-G304 PolarHBondContact O-N 2.77Å; F300-M328 HydrophobicContact CD1-CE 4.21Å; F300-M331 HydrophobicContact CZ-CB 4.33Å
301	T	93.3	Very high	92.8	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-60.3	-46.7	175.9	-68.2	0	0	0	0	112.3	I297 F298 A303 G304 S305 Y320 L324 M328 A360	I297-T301 PolarHBondContact O-N 3.31Å; F298-T301 WeakPolarHBondContact O-CB 3.25Å; F298-T301 PolarHBondContact O-N 2.78Å; T301-A303 PolarHBondContact O-N 3.04Å; T301-G304 PolarHBondContact O-N 3.21Å; T301-S305 PolarHBondContact O-N 2.86Å; T301-Y320 HydrophobicContact CG2-CD1 3.76Å; T301-Y320 HydrophobicContact CG2-CE1 3.73Å; T301-L324 HydrophobicContact CG2-CD1 3.44Å; T301-L324 VanDerWaalsContact CG2-CD1 3.44Å; T301-M328 WeakPolarHBondContact OG1-CE 3.31Å; T301-A360 HydrophobicContact CG2-CB 3.62Å
302	Q	93.1	Very high	92.7	Very high	65 Å²	65	23.4 Å²	23.4	30%	0.304	14%	0.144	S	C	.	.	H	α-helix	trans	-59.1	-48.2	178.9	-171.6	-175.5	14.7	0	0	111.5	F298 R299 G304 S305 E306	F298-Q302 HydrophobicContact CE1-CB 4.23Å; F298-Q302 WeakPolarHBondContact O-CB 3.42Å; F298-Q302 PolarHBondContact O-N 2.68Å; R299-Q302 VanDerWaalsContact CD-OE1 3.31Å; Q302-G304 VanDerWaalsContact C-N 3.31Å; Q302-G304 PolarHBondContact O-N 3.33Å; Q302-S305 WeakPolarHBondContact O-CB 3.37Å; Q302-S305 PolarHBondContact O-N 3.02Å; Q302-S305 VanDerWaalsContact O-N 3.13Å; Q302-E306 WeakPolarHBondContact O-CG 3.46Å; Q302-E306 PolarHBondContact O-N 3.21Å
303	A	94.1	Very high	92.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.3	-37.9	176.6	0	0	0	0	0	112	P265 R268 A269 R299 F300 T301 S305 E306 V307	P265-A303 HydrophobicContact CB-CB 4.42Å; R268-A303 HydrophobicContact CB-CB 3.58Å; A269-A303 HydrophobicContact CB-CB 3.96Å; R299-A303 VanDerWaalsContact O-CB 3.23Å; R299-A303 WeakPolarHBondContact O-CB 3.24Å; R299-A303 PolarHBondContact O-N 2.91Å; F300-A303 PolarHBondContact O-N 3.34Å; T301-A303 PolarHBondContact O-N 3.04Å; A303-S305 VanDerWaalsContact C-N 3.34Å; A303-S305 PolarHBondContact O-N 2.86Å; A303-E306 PolarHBondContact O-N 3.06Å; A303-V307 WeakPolarHBondContact O-CB 3.45Å; A303-V307 WeakPolarHBondContact O-CG2 3.39Å; A303-V307 PolarHBondContact O-N 2.91Å
304	G	93.6	Very high	92.6	Very high	13 Å²	13	34.2 Å²	34.2	13%	0.134	20%	0.195	C	C	.	.	H	α-helix	trans	-60.6	-38.9	172.1	0	0	0	0	0	113.3	F300 T301 Q302 S308	F300-G304 PolarHBondContact O-N 2.77Å; T301-G304 PolarHBondContact O-N 3.21Å; Q302-G304 VanDerWaalsContact C-N 3.31Å; Q302-G304 PolarHBondContact O-N 3.33Å; G304-S308 WeakPolarHBondContact O-CB 3.3Å; G304-S308 PolarHBondContact O-N 2.86Å
305	S	94.4	Very high	92.6	Very high	24 Å²	24	37.9 Å²	37.9	17%	0.168	22%	0.219	C	C	.	.	H	α-helix	trans	-66.6	-46.5	173.9	-173.3	0	0	0	0	112.1	T301 Q302 A303 V307 S308 A309 G319	T301-S305 PolarHBondContact O-N 2.86Å; Q302-S305 WeakPolarHBondContact O-CB 3.37Å; Q302-S305 PolarHBondContact O-N 3.02Å; Q302-S305 VanDerWaalsContact O-N 3.13Å; A303-S305 VanDerWaalsContact C-N 3.34Å; A303-S305 PolarHBondContact O-N 2.86Å; S305-V307 PolarHBondContact O-N 3.32Å; S305-S308 WeakPolarHBondContact O-CB 3.42Å; S305-S308 PolarHBondContact O-N 2.9Å; S305-S308 VanDerWaalsContact O-N 3.16Å; S305-A309 PolarHBondContact O-N 2.81Å; S305-G319 PolarHBondContact OG-O 3.31Å
306	E	93.9	Very high	92.7	Very high	65 Å²	65	40.8 Å²	40.8	30%	0.304	24%	0.24	S	C	.	.	H	α-helix	trans	-56.6	-47.6	174.9	-68.3	171.7	-116.8	0	0	111.8	P265 R268 Q302 A303 A309 L310	P265-E306 HydrophobicContact CB-CB 3.71Å; P265-E306 HydrophobicContact CG-CB 4.16Å; R268-E306 IonicContact CZ-OE1 2.68Å; R268-E306 IonicContact CZ-OE2 2.92Å; R268-E306 IonicContact NH1-OE1 3.34Å; R268-E306 PolarHBondContact NH1-OE1 2.88Å; R268-E306 IonicContact NH1-OE2 3.92Å; R268-E306 IonicContact NH2-OE1 2.91Å; R268-E306 PolarHBondContact NH2-OE1 2.8Å; R268-E306 IonicContact NH2-OE2 3.21Å; R268-E306 PolarHBondContact NH2-OE2 2.96Å; Q302-E306 WeakPolarHBondContact O-CG 3.46Å; Q302-E306 PolarHBondContact O-N 3.21Å; A303-E306 PolarHBondContact O-N 3.06Å; E306-A309 PolarHBondContact O-N 3.05Å; E306-L310 WeakPolarHBondContact O-CG 3.41Å; E306-L310 PolarHBondContact O-N 3.35Å
307	V	93.2	Very high	92.7	Very high	12 Å²	12	43 Å²	43	7%	0.073	26%	0.26	C	S	.	.	H	α-helix	trans	-60.4	-46.6	174.3	166.8	0	0	0	0	111.3	I100 P265 A269 A303 S305 A309 L310 L311	I100-V307 HydrophobicContact CD1-CG1 3.43Å; I100-V307 VanDerWaalsContact CD1-CG1 3.43Å; I100-V307 HydrophobicContact CG1-CG1 4.05Å; I100-V307 HydrophobicContact CG2-CG2 4.23Å; P265-V307 HydrophobicContact CB-CG2 4.08Å; P265-V307 HydrophobicContact CG-CG2 4.5Å; A269-V307 HydrophobicContact CB-CG2 4.4Å; A303-V307 WeakPolarHBondContact O-CB 3.45Å; A303-V307 WeakPolarHBondContact O-CG2 3.39Å; A303-V307 PolarHBondContact O-N 2.91Å; S305-V307 PolarHBondContact O-N 3.32Å; V307-A309 VanDerWaalsContact C-N 3.32Å; V307-A309 PolarHBondContact O-N 3.43Å; V307-L310 PolarHBondContact O-N 2.86Å; V307-L310 VanDerWaalsContact O-N 3.17Å; V307-L311 HydrophobicContact CG1-CD1 3.92Å; V307-L311 HydrophobicContact CG1-CG 4.21Å; V307-L311 WeakPolarHBondContact O-CG 3.25Å; V307-L311 PolarHBondContact O-N 2.88Å
308	S	94.3	Very high	92.7	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-40.9	-178.4	178.4	0	0	0	0	112.6	G304 S305 L311 G312 R313 Q321	G304-S308 WeakPolarHBondContact O-CB 3.3Å; G304-S308 PolarHBondContact O-N 2.86Å; S305-S308 WeakPolarHBondContact O-CB 3.42Å; S305-S308 PolarHBondContact O-N 2.9Å; S305-S308 VanDerWaalsContact O-N 3.16Å; S308-L311 PolarHBondContact O-N 3.3Å; S308-G312 PolarHBondContact O-N 2.84Å; S308-R313 WeakPolarHBondContact O-CB 3.41Å; S308-R313 PolarHBondContact O-N 2.81Å; S308-R313 VanDerWaalsContact O-N 3.13Å; S308-R313 WeakPolarHBondContact OG-CB 3.21Å; S308-R313 WeakPolarHBondContact OG-CD 3.12Å; S308-Q321 VanDerWaalsContact OG-CB 3.27Å; S308-Q321 WeakPolarHBondContact OG-CB 3.42Å
309	A	93.3	Very high	92.7	Very high	64 Å²	64	49.1 Å²	49.1	53%	0.529	31%	0.306	S	S	.	.	H	α-helix	trans	-63.1	-45.4	174.5	0	0	0	0	0	111.6	S305 E306 V307 L311 G312	S305-A309 PolarHBondContact O-N 2.81Å; E306-A309 PolarHBondContact O-N 3.05Å; V307-A309 VanDerWaalsContact C-N 3.32Å; V307-A309 PolarHBondContact O-N 3.43Å; A309-L311 VanDerWaalsContact C-N 3.32Å; A309-L311 PolarHBondContact O-N 2.86Å; A309-G312 PolarHBondContact O-N 2.96Å
310	L	91.7	Very high	92.9	Very high	64 Å²	64	47.7 Å²	47.7	34%	0.335	30%	0.301	S	S	.	.	H	α-helix	trans	-65.8	-30.6	177.3	-67.2	173	0	0	0	113.4	A58 V59 P265 E306 V307 G312	A58-L310 HydrophobicContact CB-CD1 4.09Å; V59-L310 HydrophobicContact CG2-CB 3.6Å; P265-L310 HydrophobicContact CG-CD1 4.4Å; E306-L310 WeakPolarHBondContact O-CG 3.41Å; E306-L310 PolarHBondContact O-N 3.35Å; V307-L310 PolarHBondContact O-N 2.86Å; V307-L310 VanDerWaalsContact O-N 3.17Å; L310-G312 PolarHBondContact O-N 2.87Å
311	L	92.3	Very high	92.9	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.037	30%	0.299	C	S	.	.	H	α-helix	trans	-70.1	-15.2	173.4	-69.9	177.3	0	0	0	113.1	V59 A89 R98 I100 V307 S308 A309 R313	V59-L311 HydrophobicContact CG2-CD2 4.31Å; A89-L311 HydrophobicContact CB-CD1 4.26Å; A89-L311 HydrophobicContact CB-CD2 3.92Å; R98-L311 HydrophobicContact CG-CD2 3.75Å; R98-L311 PolarHBondContact NH1-O 3.25Å; I100-L311 HydrophobicContact CG1-CD2 4.39Å; V307-L311 HydrophobicContact CG1-CD1 3.92Å; V307-L311 HydrophobicContact CG1-CG 4.21Å; V307-L311 WeakPolarHBondContact O-CG 3.25Å; V307-L311 PolarHBondContact O-N 2.88Å; S308-L311 PolarHBondContact O-N 3.3Å; A309-L311 VanDerWaalsContact C-N 3.32Å; A309-L311 PolarHBondContact O-N 2.86Å; L311-R313 HydrophobicContact CB-CG 4.36Å
312	G	90.4	Very high	92.9	Very high	63 Å²	63	50.8 Å²	50.8	65%	0.649	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.7	20.4	-177.8	0	0	0	0	0	114.3	S308 A309 L310	S308-G312 PolarHBondContact O-N 2.84Å; A309-G312 PolarHBondContact O-N 2.96Å; L310-G312 PolarHBondContact O-N 2.87Å
313	R	92.7	Very high	93	Very high	81 Å²	81	49.4 Å²	49.4	31%	0.306	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-76	142	175.3	-61.4	176.1	178.1	178.6	0.6	109.8	S308 L311 P315 P322 T323	S308-R313 WeakPolarHBondContact O-CB 3.41Å; S308-R313 PolarHBondContact O-N 2.81Å; S308-R313 VanDerWaalsContact O-N 3.13Å; S308-R313 WeakPolarHBondContact OG-CB 3.21Å; S308-R313 WeakPolarHBondContact OG-CD 3.12Å; L311-R313 HydrophobicContact CB-CG 4.36Å; R313-P315 WeakPolarHBondContact O-CD 3.34Å; R313-P322 HydrophobicContact CB-CG 4.34Å; R313-T323 PolarHBondContact NH1-OG1 3.5Å; R313-T323 VanDerWaalsContact NH1-OG1 3.11Å
314	I	94.5	Very high	92.9	Very high	147 Å²	147	50 Å²	50	75%	0.754	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-66.6	126.2	174.4	-60.5	175.6	0	0	0	108.6	P322	I314-P322 WeakPolarHBondContact O-CD 3.48Å
315	P	93.8	Very high	93	Very high	79 Å²	79	52.3 Å²	52.3	51%	0.513	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-63.9	150.5	176.2	-22.1	33.7	0	0	0	113	R313	R313-P315 WeakPolarHBondContact O-CD 3.34Å
316	S	93.6	Very high	92.9	Very high	69 Å²	69	55.6 Å²	55.6	48%	0.483	36%	0.358	S	S	.	.			trans	-94.6	-163.2	175.2	-164.8	0	0	0	0	111.1	V318 G319 Y320	S316-V318 PolarHBondContact O-N 2.77Å; S316-G319 PolarHBondContact O-N 3.06Å; S316-Y320 WeakPolarHBondContact CB-O 3.46Å; S316-Y320 PolarHBondContact N-O 3.19Å
317	A	88.4	Confident	92.9	Very high	61 Å²	61	55 Å²	55	50%	0.504	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-48.4	137.3	174.5	0	0	0	0	0	112	G319 Y320 P359	A317-G319 PolarHBondContact O-N 3.02Å; A317-Y320 WeakPolarHBondContact O-CD2 3.33Å; A317-Y320 PolarHBondContact O-N 3.4Å; A317-P359 HydrophobicContact CB-CG 4.26Å
318	V	89.8	Confident	92.9	Very high	112 Å²	112	54.4 Å²	54.4	68%	0.679	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	57.6	9.8	-179.1	-159.5	0	0	0	0	113.9	S316 Y320 P359	S316-V318 PolarHBondContact O-N 2.77Å; V318-Y320 HydrophobicContact CB-CD2 4.06Å; V318-Y320 HydrophobicContact CB-CE2 3.99Å; V318-Y320 HydrophobicContact CG1-CE2 4.26Å; V318-P359 HydrophobicContact CG2-CG 4.04Å
319	G	91.2	Very high	92.9	Very high	37 Å²	37	55 Å²	55	38%	0.381	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	87.1	10.2	180	0	0	0	0	0	115.1	S305 S316 A317	S305-G319 PolarHBondContact OG-O 3.31Å; S316-G319 PolarHBondContact O-N 3.06Å; A317-G319 PolarHBondContact O-N 3.02Å
320	Y	94.6	Very high	92.9	Very high	22 Å²	22	55.7 Å²	55.7	9%	0.086	36%	0.358	C	S	.	.			trans	-72	164.8	173.6	-69	-71.9	0	0	0	113.1	F298 T301 S316 A317 V318 L324 D358 P359 A360	F298-Y320 HydrophobicContact CE2-CE1 4.47Å; F298-Y320 WeakPolarHBondContact CE2-OH 3.43Å; T301-Y320 HydrophobicContact CG2-CD1 3.76Å; T301-Y320 HydrophobicContact CG2-CE1 3.73Å; S316-Y320 WeakPolarHBondContact CB-O 3.46Å; S316-Y320 PolarHBondContact N-O 3.19Å; A317-Y320 WeakPolarHBondContact O-CD2 3.33Å; A317-Y320 PolarHBondContact O-N 3.4Å; V318-Y320 HydrophobicContact CB-CD2 4.06Å; V318-Y320 HydrophobicContact CB-CE2 3.99Å; V318-Y320 HydrophobicContact CG1-CE2 4.26Å; Y320-L324 HydrophobicContact CG-CD2 4.19Å; Y320-D358 WeakPolarHBondContact CE2-OD1 3.4Å; Y320-D358 WeakPolarHBondContact CE2-OD2 3.29Å; Y320-D358 VanDerWaalsContact CZ-OD1 3.26Å; Y320-D358 VanDerWaalsContact OH-CG 3.29Å; Y320-D358 PolarHBondContact OH-OD1 3.06Å; Y320-D358 PolarHBondContact OH-OD2 3.12Å; Y320-D358 VanDerWaalsContact OH-OD2 3.05Å; Y320-P359 HydrophobicContact CD2-CB 3.88Å; Y320-P359 HydrophobicContact CD2-CG 4Å; Y320-P359 HydrophobicContact CE2-CB 4.2Å; Y320-P359 HydrophobicContact CE2-CG 4.25Å; Y320-A360 HydrophobicContact CE1-CB 3.92Å; Y320-A360 HydrophobicContact CE2-CB 4.4Å
321	Q	94.3	Very high	93	Very high	3 Å²	3	52.7 Å²	52.7	1%	0.014	34%	0.342	C	S	.	.			trans	-64.1	143.2	173.9	69.6	-83	30	0	0	112	S308 T323 L324	S308-Q321 VanDerWaalsContact OG-CB 3.27Å; S308-Q321 WeakPolarHBondContact OG-CB 3.42Å; Q321-T323 PolarHBondContact O-N 3.26Å; Q321-T323 VanDerWaalsContact O-N 3.14Å; Q321-L324 HydrophobicContact CG-CB 4.24Å; Q321-L324 WeakPolarHBondContact O-CB 3.47Å; Q321-L324 PolarHBondContact O-N 3.44Å
322	P	94.6	Very high	93.1	Very high	75 Å²	75	52.4 Å²	52.4	49%	0.487	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-13.1	176.5	28.6	-35.5	0	0	0	113.2	R313 I314	R313-P322 HydrophobicContact CB-CG 4.34Å; I314-P322 WeakPolarHBondContact O-CD 3.48Å
323	T	94	Very high	93.3	Very high	37 Å²	37	52.9 Å²	52.9	23%	0.227	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	6.5	177.9	47.7	0	0	0	0	114.1	R313 Q321 A325 T326 D327	R313-T323 PolarHBondContact NH1-OG1 3.5Å; R313-T323 VanDerWaalsContact NH1-OG1 3.11Å; Q321-T323 PolarHBondContact O-N 3.26Å; Q321-T323 VanDerWaalsContact O-N 3.14Å; T323-A325 PolarHBondContact O-N 2.88Å; T323-T326 WeakPolarHBondContact O-CA 3.43Å; T323-T326 WeakPolarHBondContact O-CB 3.36Å; T323-T326 PolarHBondContact O-N 3.03Å; T323-D327 WeakPolarHBondContact CB-OD2 3.34Å; T323-D327 PolarHBondContact O-N 3.32Å; T323-D327 PolarHBondContact OG1-OD2 3.48Å
324	L	93.4	Very high	93.4	Very high	12 Å²	12	49.1 Å²	49.1	6%	0.063	31%	0.312	C	S	.	.	H	α-helix	trans	-48.8	-50.6	-169.9	173.3	58.5	0	0	0	113.8	T301 Y320 Q321 T326 D327 M328 P359	T301-L324 HydrophobicContact CG2-CD1 3.44Å; T301-L324 VanDerWaalsContact CG2-CD1 3.44Å; Y320-L324 HydrophobicContact CG-CD2 4.19Å; Q321-L324 HydrophobicContact CG-CB 4.24Å; Q321-L324 WeakPolarHBondContact O-CB 3.47Å; Q321-L324 PolarHBondContact O-N 3.44Å; L324-T326 VanDerWaalsContact C-N 3.33Å; L324-T326 PolarHBondContact O-N 3.39Å; L324-D327 PolarHBondContact O-N 3.44Å; L324-M328 VanDerWaalsContact O-CB 3.27Å; L324-M328 WeakPolarHBondContact O-CB 3.37Å; L324-M328 PolarHBondContact O-N 2.95Å; L324-P359 HydrophobicContact CD2-CB 3.9Å
325	A	93.9	Very high	93.4	Very high	62 Å²	62	42.1 Å²	42.1	51%	0.512	28%	0.276	S	S	.	.	H	α-helix	trans	-65.1	-34.9	179.9	0	0	0	0	0	113	T323 G329 T363	T323-A325 PolarHBondContact O-N 2.88Å; A325-G329 PolarHBondContact O-N 3.19Å; A325-T363 HydrophobicContact CB-CG2 4.25Å
326	T	93.8	Very high	93.3	Very high	92 Å²	92	39.8 Å²	39.8	56%	0.564	26%	0.26	S	S	*	.	H	α-helix	trans	-75	-44.1	178.4	-46.9	0	0	0	0	111.5	T323 L324 G329 T330	T323-T326 WeakPolarHBondContact O-CA 3.43Å; T323-T326 WeakPolarHBondContact O-CB 3.36Å; T323-T326 PolarHBondContact O-N 3.03Å; L324-T326 VanDerWaalsContact C-N 3.33Å; L324-T326 PolarHBondContact O-N 3.39Å; T326-G329 PolarHBondContact O-N 2.94Å; T326-T330 WeakPolarHBondContact O-CB 3.26Å; T326-T330 PolarHBondContact O-N 3.43Å; T326-T330 PolarHBondContact O-OG1 2.86Å
327	D	92.6	Very high	93.3	Very high	52 Å²	52	37.6 Å²	37.6	28%	0.278	24%	0.243	S	C	.	.	H	α-helix	trans	-63.2	-43.1	178	-62	-29.9	0	0	0	110.5	T323 L324	T323-D327 WeakPolarHBondContact CB-OD2 3.34Å; T323-D327 PolarHBondContact O-N 3.32Å; T323-D327 PolarHBondContact OG1-OD2 3.48Å; L324-D327 PolarHBondContact O-N 3.44Å
328	M	93.4	Very high	93.4	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-65.4	-52.6	174.3	-173.3	59.6	68.2	0	0	111.3	I297 F300 T301 L324 T330 M331 Q332 T363	I297-M328 HydrophobicContact CD1-CE 4.13Å; I297-M328 HydrophobicContact CD1-SD 4.06Å; I297-M328 HydrophobicContact CG1-CE 3.97Å; I297-M328 HydrophobicContact CG1-SD 4.13Å; F300-M328 HydrophobicContact CD1-CE 4.21Å; T301-M328 WeakPolarHBondContact OG1-CE 3.31Å; L324-M328 VanDerWaalsContact O-CB 3.27Å; L324-M328 WeakPolarHBondContact O-CB 3.37Å; L324-M328 PolarHBondContact O-N 2.95Å; M328-T330 PolarHBondContact O-N 3.19Å; M328-M331 PolarHBondContact O-N 3.29Å; M328-M331 VanDerWaalsContact O-N 3.15Å; M328-M331 HydrophobicContact SD-CE 4.17Å; M328-Q332 HydrophobicContact CG-CG 3.87Å; M328-Q332 WeakPolarHBondContact O-CB 3.43Å; M328-Q332 VanDerWaalsContact O-CG 3.28Å; M328-Q332 WeakPolarHBondContact O-CG 3.45Å; M328-Q332 PolarHBondContact O-N 3.08Å; M328-Q332 HydrophobicContact SD-CG 3.68Å; M328-Q332 PolarHBondContact SD-NE2 3.13Å; M328-Q332 VanDerWaalsContact SD-NE2 3.36Å; M328-T363 HydrophobicContact CB-CG2 4.09Å; M328-T363 HydrophobicContact CG-CG2 4.17Å
329	G	94.4	Very high	93.4	Very high	14 Å²	14	36.6 Å²	36.6	14%	0.144	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-41.4	-178	0	0	0	0	0	113.5	A325 T326 M331 Q332 E333	A325-G329 PolarHBondContact O-N 3.19Å; T326-G329 PolarHBondContact O-N 2.94Å; G329-M331 PolarHBondContact O-N 3.35Å; G329-Q332 PolarHBondContact O-N 2.88Å; G329-E333 WeakPolarHBondContact O-CB 3.41Å; G329-E333 WeakPolarHBondContact O-CG 3.41Å; G329-E333 PolarHBondContact O-N 3.37Å
330	T	93.3	Very high	93.4	Very high	80 Å²	80	40.7 Å²	40.7	49%	0.491	23%	0.227	S	C	.	.	H	α-helix	trans	-60	-34.2	178.5	-54.3	0	0	0	0	112.1	T326 M328 R334	T326-T330 WeakPolarHBondContact O-CB 3.26Å; T326-T330 PolarHBondContact O-N 3.43Å; T326-T330 PolarHBondContact O-OG1 2.86Å; M328-T330 PolarHBondContact O-N 3.19Å; T330-R334 WeakPolarHBondContact O-CD 3.47Å
331	M	94.4	Very high	93.2	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-81	-48.2	175.3	-171.8	-76.8	-64.9	0	0	111.5	L273 L276 I294 I297 F300 M328 G329 E333 R334 I335	L273-M331 HydrophobicContact CD2-CB 3.95Å; L273-M331 HydrophobicContact CD2-CG 3.62Å; L276-M331 HydrophobicContact CD2-CG 3.97Å; L276-M331 HydrophobicContact CD2-SD 4.09Å; I294-M331 HydrophobicContact CD1-CE 4.32Å; I294-M331 HydrophobicContact CD1-SD 4.12Å; I297-M331 HydrophobicContact CD1-CE 3.31Å; I297-M331 HydrophobicContact CG1-CE 4.45Å; F300-M331 HydrophobicContact CZ-CB 4.33Å; M328-M331 PolarHBondContact O-N 3.29Å; M328-M331 VanDerWaalsContact O-N 3.15Å; M328-M331 HydrophobicContact SD-CE 4.17Å; G329-M331 PolarHBondContact O-N 3.35Å; M331-E333 PolarHBondContact O-N 3.34Å; M331-R334 PolarHBondContact O-N 3.35Å; M331-I335 HydrophobicContact SD-CD1 3.73Å
332	Q	95.1	Very high	93.1	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.8	-37.8	-176.3	-66.2	-69.1	-3	0	0	112.7	K190 M328 G329 R334 I335 H367	K190-Q332 WeakPolarHBondContact CE-O 3.41Å; K190-Q332 PolarHBondContact NZ-O 3.22Å; M328-Q332 HydrophobicContact CG-CG 3.87Å; M328-Q332 WeakPolarHBondContact O-CB 3.43Å; M328-Q332 VanDerWaalsContact O-CG 3.28Å; M328-Q332 WeakPolarHBondContact O-CG 3.45Å; M328-Q332 PolarHBondContact O-N 3.08Å; M328-Q332 HydrophobicContact SD-CG 3.68Å; M328-Q332 PolarHBondContact SD-NE2 3.13Å; M328-Q332 VanDerWaalsContact SD-NE2 3.36Å; G329-Q332 PolarHBondContact O-N 2.88Å; Q332-R334 VanDerWaalsContact C-N 3.26Å; Q332-R334 PolarHBondContact O-N 3.26Å; Q332-I335 WeakPolarHBondContact O-CB 3.28Å; Q332-I335 PolarHBondContact O-N 2.9Å; Q332-H367 HydrophobicContact CB-CB 4.06Å; Q332-H367 HydrophobicContact CG-CB 4.06Å
333	E	93.7	Very high	93.1	Very high	73 Å²	73	36.4 Å²	36.4	34%	0.341	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-12.8	-177.4	-62.3	-46.5	114.3	0	0	114.1	A159 K190 G329 M331 I335 H367	A159-E333 HydrophobicContact CB-CB 4Å; K190-E333 IonicContact NZ-OE1 2.83Å; K190-E333 PolarHBondContact NZ-OE1 2.6Å; K190-E333 IonicContact NZ-OE2 3.62Å; G329-E333 WeakPolarHBondContact O-CB 3.41Å; G329-E333 WeakPolarHBondContact O-CG 3.41Å; G329-E333 PolarHBondContact O-N 3.37Å; M331-E333 PolarHBondContact O-N 3.34Å; E333-I335 VanDerWaalsContact C-N 3.34Å; E333-H367 IonicContact OE1-CE1 2.71Å; E333-H367 PolarHBondContact OE1-CE1 3.03Å; E333-H367 IonicContact OE1-ND1 2.75Å; E333-H367 PolarHBondContact OE1-ND1 3.16Å
334	R	95	Very high	93.1	Very high	3 Å²	3	34.8 Å²	34.8	1%	0.011	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-24.5	166.2	-74.7	166	68.7	175.5	-0.6	112.6	I155 A157 A159 L276 T277 E280 R283 T330 M331 Q332 T336	I155-R334 PolarHBondContact O-NH1 3.18Å; I155-R334 PolarHBondContact O-NH2 2.74Å; A157-R334 WeakPolarHBondContact O-CD 3.38Å; A159-R334 HydrophobicContact CB-CG 4.35Å; L276-R334 HydrophobicContact CD1-CB 4.44Å; L276-R334 HydrophobicContact CD2-CB 3.76Å; L276-R334 HydrophobicContact CG-CB 4.35Å; T277-R334 PolarHBondContact OG1-NH2 2.89Å; E280-R334 IonicContact OE1-NE 2.65Å; E280-R334 IonicContact OE2-CZ 3.71Å; E280-R334 IonicContact OE2-NE 3.71Å; E280-R334 PolarHBondContact OE2-NE 3.12Å; E280-R334 IonicContact OE2-NH2 3.53Å; E280-R334 PolarHBondContact OE2-NH2 3.47Å; R283-R334 PolarHBondContact NH1-O 2.91Å; T330-R334 WeakPolarHBondContact O-CD 3.47Å; M331-R334 PolarHBondContact O-N 3.35Å; Q332-R334 VanDerWaalsContact C-N 3.26Å; Q332-R334 PolarHBondContact O-N 3.26Å; R334-T336 PolarHBondContact O-N 3.46Å
335	I	94.4	Very high	93.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	-83	99.9	174.1	-59.3	170.7	0	0	0	107.8	K190 L276 L292 I294 M331 Q332 E333 I343	K190-I335 WeakPolarHBondContact CE-O 3.28Å; K190-I335 HydrophobicContact CG-CG2 3.98Å; L276-I335 HydrophobicContact CD1-CG1 3.61Å; L276-I335 HydrophobicContact CD2-CG1 4.35Å; L292-I335 HydrophobicContact CD2-CD1 3.96Å; L292-I335 HydrophobicContact CD2-CG1 4.07Å; I294-I335 HydrophobicContact CD1-CD1 3.99Å; M331-I335 HydrophobicContact SD-CD1 3.73Å; Q332-I335 WeakPolarHBondContact O-CB 3.28Å; Q332-I335 PolarHBondContact O-N 2.9Å; E333-I335 VanDerWaalsContact C-N 3.34Å; I335-I343 HydrophobicContact CG2-CG2 4.15Å
336	T	92.3	Very high	93.1	Very high	29 Å²	29	31.3 Å²	31.3	18%	0.178	17%	0.167	C	C	.	.	S	Bend	trans	-165.3	165.1	179.4	-172.5	0	0	0	0	111.6	P160 R334	P160-T336 HydrophobicContact CB-CG2 4.37Å; P160-T336 HydrophobicContact CG-CG2 3.68Å; R334-T336 PolarHBondContact O-N 3.46Å
337	T	91.9	Very high	93.1	Very high	23 Å²	23	27 Å²	27	14%	0.141	14%	0.14	C	C	.	.			trans	-78.6	126	169	-60.7	0	0	0	0	111.1	S166 K187 G188 S342	S166-T337 PolarHBondContact N-O 2.82Å; K187-T337 PolarHBondContact O-OG1 3.03Å; K187-T337 VanDerWaalsContact O-OG1 3.06Å; G188-T337 VanDerWaalsContact CA-OG1 3.3Å; G188-T337 WeakPolarHBondContact CA-OG1 3.47Å; T337-S342 VanDerWaalsContact OG1-CB 3.3Å; T337-S342 WeakPolarHBondContact OG1-CB 3.47Å
338	T	92.2	Very high	93	Very high	10 Å²	10	24.5 Å²	24.5	6%	0.061	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-106.3	168.8	169.1	68.2	0	0	0	0	110	P160 D164 K340 G341	P160-T338 HydrophobicContact CB-CG2 4.06Å; P160-T338 HydrophobicContact CG-CG2 3.91Å; D164-T338 CarbonylContact O-C 3.45Å; D164-T338 VanDerWaalsContact O-CA 3.27Å; D164-T338 WeakPolarHBondContact O-CA 3.33Å; T338-K340 PolarHBondContact O-N 2.67Å; T338-K340 PolarHBondContact OG1-N 2.94Å; T338-G341 PolarHBondContact N-O 2.9Å; T338-G341 PolarHBondContact O-N 3.12Å; T338-G341 PolarHBondContact OG1-O 3.34Å; T338-G341 VanDerWaalsContact OG1-O 3.05Å
339	K	89.2	Confident	92.6	Very high	142 Å²	142	24.8 Å²	24.8	62%	0.617	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-13.6	171	-62.6	171.2	-164.7	148.3	0	115.4	T163 D164	T163-K339 WeakPolarHBondContact O-CE 3.38Å; T163-K339 PolarHBondContact O-NZ 3.45Å; D164-K339 PolarHBondContact O-N 3.5Å; D164-K339 IonicContact OD1-NZ 3.4Å; D164-K339 PolarHBondContact OD1-NZ 3.12Å
340	K	90.3	Very high	92.1	Very high	124 Å²	124	29.9 Å²	29.9	54%	0.539	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-28.8	-179.8	-69.3	-177	171.4	-177.1	0	113.8	D284 G287 T338	D284-K340 VanDerWaalsContact O-CD 3.28Å; D284-K340 WeakPolarHBondContact O-CD 3.34Å; D284-K340 PolarHBondContact O-NZ 3.29Å; G287-K340 CarbonylContact C-O 3.38Å; G287-K340 WeakPolarHBondContact CA-O 3.5Å; T338-K340 PolarHBondContact O-N 2.67Å; T338-K340 PolarHBondContact OG1-N 2.94Å
341	G	90.9	Very high	91.4	Very high	9 Å²	9	27 Å²	27	9%	0.093	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	167	170.7	-169.6	0	0	0	0	0	111.2	R283 T338	R283-G341 WeakPolarHBondContact CD-O 3.49Å; R283-G341 VanDerWaalsContact CG-O 3.3Å; R283-G341 WeakPolarHBondContact CG-O 3.22Å; T338-G341 PolarHBondContact N-O 2.9Å; T338-G341 PolarHBondContact O-N 3.12Å; T338-G341 PolarHBondContact OG1-O 3.34Å; T338-G341 VanDerWaalsContact OG1-O 3.05Å
342	S	92.2	Very high	90.6	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.133	C	C	.	.			trans	-114.4	151.7	-177.1	69.2	0	0	0	0	113.8	D289 V290 T337	D289-S342 WeakPolarHBondContact OD1-CB 3.35Å; D289-S342 PolarHBondContact OD1-N 2.78Å; D289-S342 VanDerWaalsContact OD1-N 3.12Å; D289-S342 PolarHBondContact OD1-OG 2.95Å; V290-S342 PolarHBondContact N-O 3.37Å; T337-S342 VanDerWaalsContact OG1-CB 3.3Å; T337-S342 WeakPolarHBondContact OG1-CB 3.47Å
343	I	94.5	Very high	89.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	106.7	160.9	-62.8	167.5	0	0	0	107	G188 L276 A279 E280 R283 V290 L292 I335	G188-I343 CarbonylContact C-O 3.58Å; G188-I343 WeakPolarHBondContact CA-O 3.21Å; L276-I343 HydrophobicContact CD1-CD1 4.37Å; A279-I343 HydrophobicContact CB-CD1 4.04Å; A279-I343 HydrophobicContact CB-CG1 4.36Å; A279-I343 HydrophobicContact CB-CG2 4.38Å; E280-I343 HydrophobicContact CB-CD1 4.44Å; E280-I343 HydrophobicContact CG-CD1 3.74Å; R283-I343 HydrophobicContact CB-CD1 4.12Å; R283-I343 HydrophobicContact CB-CG1 3.94Å; R283-I343 HydrophobicContact CG-CG1 4.27Å; V290-I343 HydrophobicContact CB-CG1 4.26Å; V290-I343 CarbonylContact O-C 3.59Å; V290-I343 WeakPolarHBondContact O-CA 3.27Å; L292-I343 HydrophobicContact CB-CG2 3.64Å; L292-I343 HydrophobicContact CD2-CG2 4.2Å; I335-I343 HydrophobicContact CG2-CG2 4.15Å
344	T	93.9	Very high	88.7	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.018	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	118.3	172.6	-48.6	0	0	0	0	107.7	L172 G188 I191 V290 L291 L292	L172-T344 HydrophobicContact CD2-CG2 3.77Å; G188-T344 WeakPolarHBondContact CA-OG1 3.37Å; G188-T344 PolarHBondContact N-OG1 3.28Å; I191-T344 HydrophobicContact CD1-CG2 3.52Å; V290-T344 PolarHBondContact O-N 2.82Å; L291-T344 WeakPolarHBondContact CA-O 3.49Å; L291-T344 HydrophobicContact CD2-CG2 4.4Å; L292-T344 PolarHBondContact N-O 3.04Å
345	S	94.9	Very high	87.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132	-177	73.2	0	0	0	0	112.9	G189 I191 L292 Q347	G189-S345 PolarHBondContact O-N 3.09Å; I191-S345 VanDerWaalsContact CD1-O 3.31Å; I191-S345 WeakPolarHBondContact CD1-O 3.31Å; I191-S345 PolarHBondContact N-O 3.48Å; L292-S345 CarbonylContact O-C 3.53Å; L292-S345 WeakPolarHBondContact O-CA 3.45Å; S345-Q347 PolarHBondContact OG-NE2 2.95Å
346	V	93.6	Very high	87	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	109.2	169.8	-177.2	0	0	0	0	108.3	I191 L193 L208 L292 F293 I294	I191-V346 HydrophobicContact CB-CG2 4.35Å; I191-V346 HydrophobicContact CD1-CG2 4.41Å; L193-V346 HydrophobicContact CB-CG1 4.3Å; L193-V346 HydrophobicContact CD2-CG1 4.42Å; L208-V346 HydrophobicContact CD1-CG1 4.38Å; L208-V346 HydrophobicContact CD1-CG2 4.38Å; L292-V346 PolarHBondContact O-N 3Å; F293-V346 WeakPolarHBondContact CA-O 3.44Å; F293-V346 HydrophobicContact CD1-CB 3.7Å; F293-V346 HydrophobicContact CD1-CG1 4.18Å; F293-V346 HydrophobicContact CD1-CG2 4.42Å; F293-V346 HydrophobicContact CE1-CB 3.66Å; F293-V346 HydrophobicContact CE1-CG1 4.1Å; F293-V346 HydrophobicContact CE1-CG2 3.91Å; F293-V346 HydrophobicContact CZ-CG2 4.47Å; I294-V346 PolarHBondContact N-O 2.9Å
347	Q	93.5	Very high	86.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	116.1	-169.6	-51.1	-175.1	18	0	0	109.3	I191 L193 I294 I297 S345 I349	I191-Q347 PolarHBondContact O-N 2.92Å; L193-Q347 PolarHBondContact N-O 2.66Å; I294-Q347 HydrophobicContact CB-CB 4.42Å; I294-Q347 HydrophobicContact CB-CG 4.22Å; I294-Q347 HydrophobicContact CD1-CG 4.23Å; I294-Q347 HydrophobicContact CG1-CG 4.37Å; I294-Q347 CarbonylContact O-C 3.45Å; I294-Q347 WeakPolarHBondContact O-CA 3.36Å; I297-Q347 HydrophobicContact CB-CB 4.48Å; I297-Q347 HydrophobicContact CG2-CB 4.31Å; S345-Q347 PolarHBondContact OG-NE2 2.95Å; Q347-I349 PolarHBondContact O-N 3.21Å
348	A	89.1	Confident	86.5	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.008	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	125.4	173.3	0	0	0	0	0	109.7	L193 K201 I294 D295 N296 I297	L193-A348 WeakPolarHBondContact O-CA 3.02Å; K201-A348 HydrophobicContact CD-CB 3.72Å; I294-A348 PolarHBondContact O-N 3.09Å; D295-A348 HydrophobicContact CB-CB 4.22Å; D295-A348 WeakPolarHBondContact OD1-CB 3.3Å; N296-A348 PolarHBondContact ND2-O 3.16Å; N296-A348 PolarHBondContact OD1-O 2.8Å; N296-A348 VanDerWaalsContact OD1-O 3.06Å; I297-A348 PolarHBondContact N-O 2.92Å; I297-A348 VanDerWaalsContact N-O 3.09Å
349	I	86.6	Confident	86.4	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.036	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	117.3	-177.1	-63.8	161.9	0	0	0	109.2	L193 F194 I297 Q347 V351 T364 F365 L368	L193-I349 PolarHBondContact O-N 3.42Å; F194-I349 HydrophobicContact CD1-CB 4.02Å; F194-I349 HydrophobicContact CD1-CG2 4.06Å; F194-I349 HydrophobicContact CE1-CB 3.81Å; F194-I349 HydrophobicContact CE1-CD1 3.88Å; F194-I349 HydrophobicContact CE1-CG1 4.45Å; F194-I349 HydrophobicContact CE1-CG2 3.62Å; F194-I349 HydrophobicContact CE2-CD1 4.05Å; F194-I349 HydrophobicContact CZ-CB 4.3Å; F194-I349 HydrophobicContact CZ-CD1 3.49Å; F194-I349 VanDerWaalsContact CZ-CD1 3.49Å; F194-I349 HydrophobicContact CZ-CG1 4.49Å; F194-I349 HydrophobicContact CZ-CG2 4.38Å; I297-I349 HydrophobicContact CG2-CB 4.38Å; I297-I349 HydrophobicContact CG2-CG1 3.48Å; I297-I349 VanDerWaalsContact CG2-CG1 3.48Å; Q347-I349 PolarHBondContact O-N 3.21Å; I349-V351 HydrophobicContact CG2-CG2 4.36Å; I349-T364 HydrophobicContact CD1-CG2 3.93Å; I349-T364 HydrophobicContact CG1-CG2 4.31Å; I349-F365 HydrophobicContact CD1-CE1 4.47Å; I349-F365 HydrophobicContact CG2-CE1 4.49Å; I349-L368 HydrophobicContact CD1-CD1 3.74Å
350	Y	83.3	Confident	86.4	Confident	120 Å²	120	42 Å²	42	47%	0.471	23%	0.233	S	C	.	.			trans	-83.9	126.9	163.9	178.2	-102.6	0	0	0	109.8	N296 F298 P352	N296-Y350 PolarHBondContact ND2-N 3.32Å; N296-Y350 PolarHBondContact OD1-N 2.95Å; N296-Y350 VanDerWaalsContact OD1-N 3.09Å; F298-Y350 AromaticContact CD1-CD1 3.69Å; F298-Y350 HydrophobicContact CD1-CD1 3.69Å; F298-Y350 HydrophobicContact CD1-CG 4.48Å; F298-Y350 AromaticContact CE1-CD1 3.97Å; F298-Y350 HydrophobicContact CE1-CD1 3.97Å; F298-Y350 HydrophobicContact CE1-CE1 4.42Å; F298-Y350 HydrophobicContact CG-CD1 4.11Å; Y350-P352 HydrophobicContact CD1-CG 4.41Å; Y350-P352 HydrophobicContact CE1-CB 4.37Å; Y350-P352 HydrophobicContact CE1-CG 4.35Å
351	V	79.4	Confident	86.2	Confident	19 Å²	19	36.1 Å²	36.1	12%	0.115	21%	0.208	C	C	.	.			trans	-97.8	115	174.2	-175.9	0	0	0	0	108.1	F194 I349 A353 D354 D355 L356	F194-V351 HydrophobicContact CD1-CG2 3.9Å; F194-V351 HydrophobicContact CE1-CG2 4.16Å; I349-V351 HydrophobicContact CG2-CG2 4.36Å; V351-A353 PolarHBondContact O-N 3.46Å; V351-D354 PolarHBondContact O-N 2.79Å; V351-D355 VanDerWaalsContact CG1-C 3.44Å; V351-D355 VanDerWaalsContact CG1-O 3.32Å; V351-D355 WeakPolarHBondContact CG1-O 3.26Å; V351-L356 HydrophobicContact CG1-CD2 4.02Å; V351-L356 HydrophobicContact CG2-CD2 3.93Å
352	P	76.3	Confident	86	Confident	24 Å²	24	37.9 Å²	37.9	16%	0.156	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-63.2	127.2	179.6	-22.8	35.2	0	0	0	111.4	F298 Y350 D354 D355	F298-P352 HydrophobicContact CD2-CG 4.02Å; F298-P352 HydrophobicContact CE1-CG 4.35Å; F298-P352 HydrophobicContact CE2-CG 3.28Å; F298-P352 HydrophobicContact CZ-CG 3.49Å; F298-P352 VanDerWaalsContact CZ-CG 3.49Å; Y350-P352 HydrophobicContact CD1-CG 4.41Å; Y350-P352 HydrophobicContact CE1-CB 4.37Å; Y350-P352 HydrophobicContact CE1-CG 4.35Å; P352-D354 PolarHBondContact O-N 2.82Å; P352-D355 PolarHBondContact O-N 2.92Å
353	A	77.7	Confident	85.9	Confident	94 Å²	94	39.3 Å²	39.3	78%	0.777	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	50.9	27.5	178.8	0	0	0	0	0	114.9	V351 D355	V351-A353 PolarHBondContact O-N 3.46Å; A353-D355 PolarHBondContact O-N 3.46Å
354	D	72.3	Confident	85.7	Confident	149 Å²	149	39.5 Å²	39.5	80%	0.797	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	58	19.4	-174.5	-54.8	-52.3	0	0	0	114.6	V351 P352 L356	V351-D354 PolarHBondContact O-N 2.79Å; P352-D354 PolarHBondContact O-N 2.82Å; D354-L356 PolarHBondContact O-N 3.13Å
355	D	77.4	Confident	85.4	Confident	73 Å²	73	42.3 Å²	42.3	39%	0.39	24%	0.243	S	C	.	.			trans	-88.8	101.4	176.3	-172.9	1	0	0	0	112.3	V351 P352 A353 T357 D358	V351-D355 VanDerWaalsContact CG1-C 3.44Å; V351-D355 VanDerWaalsContact CG1-O 3.32Å; V351-D355 WeakPolarHBondContact CG1-O 3.26Å; P352-D355 PolarHBondContact O-N 2.92Å; A353-D355 PolarHBondContact O-N 3.46Å; D355-T357 PolarHBondContact O-N 3.22Å; D355-T357 WeakPolarHBondContact OD1-CA 3.45Å; D355-T357 WeakPolarHBondContact OD1-CB 3.38Å; D355-T357 PolarHBondContact OD1-N 3.35Å; D355-T357 PolarHBondContact OD1-OG1 3.36Å; D355-T357 PolarHBondContact OD2-OG1 3Å; D355-D358 PolarHBondContact O-N 2.92Å
356	L	76.4	Confident	85.2	Confident	100 Å²	100	45.9 Å²	45.9	52%	0.524	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-11.5	174.7	-63.8	174.3	0	0	0	113.8	V351 D354 F365	V351-L356 HydrophobicContact CG1-CD2 4.02Å; V351-L356 HydrophobicContact CG2-CD2 3.93Å; D354-L356 PolarHBondContact O-N 3.13Å; L356-F365 HydrophobicContact CB-CE2 4.32Å; L356-F365 HydrophobicContact CD2-CE2 4.01Å; L356-F365 HydrophobicContact CD2-CZ 3.76Å
357	T	84.6	Confident	85.1	Confident	112 Å²	112	47.5 Å²	47.5	69%	0.687	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-5	178.3	75.7	0	0	0	0	113.6	D355	D355-T357 PolarHBondContact O-N 3.22Å; D355-T357 WeakPolarHBondContact OD1-CA 3.45Å; D355-T357 WeakPolarHBondContact OD1-CB 3.38Å; D355-T357 PolarHBondContact OD1-N 3.35Å; D355-T357 PolarHBondContact OD1-OG1 3.36Å; D355-T357 PolarHBondContact OD2-OG1 3Å
358	D	88.2	Confident	85.1	Confident	13 Å²	13	48 Å²	48	7%	0.07	28%	0.283	C	S	.	.	S	Bend	trans	-57	137.8	171.8	-180	-74.7	0	0	0	110.6	Y320 D355 A360 P361 A362	Y320-D358 WeakPolarHBondContact CE2-OD1 3.4Å; Y320-D358 WeakPolarHBondContact CE2-OD2 3.29Å; Y320-D358 VanDerWaalsContact CZ-OD1 3.26Å; Y320-D358 VanDerWaalsContact OH-CG 3.29Å; Y320-D358 PolarHBondContact OH-OD1 3.06Å; Y320-D358 PolarHBondContact OH-OD2 3.12Å; Y320-D358 VanDerWaalsContact OH-OD2 3.05Å; D355-D358 PolarHBondContact O-N 2.92Å; D358-A360 PolarHBondContact O-N 3.38Å; D358-A360 VanDerWaalsContact O-N 3.11Å; D358-A360 WeakPolarHBondContact OD1-CB 3.48Å; D358-A360 PolarHBondContact OD1-N 2.65Å; D358-P361 HydrophobicContact CB-CG 3.84Å; D358-P361 WeakPolarHBondContact O-CD 3.25Å; D358-P361 WeakPolarHBondContact O-CG 3.2Å; D358-P361 VanDerWaalsContact OD1-CD 3.26Å; D358-P361 WeakPolarHBondContact OD1-CD 3.36Å; D358-A362 VanDerWaalsContact O-CB 3.26Å; D358-A362 WeakPolarHBondContact O-CB 3.44Å; D358-A362 PolarHBondContact O-N 2.89Å
359	P	89.8	Confident	85.2	Confident	31 Å²	31	49.7 Å²	49.7	20%	0.201	29%	0.292	C	S	.	.	H	α-helix	trans	-54.1	-30.9	-177.7	-29.9	35.4	0	0	0	115.5	A317 V318 Y320 L324 T363	A317-P359 HydrophobicContact CB-CG 4.26Å; V318-P359 HydrophobicContact CG2-CG 4.04Å; Y320-P359 HydrophobicContact CD2-CB 3.88Å; Y320-P359 HydrophobicContact CD2-CG 4Å; Y320-P359 HydrophobicContact CE2-CB 4.2Å; Y320-P359 HydrophobicContact CE2-CG 4.25Å; L324-P359 HydrophobicContact CD2-CB 3.9Å; P359-T363 WeakPolarHBondContact O-CB 3.43Å; P359-T363 PolarHBondContact O-N 3Å; P359-T363 PolarHBondContact O-OG1 3.02Å
360	A	88.6	Confident	85.5	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.008	29%	0.291	C	S	.	.	H	α-helix	trans	-70.1	-57.2	-178.2	0	0	0	0	0	113.3	F298 T301 Y320 D358 T364	F298-A360 HydrophobicContact CD2-CB 3.87Å; F298-A360 HydrophobicContact CE2-CB 3.77Å; T301-A360 HydrophobicContact CG2-CB 3.62Å; Y320-A360 HydrophobicContact CE1-CB 3.92Å; Y320-A360 HydrophobicContact CE2-CB 4.4Å; D358-A360 PolarHBondContact O-N 3.38Å; D358-A360 VanDerWaalsContact O-N 3.11Å; D358-A360 WeakPolarHBondContact OD1-CB 3.48Å; D358-A360 PolarHBondContact OD1-N 2.65Å; A360-T364 PolarHBondContact O-N 3.18Å; A360-T364 VanDerWaalsContact O-N 3.15Å; A360-T364 PolarHBondContact O-OG1 3.41Å
361	P	86.4	Confident	86	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-60.4	-45.5	171.6	21.4	-29.9	0	0	0	111.6	D358 T363 T364 F365	D358-P361 HydrophobicContact CB-CG 3.84Å; D358-P361 WeakPolarHBondContact O-CD 3.25Å; D358-P361 WeakPolarHBondContact O-CG 3.2Å; D358-P361 VanDerWaalsContact OD1-CD 3.26Å; D358-P361 WeakPolarHBondContact OD1-CD 3.36Å; P361-T363 VanDerWaalsContact C-N 3.33Å; P361-T363 PolarHBondContact O-N 2.81Å; P361-T364 CarbonylContact O-C 3.33Å; P361-T364 WeakPolarHBondContact O-CA 3.5Å; P361-T364 WeakPolarHBondContact O-CB 3.35Å; P361-T364 PolarHBondContact O-N 3.11Å; P361-F365 HydrophobicContact CB-CE1 3.68Å; P361-F365 HydrophobicContact CB-CE2 4.12Å; P361-F365 HydrophobicContact CB-CZ 3.44Å; P361-F365 VanDerWaalsContact CB-CZ 3.44Å; P361-F365 WeakPolarHBondContact O-CD1 3.49Å; P361-F365 WeakPolarHBondContact O-CE1 3.22Å; P361-F365 WeakPolarHBondContact O-CG 3.49Å; P361-F365 PolarHBondContact O-N 2.89Å
362	A	87.6	Confident	86.7	Confident	45 Å²	45	44.2 Å²	44.2	37%	0.372	27%	0.272	S	S	.	.	H	α-helix	trans	-58.1	-41.7	-178.3	0	0	0	0	0	113.3	D358 F365	D358-A362 VanDerWaalsContact O-CB 3.26Å; D358-A362 WeakPolarHBondContact O-CB 3.44Å; D358-A362 PolarHBondContact O-N 2.89Å; A362-F365 PolarHBondContact O-N 2.99Å
363	T	90.4	Very high	87.4	Confident	31 Å²	31	44.8 Å²	44.8	19%	0.19	28%	0.275	C	S	.	.	H	α-helix	trans	-66.4	-39.7	173.9	-57.6	0	0	0	0	111.4	A325 M328 P359 P361 F365 H367	A325-T363 HydrophobicContact CB-CG2 4.25Å; M328-T363 HydrophobicContact CB-CG2 4.09Å; M328-T363 HydrophobicContact CG-CG2 4.17Å; P359-T363 WeakPolarHBondContact O-CB 3.43Å; P359-T363 PolarHBondContact O-N 3Å; P359-T363 PolarHBondContact O-OG1 3.02Å; P361-T363 VanDerWaalsContact C-N 3.33Å; P361-T363 PolarHBondContact O-N 2.81Å; T363-F365 VanDerWaalsContact C-N 3.35Å; T363-F365 PolarHBondContact O-N 3.32Å; T363-H367 PolarHBondContact O-CD2 3.3Å
364	T	89.3	Confident	88.1	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.018	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-40.7	178.7	-52.7	0	0	0	0	111.2	I297 I349 A360 P361 A366 H367	I297-T364 HydrophobicContact CG2-CG2 4.2Å; I349-T364 HydrophobicContact CD1-CG2 3.93Å; I349-T364 HydrophobicContact CG1-CG2 4.31Å; A360-T364 PolarHBondContact O-N 3.18Å; A360-T364 VanDerWaalsContact O-N 3.15Å; A360-T364 PolarHBondContact O-OG1 3.41Å; P361-T364 CarbonylContact O-C 3.33Å; P361-T364 WeakPolarHBondContact O-CA 3.5Å; P361-T364 WeakPolarHBondContact O-CB 3.35Å; P361-T364 PolarHBondContact O-N 3.11Å; T364-A366 VanDerWaalsContact C-N 3.27Å; T364-A366 PolarHBondContact O-N 3.26Å; T364-H367 PolarHBondContact O-N 3.43Å
365	F	87.1	Confident	88.8	Confident	62 Å²	62	34.9 Å²	34.9	27%	0.272	21%	0.211	S	C	.	.	H	α-helix	trans	-61.7	-32	-176.6	-60.7	-9.6	0	0	0	113.5	F194 I349 L356 P361 A362 T363 H367 L368	F194-F365 HydrophobicContact CE1-CD1 4.39Å; F194-F365 AromaticContact CE1-CE1 3.35Å; F194-F365 HydrophobicContact CE1-CE1 3.35Å; F194-F365 AromaticContact CE1-CZ 3.68Å; F194-F365 HydrophobicContact CE1-CZ 3.68Å; F194-F365 AromaticContact CZ-CD1 3.95Å; F194-F365 HydrophobicContact CZ-CD1 3.95Å; F194-F365 AromaticContact CZ-CE1 3.32Å; F194-F365 HydrophobicContact CZ-CE1 3.32Å; F194-F365 AromaticContact CZ-CZ 3.94Å; F194-F365 HydrophobicContact CZ-CZ 3.94Å; I349-F365 HydrophobicContact CD1-CE1 4.47Å; I349-F365 HydrophobicContact CG2-CE1 4.49Å; L356-F365 HydrophobicContact CB-CE2 4.32Å; L356-F365 HydrophobicContact CD2-CE2 4.01Å; L356-F365 HydrophobicContact CD2-CZ 3.76Å; P361-F365 HydrophobicContact CB-CE1 3.68Å; P361-F365 HydrophobicContact CB-CE2 4.12Å; P361-F365 HydrophobicContact CB-CZ 3.44Å; P361-F365 VanDerWaalsContact CB-CZ 3.44Å; P361-F365 WeakPolarHBondContact O-CD1 3.49Å; P361-F365 WeakPolarHBondContact O-CE1 3.22Å; P361-F365 WeakPolarHBondContact O-CG 3.49Å; P361-F365 PolarHBondContact O-N 2.89Å; A362-F365 PolarHBondContact O-N 2.99Å; T363-F365 VanDerWaalsContact C-N 3.35Å; T363-F365 PolarHBondContact O-N 3.32Å; F365-H367 PolarHBondContact O-N 2.94Å; F365-L368 HydrophobicContact CD1-CD1 4.01Å; F365-L368 PolarHBondContact O-N 3.41Å; F365-L368 VanDerWaalsContact O-N 3.12Å
366	A	90.5	Very high	89.4	Confident	76 Å²	76	38.4 Å²	38.4	63%	0.628	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.5	176.7	0	0	0	0	0	112.9	T364	T364-A366 VanDerWaalsContact C-N 3.27Å; T364-A366 PolarHBondContact O-N 3.26Å
367	H	92.5	Very high	90	Very high	36 Å²	36	36.4 Å²	36.4	17%	0.167	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-10.6	178.6	-61.2	-84.4	0	0	0	113.7	K190 Q332 E333 T363 T364 F365	K190-H367 WeakPolarHBondContact CB-O 3.38Å; K190-H367 HydrophobicContact CD-CB 4.22Å; K190-H367 WeakPolarHBondContact CD-O 3.39Å; Q332-H367 HydrophobicContact CB-CB 4.06Å; Q332-H367 HydrophobicContact CG-CB 4.06Å; E333-H367 IonicContact OE1-CE1 2.71Å; E333-H367 PolarHBondContact OE1-CE1 3.03Å; E333-H367 IonicContact OE1-ND1 2.75Å; E333-H367 PolarHBondContact OE1-ND1 3.16Å; T363-H367 PolarHBondContact O-CD2 3.3Å; T364-H367 PolarHBondContact O-N 3.43Å; F365-H367 PolarHBondContact O-N 2.94Å
368	L	92.4	Very high	90.4	Very high	10 Å²	10	31.8 Å²	31.8	5%	0.052	19%	0.188	C	C	.	.			trans	-80.2	142.5	-175.9	-59.4	179.9	0	0	0	112.7	K190 F194 I349 F365 T371 R395	K190-L368 HydrophobicContact CB-CD2 4.22Å; F194-L368 HydrophobicContact CE2-CD1 4.39Å; F194-L368 HydrophobicContact CZ-CD1 4.2Å; I349-L368 HydrophobicContact CD1-CD1 3.74Å; F365-L368 HydrophobicContact CD1-CD1 4.01Å; F365-L368 PolarHBondContact O-N 3.41Å; F365-L368 VanDerWaalsContact O-N 3.12Å; L368-T371 HydrophobicContact CD1-CG2 4.14Å; L368-R395 PolarHBondContact O-NH2 3.27Å; L368-R395 VanDerWaalsContact O-NH2 3.13Å
369	D	91.8	Very high	90.5	Very high	36 Å²	36	31.7 Å²	31.7	19%	0.193	19%	0.189	C	C	.	.	S	Bend	trans	-97.3	-30.3	170.3	-63.1	-68.2	0	0	0	112.1	G189 K190 R395	G189-D369 WeakPolarHBondContact CA-OD2 3.36Å; K190-D369 PolarHBondContact N-OD2 2.94Å; K190-D369 PolarHBondContact O-N 3.42Å; D369-R395 VanDerWaalsContact O-CB 3.24Å; D369-R395 WeakPolarHBondContact O-CB 3.37Å; D369-R395 PolarHBondContact O-N 3.09Å; D369-R395 IonicContact OD1-CZ 3.8Å; D369-R395 IonicContact OD1-NE 3.92Å; D369-R395 IonicContact OD1-NH1 3.77Å; D369-R395 PolarHBondContact OD1-NH1 3.06Å
370	A	93.4	Very high	90.5	Very high	3 Å²	3	37.3 Å²	37.3	3%	0.025	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	150	175.8	0	0	0	0	0	112.1	Y185 K190 I191 G192 T393	Y185-A370 HydrophobicContact CD1-CB 4.15Å; Y185-A370 HydrophobicContact CE1-CB 4.46Å; K190-A370 PolarHBondContact O-N 3.06Å; I191-A370 WeakPolarHBondContact CA-O 3.38Å; I191-A370 HydrophobicContact CG1-CB 4.31Å; G192-A370 PolarHBondContact N-O 3.24Å; A370-T393 CarbonylContact C-O 3.57Å; A370-T393 WeakPolarHBondContact CA-O 3.24Å
371	T	93.3	Very high	90.7	Very high	29 Å²	29	41 Å²	41	18%	0.178	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.8	173.7	61.6	0	0	0	0	109.3	G192 F194 L368 S392 T393	G192-T371 WeakPolarHBondContact O-CA 3.47Å; F194-T371 HydrophobicContact CE2-CG2 3.85Å; F194-T371 HydrophobicContact CZ-CG2 4.45Å; L368-T371 HydrophobicContact CD1-CG2 4.14Å; T371-S392 CarbonylContact O-C 3.54Å; T371-S392 VanDerWaalsContact O-CA 3.29Å; T371-S392 WeakPolarHBondContact O-CA 3.27Å; T371-S392 WeakPolarHBondContact O-CB 3.4Å; T371-T393 PolarHBondContact N-O 2.85Å; T371-T393 PolarHBondContact O-N 2.66Å; T371-T393 PolarHBondContact OG1-N 2.99Å; T371-T393 PolarHBondContact OG1-OG1 3.07Å
372	T	94.1	Very high	90.9	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	112.8	172.7	-57.8	0	0	0	0	107.6	Y185 G192 L193 F194 L204 V387	Y185-T372 WeakPolarHBondContact CE1-OG1 3.21Å; Y185-T372 PolarHBondContact OH-OG1 2.94Å; G192-T372 PolarHBondContact O-N 2.94Å; L193-T372 WeakPolarHBondContact CA-O 3.24Å; L193-T372 HydrophobicContact CD1-CG2 3.82Å; F194-T372 PolarHBondContact N-O 3.45Å; L204-T372 HydrophobicContact CD2-CG2 4.47Å; T372-V387 HydrophobicContact CG2-CB 4.47Å; T372-V387 HydrophobicContact CG2-CG1 3.85Å; T372-V387 HydrophobicContact CG2-CG2 3.79Å
373	V	92.1	Very high	91.2	Very high	35 Å²	35	40 Å²	40	21%	0.212	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	122.1	-176.9	-177.5	0	0	0	0	109.3	F194 V387 D388 D391 S392	F194-V373 HydrophobicContact CB-CG1 4.46Å; F194-V373 HydrophobicContact CB-CG2 4.33Å; F194-V373 HydrophobicContact CD2-CG2 4.22Å; F194-V373 HydrophobicContact CG-CG2 4.48Å; V373-V387 CarbonylContact O-C 3.54Å; V373-V387 WeakPolarHBondContact O-CA 3.42Å; V373-D388 HydrophobicContact CB-CB 4.42Å; V373-D388 PolarHBondContact O-N 2.86Å; V373-D391 HydrophobicContact CB-CB 4.22Å; V373-D391 HydrophobicContact CG1-CB 4.38Å; V373-D391 HydrophobicContact CG2-CB 4.15Å; V373-S392 PolarHBondContact N-OG 2.81Å
374	L	90.9	Very high	91.4	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.037	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	114.1	175.4	-59.2	178.6	0	0	0	110.6	L193 F194 V199 K201 L204 A386 V387	L193-L374 HydrophobicContact CD1-CD1 3.9Å; L193-L374 HydrophobicContact CD1-CD2 4.43Å; L193-L374 HydrophobicContact CD1-CG 3.89Å; L193-L374 HydrophobicContact CG-CD1 4.4Å; F194-L374 VanDerWaalsContact O-CB 3.28Å; F194-L374 WeakPolarHBondContact O-CB 3.1Å; F194-L374 WeakPolarHBondContact O-CG 3.25Å; F194-L374 PolarHBondContact O-N 3.08Å; V199-L374 HydrophobicContact CB-CB 4.02Å; V199-L374 HydrophobicContact CG2-CB 3.38Å; V199-L374 HydrophobicContact CG2-CD1 3.85Å; V199-L374 HydrophobicContact CG2-CG 4.27Å; K201-L374 HydrophobicContact CB-CD1 3.99Å; K201-L374 HydrophobicContact CG-CD1 4.23Å; L204-L374 HydrophobicContact CD2-CD1 4.42Å; L204-L374 HydrophobicContact CD2-CD2 4.1Å; L374-A386 CarbonylContact C-O 3.22Å; L374-A386 VanDerWaalsContact CA-O 3.3Å; L374-A386 WeakPolarHBondContact CA-O 3.41Å; L374-V387 HydrophobicContact CD2-CB 4.35Å; L374-V387 HydrophobicContact CD2-CG2 3.59Å
375	S	88.5	Confident	91.6	Very high	28 Å²	28	43 Å²	43	20%	0.196	23%	0.234	C	C	.	.			trans	-97.7	131.5	-173.8	178.3	0	0	0	0	112.2	A377 I378 A379 A386	S375-A377 VanDerWaalsContact C-N 3.32Å; S375-A377 PolarHBondContact O-N 3.21Å; S375-A377 PolarHBondContact OG-N 3.45Å; S375-I378 PolarHBondContact O-N 3.12Å; S375-A379 PolarHBondContact O-N 3.25Å; S375-A386 PolarHBondContact N-O 3.5Å
376	R	89.1	Confident	92	Very high	147 Å²	147	40.1 Å²	40.1	56%	0.555	22%	0.222	S	C	*	.	H	α-helix	trans	-62.6	-39.2	175.3	-177.7	179.5	-68.2	152.7	1.9	111.9	V199 I378 A379 E380	V199-R376 HydrophobicContact CG1-CB 4.2Å; R376-I378 PolarHBondContact O-N 3.29Å; R376-A379 WeakPolarHBondContact O-CB 3.35Å; R376-A379 PolarHBondContact O-N 3.34Å; R376-A379 VanDerWaalsContact O-N 3.12Å; R376-E380 VanDerWaalsContact CD-OE1 3.26Å; R376-E380 WeakPolarHBondContact CD-OE1 3.31Å; R376-E380 HydrophobicContact CG-CG 4.16Å; R376-E380 VanDerWaalsContact CG-OE1 3.27Å; R376-E380 WeakPolarHBondContact CG-OE1 3.38Å; R376-E380 WeakPolarHBondContact O-CG 3.45Å; R376-E380 PolarHBondContact O-N 2.88Å
377	A	89.8	Confident	92.2	Very high	58 Å²	58	36.9 Å²	36.9	48%	0.479	19%	0.194	S	C	.	.	H	α-helix	trans	-61.4	-32.4	179.8	0	0	0	0	0	112.2	S375 L381	S375-A377 VanDerWaalsContact C-N 3.32Å; S375-A377 PolarHBondContact O-N 3.21Å; S375-A377 PolarHBondContact OG-N 3.45Å; A377-L381 WeakPolarHBondContact O-CG 3.19Å; A377-L381 PolarHBondContact O-N 3.15Å
378	I	91.8	Very high	92.3	Very high	16 Å²	16	35.9 Å²	35.9	8%	0.082	19%	0.19	C	C	.	.	H	α-helix	trans	-74.9	-40.3	176.2	-61.7	-180	0	0	0	110.8	S375 R376 E380 L381 I383 A386 V387 D388	S375-I378 PolarHBondContact O-N 3.12Å; R376-I378 PolarHBondContact O-N 3.29Å; I378-E380 VanDerWaalsContact C-N 3.35Å; I378-E380 PolarHBondContact O-N 2.68Å; I378-L381 WeakPolarHBondContact O-CB 3.25Å; I378-L381 PolarHBondContact O-N 3.37Å; I378-I383 HydrophobicContact CG2-CB 3.69Å; I378-I383 HydrophobicContact CG2-CG2 3.73Å; I378-I383 PolarHBondContact O-N 3.44Å; I378-A386 HydrophobicContact CB-CB 4.47Å; I378-A386 HydrophobicContact CG2-CB 4.34Å; I378-V387 WeakPolarHBondContact CD1-O 3.44Å; I378-D388 HydrophobicContact CD1-CB 4.04Å
379	A	90.6	Very high	92.4	Very high	11 Å²	11	36 Å²	36	9%	0.091	19%	0.191	C	C	.	.	H	α-helix	trans	-62.8	-38.7	173.8	0	0	0	0	0	112.6	S375 R376 L381 G382 Y384 A386	S375-A379 PolarHBondContact O-N 3.25Å; R376-A379 WeakPolarHBondContact O-CB 3.35Å; R376-A379 PolarHBondContact O-N 3.34Å; R376-A379 VanDerWaalsContact O-N 3.12Å; A379-L381 VanDerWaalsContact C-N 3.29Å; A379-L381 PolarHBondContact O-N 3.49Å; A379-G382 WeakPolarHBondContact O-CA 3.19Å; A379-G382 PolarHBondContact O-N 3.36Å; A379-Y384 HydrophobicContact CB-CE1 4.26Å; A379-Y384 PolarHBondContact O-OH 2.91Å; A379-A386 HydrophobicContact CB-CB 3.81Å
380	E	91.3	Very high	92.5	Very high	148 Å²	148	36.1 Å²	36.1	69%	0.692	19%	0.191	S	C	*	.	H	α-helix	trans	-65.5	-28.7	176	-74.9	171.3	-176	0	0	112.8	R376 I378 G382	R376-E380 VanDerWaalsContact CD-OE1 3.26Å; R376-E380 WeakPolarHBondContact CD-OE1 3.31Å; R376-E380 HydrophobicContact CG-CG 4.16Å; R376-E380 VanDerWaalsContact CG-OE1 3.27Å; R376-E380 WeakPolarHBondContact CG-OE1 3.38Å; R376-E380 WeakPolarHBondContact O-CG 3.45Å; R376-E380 PolarHBondContact O-N 2.88Å; I378-E380 VanDerWaalsContact C-N 3.35Å; I378-E380 PolarHBondContact O-N 2.68Å; E380-G382 PolarHBondContact O-N 3.48Å
381	L	91.3	Very high	92.4	Very high	79 Å²	79	40.2 Å²	40.2	41%	0.414	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-1	169.5	-66.7	171.7	0	0	0	113.3	A377 I378 A379 I383 R451	A377-L381 WeakPolarHBondContact O-CG 3.19Å; A377-L381 PolarHBondContact O-N 3.15Å; I378-L381 WeakPolarHBondContact O-CB 3.25Å; I378-L381 PolarHBondContact O-N 3.37Å; A379-L381 VanDerWaalsContact C-N 3.29Å; A379-L381 PolarHBondContact O-N 3.49Å; L381-I383 VanDerWaalsContact C-N 3.33Å; L381-I383 HydrophobicContact CB-CD1 4.14Å; L381-I383 HydrophobicContact CB-CG1 4.16Å; L381-I383 HydrophobicContact CD1-CD1 4.49Å; L381-R451 PolarHBondContact O-NH1 2.8Å; L381-R451 PolarHBondContact O-NH2 2.91Å
382	G	91.7	Very high	92.4	Very high	21 Å²	21	38.9 Å²	38.9	22%	0.216	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	16.6	-177	0	0	0	0	0	114.2	A379 E380 Y384 Y497	A379-G382 WeakPolarHBondContact O-CA 3.19Å; A379-G382 PolarHBondContact O-N 3.36Å; E380-G382 PolarHBondContact O-N 3.48Å; G382-Y384 WeakPolarHBondContact O-CD2 3.06Å; G382-Y497 VanDerWaalsContact O-CE2 3.26Å; G382-Y497 WeakPolarHBondContact O-CE2 3.13Å; G382-Y497 PolarHBondContact O-OH 3.23Å
383	I	93.6	Very high	92.4	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	23%	0.227	C	C	.	.			trans	-91.4	114.5	-176.9	-61.4	177.6	0	0	0	108.9	I378 L381 A386 Q450 R451	I378-I383 HydrophobicContact CG2-CB 3.69Å; I378-I383 HydrophobicContact CG2-CG2 3.73Å; I378-I383 PolarHBondContact O-N 3.44Å; L381-I383 VanDerWaalsContact C-N 3.33Å; L381-I383 HydrophobicContact CB-CD1 4.14Å; L381-I383 HydrophobicContact CB-CG1 4.16Å; L381-I383 HydrophobicContact CD1-CD1 4.49Å; I383-A386 WeakPolarHBondContact O-CA 3.32Å; I383-Q450 HydrophobicContact CD1-CG 3.74Å; I383-R451 VanDerWaalsContact CG1-NH1 3.35Å
384	Y	93.5	Very high	92.5	Very high	89 Å²	89	41.6 Å²	41.6	35%	0.349	22%	0.222	S	C	.	.	S	Bend	trans	-124.1	135.7	178.2	-67.7	-83.3	0	0	0	110.3	A379 G382 S454 Q455	A379-Y384 HydrophobicContact CB-CE1 4.26Å; A379-Y384 PolarHBondContact O-OH 2.91Å; G382-Y384 WeakPolarHBondContact O-CD2 3.06Å; Y384-S454 CarbonylContact O-C 3.58Å; Y384-S454 WeakPolarHBondContact O-CA 3.49Å; Y384-S454 WeakPolarHBondContact O-CB 3.4Å; Y384-Q455 PolarHBondContact O-N 3.34Å
385	P	95	Very high	92.6	Very high	9 Å²	9	48.2 Å²	48.2	6%	0.058	25%	0.247	C	C	.	.	S	Bend	cis	-67.1	146.6	-4.2	32.2	-38.1	0	0	0	112.1	I176 V178 L204 V387 F457	I176-P385 HydrophobicContact CG2-CG 4.07Å; V178-P385 HydrophobicContact CG1-CG 3.76Å; L204-P385 HydrophobicContact CD1-CB 4.33Å; P385-V387 HydrophobicContact CB-CG2 4.17Å; P385-V387 HydrophobicContact CG-CG2 4.31Å; P385-V387 PolarHBondContact O-N 2.96Å; P385-F457 HydrophobicContact CB-CE2 3.92Å; P385-F457 HydrophobicContact CB-CZ 3.6Å; P385-F457 HydrophobicContact CG-CE1 4.11Å; P385-F457 HydrophobicContact CG-CE2 4.37Å; P385-F457 HydrophobicContact CG-CZ 3.56Å
386	A	94.3	Very high	92.8	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.008	24%	0.238	C	C	.	.			trans	-79.9	36.9	-172.1	0	0	0	0	0	114.1	L374 S375 I378 A379 I383	L374-A386 CarbonylContact C-O 3.22Å; L374-A386 VanDerWaalsContact CA-O 3.3Å; L374-A386 WeakPolarHBondContact CA-O 3.41Å; S375-A386 PolarHBondContact N-O 3.5Å; I378-A386 HydrophobicContact CB-CB 4.47Å; I378-A386 HydrophobicContact CG2-CB 4.34Å; A379-A386 HydrophobicContact CB-CB 3.81Å; I383-A386 WeakPolarHBondContact O-CA 3.32Å
387	V	95.2	Very high	93	Very high	7 Å²	7	41 Å²	41	4%	0.042	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-72.8	129.6	-176.6	-179.9	0	0	0	0	110.4	V178 T372 V373 L374 I378 P385 P389 S392	V178-V387 HydrophobicContact CG1-CB 3.87Å; V178-V387 HydrophobicContact CG1-CG1 4.39Å; V178-V387 HydrophobicContact CG1-CG2 3.84Å; V178-V387 HydrophobicContact CG2-CB 3.79Å; V178-V387 HydrophobicContact CG2-CG1 3.71Å; T372-V387 HydrophobicContact CG2-CB 4.47Å; T372-V387 HydrophobicContact CG2-CG1 3.85Å; T372-V387 HydrophobicContact CG2-CG2 3.79Å; V373-V387 CarbonylContact O-C 3.54Å; V373-V387 WeakPolarHBondContact O-CA 3.42Å; L374-V387 HydrophobicContact CD2-CB 4.35Å; L374-V387 HydrophobicContact CD2-CG2 3.59Å; I378-V387 WeakPolarHBondContact CD1-O 3.44Å; P385-V387 HydrophobicContact CB-CG2 4.17Å; P385-V387 HydrophobicContact CG-CG2 4.31Å; P385-V387 PolarHBondContact O-N 2.96Å; V387-P389 WeakPolarHBondContact O-CD 3.19Å; V387-S392 WeakPolarHBondContact CG1-OG 3.35Å
388	D	94.4	Very high	93.1	Very high	16 Å²	16	41.2 Å²	41.2	9%	0.086	21%	0.21	C	C	.	.			trans	-76	118.1	172.2	-162.8	-65.7	0	0	0	110.5	V373 I378 L390 D391 S392	V373-D388 HydrophobicContact CB-CB 4.42Å; V373-D388 PolarHBondContact O-N 2.86Å; I378-D388 HydrophobicContact CD1-CB 4.04Å; D388-L390 VanDerWaalsContact C-N 3.27Å; D388-L390 PolarHBondContact O-N 2.97Å; D388-L390 PolarHBondContact OD1-N 3.15Å; D388-D391 HydrophobicContact CB-CB 4.19Å; D388-D391 PolarHBondContact OD1-N 2.92Å; D388-S392 WeakPolarHBondContact O-CB 3.26Å; D388-S392 PolarHBondContact O-N 3.28Å; D388-S392 PolarHBondContact O-OG 3.44Å
389	P	94.2	Very high	93.3	Very high	13 Å²	13	43 Å²	43	8%	0.084	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-9.8	-175.1	31.1	-35.1	0	0	0	114.2	L182 V387 Q414 L417 L453	L182-P389 HydrophobicContact CD1-CB 3.32Å; V387-P389 WeakPolarHBondContact O-CD 3.19Å; P389-Q414 PolarHBondContact O-NE2 2.76Å; P389-L417 HydrophobicContact CB-CD1 3.76Å; P389-L417 HydrophobicContact CG-CD1 3.68Å; P389-L453 HydrophobicContact CB-CD1 4Å; P389-L453 HydrophobicContact CG-CD1 4.25Å
390	L	93.9	Very high	93.3	Very high	37 Å²	37	49.7 Å²	49.7	19%	0.194	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-41.4	-179.1	-60	176.1	0	0	0	111.4	D388 Q414 L417 Q418 K421	D388-L390 VanDerWaalsContact C-N 3.27Å; D388-L390 PolarHBondContact O-N 2.97Å; D388-L390 PolarHBondContact OD1-N 3.15Å; L390-Q414 HydrophobicContact CD2-CB 4.44Å; L390-L417 HydrophobicContact CD2-CB 4.19Å; L390-Q418 HydrophobicContact CD2-CB 4.24Å; L390-K421 HydrophobicContact CD1-CD 3.72Å
391	D	91.5	Very high	93.4	Very high	90 Å²	90	45 Å²	45	48%	0.481	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-17	-178.7	-64.3	-14.5	0	0	0	113.2	V373 D388	V373-D391 HydrophobicContact CB-CB 4.22Å; V373-D391 HydrophobicContact CG1-CB 4.38Å; V373-D391 HydrophobicContact CG2-CB 4.15Å; D388-D391 HydrophobicContact CB-CB 4.19Å; D388-D391 PolarHBondContact OD1-N 2.92Å
392	S	93.9	Very high	93.5	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.007	22%	0.221	C	C	.	.			trans	-80.1	134.7	172.5	-56.9	0	0	0	0	111.4	T371 V373 V387 D388	T371-S392 CarbonylContact O-C 3.54Å; T371-S392 VanDerWaalsContact O-CA 3.29Å; T371-S392 WeakPolarHBondContact O-CA 3.27Å; T371-S392 WeakPolarHBondContact O-CB 3.4Å; V373-S392 PolarHBondContact N-OG 2.81Å; V387-S392 WeakPolarHBondContact CG1-OG 3.35Å; D388-S392 WeakPolarHBondContact O-CB 3.26Å; D388-S392 PolarHBondContact O-N 3.28Å; D388-S392 PolarHBondContact O-OG 3.44Å
393	T	94.2	Very high	93.6	Very high	76 Å²	76	42.6 Å²	42.6	47%	0.466	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	160.2	-175.2	71.3	0	0	0	0	112	A370 T371	A370-T393 CarbonylContact C-O 3.57Å; A370-T393 WeakPolarHBondContact CA-O 3.24Å; T371-T393 PolarHBondContact N-O 2.85Å; T371-T393 PolarHBondContact O-N 2.66Å; T371-T393 PolarHBondContact OG1-N 2.99Å; T371-T393 PolarHBondContact OG1-OG1 3.07Å
394	S	94.5	Very high	93.7	Very high	15 Å²	15	45 Å²	45	11%	0.105	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	138	171.5	176	0	0	0	0	111.2	P184 I396 M397	P184-S394 WeakPolarHBondContact O-CB 3.31Å; P184-S394 PolarHBondContact O-OG 3.17Å; S394-I396 PolarHBondContact O-N 2.69Å; S394-I396 WeakPolarHBondContact OG-CG1 3.35Å; S394-I396 PolarHBondContact OG-N 3.34Å; S394-M397 WeakPolarHBondContact O-CB 3.43Å; S394-M397 PolarHBondContact O-N 3.4Å
395	R	91.8	Very high	93.8	Very high	147 Å²	147	45.9 Å²	45.9	56%	0.555	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-29.4	177	-177.9	179.1	-69.1	159.3	-2.8	112.2	L368 D369 M397	L368-R395 PolarHBondContact O-NH2 3.27Å; L368-R395 VanDerWaalsContact O-NH2 3.13Å; D369-R395 VanDerWaalsContact O-CB 3.24Å; D369-R395 WeakPolarHBondContact O-CB 3.37Å; D369-R395 PolarHBondContact O-N 3.09Å; D369-R395 IonicContact OD1-CZ 3.8Å; D369-R395 IonicContact OD1-NE 3.92Å; D369-R395 IonicContact OD1-NH1 3.77Å; D369-R395 PolarHBondContact OD1-NH1 3.06Å; R395-M397 VanDerWaalsContact C-N 3.29Å; R395-M397 PolarHBondContact O-N 2.75Å
396	I	92.6	Very high	93.9	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	4	179.3	60.4	154.8	0	0	0	113.8	I171 P184 A186 S394 D398 I401 V402	I171-I396 HydrophobicContact CG1-CD1 4.12Å; P184-I396 HydrophobicContact CB-CD1 4.09Å; P184-I396 HydrophobicContact CG-CD1 4.22Å; P184-I396 HydrophobicContact CG-CG1 4.26Å; P184-I396 WeakPolarHBondContact O-CG1 3.28Å; A186-I396 HydrophobicContact CB-CD1 4.19Å; A186-I396 HydrophobicContact CB-CG1 4.43Å; A186-I396 HydrophobicContact CB-CG2 3.85Å; S394-I396 PolarHBondContact O-N 2.69Å; S394-I396 WeakPolarHBondContact OG-CG1 3.35Å; S394-I396 PolarHBondContact OG-N 3.34Å; I396-D398 PolarHBondContact O-N 2.72Å; I396-I401 HydrophobicContact CB-CD1 4.27Å; I396-I401 HydrophobicContact CB-CG2 4.2Å; I396-I401 HydrophobicContact CG2-CD1 4.18Å; I396-I401 HydrophobicContact CG2-CG2 4.5Å; I396-V402 VanDerWaalsContact O-CG1 3.32Å; I396-V402 WeakPolarHBondContact O-CG1 3.46Å
397	M	93.7	Very high	94	Very high	19 Å²	19	48.2 Å²	48.2	9%	0.094	26%	0.262	C	S	.	.			trans	-73.8	62.7	168.5	-73.3	-62.8	-65.9	0	0	111.6	P184 S394 R395 V402 Y407 A410	P184-M397 WeakPolarHBondContact CD-SD 3.26Å; P184-M397 HydrophobicContact CG-CG 3.96Å; P184-M397 HydrophobicContact CG-SD 3.36Å; P184-M397 WeakPolarHBondContact CG-SD 3.49Å; S394-M397 WeakPolarHBondContact O-CB 3.43Å; S394-M397 PolarHBondContact O-N 3.4Å; R395-M397 VanDerWaalsContact C-N 3.29Å; R395-M397 PolarHBondContact O-N 2.75Å; M397-V402 HydrophobicContact SD-CG1 4.4Å; M397-Y407 VanDerWaalsContact O-CE2 3.29Å; M397-Y407 WeakPolarHBondContact O-CE2 3.29Å; M397-A410 HydrophobicContact CE-CB 3.41Å; M397-A410 VanDerWaalsContact CE-CB 3.41Å
398	D	93.1	Very high	94.1	Very high	63 Å²	63	53 Å²	53	34%	0.337	29%	0.287	S	S	.	.			trans	-123	131.1	177.4	-173.8	-54.8	0	0	0	108.9	I396 N400 I401 V402	I396-D398 PolarHBondContact O-N 2.72Å; D398-N400 PolarHBondContact O-N 3.38Å; D398-N400 VanDerWaalsContact OD1-CB 3.27Å; D398-N400 WeakPolarHBondContact OD1-CB 3.33Å; D398-N400 PolarHBondContact OD1-N 3.35Å; D398-N400 PolarHBondContact OD1-ND2 3.06Å; D398-I401 HydrophobicContact CB-CD1 4.08Å; D398-I401 HydrophobicContact CB-CG1 4.27Å; D398-I401 PolarHBondContact O-N 3.2Å; D398-V402 VanDerWaalsContact O-CG2 3.31Å; D398-V402 WeakPolarHBondContact O-CG2 3.2Å; D398-V402 PolarHBondContact O-N 3.5Å
399	P	94.3	Very high	94.3	Very high	54 Å²	54	52.7 Å²	52.7	35%	0.351	29%	0.285	S	S	.	.	H	α-helix	trans	-52.8	-25.1	178.5	-24.6	31.6	0	0	0	115.1	I401 G403 Y407	P399-I401 VanDerWaalsContact C-N 3.34Å; P399-G403 CarbonylContact O-C 3.42Å; P399-G403 WeakPolarHBondContact O-CA 3.37Å; P399-G403 PolarHBondContact O-N 2.86Å; P399-Y407 HydrophobicContact CB-CG 4.43Å; P399-Y407 HydrophobicContact CG-CD1 3.7Å; P399-Y407 HydrophobicContact CG-CD2 3.93Å; P399-Y407 HydrophobicContact CG-CE1 3.99Å; P399-Y407 HydrophobicContact CG-CE2 4.22Å; P399-Y407 HydrophobicContact CG-CG 3.66Å
400	N	92.6	Very high	94.4	Very high	150 Å²	150	52 Å²	52	80%	0.802	28%	0.281	S	S	*	.	H	α-helix	trans	-77.5	-18.5	178.7	-58.2	-74.5	0	0	0	113.1	D398	D398-N400 PolarHBondContact O-N 3.38Å; D398-N400 VanDerWaalsContact OD1-CB 3.27Å; D398-N400 WeakPolarHBondContact OD1-CB 3.33Å; D398-N400 PolarHBondContact OD1-N 3.35Å; D398-N400 PolarHBondContact OD1-ND2 3.06Å
401	I	91.9	Very high	94.5	Very high	51 Å²	51	55.5 Å²	55.5	26%	0.262	29%	0.292	S	S	.	.	H	α-helix	trans	-105.5	-56.4	-178.6	-55	170.7	0	0	0	110.3	Q169 I396 D398 P399 G403	Q169-I401 HydrophobicContact CB-CD1 4.48Å; Q169-I401 HydrophobicContact CB-CG2 4.5Å; I396-I401 HydrophobicContact CB-CD1 4.27Å; I396-I401 HydrophobicContact CB-CG2 4.2Å; I396-I401 HydrophobicContact CG2-CD1 4.18Å; I396-I401 HydrophobicContact CG2-CG2 4.5Å; D398-I401 HydrophobicContact CB-CD1 4.08Å; D398-I401 HydrophobicContact CB-CG1 4.27Å; D398-I401 PolarHBondContact O-N 3.2Å; P399-I401 VanDerWaalsContact C-N 3.34Å; I401-G403 VanDerWaalsContact C-N 3.33Å
402	V	92.9	Very high	94.8	Very high	18 Å²	18	52.2 Å²	52.2	11%	0.109	28%	0.28	C	S	.	.	H	α-helix	trans	-81.1	-13.7	-179.1	-66.2	0	0	0	0	113.6	I171 P184 I396 M397 D398 H406	I171-V402 HydrophobicContact CD1-CB 4.31Å; I171-V402 HydrophobicContact CD1-CG1 3.78Å; I171-V402 HydrophobicContact CG1-CG1 4.3Å; P184-V402 HydrophobicContact CG-CG1 4.23Å; I396-V402 VanDerWaalsContact O-CG1 3.32Å; I396-V402 WeakPolarHBondContact O-CG1 3.46Å; M397-V402 HydrophobicContact SD-CG1 4.4Å; D398-V402 VanDerWaalsContact O-CG2 3.31Å; D398-V402 WeakPolarHBondContact O-CG2 3.2Å; D398-V402 PolarHBondContact O-N 3.5Å; V402-H406 HydrophobicContact CB-CB 4.09Å; V402-H406 HydrophobicContact CG2-CB 4.3Å; V402-H406 WeakPolarHBondContact O-CB 3.39Å
403	G	94.7	Very high	94.9	Very high	30 Å²	30	52.2 Å²	52.2	31%	0.309	28%	0.279	S	S	.	.			trans	82.6	151	-171.7	0	0	0	0	0	112.7	P399 I401 E405 H406 Y407	P399-G403 CarbonylContact O-C 3.42Å; P399-G403 WeakPolarHBondContact O-CA 3.37Å; P399-G403 PolarHBondContact O-N 2.86Å; I401-G403 VanDerWaalsContact C-N 3.33Å; G403-E405 VanDerWaalsContact C-N 3.35Å; G403-E405 PolarHBondContact O-N 2.96Å; G403-H406 PolarHBondContact O-N 3.32Å; G403-Y407 PolarHBondContact O-N 2.91Å; G403-Y407 VanDerWaalsContact O-N 3.14Å
404	A	95.6	Very high	95	Very high	55 Å²	55	50 Å²	50	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-58	-41.7	-176	0	0	0	0	0	113.4	H406 Y407 D408	A404-H406 PolarHBondContact O-N 3.37Å; A404-Y407 PolarHBondContact O-N 3.06Å; A404-D408 WeakPolarHBondContact O-CB 2.95Å; A404-D408 VanDerWaalsContact O-CG 3.23Å; A404-D408 PolarHBondContact O-N 3.12Å
405	E	96.1	Very high	95.1	Very high	107 Å²	107	55.8 Å²	55.8	50%	0.5	29%	0.287	S	S	.	.	H	α-helix	trans	-63.3	-42.4	-177.9	-178.3	171.8	-144.8	0	0	113	G403 V409 I477 K481	G403-E405 VanDerWaalsContact C-N 3.35Å; G403-E405 PolarHBondContact O-N 2.96Å; E405-V409 WeakPolarHBondContact O-CB 3.32Å; E405-V409 WeakPolarHBondContact O-CG2 3.18Å; E405-V409 PolarHBondContact O-N 3.21Å; E405-I477 HydrophobicContact CG-CG2 3.95Å; E405-K481 IonicContact OE1-NZ 3.61Å; E405-K481 PolarHBondContact OE1-NZ 2.85Å
406	H	96.8	Very high	95.3	Very high	4 Å²	4	50 Å²	50	2%	0.019	27%	0.267	C	S	.	.	H	α-helix	trans	-64.4	-50.3	175.2	-173.3	164.3	0	0	0	109.6	D180 L181 V402 G403 A404 D408 V409 A410 I477	D180-H406 PolarHBondContact O-CE1 3.13Å; D180-H406 PolarHBondContact O-NE2 3.1Å; L181-H406 PolarHBondContact O-NE2 3.44Å; V402-H406 HydrophobicContact CB-CB 4.09Å; V402-H406 HydrophobicContact CG2-CB 4.3Å; V402-H406 WeakPolarHBondContact O-CB 3.39Å; G403-H406 PolarHBondContact O-N 3.32Å; A404-H406 PolarHBondContact O-N 3.37Å; H406-D408 PolarHBondContact O-N 2.98Å; H406-V409 PolarHBondContact O-N 2.91Å; H406-A410 WeakPolarHBondContact O-CB 3.25Å; H406-A410 PolarHBondContact O-N 3Å; H406-I477 HydrophobicContact CB-CD1 3.77Å; H406-I477 HydrophobicContact CB-CG1 4.38Å
407	Y	97.1	Very high	95.5	Very high	56 Å²	56	50.1 Å²	50.1	22%	0.22	27%	0.268	C	S	.	.	H	α-helix	trans	-57.4	-49.4	-178.6	-175.8	-93.8	0	0	0	112.7	M397 P399 G403 A404 V409 A410 R411	M397-Y407 VanDerWaalsContact O-CE2 3.29Å; M397-Y407 WeakPolarHBondContact O-CE2 3.29Å; P399-Y407 HydrophobicContact CB-CG 4.43Å; P399-Y407 HydrophobicContact CG-CD1 3.7Å; P399-Y407 HydrophobicContact CG-CD2 3.93Å; P399-Y407 HydrophobicContact CG-CE1 3.99Å; P399-Y407 HydrophobicContact CG-CE2 4.22Å; P399-Y407 HydrophobicContact CG-CG 3.66Å; G403-Y407 PolarHBondContact O-N 2.91Å; G403-Y407 VanDerWaalsContact O-N 3.14Å; A404-Y407 PolarHBondContact O-N 3.06Å; Y407-V409 PolarHBondContact O-N 2.79Å; Y407-A410 PolarHBondContact O-N 3.39Å; Y407-R411 HydrophobicContact CD1-CG 4.02Å; Y407-R411 HydrophobicContact CE1-CG 3.63Å; Y407-R411 HydrophobicContact CE2-CG 4.18Å; Y407-R411 HydrophobicContact CG-CG 4.47Å; Y407-R411 VanDerWaalsContact CZ-NE 3.33Å; Y407-R411 WeakPolarHBondContact O-CB 3.32Å; Y407-R411 WeakPolarHBondContact O-CG 3.34Å; Y407-R411 PolarHBondContact O-N 3.42Å; Y407-R411 PolarHBondContact OH-NE 3.04Å; Y407-R411 PolarHBondContact OH-NH2 2.9Å
408	D	97.3	Very high	95.6	Very high	107 Å²	107	53.2 Å²	53.2	57%	0.572	28%	0.282	S	S	*	.	H	α-helix	trans	-64.9	-39.9	-177.5	-69.4	-22.3	0	0	0	111.8	A404 H406 G412	A404-D408 WeakPolarHBondContact O-CB 2.95Å; A404-D408 VanDerWaalsContact O-CG 3.23Å; A404-D408 PolarHBondContact O-N 3.12Å; H406-D408 PolarHBondContact O-N 2.98Å; D408-G412 PolarHBondContact O-N 2.88Å
409	V	97.3	Very high	95.7	Very high	9 Å²	9	53.2 Å²	53.2	6%	0.055	28%	0.282	C	S	.	.	H	α-helix	trans	-66.2	-45	175.6	172.9	0	0	0	0	110.9	L181 E405 H406 Y407 G412 V413 I477 F480 K481 L484	L181-V409 HydrophobicContact CD1-CG1 4.17Å; E405-V409 WeakPolarHBondContact O-CB 3.32Å; E405-V409 WeakPolarHBondContact O-CG2 3.18Å; E405-V409 PolarHBondContact O-N 3.21Å; H406-V409 PolarHBondContact O-N 2.91Å; Y407-V409 PolarHBondContact O-N 2.79Å; V409-G412 PolarHBondContact O-N 2.89Å; V409-V413 WeakPolarHBondContact O-CG2 3.36Å; V409-V413 PolarHBondContact O-N 3.38Å; V409-I477 HydrophobicContact CG2-CG2 4.29Å; V409-F480 HydrophobicContact CG1-CB 3.69Å; V409-K481 HydrophobicContact CG1-CB 4.5Å; V409-K481 HydrophobicContact CG2-CB 3.79Å; V409-K481 HydrophobicContact CG2-CD 4.31Å; V409-K481 HydrophobicContact CG2-CG 4.03Å; V409-L484 HydrophobicContact CG1-CD1 4.13Å
410	A	96.8	Very high	95.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-42.6	177.9	0	0	0	0	0	112.2	L181 L182 M397 H406 Y407 V413 Q414	L181-A410 HydrophobicContact CD1-CB 4.37Å; L181-A410 HydrophobicContact CG-CB 4.27Å; L181-A410 WeakPolarHBondContact O-CB 3.46Å; L182-A410 HydrophobicContact CD2-CB 4.03Å; M397-A410 HydrophobicContact CE-CB 3.41Å; M397-A410 VanDerWaalsContact CE-CB 3.41Å; H406-A410 WeakPolarHBondContact O-CB 3.25Å; H406-A410 PolarHBondContact O-N 3Å; Y407-A410 PolarHBondContact O-N 3.39Å; A410-V413 PolarHBondContact O-N 2.63Å; A410-Q414 WeakPolarHBondContact O-CG 3.49Å; A410-Q414 PolarHBondContact O-N 2.83Å
411	R	96.7	Very high	95.7	Very high	109 Å²	109	49.1 Å²	49.1	41%	0.411	25%	0.251	S	S	.	.	H	α-helix	trans	-66.3	-37.1	174.5	-68.3	-53.4	-170	-168.7	2	112.6	Y407 Q414 K415	Y407-R411 HydrophobicContact CD1-CG 4.02Å; Y407-R411 HydrophobicContact CE1-CG 3.63Å; Y407-R411 HydrophobicContact CE2-CG 4.18Å; Y407-R411 HydrophobicContact CG-CG 4.47Å; Y407-R411 VanDerWaalsContact CZ-NE 3.33Å; Y407-R411 WeakPolarHBondContact O-CB 3.32Å; Y407-R411 WeakPolarHBondContact O-CG 3.34Å; Y407-R411 PolarHBondContact O-N 3.42Å; Y407-R411 PolarHBondContact OH-NE 3.04Å; Y407-R411 PolarHBondContact OH-NH2 2.9Å; R411-Q414 PolarHBondContact O-N 3.41Å; R411-K415 WeakPolarHBondContact O-CB 3.18Å; R411-K415 PolarHBondContact O-N 3.17Å
412	G	96.8	Very high	95.8	Very high	22 Å²	22	50.2 Å²	50.2	23%	0.227	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-44.3	172.4	0	0	0	0	0	112.6	D408 V409 K415 I416	D408-G412 PolarHBondContact O-N 2.88Å; V409-G412 PolarHBondContact O-N 2.89Å; G412-K415 PolarHBondContact O-N 2.68Å; G412-I416 PolarHBondContact O-N 3.19Å; G412-I416 VanDerWaalsContact O-N 3.1Å
413	V	96.8	Very high	95.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-49.7	174.5	164.5	0	0	0	0	111.5	L181 L182 V409 A410 K415 I416 L417 I449 F480 L484	L181-V413 HydrophobicContact CD2-CG2 4.16Å; L182-V413 HydrophobicContact CD1-CG1 4.25Å; L182-V413 HydrophobicContact CD2-CB 4.3Å; L182-V413 HydrophobicContact CD2-CG1 3.92Å; V409-V413 WeakPolarHBondContact O-CG2 3.36Å; V409-V413 PolarHBondContact O-N 3.38Å; A410-V413 PolarHBondContact O-N 2.63Å; V413-K415 VanDerWaalsContact C-N 3.31Å; V413-K415 PolarHBondContact O-N 2.64Å; V413-I416 PolarHBondContact O-N 3.4Å; V413-L417 HydrophobicContact CG1-CD1 3.72Å; V413-L417 WeakPolarHBondContact O-CG 3.46Å; V413-L417 PolarHBondContact O-N 3.34Å; V413-L417 VanDerWaalsContact O-N 3.08Å; V413-I449 HydrophobicContact CG1-CG2 3.76Å; V413-I449 HydrophobicContact CG2-CG2 4.44Å; V413-F480 HydrophobicContact CG2-CB 4.07Å; V413-F480 HydrophobicContact CG2-CD1 3.66Å; V413-F480 HydrophobicContact CG2-CG 4.16Å; V413-L484 HydrophobicContact CG2-CD1 4.24Å; V413-L484 HydrophobicContact CG2-CD2 4.24Å; V413-L484 HydrophobicContact CG2-CG 4.35Å
414	Q	96.2	Very high	95.7	Very high	29 Å²	29	52.4 Å²	52.4	14%	0.136	27%	0.265	C	S	.	.	H	α-helix	trans	-59.5	-41.6	177.5	-73.7	-175.1	-38.1	0	0	112	L182 P389 L390 A410 R411 L417 Q418	L182-Q414 HydrophobicContact CD2-CG 4.15Å; P389-Q414 PolarHBondContact O-NE2 2.76Å; L390-Q414 HydrophobicContact CD2-CB 4.44Å; A410-Q414 WeakPolarHBondContact O-CG 3.49Å; A410-Q414 PolarHBondContact O-N 2.83Å; R411-Q414 PolarHBondContact O-N 3.41Å; Q414-L417 PolarHBondContact O-N 2.82Å; Q414-Q418 VanDerWaalsContact O-CB 3.31Å; Q414-Q418 WeakPolarHBondContact O-CB 3.4Å; Q414-Q418 PolarHBondContact O-N 2.76Å
415	K	96.8	Very high	95.4	Very high	137 Å²	137	55.4 Å²	55.4	60%	0.596	27%	0.273	S	S	*	.	H	α-helix	trans	-60.5	-53.1	177.9	-169.7	-167.8	171.2	-163.7	0	111.6	R411 G412 V413 L417 Q418 D419	R411-K415 WeakPolarHBondContact O-CB 3.18Å; R411-K415 PolarHBondContact O-N 3.17Å; G412-K415 PolarHBondContact O-N 2.68Å; V413-K415 VanDerWaalsContact C-N 3.31Å; V413-K415 PolarHBondContact O-N 2.64Å; K415-L417 VanDerWaalsContact C-N 3.27Å; K415-L417 PolarHBondContact O-N 3.48Å; K415-Q418 PolarHBondContact O-N 2.86Å; K415-Q418 VanDerWaalsContact O-N 3.12Å; K415-D419 WeakPolarHBondContact CE-OD2 3.48Å; K415-D419 WeakPolarHBondContact O-CB 3.47Å; K415-D419 VanDerWaalsContact O-CG 3.24Å; K415-D419 PolarHBondContact O-N 2.88Å
416	I	96.4	Very high	95.1	Very high	25 Å²	25	53.9 Å²	53.9	13%	0.128	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-37.7	-179.5	-70.3	-174.5	0	0	0	111.7	G412 V413 Y420 T442 A446 I449 L484	G412-I416 PolarHBondContact O-N 3.19Å; G412-I416 VanDerWaalsContact O-N 3.1Å; V413-I416 PolarHBondContact O-N 3.4Å; I416-Y420 VanDerWaalsContact O-CB 3.28Å; I416-Y420 WeakPolarHBondContact O-CB 3.46Å; I416-Y420 PolarHBondContact O-N 3.31Å; I416-T442 HydrophobicContact CG2-CG2 4.38Å; I416-A446 HydrophobicContact CG2-CB 3.7Å; I416-I449 HydrophobicContact CB-CD1 4.33Å; I416-I449 HydrophobicContact CD1-CD1 4.31Å; I416-I449 HydrophobicContact CG2-CD1 4.01Å; I416-L484 HydrophobicContact CD1-CD2 3.53Å; I416-L484 HydrophobicContact CG1-CD2 4.36Å
417	L	95.8	Very high	94.9	Very high	8 Å²	8	55.3 Å²	55.3	4%	0.042	28%	0.275	C	S	.	.	H	α-helix	trans	-70.4	-34.9	177.2	-68.5	169.6	0	0	0	112.6	P389 L390 V413 Q414 K415 K421 I449 Q450 L453	P389-L417 HydrophobicContact CB-CD1 3.76Å; P389-L417 HydrophobicContact CG-CD1 3.68Å; L390-L417 HydrophobicContact CD2-CB 4.19Å; V413-L417 HydrophobicContact CG1-CD1 3.72Å; V413-L417 WeakPolarHBondContact O-CG 3.46Å; V413-L417 PolarHBondContact O-N 3.34Å; V413-L417 VanDerWaalsContact O-N 3.08Å; Q414-L417 PolarHBondContact O-N 2.82Å; K415-L417 VanDerWaalsContact C-N 3.27Å; K415-L417 PolarHBondContact O-N 3.48Å; L417-K421 WeakPolarHBondContact O-CB 3.39Å; L417-K421 PolarHBondContact O-N 3.39Å; L417-I449 HydrophobicContact CD1-CG2 3.94Å; L417-I449 HydrophobicContact CD2-CG2 4.05Å; L417-I449 HydrophobicContact CG-CG2 4.07Å; L417-Q450 HydrophobicContact CD2-CB 4.35Å; L417-L453 HydrophobicContact CD1-CD1 4.12Å
418	Q	95.7	Very high	94.6	Very high	84 Å²	84	56.7 Å²	56.7	39%	0.393	30%	0.298	S	S	.	.	H	α-helix	trans	-69.9	-44.7	174.2	-178.3	56.3	64.8	0	0	111.8	L390 Q414 K415 Y420 K421 S422	L390-Q418 HydrophobicContact CD2-CB 4.24Å; Q414-Q418 VanDerWaalsContact O-CB 3.31Å; Q414-Q418 WeakPolarHBondContact O-CB 3.4Å; Q414-Q418 PolarHBondContact O-N 2.76Å; K415-Q418 PolarHBondContact O-N 2.86Å; K415-Q418 VanDerWaalsContact O-N 3.12Å; Q418-Y420 VanDerWaalsContact C-N 3.32Å; Q418-Y420 PolarHBondContact O-N 3.02Å; Q418-K421 PolarHBondContact O-N 3.26Å; Q418-S422 PolarHBondContact O-N 3.25Å; Q418-S422 VanDerWaalsContact O-N 3.08Å
419	D	95.1	Very high	94.4	Very high	62 Å²	62	58.3 Å²	58.3	33%	0.332	31%	0.305	S	S	.	.	H	α-helix	trans	-60.2	-44	175.4	-65.1	-21.7	0	0	0	109.7	K415 K421 S422 L423 T442	K415-D419 WeakPolarHBondContact CE-OD2 3.48Å; K415-D419 WeakPolarHBondContact O-CB 3.47Å; K415-D419 VanDerWaalsContact O-CG 3.24Å; K415-D419 PolarHBondContact O-N 2.88Å; D419-K421 PolarHBondContact O-N 3.46Å; D419-S422 PolarHBondContact O-N 3.35Å; D419-L423 WeakPolarHBondContact O-CG 3.31Å; D419-L423 PolarHBondContact O-N 3.11Å; D419-T442 HydrophobicContact CB-CG2 4.21Å
420	Y	95.1	Very high	94.1	Very high	27 Å²	27	63.2 Å²	63.2	11%	0.106	33%	0.33	C	S	.	.	H	α-helix	trans	-59.7	-43.7	173.1	172.1	-129.7	0	0	0	113.4	I416 Q418 S422 L423 Q424 V443 A446	I416-Y420 VanDerWaalsContact O-CB 3.28Å; I416-Y420 WeakPolarHBondContact O-CB 3.46Å; I416-Y420 PolarHBondContact O-N 3.31Å; Q418-Y420 VanDerWaalsContact C-N 3.32Å; Q418-Y420 PolarHBondContact O-N 3.02Å; Y420-S422 VanDerWaalsContact C-N 3.26Å; Y420-S422 PolarHBondContact O-N 3.09Å; Y420-L423 CarbonylContact O-C 2.97Å; Y420-L423 PolarHBondContact O-N 2.92Å; Y420-Q424 HydrophobicContact CD2-CG 4.2Å; Y420-Q424 HydrophobicContact CE1-CG 4.36Å; Y420-Q424 VanDerWaalsContact CE1-NE2 3.31Å; Y420-Q424 HydrophobicContact CE2-CG 3.69Å; Y420-Q424 WeakPolarHBondContact O-CG 3.3Å; Y420-Q424 PolarHBondContact O-N 3.16Å; Y420-Q424 PolarHBondContact OH-NE2 3.1Å; Y420-V443 HydrophobicContact CD2-CB 4.33Å; Y420-V443 HydrophobicContact CD2-CG1 3.92Å; Y420-V443 HydrophobicContact CD2-CG2 4.06Å; Y420-V443 HydrophobicContact CE2-CG1 3.74Å; Y420-A446 HydrophobicContact CD1-CB 3.78Å; Y420-A446 HydrophobicContact CD2-CB 4.26Å; Y420-A446 HydrophobicContact CG-CB 3.53Å
421	K	92.8	Very high	93.9	Very high	91 Å²	91	64.6 Å²	64.6	40%	0.396	34%	0.344	S	S	.	.	H	α-helix	trans	-60.2	-36.9	176.9	-169.5	171.1	-178.9	174.6	0	111.5	L390 L417 Q418 D419	L390-K421 HydrophobicContact CD1-CD 3.72Å; L417-K421 WeakPolarHBondContact O-CB 3.39Å; L417-K421 PolarHBondContact O-N 3.39Å; Q418-K421 PolarHBondContact O-N 3.26Å; D419-K421 PolarHBondContact O-N 3.46Å
422	S	92.3	Very high	93.6	Very high	74 Å²	74	62.4 Å²	62.4	52%	0.517	34%	0.34	S	S	.	.	H	α-helix	trans	-71.5	-30.2	172.9	-66.9	0	0	0	0	113.8	Q418 D419 Y420	Q418-S422 PolarHBondContact O-N 3.25Å; Q418-S422 VanDerWaalsContact O-N 3.08Å; D419-S422 PolarHBondContact O-N 3.35Å; Y420-S422 VanDerWaalsContact C-N 3.26Å; Y420-S422 PolarHBondContact O-N 3.09Å
423	L	94.2	Very high	93.2	Very high	18 Å²	18	68 Å²	68	9%	0.094	36%	0.364	C	S	.	.	H	α-helix	trans	-77.7	-21.5	174.8	-67.4	173	0	0	0	113.4	D419 Y420 D425 I426 I427 L435 D439 V443	D419-L423 WeakPolarHBondContact O-CG 3.31Å; D419-L423 PolarHBondContact O-N 3.11Å; Y420-L423 CarbonylContact O-C 2.97Å; Y420-L423 PolarHBondContact O-N 2.92Å; L423-D425 PolarHBondContact O-N 3.14Å; L423-I426 HydrophobicContact CD2-CD1 4.3Å; L423-I426 PolarHBondContact O-N 2.75Å; L423-I427 HydrophobicContact CB-CD1 4.34Å; L423-I427 WeakPolarHBondContact O-CD1 3.37Å; L423-I427 VanDerWaalsContact O-CG1 3.27Å; L423-I427 WeakPolarHBondContact O-CG1 3.31Å; L423-I427 PolarHBondContact O-N 3.21Å; L423-L435 HydrophobicContact CD2-CD2 4.05Å; L423-D439 HydrophobicContact CD1-CB 3.99Å; L423-D439 HydrophobicContact CD2-CB 4.33Å; L423-V443 HydrophobicContact CB-CG2 4.29Å; L423-V443 HydrophobicContact CD1-CG2 3.77Å
424	Q	91.7	Very high	92.9	Very high	77 Å²	77	75.1 Å²	75.1	36%	0.36	40%	0.398	S	S	.	.	H	α-helix	trans	-57.9	-43.4	-178.6	-81.8	-178.5	-20.2	0	0	113.2	Y420 I426 I427 A428	Y420-Q424 HydrophobicContact CD2-CG 4.2Å; Y420-Q424 HydrophobicContact CE1-CG 4.36Å; Y420-Q424 VanDerWaalsContact CE1-NE2 3.31Å; Y420-Q424 HydrophobicContact CE2-CG 3.69Å; Y420-Q424 WeakPolarHBondContact O-CG 3.3Å; Y420-Q424 PolarHBondContact O-N 3.16Å; Y420-Q424 PolarHBondContact OH-NE2 3.1Å; Q424-I426 VanDerWaalsContact C-N 3.32Å; Q424-I426 PolarHBondContact O-N 3.19Å; Q424-I427 PolarHBondContact O-N 3.47Å; Q424-A428 WeakPolarHBondContact O-CB 3.49Å; Q424-A428 PolarHBondContact O-N 3.34Å
425	D	89.9	Confident	92.7	Very high	118 Å²	118	74.3 Å²	74.3	63%	0.631	39%	0.394	S	S	*	.	H	α-helix	trans	-64.3	-37.5	178.5	-71.2	-25	0	0	0	111.9	L423 A428 I429	L423-D425 PolarHBondContact O-N 3.14Å; D425-A428 PolarHBondContact O-N 3.47Å; D425-I429 WeakPolarHBondContact O-CG1 2.97Å; D425-I429 PolarHBondContact O-N 2.87Å
426	I	90.7	Very high	92.5	Very high	74 Å²	74	70.3 Å²	70.3	38%	0.379	38%	0.384	S	S	.	.	H	α-helix	trans	-66.2	-47.4	176.3	-61.9	176.1	0	0	0	109.9	L423 Q424 A428 I429 L430 L435	L423-I426 HydrophobicContact CD2-CD1 4.3Å; L423-I426 PolarHBondContact O-N 2.75Å; Q424-I426 VanDerWaalsContact C-N 3.32Å; Q424-I426 PolarHBondContact O-N 3.19Å; I426-A428 VanDerWaalsContact C-N 3.27Å; I426-A428 PolarHBondContact O-N 3.36Å; I426-I429 PolarHBondContact O-N 3.11Å; I426-L430 HydrophobicContact CG2-CD1 4.08Å; I426-L430 PolarHBondContact O-N 3.33Å; I426-L435 HydrophobicContact CG2-CD2 4Å
427	I	91.3	Very high	92.3	Very high	34 Å²	34	75.9 Å²	75.9	17%	0.174	41%	0.409	C	S	.	.	H	α-helix	trans	-59.9	-38.5	177.4	-65.5	161.5	0	0	0	111.1	L423 Q424 I429 G431 L435 V443	L423-I427 HydrophobicContact CB-CD1 4.34Å; L423-I427 WeakPolarHBondContact O-CD1 3.37Å; L423-I427 VanDerWaalsContact O-CG1 3.27Å; L423-I427 WeakPolarHBondContact O-CG1 3.31Å; L423-I427 PolarHBondContact O-N 3.21Å; Q424-I427 PolarHBondContact O-N 3.47Å; I427-I429 VanDerWaalsContact C-N 3.3Å; I427-I429 PolarHBondContact O-N 2.81Å; I427-G431 VanDerWaalsContact O-CA 3.25Å; I427-G431 WeakPolarHBondContact O-CA 3.33Å; I427-G431 PolarHBondContact O-N 3.25Å; I427-L435 HydrophobicContact CD1-CD1 3.97Å; I427-L435 HydrophobicContact CG1-CD1 3.72Å; I427-L435 HydrophobicContact CG1-CG 4.35Å; I427-V443 HydrophobicContact CD1-CG1 4.19Å; I427-V443 HydrophobicContact CD1-CG2 3.89Å
428	A	92.2	Very high	92.1	Very high	85 Å²	85	82.7 Å²	82.7	70%	0.702	44%	0.441	S	S	*	.	H	α-helix	trans	-68.7	-26.2	-180	0	0	0	0	0	113.7	Q424 D425 I426	Q424-A428 WeakPolarHBondContact O-CB 3.49Å; Q424-A428 PolarHBondContact O-N 3.34Å; D425-A428 PolarHBondContact O-N 3.47Å; I426-A428 VanDerWaalsContact C-N 3.27Å; I426-A428 PolarHBondContact O-N 3.36Å
429	I	92.4	Very high	92.1	Very high	142 Å²	142	81.3 Å²	81.3	73%	0.728	44%	0.436	S	S	*	.	H	α-helix	trans	-98.2	-47.7	-177.8	-63.9	168.6	0	0	0	112	D425 I426 I427	D425-I429 WeakPolarHBondContact O-CG1 2.97Å; D425-I429 PolarHBondContact O-N 2.87Å; I426-I429 PolarHBondContact O-N 3.11Å; I427-I429 VanDerWaalsContact C-N 3.3Å; I427-I429 PolarHBondContact O-N 2.81Å
430	L	91.6	Very high	91.9	Very high	111 Å²	111	80.7 Å²	80.7	58%	0.581	43%	0.43	S	S	*	.	H	α-helix	trans	-100.9	-17.7	-171.6	-62.7	178.9	0	0	0	113.4	I426 E434	I426-L430 HydrophobicContact CG2-CD1 4.08Å; I426-L430 PolarHBondContact O-N 3.33Å; L430-E434 HydrophobicContact CB-CB 4.12Å; L430-E434 HydrophobicContact CB-CG 4.21Å; L430-E434 WeakPolarHBondContact O-CG 3.5Å
431	G	91.2	Very high	91.9	Very high	29 Å²	29	82.8 Å²	82.8	30%	0.299	44%	0.443	S	S	.	.			trans	87.5	173.7	-171.8	0	0	0	0	0	113.2	I427	I427-G431 VanDerWaalsContact O-CA 3.25Å; I427-G431 WeakPolarHBondContact O-CA 3.33Å; I427-G431 PolarHBondContact O-N 3.25Å
432	M	90	Very high	91.9	Very high	64 Å²	64	79.9 Å²	79.9	32%	0.315	43%	0.433	S	S	.	.	S	Bend	trans	-83.4	-20.9	-172.4	-161.8	160.9	-171	0	0	113.4	K440 V443	M432-K440 WeakPolarHBondContact O-CE 3.41Å; M432-V443 HydrophobicContact CE-CB 4.07Å; M432-V443 HydrophobicContact CE-CG1 3.47Å; M432-V443 VanDerWaalsContact CE-CG1 3.47Å
433	D	90	Very high	92	Very high	139 Å²	139	76.4 Å²	76.4	74%	0.743	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-29.3	-176.6	-62.5	-54.8	0	0	0	113.1	L435 K440	D433-L435 PolarHBondContact O-N 2.64Å; D433-K440 WeakPolarHBondContact O-CE 3.34Å; D433-K440 PolarHBondContact O-NZ 3.49Å
434	E	90.1	Very high	92	Very high	149 Å²	149	77 Å²	77	70%	0.696	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-7.2	179.5	-63.3	-63.3	145.5	0	0	113.8	L430	L430-E434 HydrophobicContact CB-CB 4.12Å; L430-E434 HydrophobicContact CB-CG 4.21Å; L430-E434 WeakPolarHBondContact O-CG 3.5Å
435	L	91.5	Very high	92.2	Very high	12 Å²	12	75.8 Å²	75.8	6%	0.063	41%	0.409	C	S	.	.	S	Bend	trans	-72.6	152.7	173.6	-71.5	-175.7	0	0	0	111.8	L423 I426 I427 D433 D439 K440 V443	L423-L435 HydrophobicContact CD2-CD2 4.05Å; I426-L435 HydrophobicContact CG2-CD2 4Å; I427-L435 HydrophobicContact CD1-CD1 3.97Å; I427-L435 HydrophobicContact CG1-CD1 3.72Å; I427-L435 HydrophobicContact CG1-CG 4.35Å; D433-L435 PolarHBondContact O-N 2.64Å; L435-D439 HydrophobicContact CB-CB 4.01Å; L435-D439 HydrophobicContact CD1-CB 4.3Å; L435-D439 HydrophobicContact CD2-CB 4.18Å; L435-D439 HydrophobicContact CG-CB 4.4Å; L435-K440 HydrophobicContact CB-CG 3.83Å; L435-K440 WeakPolarHBondContact O-CE 3.17Å; L435-K440 PolarHBondContact O-NZ 2.87Å; L435-V443 HydrophobicContact CD1-CG2 4Å
436	S	93.4	Very high	92.4	Very high	54 Å²	54	70.2 Å²	70.2	38%	0.378	38%	0.379	S	S	.	.			trans	-66.3	158.6	168.3	80.5	0	0	0	0	110.8	E438 D439 K440	S436-E438 PolarHBondContact O-N 3.17Å; S436-D439 VanDerWaalsContact CB-OD2 3.31Å; S436-D439 WeakPolarHBondContact CB-OD2 3.46Å; S436-D439 PolarHBondContact N-OD2 2.75Å; S436-D439 PolarHBondContact O-N 3.19Å; S436-D439 VanDerWaalsContact O-N 3.15Å; S436-D439 PolarHBondContact OG-N 2.71Å; S436-D439 VanDerWaalsContact OG-N 3.13Å; S436-D439 PolarHBondContact OG-OD2 2.83Å; S436-K440 WeakPolarHBondContact O-CG 3.29Å; S436-K440 PolarHBondContact O-N 2.91Å
437	E	92.3	Very high	92.6	Very high	141 Å²	141	70 Å²	70	66%	0.659	37%	0.373	S	S	*	.	H	α-helix	trans	-63.6	-26.5	178	-61.1	-57.3	122.6	0	0	112.7	K440 L441	E437-K440 WeakPolarHBondContact OE1-CD 3.09Å; E437-K440 IonicContact OE1-NZ 2.87Å; E437-K440 PolarHBondContact OE1-NZ 3.22Å; E437-L441 WeakPolarHBondContact O-CB 3.23Å; E437-L441 PolarHBondContact O-N 2.76Å
438	E	91.7	Very high	92.8	Very high	152 Å²	152	68.9 Å²	68.9	71%	0.71	37%	0.367	S	S	*	.	H	α-helix	trans	-73.1	-39.9	173.4	-173	171.5	-174.8	0	0	111.8	S436 L441 T442	S436-E438 PolarHBondContact O-N 3.17Å; E438-L441 PolarHBondContact O-N 3.18Å; E438-T442 WeakPolarHBondContact O-CB 3.45Å; E438-T442 PolarHBondContact O-N 2.93Å; E438-T442 PolarHBondContact O-OG1 3.26Å
439	D	93.7	Very high	93	Very high	55 Å²	55	64.9 Å²	64.9	29%	0.294	33%	0.334	S	S	.	.	H	α-helix	trans	-66.4	-42.7	173.2	-63.4	-52.5	0	0	0	111.1	L423 L435 S436 L441 T442 V443	L423-D439 HydrophobicContact CD1-CB 3.99Å; L423-D439 HydrophobicContact CD2-CB 4.33Å; L435-D439 HydrophobicContact CB-CB 4.01Å; L435-D439 HydrophobicContact CD1-CB 4.3Å; L435-D439 HydrophobicContact CD2-CB 4.18Å; L435-D439 HydrophobicContact CG-CB 4.4Å; S436-D439 VanDerWaalsContact CB-OD2 3.31Å; S436-D439 WeakPolarHBondContact CB-OD2 3.46Å; S436-D439 PolarHBondContact N-OD2 2.75Å; S436-D439 PolarHBondContact O-N 3.19Å; S436-D439 VanDerWaalsContact O-N 3.15Å; S436-D439 PolarHBondContact OG-N 2.71Å; S436-D439 VanDerWaalsContact OG-N 3.13Å; S436-D439 PolarHBondContact OG-OD2 2.83Å; D439-L441 VanDerWaalsContact C-N 3.33Å; D439-L441 PolarHBondContact O-N 2.97Å; D439-T442 WeakPolarHBondContact O-CB 3.39Å; D439-T442 PolarHBondContact O-N 2.65Å; D439-T442 VanDerWaalsContact O-N 3.15Å; D439-V443 VanDerWaalsContact O-CG2 3.27Å; D439-V443 WeakPolarHBondContact O-CG2 3.48Å; D439-V443 PolarHBondContact O-N 3.22Å
440	K	92.8	Very high	93.2	Very high	49 Å²	49	59.6 Å²	59.6	21%	0.213	31%	0.306	C	S	.	.	H	α-helix	trans	-58.4	-44.4	174.7	-72.3	172	-173.9	161.9	0	111.4	M432 D433 L435 S436 E437 V443 A444	M432-K440 WeakPolarHBondContact O-CE 3.41Å; D433-K440 WeakPolarHBondContact O-CE 3.34Å; D433-K440 PolarHBondContact O-NZ 3.49Å; L435-K440 HydrophobicContact CB-CG 3.83Å; L435-K440 WeakPolarHBondContact O-CE 3.17Å; L435-K440 PolarHBondContact O-NZ 2.87Å; S436-K440 WeakPolarHBondContact O-CG 3.29Å; S436-K440 PolarHBondContact O-N 2.91Å; E437-K440 WeakPolarHBondContact OE1-CD 3.09Å; E437-K440 IonicContact OE1-NZ 2.87Å; E437-K440 PolarHBondContact OE1-NZ 3.22Å; K440-V443 PolarHBondContact O-N 2.9Å; K440-A444 WeakPolarHBondContact O-CB 3.36Å; K440-A444 PolarHBondContact O-N 2.98Å
441	L	93.2	Very high	93.3	Very high	71 Å²	71	57.1 Å²	57.1	37%	0.372	29%	0.289	S	S	.	.	H	α-helix	trans	-62.3	-43.4	174.6	-177.5	63.4	0	0	0	111.6	E437 E438 D439 A444 R445	E437-L441 WeakPolarHBondContact O-CB 3.23Å; E437-L441 PolarHBondContact O-N 2.76Å; E438-L441 PolarHBondContact O-N 3.18Å; D439-L441 VanDerWaalsContact C-N 3.33Å; D439-L441 PolarHBondContact O-N 2.97Å; L441-A444 PolarHBondContact O-N 3.12Å; L441-R445 WeakPolarHBondContact O-CG 3.48Å; L441-R445 PolarHBondContact O-N 2.69Å
442	T	93.9	Very high	93.6	Very high	30 Å²	30	55.7 Å²	55.7	18%	0.184	27%	0.274	C	S	.	.	H	α-helix	trans	-61	-45.3	177.3	-60	0	0	0	0	111.3	I416 D419 E438 D439 R445 A446	I416-T442 HydrophobicContact CG2-CG2 4.38Å; D419-T442 HydrophobicContact CB-CG2 4.21Å; E438-T442 WeakPolarHBondContact O-CB 3.45Å; E438-T442 PolarHBondContact O-N 2.93Å; E438-T442 PolarHBondContact O-OG1 3.26Å; D439-T442 WeakPolarHBondContact O-CB 3.39Å; D439-T442 PolarHBondContact O-N 2.65Å; D439-T442 VanDerWaalsContact O-N 3.15Å; T442-R445 PolarHBondContact O-N 3.05Å; T442-A446 VanDerWaalsContact O-CB 3.24Å; T442-A446 WeakPolarHBondContact O-CB 3.17Å; T442-A446 PolarHBondContact O-N 3.02Å
443	V	94.8	Very high	93.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.6	-42.9	176.3	177.6	0	0	0	0	111.5	Y420 L423 I427 M432 L435 D439 K440 A446 R447	Y420-V443 HydrophobicContact CD2-CB 4.33Å; Y420-V443 HydrophobicContact CD2-CG1 3.92Å; Y420-V443 HydrophobicContact CD2-CG2 4.06Å; Y420-V443 HydrophobicContact CE2-CG1 3.74Å; L423-V443 HydrophobicContact CB-CG2 4.29Å; L423-V443 HydrophobicContact CD1-CG2 3.77Å; I427-V443 HydrophobicContact CD1-CG1 4.19Å; I427-V443 HydrophobicContact CD1-CG2 3.89Å; M432-V443 HydrophobicContact CE-CB 4.07Å; M432-V443 HydrophobicContact CE-CG1 3.47Å; M432-V443 VanDerWaalsContact CE-CG1 3.47Å; L435-V443 HydrophobicContact CD1-CG2 4Å; D439-V443 VanDerWaalsContact O-CG2 3.27Å; D439-V443 WeakPolarHBondContact O-CG2 3.48Å; D439-V443 PolarHBondContact O-N 3.22Å; K440-V443 PolarHBondContact O-N 2.9Å; V443-A446 PolarHBondContact O-N 2.87Å; V443-R447 WeakPolarHBondContact O-CG 3.49Å; V443-R447 PolarHBondContact O-N 3.1Å
444	A	94	Very high	94.2	Very high	32 Å²	32	46.5 Å²	46.5	26%	0.264	23%	0.226	S	C	.	.	H	α-helix	trans	-61.8	-44.7	177.9	0	0	0	0	0	111.7	K440 L441 K448	K440-A444 WeakPolarHBondContact O-CB 3.36Å; K440-A444 PolarHBondContact O-N 2.98Å; L441-A444 PolarHBondContact O-N 3.12Å; A444-K448 WeakPolarHBondContact O-CG 3.49Å; A444-K448 PolarHBondContact O-N 2.78Å
445	R	95.1	Very high	94.4	Very high	51 Å²	51	39.4 Å²	39.4	19%	0.192	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-43.7	173.6	-72.5	-177.2	-178.1	175.1	5.4	111.9	L441 T442 R447 K448 I449 L484 D489	L441-R445 WeakPolarHBondContact O-CG 3.48Å; L441-R445 PolarHBondContact O-N 2.69Å; T442-R445 PolarHBondContact O-N 3.05Å; R445-R447 PolarHBondContact O-N 3.1Å; R445-K448 WeakPolarHBondContact O-CB 3.46Å; R445-K448 PolarHBondContact O-N 2.97Å; R445-I449 WeakPolarHBondContact O-CB 3.37Å; R445-I449 VanDerWaalsContact O-CG1 3.29Å; R445-I449 WeakPolarHBondContact O-CG1 3.42Å; R445-I449 PolarHBondContact O-N 3.04Å; R445-L484 PolarHBondContact NH1-O 2.76Å; R445-D489 VanDerWaalsContact CG-OD1 3.27Å; R445-D489 WeakPolarHBondContact CG-OD1 3.44Å; R445-D489 IonicContact CZ-OD1 3.64Å; R445-D489 IonicContact CZ-OD2 2.67Å; R445-D489 VanDerWaalsContact CZ-OD2 3.27Å; R445-D489 IonicContact NE-OD1 2.75Å; R445-D489 PolarHBondContact NE-OD1 3.41Å; R445-D489 IonicContact NE-OD2 2.74Å; R445-D489 PolarHBondContact NE-OD2 2.9Å; R445-D489 VanDerWaalsContact NE-OD2 3.07Å; R445-D489 IonicContact NH2-OD1 2.63Å; R445-D489 IonicContact NH2-OD2 2.62Å; R445-D489 PolarHBondContact NH2-OD2 3.48Å
446	A	95.6	Very high	94.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.2	-44	178.7	0	0	0	0	0	112.3	I416 Y420 T442 V443 I449 Q450	I416-A446 HydrophobicContact CG2-CB 3.7Å; Y420-A446 HydrophobicContact CD1-CB 3.78Å; Y420-A446 HydrophobicContact CD2-CB 4.26Å; Y420-A446 HydrophobicContact CG-CB 3.53Å; T442-A446 VanDerWaalsContact O-CB 3.24Å; T442-A446 WeakPolarHBondContact O-CB 3.17Å; T442-A446 PolarHBondContact O-N 3.02Å; V443-A446 PolarHBondContact O-N 2.87Å; A446-I449 PolarHBondContact O-N 2.77Å; A446-Q450 WeakPolarHBondContact O-CB 3.27Å; A446-Q450 PolarHBondContact O-N 2.94Å
447	R	94.6	Very high	94.5	Very high	71 Å²	71	37.1 Å²	37.1	27%	0.268	18%	0.177	S	C	.	.	H	α-helix	trans	-62.9	-42.4	175	-72.5	179.8	177.9	-179	2.2	112.4	V443 R445 Q450 R451 E493	V443-R447 WeakPolarHBondContact O-CG 3.49Å; V443-R447 PolarHBondContact O-N 3.1Å; R445-R447 PolarHBondContact O-N 3.1Å; R447-Q450 PolarHBondContact O-N 3.41Å; R447-R451 WeakPolarHBondContact O-CG 3.21Å; R447-R451 PolarHBondContact O-N 2.71Å; R447-E493 HydrophobicContact CB-CG 4.4Å; R447-E493 WeakPolarHBondContact CD-OE1 3.39Å; R447-E493 WeakPolarHBondContact CD-OE2 3.5Å; R447-E493 IonicContact NH1-OE1 3.2Å; R447-E493 PolarHBondContact NH1-OE1 3.42Å
448	K	95.6	Very high	94.4	Very high	10 Å²	10	33.9 Å²	33.9	4%	0.043	16%	0.162	C	C	.	.	H	α-helix	trans	-60.5	-46.6	174.3	-71	172.3	175.9	-170.6	0	111.8	A444 R445 R451 F452 Y488 D489 L491 E493 F496	A444-K448 WeakPolarHBondContact O-CG 3.49Å; A444-K448 PolarHBondContact O-N 2.78Å; R445-K448 WeakPolarHBondContact O-CB 3.46Å; R445-K448 PolarHBondContact O-N 2.97Å; K448-R451 PolarHBondContact O-N 3.26Å; K448-F452 VanDerWaalsContact O-CB 3.28Å; K448-F452 WeakPolarHBondContact O-CB 3.42Å; K448-F452 PolarHBondContact O-N 3.46Å; K448-Y488 PolarHBondContact NZ-O 3.18Å; K448-D489 PolarHBondContact NZ-O 3.23Å; K448-L491 WeakPolarHBondContact CE-O 3.25Å; K448-L491 PolarHBondContact NZ-O 3.4Å; K448-E493 HydrophobicContact CG-CG 4.3Å; K448-F496 HydrophobicContact CB-CD1 4.49Å; K448-F496 HydrophobicContact CB-CD2 4.02Å; K448-F496 HydrophobicContact CB-CE2 4.08Å; K448-F496 HydrophobicContact CB-CG 4.22Å; K448-F496 HydrophobicContact CB-CZ 4.32Å; K448-F496 HydrophobicContact CD-CD2 4.29Å; K448-F496 HydrophobicContact CD-CE2 3.67Å; K448-F496 HydrophobicContact CD-CZ 4.06Å; K448-F496 HydrophobicContact CG-CD2 3.78Å; K448-F496 HydrophobicContact CG-CE2 3.7Å; K448-F496 HydrophobicContact CG-CG 4.47Å; K448-F496 HydrophobicContact CG-CZ 4.31Å
449	I	96.1	Very high	94	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.8	-49	174.6	-69.9	172.7	0	0	0	110.3	V413 I416 L417 R445 A446 R451 F452 L453 F480 I483 L484	V413-I449 HydrophobicContact CG1-CG2 3.76Å; V413-I449 HydrophobicContact CG2-CG2 4.44Å; I416-I449 HydrophobicContact CB-CD1 4.33Å; I416-I449 HydrophobicContact CD1-CD1 4.31Å; I416-I449 HydrophobicContact CG2-CD1 4.01Å; L417-I449 HydrophobicContact CD1-CG2 3.94Å; L417-I449 HydrophobicContact CD2-CG2 4.05Å; L417-I449 HydrophobicContact CG-CG2 4.07Å; R445-I449 WeakPolarHBondContact O-CB 3.37Å; R445-I449 VanDerWaalsContact O-CG1 3.29Å; R445-I449 WeakPolarHBondContact O-CG1 3.42Å; R445-I449 PolarHBondContact O-N 3.04Å; A446-I449 PolarHBondContact O-N 2.77Å; I449-R451 VanDerWaalsContact C-N 3.31Å; I449-R451 PolarHBondContact O-N 3.37Å; I449-F452 PolarHBondContact O-N 2.92Å; I449-F452 VanDerWaalsContact O-N 3.12Å; I449-L453 HydrophobicContact CG2-CD1 4.44Å; I449-L453 WeakPolarHBondContact O-CG 3.42Å; I449-L453 PolarHBondContact O-N 3.33Å; I449-F480 HydrophobicContact CG2-CD1 4.34Å; I449-F480 HydrophobicContact CG2-CE1 4.01Å; I449-I483 HydrophobicContact CD1-CG2 4.23Å; I449-I483 HydrophobicContact CG1-CG2 3.6Å; I449-L484 HydrophobicContact CD1-CD2 3.97Å
450	Q	95	Very high	93.7	Very high	32 Å²	32	25.2 Å²	25.2	15%	0.15	12%	0.122	C	C	.	.	H	α-helix	trans	-59.7	-41	-179.8	-157.8	-164.2	18.6	0	0	111.8	I383 L417 A446 R447	I383-Q450 HydrophobicContact CD1-CG 3.74Å; L417-Q450 HydrophobicContact CD2-CB 4.35Å; A446-Q450 WeakPolarHBondContact O-CB 3.27Å; A446-Q450 PolarHBondContact O-N 2.94Å; R447-Q450 PolarHBondContact O-N 3.41Å
451	R	95.4	Very high	93.4	Very high	58 Å²	58	25.8 Å²	25.8	22%	0.219	13%	0.126	C	C	.	.	H	α-helix	trans	-69.9	-41.1	173.4	-66.1	-67	171.5	-166.3	-5.9	111.9	L381 I383 R447 K448 I449 L453 S454 F496	L381-R451 PolarHBondContact O-NH1 2.8Å; L381-R451 PolarHBondContact O-NH2 2.91Å; I383-R451 VanDerWaalsContact CG1-NH1 3.35Å; R447-R451 WeakPolarHBondContact O-CG 3.21Å; R447-R451 PolarHBondContact O-N 2.71Å; K448-R451 PolarHBondContact O-N 3.26Å; I449-R451 VanDerWaalsContact C-N 3.31Å; I449-R451 PolarHBondContact O-N 3.37Å; R451-L453 PolarHBondContact O-N 2.86Å; R451-S454 VanDerWaalsContact O-CB 3.25Å; R451-S454 WeakPolarHBondContact O-CB 3.37Å; R451-S454 PolarHBondContact O-N 3.44Å; R451-S454 PolarHBondContact O-OG 3.37Å; R451-F496 CarbonylContact C-O 3.55Å; R451-F496 HydrophobicContact CB-CB 4.01Å
452	F	96.9	Very high	92.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.6	-21.6	179.3	-165.8	-125.4	0	0	0	113.5	K177 K448 I449 S454 F480 I483 F496 V499 I502 V505	K177-F452 HydrophobicContact CD-CE1 4.33Å; K177-F452 HydrophobicContact CD-CZ 4.13Å; K177-F452 WeakPolarHBondContact CE-O 3.46Å; K177-F452 PolarHBondContact NZ-O 2.7Å; K448-F452 VanDerWaalsContact O-CB 3.28Å; K448-F452 WeakPolarHBondContact O-CB 3.42Å; K448-F452 PolarHBondContact O-N 3.46Å; I449-F452 PolarHBondContact O-N 2.92Å; I449-F452 VanDerWaalsContact O-N 3.12Å; F452-S454 PolarHBondContact O-N 2.85Å; F452-F480 HydrophobicContact CB-CE1 4.4Å; F452-F480 HydrophobicContact CB-CZ 4.37Å; F452-F480 HydrophobicContact CD1-CD1 4.08Å; F452-F480 HydrophobicContact CD1-CD2 4.01Å; F452-F480 AromaticContact CD1-CE1 3.67Å; F452-F480 HydrophobicContact CD1-CE1 3.67Å; F452-F480 AromaticContact CD1-CE2 3.58Å; F452-F480 HydrophobicContact CD1-CE2 3.58Å; F452-F480 HydrophobicContact CD1-CG 4.25Å; F452-F480 AromaticContact CD1-CZ 3.39Å; F452-F480 HydrophobicContact CD1-CZ 3.39Å; F452-F480 AromaticContact CE1-CD2 3.89Å; F452-F480 HydrophobicContact CE1-CD2 3.89Å; F452-F480 HydrophobicContact CE1-CE1 4.5Å; F452-F480 AromaticContact CE1-CE2 3.69Å; F452-F480 HydrophobicContact CE1-CE2 3.69Å; F452-F480 HydrophobicContact CE1-CG 4.38Å; F452-F480 HydrophobicContact CE1-CZ 4.02Å; F452-F480 HydrophobicContact CG-CZ 4.22Å; F452-I483 HydrophobicContact CB-CD1 4.17Å; F452-I483 HydrophobicContact CD1-CD1 3.42Å; F452-I483 VanDerWaalsContact CD1-CD1 3.42Å; F452-I483 HydrophobicContact CE1-CD1 3.96Å; F452-I483 HydrophobicContact CG-CD1 3.86Å; F452-F496 WeakPolarHBondContact CA-O 3.48Å; F452-F496 HydrophobicContact CB-CB 4.16Å; F452-F496 HydrophobicContact CB-CD1 3.96Å; F452-F496 HydrophobicContact CD2-CD1 4.05Å; F452-F496 HydrophobicContact CG-CD1 4.11Å; F452-F496 PolarHBondContact N-O 2.95Å; F452-V499 HydrophobicContact CD2-CG2 3.89Å; F452-V499 HydrophobicContact CE2-CG2 4Å; F452-I502 HydrophobicContact CE1-CD1 4.4Å; F452-I502 HydrophobicContact CE2-CD1 4.26Å; F452-I502 HydrophobicContact CZ-CB 4.21Å; F452-I502 HydrophobicContact CZ-CD1 4.04Å; F452-V505 HydrophobicContact CD2-CG2 4.02Å; F452-V505 HydrophobicContact CE2-CG2 3.84Å
453	L	96.1	Very high	91.9	Very high	9 Å²	9	32.5 Å²	32.5	5%	0.047	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-18.9	169.2	-70.4	166.8	0	0	0	112.9	V178 L182 P389 L417 I449 R451 F480	V178-L453 HydrophobicContact CB-CB 4.41Å; V178-L453 HydrophobicContact CB-CD2 3.77Å; V178-L453 HydrophobicContact CG2-CD2 3.93Å; L182-L453 HydrophobicContact CD1-CD2 4.19Å; P389-L453 HydrophobicContact CB-CD1 4Å; P389-L453 HydrophobicContact CG-CD1 4.25Å; L417-L453 HydrophobicContact CD1-CD1 4.12Å; I449-L453 HydrophobicContact CG2-CD1 4.44Å; I449-L453 WeakPolarHBondContact O-CG 3.42Å; I449-L453 PolarHBondContact O-N 3.33Å; R451-L453 PolarHBondContact O-N 2.86Å; L453-F480 HydrophobicContact CD2-CE1 3.89Å; L453-F480 HydrophobicContact CD2-CE2 4.38Å; L453-F480 HydrophobicContact CD2-CZ 3.49Å; L453-F480 VanDerWaalsContact CD2-CZ 3.49Å; L453-F480 HydrophobicContact CG-CE1 4.06Å; L453-F480 HydrophobicContact CG-CZ 3.91Å
454	S	95.6	Very high	91.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.175	C	C	.	.			trans	-69.4	151.8	171.6	72.1	0	0	0	0	112.5	K177 Y384 R451 F452 M498	K177-S454 PolarHBondContact NZ-O 2.61Å; Y384-S454 CarbonylContact O-C 3.58Å; Y384-S454 WeakPolarHBondContact O-CA 3.49Å; Y384-S454 WeakPolarHBondContact O-CB 3.4Å; R451-S454 VanDerWaalsContact O-CB 3.25Å; R451-S454 WeakPolarHBondContact O-CB 3.37Å; R451-S454 PolarHBondContact O-N 3.44Å; R451-S454 PolarHBondContact O-OG 3.37Å; F452-S454 PolarHBondContact O-N 2.85Å; S454-M498 PolarHBondContact OG-N 2.83Å
455	Q	95.4	Very high	90.9	Very high	1 Å²	1	37 Å²	37	1%	0.005	20%	0.196	C	C	.	.			trans	-153.7	129.9	-177.5	-175.1	169.5	-31.1	0	0	110.5	G175 Y384 F457 K469	G175-Q455 PolarHBondContact O-NE2 2.84Å; Y384-Q455 PolarHBondContact O-N 3.34Å; Q455-F457 HydrophobicContact CB-CD1 4.47Å; Q455-F457 HydrophobicContact CB-CE1 4.29Å; Q455-F457 HydrophobicContact CG-CD1 4.35Å; Q455-F457 HydrophobicContact CG-CE1 4.4Å; Q455-F457 PolarHBondContact O-N 2.93Å; Q455-K469 PolarHBondContact NE2-O 3.05Å
456	P	94.3	Very high	90.5	Very high	6 Å²	6	38.8 Å²	38.8	4%	0.039	21%	0.207	C	C	.	.			trans	-70.1	121.3	171	30.2	-33.2	0	0	0	108.9	H466 G468 K469 M498	P456-H466 HydrophobicContact CB-CB 3.93Å; P456-G468 WeakPolarHBondContact O-CA 3.46Å; P456-K469 HydrophobicContact CG-CB 4.21Å; P456-K469 HydrophobicContact CG-CG 3.73Å; P456-K469 PolarHBondContact O-N 2.9Å; P456-M498 HydrophobicContact CB-SD 4.41Å
457	F	93.2	Very high	90.3	Very high	12 Å²	12	44.8 Å²	44.8	5%	0.053	24%	0.238	C	C	.	.			trans	-87.6	142.7	177.5	-75	-6.5	0	0	0	111	I176 V203 L204 E207 P385 Q455 V459 A460 E461	I176-F457 HydrophobicContact CD1-CE1 4.1Å; I176-F457 HydrophobicContact CD1-CZ 3.85Å; I176-F457 HydrophobicContact CG1-CE1 4.03Å; I176-F457 HydrophobicContact CG1-CZ 4.27Å; I176-F457 HydrophobicContact CG2-CE1 4.04Å; I176-F457 HydrophobicContact CG2-CZ 4.09Å; V203-F457 HydrophobicContact CG1-CD2 4.18Å; L204-F457 HydrophobicContact CB-CE2 4.41Å; L204-F457 HydrophobicContact CD1-CE2 3.8Å; L204-F457 HydrophobicContact CD1-CZ 3.7Å; E207-F457 HydrophobicContact CB-CB 4.34Å; E207-F457 HydrophobicContact CB-CD1 4.47Å; E207-F457 HydrophobicContact CB-CD2 3.7Å; E207-F457 HydrophobicContact CB-CE2 3.99Å; E207-F457 HydrophobicContact CB-CG 3.96Å; E207-F457 HydrophobicContact CB-CZ 4.46Å; E207-F457 HydrophobicContact CG-CB 3.96Å; E207-F457 HydrophobicContact CG-CD1 3.71Å; E207-F457 HydrophobicContact CG-CD2 3.86Å; E207-F457 HydrophobicContact CG-CE1 4.05Å; E207-F457 HydrophobicContact CG-CE2 4.2Å; E207-F457 HydrophobicContact CG-CG 3.59Å; E207-F457 HydrophobicContact CG-CZ 4.26Å; E207-F457 VanDerWaalsContact OE1-CA 3.32Å; E207-F457 WeakPolarHBondContact OE1-CA 3.32Å; P385-F457 HydrophobicContact CB-CE2 3.92Å; P385-F457 HydrophobicContact CB-CZ 3.6Å; P385-F457 HydrophobicContact CG-CE1 4.11Å; P385-F457 HydrophobicContact CG-CE2 4.37Å; P385-F457 HydrophobicContact CG-CZ 3.56Å; Q455-F457 HydrophobicContact CB-CD1 4.47Å; Q455-F457 HydrophobicContact CB-CE1 4.29Å; Q455-F457 HydrophobicContact CG-CD1 4.35Å; Q455-F457 HydrophobicContact CG-CE1 4.4Å; Q455-F457 PolarHBondContact O-N 2.93Å; F457-V459 HydrophobicContact CB-CG2 4.4Å; F457-V459 PolarHBondContact O-N 3.28Å; F457-A460 HydrophobicContact CB-CB 3.96Å; F457-A460 WeakPolarHBondContact O-CA 3.39Å; F457-A460 WeakPolarHBondContact O-CB 3.36Å; F457-A460 PolarHBondContact O-N 2.88Å; F457-E461 PolarHBondContact O-N 3.18Å
458	Q	88.9	Confident	90.1	Very high	73 Å²	73	42.3 Å²	42.3	34%	0.341	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-65.9	-39.5	180	-178.6	157.2	47.7	0	0	112	E207 N210 K214 A460 E461	E207-Q458 VanDerWaalsContact CD-N 3.32Å; E207-Q458 PolarHBondContact OE1-N 3.31Å; E207-Q458 PolarHBondContact OE2-N 3.42Å; N210-Q458 PolarHBondContact ND2-OE1 3.3Å; K214-Q458 VanDerWaalsContact NZ-CD 3.34Å; Q458-A460 PolarHBondContact O-N 3.43Å; Q458-E461 WeakPolarHBondContact O-CB 3.4Å; Q458-E461 WeakPolarHBondContact O-CG 3.38Å; Q458-E461 PolarHBondContact O-N 2.93Å
459	V	84.9	Confident	89.9	Confident	12 Å²	12	45 Å²	45	7%	0.073	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-66.9	-14.2	174.3	-56.6	0	0	0	0	113	V203 M206 E207 N210 F457	V203-V459 HydrophobicContact CG1-CG2 3.85Å; M206-V459 HydrophobicContact CB-CB 4.21Å; M206-V459 HydrophobicContact CB-CG1 4.05Å; M206-V459 HydrophobicContact CB-CG2 3.97Å; E207-V459 HydrophobicContact CB-CG2 3.99Å; E207-V459 WeakPolarHBondContact OE2-CG2 3.1Å; E207-V459 PolarHBondContact OE2-N 3.45Å; N210-V459 HydrophobicContact CB-CG1 3.97Å; F457-V459 HydrophobicContact CB-CG2 4.4Å; F457-V459 PolarHBondContact O-N 3.28Å
460	A	86.3	Confident	89.7	Confident	12 Å²	12	48.9 Å²	48.9	10%	0.099	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-98.9	2.4	178.3	0	0	0	0	0	113.9	V203 F457 Q458 V462 F463 T464	V203-A460 HydrophobicContact CG1-CB 4.2Å; F457-A460 HydrophobicContact CB-CB 3.96Å; F457-A460 WeakPolarHBondContact O-CA 3.39Å; F457-A460 WeakPolarHBondContact O-CB 3.36Å; F457-A460 PolarHBondContact O-N 2.88Å; Q458-A460 PolarHBondContact O-N 3.43Å; A460-V462 VanDerWaalsContact C-N 3.25Å; A460-V462 PolarHBondContact O-N 3.48Å; A460-F463 PolarHBondContact O-N 3.48Å; A460-F463 VanDerWaalsContact O-N 3.16Å; A460-T464 HydrophobicContact CB-CG2 4.22Å; A460-T464 WeakPolarHBondContact O-CB 3.4Å; A460-T464 WeakPolarHBondContact O-CG2 3.04Å; A460-T464 PolarHBondContact O-N 3.43Å; A460-T464 PolarHBondContact O-OG1 2.93Å
461	E	86.3	Confident	89.7	Confident	62 Å²	62	47.3 Å²	47.3	29%	0.29	26%	0.26	S	S	.	.	H	α-helix	trans	-54.5	-41.9	177.7	-79	176.8	-169.4	0	0	111.8	F457 Q458 F463 G465 H466 G468	F457-E461 PolarHBondContact O-N 3.18Å; Q458-E461 WeakPolarHBondContact O-CB 3.4Å; Q458-E461 WeakPolarHBondContact O-CG 3.38Å; Q458-E461 PolarHBondContact O-N 2.93Å; E461-F463 VanDerWaalsContact C-N 3.29Å; E461-F463 PolarHBondContact O-N 2.91Å; E461-G465 WeakPolarHBondContact O-CA 3.19Å; E461-G465 PolarHBondContact O-N 3.01Å; E461-H466 WeakPolarHBondContact CG-O 3.47Å; E461-G468 PolarHBondContact OE1-N 3.36Å
462	V	77.9	Confident	89.7	Confident	111 Å²	111	47.2 Å²	47.2	67%	0.673	27%	0.266	S	S	*	.	H	α-helix	trans	-62.7	-33.8	-178.6	-173.8	0	0	0	0	112.5	A460	A460-V462 VanDerWaalsContact C-N 3.25Å; A460-V462 PolarHBondContact O-N 3.48Å
463	F	78.8	Confident	89.5	Confident	131 Å²	131	48.7 Å²	48.7	58%	0.575	27%	0.274	S	S	*	.	H	α-helix	trans	-94.3	-29.7	-176.6	-51.7	-65.4	0	0	0	113.3	A460 E461	A460-F463 PolarHBondContact O-N 3.48Å; A460-F463 VanDerWaalsContact O-N 3.16Å; E461-F463 VanDerWaalsContact C-N 3.29Å; E461-F463 PolarHBondContact O-N 2.91Å
464	T	83.1	Confident	89.5	Confident	56 Å²	56	57 Å²	57	34%	0.344	31%	0.31	S	S	.	.	H	α-helix	trans	-104.8	-22.5	-172.3	63.3	0	0	0	0	114	A460 H466	A460-T464 HydrophobicContact CB-CG2 4.22Å; A460-T464 WeakPolarHBondContact O-CB 3.4Å; A460-T464 WeakPolarHBondContact O-CG2 3.04Å; A460-T464 PolarHBondContact O-N 3.43Å; A460-T464 PolarHBondContact O-OG1 2.93Å; T464-H466 PolarHBondContact O-N 3.13Å; T464-H466 VanDerWaalsContact O-N 3.16Å; T464-H466 PolarHBondContact OG1-N 2.86Å
465	G	84.2	Confident	89.5	Confident	69 Å²	69	60.5 Å²	60.5	71%	0.711	33%	0.326	S	S	*	.			trans	67.9	1.1	-171.5	0	0	0	0	0	114.6	E461	E461-G465 WeakPolarHBondContact O-CA 3.19Å; E461-G465 PolarHBondContact O-N 3.01Å
466	H	86.9	Confident	89.5	Confident	89 Å²	89	60.4 Å²	60.4	41%	0.412	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-92.6	127.1	175.5	-65.4	-44	0	0	0	110.1	P456 E461 T464 G468	P456-H466 HydrophobicContact CB-CB 3.93Å; E461-H466 WeakPolarHBondContact CG-O 3.47Å; T464-H466 PolarHBondContact O-N 3.13Å; T464-H466 VanDerWaalsContact O-N 3.16Å; T464-H466 PolarHBondContact OG1-N 2.86Å; H466-G468 PolarHBondContact O-N 2.96Å
467	L	90.4	Very high	89.6	Confident	127 Å²	127	61.1 Å²	61.1	67%	0.665	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-59.6	130.9	175.4	-66.8	175.6	0	0	0	111
468	G	90.9	Very high	89.8	Confident	19 Å²	19	65.4 Å²	65.4	20%	0.196	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-63.5	146.8	179.7	0	0	0	0	0	112.4	P456 E461 H466	P456-G468 WeakPolarHBondContact O-CA 3.46Å; E461-G468 PolarHBondContact OE1-N 3.36Å; H466-G468 PolarHBondContact O-N 2.96Å
469	K	91.9	Very high	90.1	Very high	65 Å²	65	61.9 Å²	61.9	28%	0.283	33%	0.331	S	S	.	.			trans	-128.5	121.8	-179.3	-61	-68.9	176.6	165.9	0	109.6	Q455 P456 V471 E504	Q455-K469 PolarHBondContact NE2-O 3.05Å; P456-K469 HydrophobicContact CG-CB 4.21Å; P456-K469 HydrophobicContact CG-CG 3.73Å; P456-K469 PolarHBondContact O-N 2.9Å; K469-V471 HydrophobicContact CB-CG2 4.48Å; K469-E504 VanDerWaalsContact CE-OE1 3.25Å; K469-E504 WeakPolarHBondContact CE-OE1 3.48Å; K469-E504 IonicContact NZ-OE1 2.64Å; K469-E504 PolarHBondContact NZ-OE1 2.89Å; K469-E504 IonicContact NZ-OE2 3.76Å
470	L	91.9	Very high	90.6	Very high	82 Å²	82	61.3 Å²	61.3	43%	0.429	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-95.8	116.4	167.1	-171.8	157.1	0	0	0	107.3	N211	N211-L470 HydrophobicContact CB-CD1 4.07Å
471	V	94.2	Very high	91.1	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-103.8	119.2	-172.7	-173.5	0	0	0	0	110.2	G175 K177 K469 E475	G175-V471 WeakPolarHBondContact CA-O 3.48Å; G175-V471 PolarHBondContact O-N 2.79Å; G175-V471 VanDerWaalsContact O-N 3.09Å; K177-V471 HydrophobicContact CD-CB 4.39Å; K177-V471 HydrophobicContact CD-CG1 4.12Å; K177-V471 HydrophobicContact CD-CG2 4.15Å; K177-V471 HydrophobicContact CG-CB 3.88Å; K177-V471 HydrophobicContact CG-CG1 3.96Å; K177-V471 HydrophobicContact CG-CG2 3.96Å; K469-V471 HydrophobicContact CB-CG2 4.48Å; V471-E475 HydrophobicContact CG1-CB 4.23Å
472	P	94.6	Very high	91.5	Very high	55 Å²	55	63.3 Å²	63.3	36%	0.357	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-62.3	140.6	175.7	-22	33	0	0	0	112.6	K474 E475 T476	P472-K474 PolarHBondContact O-N 2.97Å; P472-K474 VanDerWaalsContact O-N 3.07Å; P472-E475 HydrophobicContact CB-CG 4.45Å; P472-E475 WeakPolarHBondContact CD-OE2 3.39Å; P472-E475 PolarHBondContact O-N 3.01Å; P472-T476 PolarHBondContact O-N 2.79Å; P472-T476 VanDerWaalsContact O-N 3.07Å; P472-T476 PolarHBondContact O-OG1 3.21Å
473	L	94.1	Very high	92.3	Very high	32 Å²	32	58.2 Å²	58.2	17%	0.168	30%	0.304	C	S	.	.	H	α-helix	trans	-48.7	-40.4	179.4	175.7	62.1	0	0	0	113.8	I171 V173 D180 E475 T476 I477	I171-L473 HydrophobicContact CD1-CD2 4.34Å; V173-L473 HydrophobicContact CG1-CB 4.32Å; V173-L473 HydrophobicContact CG2-CB 4.48Å; V173-L473 HydrophobicContact CG2-CD2 4.35Å; D180-L473 HydrophobicContact CB-CD1 4.12Å; L473-E475 VanDerWaalsContact C-N 3.33Å; L473-E475 PolarHBondContact O-N 3.47Å; L473-T476 WeakPolarHBondContact O-CB 3.21Å; L473-T476 PolarHBondContact O-N 3.37Å; L473-I477 HydrophobicContact CD1-CD1 3.87Å; L473-I477 HydrophobicContact CD1-CG1 4.09Å; L473-I477 HydrophobicContact CG-CD1 3.88Å; L473-I477 WeakPolarHBondContact O-CG1 3.47Å; L473-I477 PolarHBondContact O-N 3.08Å
474	K	95.4	Very high	93	Very high	182 Å²	182	53.8 Å²	53.8	79%	0.791	29%	0.286	S	S	*	.	H	α-helix	trans	-63.4	-36.8	178.3	-66.6	-176.5	179	179.4	0	113.1	P472 K478	P472-K474 PolarHBondContact O-N 2.97Å; P472-K474 VanDerWaalsContact O-N 3.07Å; K474-K478 VanDerWaalsContact O-CB 3.3Å; K474-K478 WeakPolarHBondContact O-CB 3.49Å; K474-K478 PolarHBondContact O-N 2.94Å
475	E	95.6	Very high	93.5	Very high	74 Å²	74	53.9 Å²	53.9	35%	0.346	30%	0.298	S	S	.	.	H	α-helix	trans	-75.4	-36.6	178	-66	177.8	-171.4	0	0	110.8	V471 P472 L473 G479 P501	V471-E475 HydrophobicContact CG1-CB 4.23Å; P472-E475 HydrophobicContact CB-CG 4.45Å; P472-E475 WeakPolarHBondContact CD-OE2 3.39Å; P472-E475 PolarHBondContact O-N 3.01Å; L473-E475 VanDerWaalsContact C-N 3.33Å; L473-E475 PolarHBondContact O-N 3.47Å; E475-G479 PolarHBondContact O-N 2.98Å; E475-P501 WeakPolarHBondContact OE2-CG 3.49Å
476	T	96	Very high	93.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-55.4	-57.7	169	-53.6	0	0	0	0	111.2	K177 L181 P472 L473 K478 G479 F480	K177-T476 HydrophobicContact CB-CG2 4.07Å; K177-T476 HydrophobicContact CG-CG2 4.19Å; L181-T476 HydrophobicContact CB-CG2 4Å; L181-T476 HydrophobicContact CD1-CG2 4.49Å; P472-T476 PolarHBondContact O-N 2.79Å; P472-T476 VanDerWaalsContact O-N 3.07Å; P472-T476 PolarHBondContact O-OG1 3.21Å; L473-T476 WeakPolarHBondContact O-CB 3.21Å; L473-T476 PolarHBondContact O-N 3.37Å; T476-K478 PolarHBondContact O-N 2.86Å; T476-G479 PolarHBondContact O-N 2.82Å; T476-F480 HydrophobicContact CG2-CD2 3.92Å; T476-F480 HydrophobicContact CG2-CE2 3.97Å; T476-F480 WeakPolarHBondContact O-CD2 3.36Å; T476-F480 PolarHBondContact O-N 2.86Å
477	I	96.3	Very high	94.2	Very high	20 Å²	20	53.1 Å²	53.1	10%	0.103	28%	0.28	C	S	.	.	H	α-helix	trans	-58.4	-47.5	-178.4	-65.6	165.1	0	0	0	110.6	L181 E405 H406 V409 L473 G479 K481	L181-I477 HydrophobicContact CD1-CG1 4.4Å; E405-I477 HydrophobicContact CG-CG2 3.95Å; H406-I477 HydrophobicContact CB-CD1 3.77Å; H406-I477 HydrophobicContact CB-CG1 4.38Å; V409-I477 HydrophobicContact CG2-CG2 4.29Å; L473-I477 HydrophobicContact CD1-CD1 3.87Å; L473-I477 HydrophobicContact CD1-CG1 4.09Å; L473-I477 HydrophobicContact CG-CD1 3.88Å; L473-I477 WeakPolarHBondContact O-CG1 3.47Å; L473-I477 PolarHBondContact O-N 3.08Å; I477-G479 PolarHBondContact O-N 2.83Å; I477-K481 WeakPolarHBondContact O-CB 3.39Å; I477-K481 PolarHBondContact O-N 3.18Å
478	K	96.3	Very high	94.4	Very high	102 Å²	102	49.1 Å²	49.1	44%	0.443	26%	0.257	S	S	.	.	H	α-helix	trans	-56.6	-49.5	176.7	-178.8	-165.9	172.3	-163.8	0	111.8	K474 T476 K481 S482 E503	K474-K478 VanDerWaalsContact O-CB 3.3Å; K474-K478 WeakPolarHBondContact O-CB 3.49Å; K474-K478 PolarHBondContact O-N 2.94Å; T476-K478 PolarHBondContact O-N 2.86Å; K478-K481 PolarHBondContact O-N 2.8Å; K478-S482 PolarHBondContact O-N 3.3Å; K478-S482 PolarHBondContact O-OG 2.73Å; K478-E503 IonicContact NZ-OE1 3.52Å; K478-E503 PolarHBondContact NZ-OE1 3.36Å
479	G	95.3	Very high	94.4	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.8	-49.9	-177.5	0	0	0	0	0	112.7	E475 T476 I477 K481 S482 I483	E475-G479 PolarHBondContact O-N 2.98Å; T476-G479 PolarHBondContact O-N 2.82Å; I477-G479 PolarHBondContact O-N 2.83Å; G479-K481 PolarHBondContact O-N 2.96Å; G479-S482 PolarHBondContact O-N 3.13Å; G479-I483 WeakPolarHBondContact O-CG1 3.43Å; G479-I483 PolarHBondContact O-N 3.03Å; G479-I483 VanDerWaalsContact O-N 3.15Å
480	F	96.6	Very high	94.4	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-66.1	-37	176.9	-76.7	-82	0	0	0	112.2	K177 L181 V409 V413 I449 F452 L453 T476 S482 I483 L484	K177-F480 HydrophobicContact CB-CE2 4.33Å; K177-F480 HydrophobicContact CD-CE2 4.46Å; L181-F480 HydrophobicContact CD2-CB 4.09Å; L181-F480 HydrophobicContact CD2-CD1 4.04Å; L181-F480 HydrophobicContact CD2-CD2 3.57Å; L181-F480 HydrophobicContact CD2-CE1 4.39Å; L181-F480 HydrophobicContact CD2-CE2 3.97Å; L181-F480 HydrophobicContact CD2-CG 3.62Å; L181-F480 HydrophobicContact CD2-CZ 4.36Å; V409-F480 HydrophobicContact CG1-CB 3.69Å; V413-F480 HydrophobicContact CG2-CB 4.07Å; V413-F480 HydrophobicContact CG2-CD1 3.66Å; V413-F480 HydrophobicContact CG2-CG 4.16Å; I449-F480 HydrophobicContact CG2-CD1 4.34Å; I449-F480 HydrophobicContact CG2-CE1 4.01Å; F452-F480 HydrophobicContact CB-CE1 4.4Å; F452-F480 HydrophobicContact CB-CZ 4.37Å; F452-F480 HydrophobicContact CD1-CD1 4.08Å; F452-F480 HydrophobicContact CD1-CD2 4.01Å; F452-F480 AromaticContact CD1-CE1 3.67Å; F452-F480 HydrophobicContact CD1-CE1 3.67Å; F452-F480 AromaticContact CD1-CE2 3.58Å; F452-F480 HydrophobicContact CD1-CE2 3.58Å; F452-F480 HydrophobicContact CD1-CG 4.25Å; F452-F480 AromaticContact CD1-CZ 3.39Å; F452-F480 HydrophobicContact CD1-CZ 3.39Å; F452-F480 AromaticContact CE1-CD2 3.89Å; F452-F480 HydrophobicContact CE1-CD2 3.89Å; F452-F480 HydrophobicContact CE1-CE1 4.5Å; F452-F480 AromaticContact CE1-CE2 3.69Å; F452-F480 HydrophobicContact CE1-CE2 3.69Å; F452-F480 HydrophobicContact CE1-CG 4.38Å; F452-F480 HydrophobicContact CE1-CZ 4.02Å; F452-F480 HydrophobicContact CG-CZ 4.22Å; L453-F480 HydrophobicContact CD2-CE1 3.89Å; L453-F480 HydrophobicContact CD2-CE2 4.38Å; L453-F480 HydrophobicContact CD2-CZ 3.49Å; L453-F480 VanDerWaalsContact CD2-CZ 3.49Å; L453-F480 HydrophobicContact CG-CE1 4.06Å; L453-F480 HydrophobicContact CG-CZ 3.91Å; T476-F480 HydrophobicContact CG2-CD2 3.92Å; T476-F480 HydrophobicContact CG2-CE2 3.97Å; T476-F480 WeakPolarHBondContact O-CD2 3.36Å; T476-F480 PolarHBondContact O-N 2.86Å; F480-S482 PolarHBondContact O-N 2.96Å; F480-I483 PolarHBondContact O-N 3.07Å; F480-L484 VanDerWaalsContact O-CG 3.32Å; F480-L484 WeakPolarHBondContact O-CG 3.23Å; F480-L484 PolarHBondContact O-N 3.23Å
481	K	96.6	Very high	94.5	Very high	103 Å²	103	51.5 Å²	51.5	45%	0.448	27%	0.268	S	S	.	.	H	α-helix	trans	-59.6	-45.6	175.3	-172.9	176.1	-178	-179.4	0	112.7	E405 V409 I477 K478 G479 L484 G485	E405-K481 IonicContact OE1-NZ 3.61Å; E405-K481 PolarHBondContact OE1-NZ 2.85Å; V409-K481 HydrophobicContact CG1-CB 4.5Å; V409-K481 HydrophobicContact CG2-CB 3.79Å; V409-K481 HydrophobicContact CG2-CD 4.31Å; V409-K481 HydrophobicContact CG2-CG 4.03Å; I477-K481 WeakPolarHBondContact O-CB 3.39Å; I477-K481 PolarHBondContact O-N 3.18Å; K478-K481 PolarHBondContact O-N 2.8Å; G479-K481 PolarHBondContact O-N 2.96Å; K481-L484 PolarHBondContact O-N 3.48Å; K481-G485 PolarHBondContact O-N 2.68Å
482	S	95.3	Very high	94.5	Very high	12 Å²	12	54.5 Å²	54.5	8%	0.084	29%	0.288	C	S	.	.	H	α-helix	trans	-66.1	-35.9	176.7	-73.2	0	0	0	0	113	K478 G479 F480 G485 G486 E487 Y488	K478-S482 PolarHBondContact O-N 3.3Å; K478-S482 PolarHBondContact O-OG 2.73Å; G479-S482 PolarHBondContact O-N 3.13Å; F480-S482 PolarHBondContact O-N 2.96Å; S482-G485 PolarHBondContact O-N 2.87Å; S482-G486 PolarHBondContact O-N 3.12Å; S482-E487 WeakPolarHBondContact CB-OE2 3.47Å; S482-E487 PolarHBondContact O-N 2.84Å; S482-E487 VanDerWaalsContact O-N 3.08Å; S482-E487 PolarHBondContact OG-OE2 3.43Å; S482-Y488 VanDerWaalsContact CB-CE2 3.46Å
483	I	94.1	Very high	94.4	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-65.8	-44.2	173.4	-63.2	164.3	0	0	0	110.8	I449 F452 G479 F480 G485 G486 Y488 F496 I502	I449-I483 HydrophobicContact CD1-CG2 4.23Å; I449-I483 HydrophobicContact CG1-CG2 3.6Å; F452-I483 HydrophobicContact CB-CD1 4.17Å; F452-I483 HydrophobicContact CD1-CD1 3.42Å; F452-I483 VanDerWaalsContact CD1-CD1 3.42Å; F452-I483 HydrophobicContact CE1-CD1 3.96Å; F452-I483 HydrophobicContact CG-CD1 3.86Å; G479-I483 WeakPolarHBondContact O-CG1 3.43Å; G479-I483 PolarHBondContact O-N 3.03Å; G479-I483 VanDerWaalsContact O-N 3.15Å; F480-I483 PolarHBondContact O-N 3.07Å; I483-G485 VanDerWaalsContact C-N 3.29Å; I483-G485 PolarHBondContact O-N 2.75Å; I483-G486 PolarHBondContact O-N 2.9Å; I483-G486 VanDerWaalsContact O-N 3.15Å; I483-Y488 HydrophobicContact CG1-CD2 4.32Å; I483-F496 HydrophobicContact CD1-CD1 3.99Å; I483-F496 HydrophobicContact CD1-CE1 3.64Å; I483-F496 HydrophobicContact CG1-CE1 3.81Å; I483-I502 HydrophobicContact CD1-CD1 3.99Å; I483-I502 HydrophobicContact CG1-CD1 4.09Å
484	L	94.3	Very high	94.3	Very high	39 Å²	39	59.8 Å²	59.8	20%	0.204	31%	0.307	C	S	.	.	H	α-helix	trans	-61.3	-37.4	174.5	-68.7	178.7	0	0	0	112.2	V409 V413 I416 R445 I449 F480 K481 G486	V409-L484 HydrophobicContact CG1-CD1 4.13Å; V413-L484 HydrophobicContact CG2-CD1 4.24Å; V413-L484 HydrophobicContact CG2-CD2 4.24Å; V413-L484 HydrophobicContact CG2-CG 4.35Å; I416-L484 HydrophobicContact CD1-CD2 3.53Å; I416-L484 HydrophobicContact CG1-CD2 4.36Å; R445-L484 PolarHBondContact NH1-O 2.76Å; I449-L484 HydrophobicContact CD1-CD2 3.97Å; F480-L484 VanDerWaalsContact O-CG 3.32Å; F480-L484 WeakPolarHBondContact O-CG 3.23Å; F480-L484 PolarHBondContact O-N 3.23Å; K481-L484 PolarHBondContact O-N 3.48Å; L484-G486 PolarHBondContact O-N 2.83Å
485	G	92.9	Very high	94.3	Very high	57 Å²	57	51.1 Å²	51.1	59%	0.588	27%	0.269	S	S	*	.	H	α-helix	trans	-70.5	-12.9	176	0	0	0	0	0	115	K481 S482 I483	K481-G485 PolarHBondContact O-N 2.68Å; S482-G485 PolarHBondContact O-N 2.87Å; I483-G485 VanDerWaalsContact C-N 3.29Å; I483-G485 PolarHBondContact O-N 2.75Å
486	G	93	Very high	94.3	Very high	17 Å²	17	47.6 Å²	47.6	18%	0.175	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	9.4	-178.8	0	0	0	0	0	115.3	S482 I483 L484 Y488 D489	S482-G486 PolarHBondContact O-N 3.12Å; I483-G486 PolarHBondContact O-N 2.9Å; I483-G486 VanDerWaalsContact O-N 3.15Å; L484-G486 PolarHBondContact O-N 2.83Å; G486-Y488 PolarHBondContact O-N 3.48Å; G486-Y488 VanDerWaalsContact O-N 3.07Å; G486-D489 VanDerWaalsContact CA-OD2 3.3Å; G486-D489 WeakPolarHBondContact CA-OD2 3.36Å; G486-D489 PolarHBondContact O-N 3.06Å
487	E	93.3	Very high	94.2	Very high	126 Å²	126	51 Å²	51	59%	0.589	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.7	-176.9	-64.1	179.1	179	0	0	113.1	S482	S482-E487 WeakPolarHBondContact CB-OE2 3.47Å; S482-E487 PolarHBondContact O-N 2.84Å; S482-E487 VanDerWaalsContact O-N 3.08Å; S482-E487 PolarHBondContact OG-OE2 3.43Å
488	Y	93.6	Very high	94	Very high	43 Å²	43	51.1 Å²	51.1	17%	0.169	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	24.1	-178.2	-56.7	-67	0	0	0	113.5	K448 S482 I483 G486 N490 L491 I502 V506	K448-Y488 PolarHBondContact NZ-O 3.18Å; S482-Y488 VanDerWaalsContact CB-CE2 3.46Å; I483-Y488 HydrophobicContact CG1-CD2 4.32Å; G486-Y488 PolarHBondContact O-N 3.48Å; G486-Y488 VanDerWaalsContact O-N 3.07Å; Y488-N490 PolarHBondContact O-N 3.35Å; Y488-L491 HydrophobicContact CD1-CD1 3.64Å; Y488-L491 HydrophobicContact CD1-CG 4.28Å; Y488-L491 HydrophobicContact CE1-CD1 4.47Å; Y488-L491 HydrophobicContact CG-CD1 4.22Å; Y488-L491 PolarHBondContact O-N 3.07Å; Y488-I502 HydrophobicContact CD2-CD1 3.93Å; Y488-I502 HydrophobicContact CD2-CG1 4.01Å; Y488-I502 HydrophobicContact CE2-CD1 3.81Å; Y488-I502 HydrophobicContact CE2-CG1 3.33Å; Y488-V506 HydrophobicContact CD1-CG2 4.39Å; Y488-V506 HydrophobicContact CE1-CG2 3.72Å
489	D	92	Very high	93.9	Very high	56 Å²	56	46.5 Å²	46.5	30%	0.299	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25.5	178.1	-78.9	-21.7	0	0	0	113	R445 K448 G486	R445-D489 VanDerWaalsContact CG-OD1 3.27Å; R445-D489 WeakPolarHBondContact CG-OD1 3.44Å; R445-D489 IonicContact CZ-OD1 3.64Å; R445-D489 IonicContact CZ-OD2 2.67Å; R445-D489 VanDerWaalsContact CZ-OD2 3.27Å; R445-D489 IonicContact NE-OD1 2.75Å; R445-D489 PolarHBondContact NE-OD1 3.41Å; R445-D489 IonicContact NE-OD2 2.74Å; R445-D489 PolarHBondContact NE-OD2 2.9Å; R445-D489 VanDerWaalsContact NE-OD2 3.07Å; R445-D489 IonicContact NH2-OD1 2.63Å; R445-D489 IonicContact NH2-OD2 2.62Å; R445-D489 PolarHBondContact NH2-OD2 3.48Å; K448-D489 PolarHBondContact NZ-O 3.23Å; G486-D489 VanDerWaalsContact CA-OD2 3.3Å; G486-D489 WeakPolarHBondContact CA-OD2 3.36Å; G486-D489 PolarHBondContact O-N 3.06Å
490	N	92.1	Very high	93.8	Very high	133 Å²	133	46.5 Å²	46.5	71%	0.711	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-19	175.7	65.1	-29	0	0	0	115	Y488	Y488-N490 PolarHBondContact O-N 3.35Å
491	L	93.8	Very high	93.7	Very high	26 Å²	26	47.6 Å²	47.6	14%	0.136	25%	0.254	C	S	.	.	S	Bend	trans	-79.6	148.4	-176.2	-58.3	-168.8	0	0	0	112.3	K448 Y488 F496 V505 V506 A509	K448-L491 WeakPolarHBondContact CE-O 3.25Å; K448-L491 PolarHBondContact NZ-O 3.4Å; Y488-L491 HydrophobicContact CD1-CD1 3.64Å; Y488-L491 HydrophobicContact CD1-CG 4.28Å; Y488-L491 HydrophobicContact CE1-CD1 4.47Å; Y488-L491 HydrophobicContact CG-CD1 4.22Å; Y488-L491 PolarHBondContact O-N 3.07Å; L491-F496 HydrophobicContact CB-CE2 4.03Å; L491-F496 HydrophobicContact CB-CZ 4.43Å; L491-V505 HydrophobicContact CD1-CG1 3.87Å; L491-V506 HydrophobicContact CD1-CG2 4.37Å; L491-A509 HydrophobicContact CB-CB 4.49Å; L491-A509 HydrophobicContact CD1-CB 4.27Å; L491-A509 HydrophobicContact CD2-CB 3.9Å; L491-A509 HydrophobicContact CG-CB 4.45Å
492	P	93.7	Very high	93.5	Very high	63 Å²	63	42.7 Å²	42.7	41%	0.409	23%	0.233	S	C	.	.			trans	-71.6	148.1	178.3	29.2	-34.7	0	0	0	112.4	Q494 A495 A509 L512	P492-Q494 PolarHBondContact O-N 2.91Å; P492-Q494 VanDerWaalsContact O-N 3.16Å; P492-A495 HydrophobicContact CG-CB 4.22Å; P492-A495 WeakPolarHBondContact O-CB 3.37Å; P492-A495 PolarHBondContact O-N 3.38Å; P492-A495 VanDerWaalsContact O-N 3.09Å; P492-A509 HydrophobicContact CG-CB 4.49Å; P492-L512 HydrophobicContact CG-CD1 4.41Å
493	E	92.4	Very high	93.5	Very high	69 Å²	69	45.5 Å²	45.5	32%	0.322	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-55.2	-35.7	-179.4	-64.6	-177.6	-164	0	0	113.2	R447 K448 A495 F496	R447-E493 HydrophobicContact CB-CG 4.4Å; R447-E493 WeakPolarHBondContact CD-OE1 3.39Å; R447-E493 WeakPolarHBondContact CD-OE2 3.5Å; R447-E493 IonicContact NH1-OE1 3.2Å; R447-E493 PolarHBondContact NH1-OE1 3.42Å; K448-E493 HydrophobicContact CG-CG 4.3Å; E493-A495 PolarHBondContact O-N 2.96Å; E493-F496 PolarHBondContact O-N 3.16Å; E493-F496 VanDerWaalsContact O-N 3.17Å
494	Q	92.6	Very high	93.4	Very high	130 Å²	130	47.5 Å²	47.5	61%	0.607	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-65.6	-23.1	-179	-67.4	-177.8	-3.1	0	0	113.9	P492 F496 Y497 L512	P492-Q494 PolarHBondContact O-N 2.91Å; P492-Q494 VanDerWaalsContact O-N 3.16Å; Q494-F496 PolarHBondContact O-N 3.17Å; Q494-Y497 PolarHBondContact O-N 3.13Å; Q494-L512 HydrophobicContact CB-CD1 4.16Å
495	A	94.6	Very high	93.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-67.2	-25	176.1	0	0	0	0	0	112.4	P492 E493 V505 A509 L512	P492-A495 HydrophobicContact CG-CB 4.22Å; P492-A495 WeakPolarHBondContact O-CB 3.37Å; P492-A495 PolarHBondContact O-N 3.38Å; P492-A495 VanDerWaalsContact O-N 3.09Å; E493-A495 PolarHBondContact O-N 2.96Å; A495-V505 HydrophobicContact CB-CG1 3.82Å; A495-A509 HydrophobicContact CB-CB 3.84Å; A495-L512 HydrophobicContact CB-CD1 4.43Å
496	F	95.5	Very high	93.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-85.8	-5.2	179.5	-65.4	-91.4	0	0	0	113.8	K448 R451 F452 I483 L491 E493 Q494 I502 V505	K448-F496 HydrophobicContact CB-CD1 4.49Å; K448-F496 HydrophobicContact CB-CD2 4.02Å; K448-F496 HydrophobicContact CB-CE2 4.08Å; K448-F496 HydrophobicContact CB-CG 4.22Å; K448-F496 HydrophobicContact CB-CZ 4.32Å; K448-F496 HydrophobicContact CD-CD2 4.29Å; K448-F496 HydrophobicContact CD-CE2 3.67Å; K448-F496 HydrophobicContact CD-CZ 4.06Å; K448-F496 HydrophobicContact CG-CD2 3.78Å; K448-F496 HydrophobicContact CG-CE2 3.7Å; K448-F496 HydrophobicContact CG-CG 4.47Å; K448-F496 HydrophobicContact CG-CZ 4.31Å; R451-F496 CarbonylContact C-O 3.55Å; R451-F496 HydrophobicContact CB-CB 4.01Å; F452-F496 WeakPolarHBondContact CA-O 3.48Å; F452-F496 HydrophobicContact CB-CB 4.16Å; F452-F496 HydrophobicContact CB-CD1 3.96Å; F452-F496 HydrophobicContact CD2-CD1 4.05Å; F452-F496 HydrophobicContact CG-CD1 4.11Å; F452-F496 PolarHBondContact N-O 2.95Å; I483-F496 HydrophobicContact CD1-CD1 3.99Å; I483-F496 HydrophobicContact CD1-CE1 3.64Å; I483-F496 HydrophobicContact CG1-CE1 3.81Å; L491-F496 HydrophobicContact CB-CE2 4.03Å; L491-F496 HydrophobicContact CB-CZ 4.43Å; E493-F496 PolarHBondContact O-N 3.16Å; E493-F496 VanDerWaalsContact O-N 3.17Å; Q494-F496 PolarHBondContact O-N 3.17Å; F496-I502 HydrophobicContact CE1-CD1 4.09Å; F496-V505 HydrophobicContact CD1-CB 4.48Å; F496-V505 HydrophobicContact CD1-CG1 3.76Å; F496-V505 HydrophobicContact CD1-CG2 3.87Å; F496-V505 HydrophobicContact CD2-CG1 4Å; F496-V505 HydrophobicContact CE1-CG1 3.68Å; F496-V505 HydrophobicContact CE1-CG2 4.25Å; F496-V505 HydrophobicContact CE2-CG1 3.91Å; F496-V505 HydrophobicContact CG-CG1 3.94Å; F496-V505 HydrophobicContact CG-CG2 4.42Å; F496-V505 HydrophobicContact CZ-CG1 3.77Å
497	Y	94.7	Very high	93.4	Very high	70 Å²	70	49.5 Å²	49.5	28%	0.275	25%	0.245	S	C	.	.	S	Bend	trans	-88.9	132.1	-176.4	-179.7	-113.4	0	0	0	112.3	G382 Q494 K508	G382-Y497 VanDerWaalsContact O-CE2 3.26Å; G382-Y497 WeakPolarHBondContact O-CE2 3.13Å; G382-Y497 PolarHBondContact O-OH 3.23Å; Q494-Y497 PolarHBondContact O-N 3.13Å; Y497-K508 PolarHBondContact O-NZ 3.05Å
498	M	91.8	Very high	93.3	Very high	24 Å²	24	46.3 Å²	46.3	12%	0.118	23%	0.229	C	C	.	.	S	Bend	trans	50.4	61.9	178.3	-70	-66.4	-153.1	0	0	113.3	S454 P456	S454-M498 PolarHBondContact OG-N 2.83Å; P456-M498 HydrophobicContact CB-SD 4.41Å
499	V	93.7	Very high	93.3	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.03	23%	0.225	C	C	.	.			trans	-135.4	157.6	179.4	-68.9	0	0	0	0	111.3	K177 F452 E504 V505 K508	K177-V499 PolarHBondContact NZ-O 3Å; F452-V499 HydrophobicContact CD2-CG2 3.89Å; F452-V499 HydrophobicContact CE2-CG2 4Å; V499-E504 HydrophobicContact CB-CB 4.3Å; V499-E504 HydrophobicContact CG1-CB 4.49Å; V499-V505 HydrophobicContact CG2-CG2 3.86Å; V499-K508 HydrophobicContact CG1-CD 3.77Å
500	G	93.1	Very high	93.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-84.5	-111.2	174.8	0	0	0	0	0	112.1	E504	G500-E504 WeakPolarHBondContact CA-OE2 3.44Å; G500-E504 PolarHBondContact N-OE2 2.85Å
501	P	94.9	Very high	93.2	Very high	23 Å²	23	47 Å²	47	15%	0.149	23%	0.228	C	C	.	.	S	Bend	trans	-65.8	167.6	175.5	-21.7	34.9	0	0	0	114.3	E475 E503 E504	E475-P501 WeakPolarHBondContact OE2-CG 3.49Å; P501-E503 WeakPolarHBondContact CB-OE2 3.47Å; P501-E503 PolarHBondContact O-N 2.75Å; P501-E504 PolarHBondContact O-N 3.32Å; P501-E504 VanDerWaalsContact O-N 3.16Å
502	I	93.1	Very high	93	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66	-27.3	-178.9	-167.2	62.1	0	0	0	112.7	F452 I483 Y488 F496 E504 V505	F452-I502 HydrophobicContact CE1-CD1 4.4Å; F452-I502 HydrophobicContact CE2-CD1 4.26Å; F452-I502 HydrophobicContact CZ-CB 4.21Å; F452-I502 HydrophobicContact CZ-CD1 4.04Å; I483-I502 HydrophobicContact CD1-CD1 3.99Å; I483-I502 HydrophobicContact CG1-CD1 4.09Å; Y488-I502 HydrophobicContact CD2-CD1 3.93Å; Y488-I502 HydrophobicContact CD2-CG1 4.01Å; Y488-I502 HydrophobicContact CE2-CD1 3.81Å; Y488-I502 HydrophobicContact CE2-CG1 3.33Å; F496-I502 HydrophobicContact CE1-CD1 4.09Å; I502-E504 PolarHBondContact O-N 2.88Å; I502-V505 HydrophobicContact CD1-CB 4.34Å; I502-V505 HydrophobicContact CD1-CG2 4Å; I502-V505 VanDerWaalsContact O-CB 3.29Å; I502-V505 WeakPolarHBondContact O-CB 3.43Å; I502-V505 PolarHBondContact O-N 2.85Å; I502-V505 VanDerWaalsContact O-N 3.11Å
503	E	93.6	Very high	92.8	Very high	71 Å²	71	46.8 Å²	46.8	33%	0.332	23%	0.23	S	C	.	.	H	α-helix	trans	-62.6	-30.1	175.3	-67.4	74.1	-167.3	0	0	112.4	K478 P501 V505 V506 Q507	K478-E503 IonicContact NZ-OE1 3.52Å; K478-E503 PolarHBondContact NZ-OE1 3.36Å; P501-E503 WeakPolarHBondContact CB-OE2 3.47Å; P501-E503 PolarHBondContact O-N 2.75Å; E503-V505 VanDerWaalsContact C-N 3.33Å; E503-V506 PolarHBondContact O-N 2.9Å; E503-Q507 PolarHBondContact O-N 2.81Å
504	E	93.3	Very high	92.5	Very high	46 Å²	46	50.5 Å²	50.5	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-72.5	-26.7	175.6	-62.8	-170.8	166.3	0	0	112.4	K469 V499 G500 P501 I502 K508	K469-E504 VanDerWaalsContact CE-OE1 3.25Å; K469-E504 WeakPolarHBondContact CE-OE1 3.48Å; K469-E504 IonicContact NZ-OE1 2.64Å; K469-E504 PolarHBondContact NZ-OE1 2.89Å; K469-E504 IonicContact NZ-OE2 3.76Å; V499-E504 HydrophobicContact CB-CB 4.3Å; V499-E504 HydrophobicContact CG1-CB 4.49Å; G500-E504 WeakPolarHBondContact CA-OE2 3.44Å; G500-E504 PolarHBondContact N-OE2 2.85Å; P501-E504 PolarHBondContact O-N 3.32Å; P501-E504 VanDerWaalsContact O-N 3.16Å; I502-E504 PolarHBondContact O-N 2.88Å; E504-K508 VanDerWaalsContact O-CB 3.28Å; E504-K508 WeakPolarHBondContact O-CB 3.39Å; E504-K508 PolarHBondContact O-N 2.84Å
505	V	93.3	Very high	91.9	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.7	-44.2	174.3	179.7	0	0	0	0	110.3	F452 L491 A495 F496 V499 I502 E503 K508 A509	F452-V505 HydrophobicContact CD2-CG2 4.02Å; F452-V505 HydrophobicContact CE2-CG2 3.84Å; L491-V505 HydrophobicContact CD1-CG1 3.87Å; A495-V505 HydrophobicContact CB-CG1 3.82Å; F496-V505 HydrophobicContact CD1-CB 4.48Å; F496-V505 HydrophobicContact CD1-CG1 3.76Å; F496-V505 HydrophobicContact CD1-CG2 3.87Å; F496-V505 HydrophobicContact CD2-CG1 4Å; F496-V505 HydrophobicContact CE1-CG1 3.68Å; F496-V505 HydrophobicContact CE1-CG2 4.25Å; F496-V505 HydrophobicContact CE2-CG1 3.91Å; F496-V505 HydrophobicContact CG-CG1 3.94Å; F496-V505 HydrophobicContact CG-CG2 4.42Å; F496-V505 HydrophobicContact CZ-CG1 3.77Å; V499-V505 HydrophobicContact CG2-CG2 3.86Å; I502-V505 HydrophobicContact CD1-CB 4.34Å; I502-V505 HydrophobicContact CD1-CG2 4Å; I502-V505 VanDerWaalsContact O-CB 3.29Å; I502-V505 WeakPolarHBondContact O-CB 3.43Å; I502-V505 PolarHBondContact O-N 2.85Å; I502-V505 VanDerWaalsContact O-N 3.11Å; E503-V505 VanDerWaalsContact C-N 3.33Å; V505-K508 PolarHBondContact O-N 2.82Å; V505-A509 WeakPolarHBondContact O-CB 3.44Å; V505-A509 PolarHBondContact O-N 3.37Å
506	V	92.9	Very high	90.9	Very high	45 Å²	45	58.1 Å²	58.1	27%	0.273	28%	0.283	S	S	.	.	H	α-helix	trans	-63.2	-49.7	179.8	-175.6	0	0	0	0	110.3	Y488 L491 E503 K508 A509 E510	Y488-V506 HydrophobicContact CD1-CG2 4.39Å; Y488-V506 HydrophobicContact CE1-CG2 3.72Å; L491-V506 HydrophobicContact CD1-CG2 4.37Å; E503-V506 PolarHBondContact O-N 2.9Å; V506-K508 VanDerWaalsContact C-N 3.25Å; V506-K508 PolarHBondContact O-N 2.87Å; V506-A509 PolarHBondContact O-N 2.84Å; V506-A509 VanDerWaalsContact O-N 3.12Å; V506-E510 WeakPolarHBondContact O-CG 3.41Å; V506-E510 PolarHBondContact O-N 3.38Å
507	Q	92.8	Very high	88.9	Confident	109 Å²	109	65.5 Å²	65.5	51%	0.509	34%	0.335	S	S	.	.	H	α-helix	trans	-60	-34.5	177.2	-64.9	174.8	16.9	0	0	112.8	E503 K511	E503-Q507 PolarHBondContact O-N 2.81Å; Q507-K511 WeakPolarHBondContact O-CG 3.45Å; Q507-K511 PolarHBondContact O-N 2.9Å
508	K	92.7	Very high	88.6	Confident	60 Å²	60	65.3 Å²	65.3	26%	0.261	34%	0.338	S	S	.	.	H	α-helix	trans	-74.4	-36.8	176.6	-170.9	167.9	179.1	170.5	0	111.9	Y497 V499 E504 V505 V506 K511 L512	Y497-K508 PolarHBondContact O-NZ 3.05Å; V499-K508 HydrophobicContact CG1-CD 3.77Å; E504-K508 VanDerWaalsContact O-CB 3.28Å; E504-K508 WeakPolarHBondContact O-CB 3.39Å; E504-K508 PolarHBondContact O-N 2.84Å; V505-K508 PolarHBondContact O-N 2.82Å; V506-K508 VanDerWaalsContact C-N 3.25Å; V506-K508 PolarHBondContact O-N 2.87Å; K508-K511 PolarHBondContact O-N 3.29Å; K508-L512 HydrophobicContact CG-CD1 4.36Å; K508-L512 VanDerWaalsContact O-CG 3.29Å; K508-L512 WeakPolarHBondContact O-CG 3.09Å; K508-L512 PolarHBondContact O-N 2.8Å
509	A	92.1	Very high	88.4	Confident	9 Å²	9	67.5 Å²	67.5	7%	0.074	35%	0.349	C	S	.	.	H	α-helix	trans	-66.2	-39.7	173.9	0	0	0	0	0	112.2	L491 P492 A495 V505 V506 L512 A513	L491-A509 HydrophobicContact CB-CB 4.49Å; L491-A509 HydrophobicContact CD1-CB 4.27Å; L491-A509 HydrophobicContact CD2-CB 3.9Å; L491-A509 HydrophobicContact CG-CB 4.45Å; P492-A509 HydrophobicContact CG-CB 4.49Å; A495-A509 HydrophobicContact CB-CB 3.84Å; V505-A509 WeakPolarHBondContact O-CB 3.44Å; V505-A509 PolarHBondContact O-N 3.37Å; V506-A509 PolarHBondContact O-N 2.84Å; V506-A509 VanDerWaalsContact O-N 3.12Å; A509-L512 PolarHBondContact O-N 2.77Å; A509-A513 PolarHBondContact O-N 3.32Å
510	E	91.9	Very high	88.1	Confident	114 Å²	114	70.9 Å²	70.9	53%	0.533	37%	0.367	S	S	.	.	H	α-helix	trans	-59.2	-49.4	173.6	-72.5	170.6	167.3	0	0	111.2	V506 L512 A513 E514	V506-E510 WeakPolarHBondContact O-CG 3.41Å; V506-E510 PolarHBondContact O-N 3.38Å; E510-L512 PolarHBondContact O-N 2.76Å; E510-A513 WeakPolarHBondContact O-CB 3.28Å; E510-A513 PolarHBondContact O-N 3.46Å; E510-A513 VanDerWaalsContact O-N 3.1Å; E510-E514 PolarHBondContact O-N 3.02Å
511	K	90.9	Very high	87.8	Confident	124 Å²	124	75.1 Å²	75.1	54%	0.539	39%	0.389	S	S	.	.	H	α-helix	trans	-60.5	-42.4	176	-72	174.5	-178.3	179.1	0	113.4	Q507 K508 A513 E514 E515	Q507-K511 WeakPolarHBondContact O-CG 3.45Å; Q507-K511 PolarHBondContact O-N 2.9Å; K508-K511 PolarHBondContact O-N 3.29Å; K511-A513 VanDerWaalsContact C-N 3.25Å; K511-A513 PolarHBondContact O-N 2.7Å; K511-E514 PolarHBondContact O-N 2.95Å; K511-E515 WeakPolarHBondContact O-CB 3.36Å; K511-E515 WeakPolarHBondContact O-CG 3.44Å; K511-E515 PolarHBondContact O-N 3.2Å
512	L	90.4	Very high	87.4	Confident	29 Å²	29	78.4 Å²	78.4	15%	0.152	40%	0.404	C	S	.	.	H	α-helix	trans	-64.6	-30.3	176	-72.5	169.1	0	0	0	112.2	P492 Q494 A495 K508 A509 E510 H516	P492-L512 HydrophobicContact CG-CD1 4.41Å; Q494-L512 HydrophobicContact CB-CD1 4.16Å; A495-L512 HydrophobicContact CB-CD1 4.43Å; K508-L512 HydrophobicContact CG-CD1 4.36Å; K508-L512 VanDerWaalsContact O-CG 3.29Å; K508-L512 WeakPolarHBondContact O-CG 3.09Å; K508-L512 PolarHBondContact O-N 2.8Å; A509-L512 PolarHBondContact O-N 2.77Å; E510-L512 PolarHBondContact O-N 2.76Å; L512-H516 WeakPolarHBondContact O-CB 3.35Å; L512-H516 PolarHBondContact O-CD2 3.02Å; L512-H516 VanDerWaalsContact O-CG 3.26Å; L512-H516 PolarHBondContact O-N 3.42Å
513	A	88.7	Confident	87	Confident	54 Å²	54	83.6 Å²	83.6	45%	0.446	43%	0.431	S	S	.	.	H	α-helix	trans	-73.4	-39.5	172.8	0	0	0	0	0	112	A509 E510 K511 H516 S517	A509-A513 PolarHBondContact O-N 3.32Å; E510-A513 WeakPolarHBondContact O-CB 3.28Å; E510-A513 PolarHBondContact O-N 3.46Å; E510-A513 VanDerWaalsContact O-N 3.1Å; K511-A513 VanDerWaalsContact C-N 3.25Å; K511-A513 PolarHBondContact O-N 2.7Å; A513-H516 PolarHBondContact O-N 3.09Å; A513-S517 WeakPolarHBondContact O-CB 3.23Å; A513-S517 PolarHBondContact O-N 3.06Å; A513-S517 PolarHBondContact O-OG 3.12Å
514	E	86.8	Confident	86.6	Confident	147 Å²	147	84.5 Å²	84.5	69%	0.687	44%	0.438	S	S	*	.	H	α-helix	trans	-64.3	-40.2	173.6	-70.2	-179.7	166	0	0	112.4	E510 K511 H516 S517	E510-E514 PolarHBondContact O-N 3.02Å; K511-E514 PolarHBondContact O-N 2.95Å; E514-H516 PolarHBondContact O-N 2.79Å; E514-S517 PolarHBondContact O-N 3.29Å
515	E	79.9	Confident	86	Confident	142 Å²	142	87.5 Å²	87.5	66%	0.664	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-8.3	177.1	-72.3	176.1	-173.9	0	0	114	K511	K511-E515 WeakPolarHBondContact O-CB 3.36Å; K511-E515 WeakPolarHBondContact O-CG 3.44Å; K511-E515 PolarHBondContact O-N 3.2Å
516	H	72.4	Confident	85.4	Confident	148 Å²	148	94.8 Å²	94.8	69%	0.685	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	6.2	178.9	-67.8	-5.4	0	0	0	113.4	L512 A513 E514	L512-H516 WeakPolarHBondContact O-CB 3.35Å; L512-H516 PolarHBondContact O-CD2 3.02Å; L512-H516 VanDerWaalsContact O-CG 3.26Å; L512-H516 PolarHBondContact O-N 3.42Å; A513-H516 PolarHBondContact O-N 3.09Å; E514-H516 PolarHBondContact O-N 2.79Å
517	S	53.7	Low	84.8	Confident	156 Å²	156	99.3 Å²	99.3	100%	1.091	51%	0.513	S	S	*	.			trans	-100.3	0	174.9	-62.4	0	0	0	0	112.1	A513 E514	A513-S517 WeakPolarHBondContact O-CB 3.23Å; A513-S517 PolarHBondContact O-N 3.06Å; A513-S517 PolarHBondContact O-OG 3.12Å; E514-S517 PolarHBondContact O-N 3.29Å

Retrieved 517 of 517 residues in 665.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).