A0A3Q0KJ12_SCHMA Loading...

RGS domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KJ12, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 578 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37	Very low	30.3	Very low	242 Å²	242	169.3 Å²	169.3	100%	1.192	84%	0.84	S	S	*	*				0	95.6	0	-84.6	174.5	169.3	0	0	108.1
2	T	32.6	Very low	29.9	Very low	144 Å²	144	165.8 Å²	165.8	88%	0.883	84%	0.835	S	S	*	*			trans	-96.5	104.2	178.7	27.4	0	0	0	0	108.5	K4	T2-K4 PolarHBondContact O-N 3.46Å
3	T	34	Very low	29.3	Very low	135 Å²	135	165 Å²	165	83%	0.828	84%	0.835	S	S	*	*			trans	-68.8	108.4	175.6	26.1	0	0	0	0	109.7	I5	T3-I5 PolarHBondContact O-N 3.5Å
4	K	30.5	Very low	29.1	Very low	194 Å²	194	164.7 Å²	164.7	84%	0.843	83%	0.829	S	S	*	*			trans	-69.2	117.1	169.7	-78.2	176.5	173.7	176.7	0	109.3	T2 N6	T2-K4 PolarHBondContact O-N 3.46Å; K4-N6 PolarHBondContact O-N 3.49Å
5	I	36	Very low	29.3	Very low	154 Å²	154	168.7 Å²	168.7	79%	0.79	84%	0.839	S	S	*	*			trans	-87.4	89.7	166.7	-59.6	171.8	0	0	0	107	T3	T3-I5 PolarHBondContact O-N 3.5Å
6	N	28	Very low	29.3	Very low	140 Å²	140	166.3 Å²	166.3	75%	0.749	83%	0.828	S	S	*	*			trans	-102.7	101.3	159.2	-85.3	0.8	0	0	0	106.8	K4	K4-N6 PolarHBondContact O-N 3.49Å
7	R	28.5	Very low	29.2	Very low	229 Å²	229	164.6 Å²	164.6	86%	0.864	82%	0.823	S	S	*	*			trans	-113.2	88.1	160.5	-85.6	-172.9	177.1	164.4	-0.9	107.8
8	T	24.6	Very low	29.1	Very low	122 Å²	122	162.9 Å²	162.9	75%	0.748	83%	0.826	S	S	*	*			trans	-88.1	107.8	158	-46.5	0	0	0	0	105.3	E10	T8-E10 PolarHBondContact O-N 3.46Å
9	V	30	Very low	28.9	Very low	117 Å²	117	162.9 Å²	162.9	71%	0.709	83%	0.827	S	S	*	*			trans	-84.4	102.1	172.9	177.5	0	0	0	0	106.6
10	E	24.6	Very low	28.9	Very low	160 Å²	160	160 Å²	160	75%	0.748	82%	0.82	S	S	*	*			trans	-67.9	129.5	168.4	-76.8	176.9	151.4	0	0	109.4	T8 T12	T8-E10 PolarHBondContact O-N 3.46Å; E10-T12 PolarHBondContact O-N 3.16Å
11	Y	27.8	Very low	28.8	Very low	225 Å²	225	158.7 Å²	158.7	88%	0.882	82%	0.824	S	S	*	*			trans	-74.9	99.4	169.3	-70.8	-91.3	0	0	0	108.4
12	T	25.1	Very low	28	Very low	128 Å²	128	157 Å²	157	79%	0.785	81%	0.809	S	S	*	*			trans	-85.3	125.2	165.4	45.4	0	0	0	0	109.8	E10	E10-T12 PolarHBondContact O-N 3.16Å
13	N	22.3	Very low	27.9	Very low	155 Å²	155	154.9 Å²	154.9	83%	0.829	80%	0.8	S	S	*	*			trans	-61.5	125.5	168.4	-64.5	-40.5	0	0	0	109.7
14	E	26	Very low	27.6	Very low	161 Å²	161	154.5 Å²	154.5	75%	0.752	80%	0.798	S	S	*	*			trans	-177.9	88.6	151	-105.5	167.5	-154.8	0	0	110.1
15	F	32	Very low	27.3	Very low	224 Å²	224	150.7 Å²	150.7	98%	0.982	80%	0.796	S	S	*	*			trans	-132.1	111.3	143.4	-95.5	-77.3	0	0	0	108.8
16	I	30	Very low	27	Very low	130 Å²	130	148.8 Å²	148.8	67%	0.667	80%	0.796	S	S	*	*			trans	-74.2	133.2	-170	-74.4	157.5	0	0	0	111.2
17	N	26.7	Very low	26.9	Very low	138 Å²	138	150.3 Å²	150.3	74%	0.738	80%	0.799	S	S	*	*			trans	31.7	119.8	146.1	-59.5	-25.6	0	0	0	120.2
18	P	28.5	Very low	26.8	Very low	134 Å²	134	145.3 Å²	145.3	87%	0.87	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-76.4	118.7	148.7	6.8	10.2	0	0	0	110.1
19	L	25.8	Very low	26.5	Very low	164 Å²	164	147.9 Å²	147.9	86%	0.859	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.4	151.7	170.5	-155.8	64.1	0	0	0	110.2
20	P	27.5	Very low	26.4	Very low	104 Å²	104	150 Å²	150	68%	0.675	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-94.2	134.3	-150.8	33.7	-26.8	0	0	0	113.4	K22	P20-K22 PolarHBondContact O-N 3.31Å
21	C	26.3	Very low	26.4	Very low	133 Å²	133	147.4 Å²	147.4	90%	0.899	80%	0.803	S	S	*	*			trans	-78.9	107.8	164.7	-74.4	0	0	0	0	109.7
22	K	21.1	Very low	26.5	Very low	206 Å²	206	142.5 Å²	142.5	90%	0.896	80%	0.798	S	S	*	*			trans	-72.3	118.3	162.2	-78.9	176.5	174.6	177	0	109	P20	P20-K22 PolarHBondContact O-N 3.31Å
23	S	31.3	Very low	26.6	Very low	99 Å²	99	142.4 Å²	142.4	69%	0.692	80%	0.802	S	S	*	*			trans	-156.5	95.9	150.7	50.7	0	0	0	0	109.6
24	T	27.1	Very low	26.7	Very low	127 Å²	127	143.2 Å²	143.2	78%	0.779	80%	0.8	S	S	*	*			trans	32.2	104.2	143.7	47.3	0	0	0	0	118.3	S26	T24-S26 PolarHBondContact O-N 2.87Å
25	S	24.2	Very low	26.7	Very low	115 Å²	115	142.7 Å²	142.7	80%	0.804	80%	0.803	S	S	*	*			trans	-21.9	118.8	145.7	51.7	0	0	0	0	114.8
26	S	29.8	Very low	26.4	Very low	113 Å²	113	140.8 Å²	140.8	79%	0.79	80%	0.799	S	S	*	*			trans	-121.2	96.2	149.2	-50.9	0	0	0	0	105.8	T24 V28	T24-S26 PolarHBondContact O-N 2.87Å; S26-V28 PolarHBondContact O-N 3.42Å
27	E	25.5	Very low	26.3	Very low	173 Å²	173	140.1 Å²	140.1	81%	0.808	80%	0.803	S	S	*	*			trans	-63.3	118	170.1	-76	171.6	146.9	0	0	108.8
28	V	25.6	Very low	26.4	Very low	123 Å²	123	142.3 Å²	142.3	75%	0.745	81%	0.806	S	S	*	*			trans	-120.2	98.9	159.8	-180	0	0	0	0	107	S26 L30	S26-V28 PolarHBondContact O-N 3.42Å; V28-L30 PolarHBondContact O-N 3.26Å
29	H	19.7	Very low	26.7	Very low	176 Å²	176	145.2 Å²	145.2	82%	0.815	81%	0.808	S	S	*	*			trans	-60.9	116.9	165	-95.8	-91.3	0	0	0	109.8
30	L	26.7	Very low	27	Very low	162 Å²	162	144.2 Å²	144.2	85%	0.848	80%	0.804	S	S	*	*			trans	-133.2	120.6	153.6	-82.3	168.5	0	0	0	109	V28	V28-L30 PolarHBondContact O-N 3.26Å
31	S	24.5	Very low	27.4	Very low	106 Å²	106	147.4 Å²	147.4	74%	0.741	81%	0.81	S	S	*	*			trans	-69.7	169.5	-178.8	55.8	0	0	0	0	112.5	C33	S31-C33 PolarHBondContact O-N 3.07Å
32	P	31.1	Very low	28.3	Very low	121 Å²	121	147.2 Å²	147.2	79%	0.786	80%	0.799	S	S	*	*			trans	-86.1	119.7	-156.8	31.6	-29.1	0	0	0	112.4	E34	P32-E34 PolarHBondContact O-N 3.42Å
33	C	26.7	Very low	29.3	Very low	127 Å²	127	148 Å²	148	86%	0.858	80%	0.796	S	S	*	*			trans	-82.5	97.2	159.7	-88.2	0	0	0	0	109	S31 N35	S31-C33 PolarHBondContact O-N 3.07Å; C33-N35 PolarHBondContact O-N 2.79Å
34	E	23.7	Very low	30.3	Very low	172 Å²	172	147.7 Å²	147.7	80%	0.804	79%	0.79	S	S	*	*			trans	-53.8	114.5	153.5	-73.6	178.7	146.6	0	0	108.9	P32	P32-E34 PolarHBondContact O-N 3.42Å
35	N	27.1	Very low	32.4	Very low	150 Å²	150	149.9 Å²	149.9	80%	0.802	79%	0.789	S	S	*	*			trans	147.7	69.9	156	-75.4	-27.2	0	0	0	107.8	C33 P37	C33-N35 PolarHBondContact O-N 2.79Å; N35-P37 WeakPolarHBondContact O-CD 3.01Å
36	M	24.5	Very low	35.1	Very low	183 Å²	183	147.7 Å²	147.7	90%	0.901	77%	0.771	S	S	*	*			trans	-69.7	110	161.6	-75.7	-71.4	-137.3	0	0	107.5	K38	M36-K38 PolarHBondContact O-N 3.18Å
37	P	28.9	Very low	38	Very low	116 Å²	116	144.7 Å²	144.7	75%	0.753	75%	0.746	S	S	*	*			trans	-71.4	128.6	163.8	-0.1	21.1	0	0	0	106.3	N35	N35-P37 WeakPolarHBondContact O-CD 3.01Å
38	K	29.3	Very low	41.1	Very low	185 Å²	185	138.8 Å²	138.8	80%	0.804	72%	0.721	S	S	*	*			trans	-32.5	134.3	174.6	-63.3	167	179.5	175.8	0	112.3	M36 N40	M36-K38 PolarHBondContact O-N 3.18Å; K38-N40 VanDerWaalsContact C-N 3.31Å; K38-N40 PolarHBondContact O-N 3.09Å
39	E	35	Very low	44.2	Very low	194 Å²	194	133.1 Å²	133.1	91%	0.907	69%	0.687	S	S	*	*			trans	-41.4	93	164.3	-79.4	173.2	128.2	0	0	110.2	E41	E39-E41 VanDerWaalsContact C-N 3.27Å; E39-E41 PolarHBondContact O-N 3.04Å
40	N	31.1	Very low	47.6	Very low	143 Å²	143	127.4 Å²	127.4	77%	0.765	67%	0.671	S	S	*	*			trans	-81.2	85.6	172.5	-78.4	-25.3	0	0	0	107.4	K38 L42	K38-N40 VanDerWaalsContact C-N 3.31Å; K38-N40 PolarHBondContact O-N 3.09Å; N40-L42 PolarHBondContact O-N 3.3Å
41	E	36.7	Very low	50.7	Low	172 Å²	172	124.3 Å²	124.3	80%	0.804	65%	0.652	S	S	*	*			trans	22.7	67	136.2	-75.1	-176.1	137.6	0	0	115.9	E39 R43	E39-E41 VanDerWaalsContact C-N 3.27Å; E39-E41 PolarHBondContact O-N 3.04Å; E41-R43 PolarHBondContact O-N 3.15Å
42	L	43.9	Very low	53.9	Low	129 Å²	129	120.3 Å²	120.3	68%	0.675	62%	0.62	S	S	*	*			trans	-66.3	90.1	140.3	-178.3	74.3	0	0	0	103.8	N40 T44	N40-L42 PolarHBondContact O-N 3.3Å; L42-T44 PolarHBondContact O-N 3.43Å
43	R	42.7	Very low	56.7	Low	222 Å²	222	118.1 Å²	118.1	84%	0.838	61%	0.605	S	S	*	*			trans	-33.7	90.8	178.1	-93.7	-177	-93.1	-150.8	-8.9	109.5	E41 K45	E41-R43 PolarHBondContact O-N 3.15Å; R43-K45 PolarHBondContact O-N 3.48Å
44	T	53.5	Low	59.8	Low	92 Å²	92	120.6 Å²	120.6	56%	0.564	60%	0.597	S	S	*	*			trans	-65.8	95.7	157.4	46	0	0	0	0	100.1	L42 T46	L42-T44 PolarHBondContact O-N 3.43Å; T44-T46 PolarHBondContact O-N 3.23Å
45	K	70.3	Confident	63.1	Low	173 Å²	173	117.9 Å²	117.9	75%	0.752	59%	0.588	S	S	*	*			trans	-63.6	96.6	-171.4	-173.3	178	-178.9	-178.6	0	105	R43 L47	R43-K45 PolarHBondContact O-N 3.48Å; K45-L47 PolarHBondContact O-N 3.42Å
46	T	81.8	Confident	66.2	Low	70 Å²	70	113.2 Å²	113.2	43%	0.429	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-64.2	121.1	179.2	42.2	0	0	0	0	106.1	T44 N285 S287	T44-T46 PolarHBondContact O-N 3.23Å; T46-N285 CarbonylContact C-O 3.57Å; T46-N285 WeakPolarHBondContact CA-O 3.37Å; T46-N285 HydrophobicContact CG2-CB 4.41Å; T46-S287 WeakPolarHBondContact CB-OG 3.25Å; T46-S287 WeakPolarHBondContact CG2-OG 3.47Å
47	L	89	Confident	69.4	Low	49 Å²	49	105.1 Å²	105.1	26%	0.257	52%	0.523	S	S	.	.	B	Isolated β-bridge	trans	-86.1	116.8	-178	-169	69.3	0	0	0	107.8	K45 N285 I286 S287 L391 H392	K45-L47 PolarHBondContact O-N 3.42Å; L47-N285 PolarHBondContact N-O 3.39Å; L47-I286 WeakPolarHBondContact O-CA 3.28Å; L47-S287 PolarHBondContact O-N 3.27Å; L47-S287 VanDerWaalsContact O-N 3.12Å; L47-L391 HydrophobicContact CB-CD1 4.27Å; L47-L391 HydrophobicContact CD2-CD1 3.43Å; L47-L391 VanDerWaalsContact CD2-CD1 3.43Å; L47-L391 HydrophobicContact CD2-CG 4.39Å; L47-L391 HydrophobicContact CG-CD1 3.54Å; L47-H392 WeakPolarHBondContact CD2-O 3.45Å
48	V	90.4	Very high	72.3	Confident	49 Å²	49	102.7 Å²	102.7	30%	0.297	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-97	141.6	174.2	177.7	0	0	0	0	108.5	E288 F292	V48-E288 HydrophobicContact CG1-CB 4.02Å; V48-E288 HydrophobicContact CG2-CB 4.22Å; V48-E288 HydrophobicContact CG2-CG 4.24Å; V48-F292 HydrophobicContact CG1-CE2 4.16Å
49	P	91.8	Very high	75.3	Confident	5 Å²	5	98.8 Å²	98.8	3%	0.032	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-56.4	141.2	172.5	-21.8	30.8	0	0	0	112	L289 F292 I295 A389 L391	P49-L289 HydrophobicContact CG-CD2 3.7Å; P49-F292 HydrophobicContact CB-CD2 3.73Å; P49-F292 HydrophobicContact CB-CE2 3.73Å; P49-F292 HydrophobicContact CB-CG 4.2Å; P49-F292 HydrophobicContact CB-CZ 4.2Å; P49-F292 HydrophobicContact CG-CD2 3.75Å; P49-F292 HydrophobicContact CG-CE2 3.95Å; P49-F292 WeakPolarHBondContact O-CZ 3.34Å; P49-I295 HydrophobicContact CB-CG2 4.16Å; P49-I295 HydrophobicContact CG-CD1 3.91Å; P49-I295 HydrophobicContact CG-CG1 4.45Å; P49-I295 HydrophobicContact CG-CG2 4.25Å; P49-A389 HydrophobicContact CB-CB 3.89Å; P49-L391 HydrophobicContact CG-CD1 4.5Å; P49-L391 HydrophobicContact CG-CD2 4.31Å
50	A	90.8	Very high	77.9	Confident	56 Å²	56	91.9 Å²	91.9	46%	0.463	46%	0.461	S	S	.	.	B	Isolated β-bridge	trans	-106.5	138.3	177.4	0	0	0	0	0	110.9	A389 K390	A50-A389 CarbonylContact O-C 3.52Å; A50-A389 WeakPolarHBondContact O-CA 3.28Å; A50-K390 PolarHBondContact N-O 3.09Å; A50-K390 PolarHBondContact O-N 3.09Å
51	Q	91.1	Very high	80.8	Confident	97 Å²	97	86 Å²	86	45%	0.453	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-65.9	145.6	169.6	-161.4	66.1	29.3	0	0	110.1	A386	Q51-A386 PolarHBondContact NE2-O 2.72Å
52	R	91.6	Very high	83.2	Confident	22 Å²	22	83.7 Å²	83.7	8%	0.083	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-66.5	143.4	177.4	-63.1	-71.8	-179.7	158.4	-1.1	111	E296 Y385 K388	R52-E296 IonicContact CZ-OE2 3.45Å; R52-E296 IonicContact NH2-OE1 3.37Å; R52-E296 PolarHBondContact NH2-OE1 3.27Å; R52-E296 IonicContact NH2-OE2 2.7Å; R52-E296 PolarHBondContact NH2-OE2 2.86Å; R52-Y385 HydrophobicContact CG-CE1 4.33Å; R52-Y385 PolarHBondContact NH1-OH 3.44Å; R52-Y385 VanDerWaalsContact NH1-OH 3.13Å; R52-K388 WeakPolarHBondContact CG-O 3.35Å; R52-K388 PolarHBondContact NE-O 2.74Å
53	T	91.6	Very high	85.3	Confident	75 Å²	75	80 Å²	80	46%	0.46	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-82.1	155.9	174	64.2	0	0	0	0	111	N55 E56 C57	T53-N55 PolarHBondContact O-N 3.02Å; T53-E56 PolarHBondContact N-OE2 3.24Å; T53-E56 VanDerWaalsContact N-OE2 3.09Å; T53-E56 PolarHBondContact O-N 3.19Å; T53-E56 VanDerWaalsContact O-N 3.15Å; T53-E56 WeakPolarHBondContact OG1-CG 3.34Å; T53-E56 PolarHBondContact OG1-N 3.49Å; T53-E56 PolarHBondContact OG1-OE2 2.79Å; T53-C57 PolarHBondContact O-N 3.45Å; T53-C57 VanDerWaalsContact O-N 3.15Å; T53-C57 PolarHBondContact O-SG 3.43Å
54	Y	91	Very high	87.4	Confident	178 Å²	178	71.9 Å²	71.9	70%	0.698	39%	0.389	S	S	*	.	H	α-helix	trans	-56.5	-38.6	176.1	178	-107.3	0	0	0	112.6	E56 C57 I58	Y54-E56 PolarHBondContact O-N 3.2Å; Y54-C57 WeakPolarHBondContact O-CB 3.47Å; Y54-C57 PolarHBondContact O-N 3.24Å; Y54-I58 HydrophobicContact CD1-CD1 3.66Å; Y54-I58 HydrophobicContact CD1-CG1 4.46Å; Y54-I58 HydrophobicContact CE1-CD1 3.13Å; Y54-I58 HydrophobicContact CE1-CG1 4.05Å; Y54-I58 HydrophobicContact CE2-CD1 4.32Å; Y54-I58 HydrophobicContact CE2-CG1 4.41Å; Y54-I58 HydrophobicContact CG-CD1 4.45Å; Y54-I58 PolarHBondContact O-N 3.35Å
55	N	93.6	Very high	89	Confident	115 Å²	115	75.1 Å²	75.1	62%	0.615	39%	0.391	S	S	*	.	H	α-helix	trans	-63.7	-40.8	178	-67.2	-6.5	0	0	0	112	T53 C57 I58 V59	T53-N55 PolarHBondContact O-N 3.02Å; N55-C57 VanDerWaalsContact C-N 3.32Å; N55-C57 PolarHBondContact O-N 3.28Å; N55-I58 PolarHBondContact O-N 2.89Å; N55-V59 WeakPolarHBondContact O-CG2 3.27Å; N55-V59 PolarHBondContact O-N 3.27Å
56	E	91.4	Very high	90	Very high	52 Å²	52	74.5 Å²	74.5	24%	0.243	38%	0.384	C	S	.	.	H	α-helix	trans	-63.4	-39.5	174.7	-73.5	177.2	131.1	0	0	111.5	T53 Y54 V59 Y60 Y385 K390	T53-E56 PolarHBondContact N-OE2 3.24Å; T53-E56 VanDerWaalsContact N-OE2 3.09Å; T53-E56 PolarHBondContact O-N 3.19Å; T53-E56 VanDerWaalsContact O-N 3.15Å; T53-E56 WeakPolarHBondContact OG1-CG 3.34Å; T53-E56 PolarHBondContact OG1-N 3.49Å; T53-E56 PolarHBondContact OG1-OE2 2.79Å; Y54-E56 PolarHBondContact O-N 3.2Å; E56-V59 PolarHBondContact O-N 3.3Å; E56-Y60 WeakPolarHBondContact O-CB 3.05Å; E56-Y60 PolarHBondContact O-N 3.31Å; E56-Y385 HydrophobicContact CB-CE1 4.47Å; E56-K390 IonicContact OE1-NZ 2.89Å; E56-K390 PolarHBondContact OE1-NZ 3.29Å
57	C	91.3	Very high	90.4	Very high	14 Å²	14	71.2 Å²	71.2	10%	0.095	36%	0.364	C	S	.	.	H	α-helix	trans	-64.2	-38.8	176.4	-64.5	0	0	0	0	112.4	T53 Y54 N55 Y60 A61	T53-C57 PolarHBondContact O-N 3.45Å; T53-C57 VanDerWaalsContact O-N 3.15Å; T53-C57 PolarHBondContact O-SG 3.43Å; Y54-C57 WeakPolarHBondContact O-CB 3.47Å; Y54-C57 PolarHBondContact O-N 3.24Å; N55-C57 VanDerWaalsContact C-N 3.32Å; N55-C57 PolarHBondContact O-N 3.28Å; C57-Y60 PolarHBondContact O-N 3.48Å; C57-A61 WeakPolarHBondContact O-CB 3.21Å; C57-A61 PolarHBondContact O-N 2.73Å
58	I	90.8	Very high	90.4	Very high	64 Å²	64	70 Å²	70	33%	0.328	36%	0.361	S	S	.	.	H	α-helix	trans	-64.5	-47.2	174	-68.5	166.2	0	0	0	110.6	Y54 N55 Y60 A61 L62	Y54-I58 HydrophobicContact CD1-CD1 3.66Å; Y54-I58 HydrophobicContact CD1-CG1 4.46Å; Y54-I58 HydrophobicContact CE1-CD1 3.13Å; Y54-I58 HydrophobicContact CE1-CG1 4.05Å; Y54-I58 HydrophobicContact CE2-CD1 4.32Å; Y54-I58 HydrophobicContact CE2-CG1 4.41Å; Y54-I58 HydrophobicContact CG-CD1 4.45Å; Y54-I58 PolarHBondContact O-N 3.35Å; N55-I58 PolarHBondContact O-N 2.89Å; I58-Y60 PolarHBondContact O-N 3.18Å; I58-A61 WeakPolarHBondContact O-CB 3.31Å; I58-A61 PolarHBondContact O-N 3.28Å; I58-A61 VanDerWaalsContact O-N 3.11Å; I58-L62 HydrophobicContact CG2-CD1 3.98Å; I58-L62 HydrophobicContact CG2-CG 4.3Å; I58-L62 WeakPolarHBondContact O-CG 3.4Å; I58-L62 PolarHBondContact O-N 3.09Å
59	V	92.1	Very high	90.6	Very high	103 Å²	103	70.5 Å²	70.5	62%	0.624	37%	0.366	S	S	*	.	H	α-helix	trans	-60.2	-40.1	178.9	174.4	0	0	0	0	110.6	N55 E56 L62 G63	N55-V59 WeakPolarHBondContact O-CG2 3.27Å; N55-V59 PolarHBondContact O-N 3.27Å; E56-V59 PolarHBondContact O-N 3.3Å; V59-L62 PolarHBondContact O-N 3.18Å; V59-G63 PolarHBondContact O-N 3.03Å
60	Y	90.1	Very high	90.7	Very high	50 Å²	50	71.8 Å²	71.8	20%	0.196	37%	0.372	C	S	.	.	H	α-helix	trans	-62.6	-46.2	173.3	179	-103.6	0	0	0	112.3	E56 C57 I58 L62 G63 E64 Y385	E56-Y60 WeakPolarHBondContact O-CB 3.05Å; E56-Y60 PolarHBondContact O-N 3.31Å; C57-Y60 PolarHBondContact O-N 3.48Å; I58-Y60 PolarHBondContact O-N 3.18Å; Y60-L62 VanDerWaalsContact C-N 3.25Å; Y60-L62 PolarHBondContact O-N 3.15Å; Y60-G63 WeakPolarHBondContact O-CA 3.33Å; Y60-G63 PolarHBondContact O-N 3.08Å; Y60-E64 HydrophobicContact CE1-CG 4.09Å; Y60-E64 HydrophobicContact CE2-CG 4.05Å; Y60-E64 PolarHBondContact O-N 3.02Å; Y60-E64 VanDerWaalsContact O-N 3.11Å; Y60-Y385 AromaticContact CD1-CD1 3.87Å; Y60-Y385 HydrophobicContact CD1-CD1 3.87Å; Y60-Y385 AromaticContact CD1-CD2 3.85Å; Y60-Y385 HydrophobicContact CD1-CD2 3.85Å; Y60-Y385 HydrophobicContact CD1-CE2 4.5Å; Y60-Y385 AromaticContact CD1-CG 3.5Å; Y60-Y385 HydrophobicContact CD1-CG 3.5Å; Y60-Y385 VanDerWaalsContact CD1-CG 3.5Å; Y60-Y385 AromaticContact CD2-CD2 3.61Å; Y60-Y385 HydrophobicContact CD2-CD2 3.61Å; Y60-Y385 AromaticContact CD2-CE2 3.64Å; Y60-Y385 HydrophobicContact CD2-CE2 3.64Å; Y60-Y385 HydrophobicContact CD2-CG 4.12Å; Y60-Y385 HydrophobicContact CE1-CD2 4.06Å; Y60-Y385 AromaticContact CE1-CG 3.89Å; Y60-Y385 HydrophobicContact CE1-CG 3.89Å; Y60-Y385 AromaticContact CE2-CD2 3.86Å; Y60-Y385 HydrophobicContact CE2-CD2 3.86Å; Y60-Y385 HydrophobicContact CE2-CE2 4.22Å; Y60-Y385 HydrophobicContact CE2-CG 4.48Å; Y60-Y385 AromaticContact CG-CD1 3.83Å; Y60-Y385 HydrophobicContact CG-CD1 3.83Å; Y60-Y385 AromaticContact CG-CD2 3.62Å; Y60-Y385 HydrophobicContact CG-CD2 3.62Å; Y60-Y385 HydrophobicContact CG-CE1 4.03Å; Y60-Y385 AromaticContact CG-CE2 3.82Å; Y60-Y385 HydrophobicContact CG-CE2 3.82Å; Y60-Y385 AromaticContact CG-CG 3.62Å; Y60-Y385 HydrophobicContact CG-CG 3.62Å
61	A	90.3	Very high	90.8	Very high	19 Å²	19	69.8 Å²	69.8	16%	0.157	35%	0.354	C	S	.	.	H	α-helix	trans	-59.1	-36.6	176.9	0	0	0	0	0	112.5	C57 I58 F378 I382	C57-A61 WeakPolarHBondContact O-CB 3.21Å; C57-A61 PolarHBondContact O-N 2.73Å; I58-A61 WeakPolarHBondContact O-CB 3.31Å; I58-A61 PolarHBondContact O-N 3.28Å; I58-A61 VanDerWaalsContact O-N 3.11Å; A61-F378 HydrophobicContact CB-CZ 4.1Å; A61-I382 HydrophobicContact CB-CD1 3.76Å; A61-I382 HydrophobicContact CB-CG1 4.05Å
62	L	88.3	Confident	90.8	Very high	123 Å²	123	69 Å²	69	64%	0.644	36%	0.356	S	S	*	.	H	α-helix	trans	-72.7	-30.6	174.2	-66.5	173.2	0	0	0	112.8	I58 V59 Y60 W65	I58-L62 HydrophobicContact CG2-CD1 3.98Å; I58-L62 HydrophobicContact CG2-CG 4.3Å; I58-L62 WeakPolarHBondContact O-CG 3.4Å; I58-L62 PolarHBondContact O-N 3.09Å; V59-L62 PolarHBondContact O-N 3.18Å; Y60-L62 VanDerWaalsContact C-N 3.25Å; Y60-L62 PolarHBondContact O-N 3.15Å; L62-W65 WeakPolarHBondContact O-CB 3.38Å
63	G	87.1	Confident	91	Very high	52 Å²	52	70.9 Å²	70.9	54%	0.536	37%	0.37	S	S	.	.	H	α-helix	trans	-65.5	-38.1	173.8	0	0	0	0	0	112.7	V59 Y60 W65	V59-G63 PolarHBondContact O-N 3.03Å; Y60-G63 WeakPolarHBondContact O-CA 3.33Å; Y60-G63 PolarHBondContact O-N 3.08Å; G63-W65 PolarHBondContact O-N 3.12Å; G63-W65 VanDerWaalsContact O-N 3.1Å
64	E	87.3	Confident	91.1	Very high	52 Å²	52	67.5 Å²	67.5	24%	0.243	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	35.2	177.4	-63	-71.6	142.1	0	0	112.7	Y60 R66 C67 A68 F378 R381	Y60-E64 HydrophobicContact CE1-CG 4.09Å; Y60-E64 HydrophobicContact CE2-CG 4.05Å; Y60-E64 PolarHBondContact O-N 3.02Å; Y60-E64 VanDerWaalsContact O-N 3.11Å; E64-R66 PolarHBondContact O-N 2.73Å; E64-R66 VanDerWaalsContact O-N 3.11Å; E64-C67 PolarHBondContact O-N 3.11Å; E64-A68 PolarHBondContact O-N 2.7Å; E64-F378 HydrophobicContact CB-CE2 4.29Å; E64-R381 IonicContact OE2-NH1 3.55Å; E64-R381 PolarHBondContact OE2-NH1 3.15Å
65	W	88.2	Confident	91.2	Very high	159 Å²	159	62.1 Å²	62.1	60%	0.602	34%	0.335	S	S	*	.	H	α-helix	trans	-59.6	-26.8	-174.5	68.9	-90.3	0	0	0	113.7	L62 G63 A68 C69	L62-W65 WeakPolarHBondContact O-CB 3.38Å; G63-W65 PolarHBondContact O-N 3.12Å; G63-W65 VanDerWaalsContact O-N 3.1Å; W65-A68 PolarHBondContact O-N 2.81Å; W65-C69 VanDerWaalsContact O-CB 3.27Å; W65-C69 WeakPolarHBondContact O-CB 3.39Å; W65-C69 PolarHBondContact O-N 2.78Å
66	R	91	Very high	91.2	Very high	161 Å²	161	60.4 Å²	60.4	61%	0.608	33%	0.329	S	S	*	.	H	α-helix	trans	-61.9	-47.7	178.2	-64.2	179	-179.9	171.2	-0.4	111.1	E64 C69 L70	E64-R66 PolarHBondContact O-N 2.73Å; E64-R66 VanDerWaalsContact O-N 3.11Å; R66-C69 PolarHBondContact O-N 3.33Å; R66-L70 WeakPolarHBondContact O-CG 3.3Å; R66-L70 PolarHBondContact O-N 2.84Å
67	C	89.9	Confident	91.3	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66	-43.6	176.9	-159.7	0	0	0	0	111.4	E64 C69 L70 T71 E139 F378 R381	E64-C67 PolarHBondContact O-N 3.11Å; C67-C69 VanDerWaalsContact C-N 3.33Å; C67-C69 PolarHBondContact O-N 2.85Å; C67-L70 PolarHBondContact O-N 3.09Å; C67-T71 WeakPolarHBondContact O-CB 3.02Å; C67-T71 WeakPolarHBondContact O-CG2 3.29Å; C67-T71 PolarHBondContact O-N 3.36Å; C67-T71 PolarHBondContact O-OG1 2.93Å; C67-E139 VanDerWaalsContact CB-OE1 3.28Å; C67-E139 WeakPolarHBondContact CB-OE1 3.39Å; C67-E139 WeakPolarHBondContact CB-OE2 3.37Å; C67-E139 PolarHBondContact SG-OE2 3.08Å; C67-F378 HydrophobicContact CB-CD2 4.18Å; C67-R381 VanDerWaalsContact SG-CZ 3.56Å; C67-R381 PolarHBondContact SG-NH2 2.85Å; C67-R381 VanDerWaalsContact SG-NH2 3.36Å
68	A	89.6	Confident	91.3	Very high	24 Å²	24	61.9 Å²	61.9	20%	0.198	34%	0.338	C	S	.	.	H	α-helix	trans	-58.5	-45	176.5	0	0	0	0	0	111.5	E64 W65 T71 T72 F378	E64-A68 PolarHBondContact O-N 2.7Å; W65-A68 PolarHBondContact O-N 2.81Å; A68-T71 WeakPolarHBondContact CA-OG1 3.42Å; A68-T71 PolarHBondContact O-OG1 3.17Å; A68-T72 WeakPolarHBondContact O-CG2 3.38Å; A68-T72 PolarHBondContact O-N 3.43Å; A68-T72 PolarHBondContact O-OG1 2.98Å; A68-F378 HydrophobicContact CB-CD2 4.25Å; A68-F378 HydrophobicContact CB-CE1 4.24Å; A68-F378 HydrophobicContact CB-CE2 3.83Å; A68-F378 HydrophobicContact CB-CZ 3.8Å
69	C	92.8	Very high	91.3	Very high	60 Å²	60	63.5 Å²	63.5	41%	0.405	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-51.5	176.5	-175	0	0	0	0	111.4	W65 R66 C67 T71 T72 V73	W65-C69 VanDerWaalsContact O-CB 3.27Å; W65-C69 WeakPolarHBondContact O-CB 3.39Å; W65-C69 PolarHBondContact O-N 2.78Å; R66-C69 PolarHBondContact O-N 3.33Å; C67-C69 VanDerWaalsContact C-N 3.33Å; C67-C69 PolarHBondContact O-N 2.85Å; C69-T71 PolarHBondContact O-N 2.71Å; C69-T72 PolarHBondContact O-N 3.34Å; C69-T72 PolarHBondContact O-OG1 2.88Å; C69-V73 WeakPolarHBondContact O-CG2 3.44Å; C69-V73 PolarHBondContact O-N 3.01Å
70	L	94.4	Very high	91.3	Very high	31 Å²	31	63.3 Å²	63.3	16%	0.162	34%	0.341	C	S	.	.	H	α-helix	trans	-60.1	-44.2	180	-70.3	171.4	0	0	0	112.4	R66 C67 V73 L74 V132 V135 Y136 E139	R66-L70 WeakPolarHBondContact O-CG 3.3Å; R66-L70 PolarHBondContact O-N 2.84Å; C67-L70 PolarHBondContact O-N 3.09Å; L70-V73 PolarHBondContact O-N 3.44Å; L70-L74 WeakPolarHBondContact O-CB 3.29Å; L70-L74 VanDerWaalsContact O-CG 3.29Å; L70-L74 WeakPolarHBondContact O-CG 3.48Å; L70-L74 PolarHBondContact O-N 2.83Å; L70-V132 HydrophobicContact CD2-CG1 3.88Å; L70-V135 HydrophobicContact CD1-CG1 4.04Å; L70-V135 HydrophobicContact CD2-CG1 4.19Å; L70-Y136 HydrophobicContact CB-CD2 4.26Å; L70-E139 HydrophobicContact CD1-CB 4.15Å; L70-E139 HydrophobicContact CD1-CG 4.24Å
71	T	92.6	Very high	91.3	Very high	14 Å²	14	62.6 Å²	62.6	9%	0.086	34%	0.342	C	S	.	.	H	α-helix	trans	-62.1	-43.6	176	50.2	0	0	0	0	111.9	C67 A68 C69 L74 V75 Y136 F378	C67-T71 WeakPolarHBondContact O-CB 3.02Å; C67-T71 WeakPolarHBondContact O-CG2 3.29Å; C67-T71 PolarHBondContact O-N 3.36Å; C67-T71 PolarHBondContact O-OG1 2.93Å; A68-T71 WeakPolarHBondContact CA-OG1 3.42Å; A68-T71 PolarHBondContact O-OG1 3.17Å; C69-T71 PolarHBondContact O-N 2.71Å; T71-L74 PolarHBondContact O-N 3.26Å; T71-V75 WeakPolarHBondContact O-CB 3.34Å; T71-V75 VanDerWaalsContact O-CG2 3.23Å; T71-V75 WeakPolarHBondContact O-CG2 3.38Å; T71-V75 PolarHBondContact O-N 3.24Å; T71-Y136 HydrophobicContact CG2-CD2 4.1Å; T71-Y136 HydrophobicContact CG2-CE2 3.48Å; T71-Y136 VanDerWaalsContact CG2-CE2 3.48Å; T71-F378 HydrophobicContact CG2-CB 4.18Å
72	T	92.6	Very high	91.2	Very high	80 Å²	80	64.6 Å²	64.6	49%	0.491	36%	0.355	S	S	.	.	H	α-helix	trans	-64	-42.4	177	59.4	0	0	0	0	112.7	A68 C69 V75 T76	A68-T72 WeakPolarHBondContact O-CG2 3.38Å; A68-T72 PolarHBondContact O-N 3.43Å; A68-T72 PolarHBondContact O-OG1 2.98Å; C69-T72 PolarHBondContact O-N 3.34Å; C69-T72 PolarHBondContact O-OG1 2.88Å; T72-V75 PolarHBondContact O-N 3.44Å; T72-T76 WeakPolarHBondContact O-CB 3.37Å; T72-T76 VanDerWaalsContact O-CG2 3.22Å; T72-T76 WeakPolarHBondContact O-CG2 3.36Å; T72-T76 PolarHBondContact O-N 2.88Å; T72-T76 PolarHBondContact O-OG1 2.73Å
73	V	94.3	Very high	91.1	Very high	63 Å²	63	60.4 Å²	60.4	38%	0.382	34%	0.336	S	S	.	.	H	α-helix	trans	-63.3	-42.8	177	172.4	0	0	0	0	111	C69 L70 T76 G77 V132	C69-V73 WeakPolarHBondContact O-CG2 3.44Å; C69-V73 PolarHBondContact O-N 3.01Å; L70-V73 PolarHBondContact O-N 3.44Å; V73-T76 WeakPolarHBondContact CA-OG1 3.5Å; V73-T76 PolarHBondContact O-OG1 3.49Å; V73-G77 PolarHBondContact O-N 3.09Å; V73-V132 HydrophobicContact CG1-CG1 4.19Å
74	L	94.6	Very high	91.1	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-67.3	-47	177.6	-71.7	170.6	0	0	0	112.2	L70 T71 G77 I78 L129 V132 Y133 Y136 L375	L70-L74 WeakPolarHBondContact O-CB 3.29Å; L70-L74 VanDerWaalsContact O-CG 3.29Å; L70-L74 WeakPolarHBondContact O-CG 3.48Å; L70-L74 PolarHBondContact O-N 2.83Å; T71-L74 PolarHBondContact O-N 3.26Å; L74-G77 PolarHBondContact O-N 3.28Å; L74-I78 WeakPolarHBondContact O-CB 3.34Å; L74-I78 WeakPolarHBondContact O-CD1 3.3Å; L74-I78 WeakPolarHBondContact O-CG1 3.26Å; L74-I78 PolarHBondContact O-N 3.12Å; L74-L129 HydrophobicContact CD2-CD2 4.29Å; L74-L129 WeakPolarHBondContact CD2-O 3.33Å; L74-V132 HydrophobicContact CD2-CB 4.06Å; L74-V132 HydrophobicContact CD2-CG1 3.8Å; L74-V132 HydrophobicContact CG-CG1 3.88Å; L74-Y133 HydrophobicContact CD1-CD2 4.19Å; L74-Y136 HydrophobicContact CD1-CD1 4.13Å; L74-Y136 HydrophobicContact CD1-CD2 4.34Å; L74-Y136 HydrophobicContact CD1-CG 3.82Å; L74-L375 HydrophobicContact CB-CD2 3.57Å; L74-L375 HydrophobicContact CD1-CD2 4.25Å; L74-L375 HydrophobicContact CD1-CG 4.49Å
75	V	93.6	Very high	90.8	Very high	65 Å²	65	57.5 Å²	57.5	39%	0.394	32%	0.319	S	S	.	.	H	α-helix	trans	-62.3	-46.1	179.5	169.7	0	0	0	0	110.6	T71 T72 G77 I78 I79 L375	T71-V75 WeakPolarHBondContact O-CB 3.34Å; T71-V75 VanDerWaalsContact O-CG2 3.23Å; T71-V75 WeakPolarHBondContact O-CG2 3.38Å; T71-V75 PolarHBondContact O-N 3.24Å; T72-V75 PolarHBondContact O-N 3.44Å; V75-G77 PolarHBondContact O-N 3.04Å; V75-I78 PolarHBondContact O-N 3.34Å; V75-I79 HydrophobicContact CG1-CD1 3.7Å; V75-I79 HydrophobicContact CG1-CG1 4.43Å; V75-I79 WeakPolarHBondContact O-CB 3.19Å; V75-I79 WeakPolarHBondContact O-CD1 3.47Å; V75-I79 WeakPolarHBondContact O-CG1 3.12Å; V75-I79 PolarHBondContact O-N 2.75Å; V75-L375 HydrophobicContact CG2-CD2 3.99Å
76	T	93.4	Very high	90.6	Very high	79 Å²	79	54.3 Å²	54.3	49%	0.485	32%	0.317	S	S	.	.	H	α-helix	trans	-62.8	-42.5	176.7	52.4	0	0	0	0	111.8	T72 V73 I79 L80	T72-T76 WeakPolarHBondContact O-CB 3.37Å; T72-T76 VanDerWaalsContact O-CG2 3.22Å; T72-T76 WeakPolarHBondContact O-CG2 3.36Å; T72-T76 PolarHBondContact O-N 2.88Å; T72-T76 PolarHBondContact O-OG1 2.73Å; V73-T76 WeakPolarHBondContact CA-OG1 3.5Å; V73-T76 PolarHBondContact O-OG1 3.49Å; T76-I79 PolarHBondContact O-N 3.4Å; T76-L80 WeakPolarHBondContact O-CG 3.48Å; T76-L80 PolarHBondContact O-N 2.74Å
77	G	92.4	Very high	90.2	Very high	9 Å²	9	50.9 Å²	50.9	9%	0.093	31%	0.306	C	S	.	.	H	α-helix	trans	-61.2	-45.1	174.9	0	0	0	0	0	113.7	V73 L74 V75 I79 L80 V81	V73-G77 PolarHBondContact O-N 3.09Å; L74-G77 PolarHBondContact O-N 3.28Å; V75-G77 PolarHBondContact O-N 3.04Å; G77-I79 PolarHBondContact O-N 3.08Å; G77-L80 PolarHBondContact O-N 3.34Å; G77-V81 WeakPolarHBondContact O-CG2 3.46Å; G77-V81 PolarHBondContact O-N 2.67Å
78	I	92	Very high	89.6	Confident	87 Å²	87	57.2 Å²	57.2	45%	0.446	34%	0.336	S	S	.	.	H	α-helix	trans	-64.2	-40.5	176.9	-68	163.2	0	0	0	110.8	L74 V75 L80 V81 S82 L375	L74-I78 WeakPolarHBondContact O-CB 3.34Å; L74-I78 WeakPolarHBondContact O-CD1 3.3Å; L74-I78 WeakPolarHBondContact O-CG1 3.26Å; L74-I78 PolarHBondContact O-N 3.12Å; V75-I78 PolarHBondContact O-N 3.34Å; I78-L80 VanDerWaalsContact C-N 3.34Å; I78-L80 PolarHBondContact O-N 3Å; I78-V81 PolarHBondContact O-N 3.14Å; I78-S82 VanDerWaalsContact O-CB 3.28Å; I78-S82 WeakPolarHBondContact O-CB 3.02Å; I78-S82 PolarHBondContact O-N 3.4Å; I78-S82 PolarHBondContact O-OG 3.2Å; I78-L375 HydrophobicContact CD1-CD2 3.77Å
79	I	91.8	Very high	89	Confident	99 Å²	99	60.9 Å²	60.9	51%	0.508	35%	0.352	S	S	.	.	H	α-helix	trans	-61.7	-43.1	175.2	-70.3	166.2	0	0	0	110.5	V75 T76 G77 S82 S83	V75-I79 HydrophobicContact CG1-CD1 3.7Å; V75-I79 HydrophobicContact CG1-CG1 4.43Å; V75-I79 WeakPolarHBondContact O-CB 3.19Å; V75-I79 WeakPolarHBondContact O-CD1 3.47Å; V75-I79 WeakPolarHBondContact O-CG1 3.12Å; V75-I79 PolarHBondContact O-N 2.75Å; T76-I79 PolarHBondContact O-N 3.4Å; G77-I79 PolarHBondContact O-N 3.08Å; I79-S82 WeakPolarHBondContact CA-OG 3.39Å; I79-S82 PolarHBondContact O-OG 3.39Å; I79-S83 VanDerWaalsContact O-CB 3.3Å; I79-S83 WeakPolarHBondContact O-CB 3.47Å; I79-S83 PolarHBondContact O-N 3.45Å; I79-S83 PolarHBondContact O-OG 2.77Å
80	L	90.3	Very high	88.4	Confident	98 Å²	98	61.2 Å²	61.2	51%	0.513	35%	0.352	S	S	.	.	H	α-helix	trans	-64	-47.4	177.9	-71.7	171.2	0	0	0	111.8	T76 G77 I78 S83 C84	T76-L80 WeakPolarHBondContact O-CG 3.48Å; T76-L80 PolarHBondContact O-N 2.74Å; G77-L80 PolarHBondContact O-N 3.34Å; I78-L80 VanDerWaalsContact C-N 3.34Å; I78-L80 PolarHBondContact O-N 3Å; L80-S83 PolarHBondContact O-N 2.95Å; L80-S83 PolarHBondContact O-OG 2.81Å; L80-C84 PolarHBondContact O-N 3.19Å
81	V	90.1	Very high	87.4	Confident	35 Å²	35	63.3 Å²	63.3	21%	0.212	36%	0.363	C	S	.	.	H	α-helix	trans	-64.2	-44.5	178.6	173.7	0	0	0	0	111.6	G77 I78 S83 C84 G85 L122 V125 L129	G77-V81 WeakPolarHBondContact O-CG2 3.46Å; G77-V81 PolarHBondContact O-N 2.67Å; I78-V81 PolarHBondContact O-N 3.14Å; V81-S83 PolarHBondContact O-N 3.43Å; V81-C84 VanDerWaalsContact O-CB 3.3Å; V81-C84 WeakPolarHBondContact O-CB 3.23Å; V81-C84 PolarHBondContact O-N 2.98Å; V81-C84 VanDerWaalsContact O-N 3.16Å; V81-G85 PolarHBondContact O-N 3.23Å; V81-G85 VanDerWaalsContact O-N 3.15Å; V81-L122 HydrophobicContact CG1-CD1 4.29Å; V81-V125 HydrophobicContact CG2-CG1 3.98Å; V81-L129 HydrophobicContact CG2-CD1 3.93Å
82	S	88.2	Confident	86.5	Confident	61 Å²	61	70.9 Å²	70.9	43%	0.427	39%	0.391	S	S	.	.	H	α-helix	trans	-65	-38.5	178.1	56.3	0	0	0	0	112.2	I78 I79 C84 G85 V86	I78-S82 VanDerWaalsContact O-CB 3.28Å; I78-S82 WeakPolarHBondContact O-CB 3.02Å; I78-S82 PolarHBondContact O-N 3.4Å; I78-S82 PolarHBondContact O-OG 3.2Å; I79-S82 WeakPolarHBondContact CA-OG 3.39Å; I79-S82 PolarHBondContact O-OG 3.39Å; S82-C84 PolarHBondContact O-N 3.34Å; S82-G85 PolarHBondContact O-N 3.13Å; S82-G85 VanDerWaalsContact O-N 3.16Å; S82-V86 WeakPolarHBondContact O-CG2 3.26Å; S82-V86 PolarHBondContact O-N 3.1Å
83	S	87.1	Confident	85.8	Confident	35 Å²	35	72.3 Å²	72.3	25%	0.245	39%	0.393	C	S	.	.	H	α-helix	trans	-61.2	-31.8	174.8	78.9	0	0	0	0	112.5	I79 L80 V81 K87	I79-S83 VanDerWaalsContact O-CB 3.3Å; I79-S83 WeakPolarHBondContact O-CB 3.47Å; I79-S83 PolarHBondContact O-N 3.45Å; I79-S83 PolarHBondContact O-OG 2.77Å; L80-S83 PolarHBondContact O-N 2.95Å; L80-S83 PolarHBondContact O-OG 2.81Å; V81-S83 PolarHBondContact O-N 3.43Å; S83-K87 WeakPolarHBondContact O-CB 3.38Å; S83-K87 VanDerWaalsContact O-CG 3.31Å; S83-K87 WeakPolarHBondContact O-CG 3.09Å; S83-K87 PolarHBondContact O-N 3.17Å; S83-K87 VanDerWaalsContact O-N 3.16Å
84	C	86.8	Confident	84.6	Confident	7 Å²	7	74 Å²	74	5%	0.047	40%	0.4	C	S	.	.	H	α-helix	trans	-68.7	-47.4	174.2	-177	0	0	0	0	111.6	L80 V81 S82 V86 K87 Q88 F113 C117	L80-C84 PolarHBondContact O-N 3.19Å; V81-C84 VanDerWaalsContact O-CB 3.3Å; V81-C84 WeakPolarHBondContact O-CB 3.23Å; V81-C84 PolarHBondContact O-N 2.98Å; V81-C84 VanDerWaalsContact O-N 3.16Å; S82-C84 PolarHBondContact O-N 3.34Å; C84-V86 PolarHBondContact O-N 3.37Å; C84-K87 PolarHBondContact O-N 3.32Å; C84-Q88 PolarHBondContact O-N 3.39Å; C84-F113 HydrophobicContact CB-CE1 4.44Å; C84-F113 HydrophobicContact CB-CZ 4.19Å; C84-C117 VanDerWaalsContact CA-SG 3.52Å; C84-C117 HydrophobicContact CB-CB 4.41Å; C84-C117 WeakPolarHBondContact CB-SG 3.39Å; C84-C117 WeakPolarHBondContact SG-CA 3.3Å; C84-C117 WeakPolarHBondContact SG-CB 3.42Å; C84-C117 CovalentContact SG-SG 2.02Å; C84-C117 PolarHBondContact SG-SG 3.24Å
85	G	81.7	Confident	83.2	Confident	37 Å²	37	78 Å²	78	38%	0.381	43%	0.429	S	S	.	.	H	α-helix	trans	-60.8	-44.1	177.5	0	0	0	0	0	112.9	V81 S82 K87 Q88 L89	V81-G85 PolarHBondContact O-N 3.23Å; V81-G85 VanDerWaalsContact O-N 3.15Å; S82-G85 PolarHBondContact O-N 3.13Å; S82-G85 VanDerWaalsContact O-N 3.16Å; G85-K87 PolarHBondContact O-N 2.68Å; G85-Q88 PolarHBondContact O-N 2.87Å; G85-L89 PolarHBondContact O-N 3.39Å
86	V	84.4	Confident	81.7	Confident	92 Å²	92	79.5 Å²	79.5	56%	0.558	44%	0.442	S	S	*	.	H	α-helix	trans	-60.5	-46.7	176	174.3	0	0	0	0	110.6	S82 C84 Q88 L89 T90	S82-V86 WeakPolarHBondContact O-CG2 3.26Å; S82-V86 PolarHBondContact O-N 3.1Å; C84-V86 PolarHBondContact O-N 3.37Å; V86-Q88 PolarHBondContact O-N 2.98Å; V86-L89 PolarHBondContact O-N 3.09Å; V86-T90 PolarHBondContact O-N 2.81Å; V86-T90 PolarHBondContact O-OG1 2.89Å
87	K	81.3	Confident	80	Confident	88 Å²	88	82.9 Å²	82.9	38%	0.383	45%	0.452	S	S	.	.	H	α-helix	trans	-66.3	-37.6	179.2	-71.5	-170.3	-144	167.5	0	112.8	S83 C84 G85 L89 T90 I91 F113	S83-K87 WeakPolarHBondContact O-CB 3.38Å; S83-K87 VanDerWaalsContact O-CG 3.31Å; S83-K87 WeakPolarHBondContact O-CG 3.09Å; S83-K87 PolarHBondContact O-N 3.17Å; S83-K87 VanDerWaalsContact O-N 3.16Å; C84-K87 PolarHBondContact O-N 3.32Å; G85-K87 PolarHBondContact O-N 2.68Å; K87-L89 VanDerWaalsContact C-N 3.31Å; K87-L89 PolarHBondContact O-N 3.44Å; K87-T90 PolarHBondContact O-N 3.37Å; K87-I91 WeakPolarHBondContact O-CD1 3.36Å; K87-I91 VanDerWaalsContact O-CG1 3.24Å; K87-I91 WeakPolarHBondContact O-CG1 3.31Å; K87-I91 PolarHBondContact O-N 3.21Å; K87-F113 HydrophobicContact CB-CE1 4.18Å; K87-F113 HydrophobicContact CD-CD1 3.97Å; K87-F113 HydrophobicContact CD-CE1 3.41Å; K87-F113 VanDerWaalsContact CD-CE1 3.41Å; K87-F113 HydrophobicContact CD-CZ 3.82Å; K87-F113 HydrophobicContact CG-CE1 4.24Å
88	Q	77.5	Confident	77.9	Confident	133 Å²	133	88 Å²	88	62%	0.621	49%	0.487	S	S	*	.	H	α-helix	trans	-62.5	-41.1	174.7	-172.8	175.7	4.1	0	0	111.3	C84 G85 V86 I91 Y92	C84-Q88 PolarHBondContact O-N 3.39Å; G85-Q88 PolarHBondContact O-N 2.87Å; V86-Q88 PolarHBondContact O-N 2.98Å; Q88-I91 PolarHBondContact O-N 3.39Å; Q88-Y92 PolarHBondContact O-N 2.87Å
89	L	77.1	Confident	75.5	Confident	102 Å²	102	90.8 Å²	90.8	53%	0.534	50%	0.503	S	S	.	.	H	α-helix	trans	-65.2	-43.9	174.6	-174.5	66.5	0	0	0	111.8	G85 V86 K87 I91 Y92 M93	G85-L89 PolarHBondContact O-N 3.39Å; V86-L89 PolarHBondContact O-N 3.09Å; K87-L89 VanDerWaalsContact C-N 3.31Å; K87-L89 PolarHBondContact O-N 3.44Å; L89-I91 VanDerWaalsContact C-N 3.34Å; L89-I91 PolarHBondContact O-N 2.9Å; L89-Y92 PolarHBondContact O-N 3.47Å; L89-M93 HydrophobicContact CD1-CE 4.14Å; L89-M93 WeakPolarHBondContact O-CG 3.46Å; L89-M93 PolarHBondContact O-N 3.44Å
90	T	79.5	Confident	73.1	Confident	67 Å²	67	92.3 Å²	92.3	41%	0.411	52%	0.517	S	S	.	.	H	α-helix	trans	-61.2	-41.8	176.5	-56.2	0	0	0	0	111.8	V86 K87 M93 N94	V86-T90 PolarHBondContact O-N 2.81Å; V86-T90 PolarHBondContact O-OG1 2.89Å; K87-T90 PolarHBondContact O-N 3.37Å; T90-M93 PolarHBondContact O-N 3.05Å; T90-N94 WeakPolarHBondContact O-CB 3.15Å; T90-N94 VanDerWaalsContact O-CG 3.32Å; T90-N94 PolarHBondContact O-N 3.37Å
91	I	74.3	Confident	70.7	Confident	75 Å²	75	96.4 Å²	96.4	39%	0.385	53%	0.527	S	S	.	.	H	α-helix	trans	-63.8	-42.5	176.1	-67.8	162.5	0	0	0	110.7	K87 Q88 L89 N94 S95	K87-I91 WeakPolarHBondContact O-CD1 3.36Å; K87-I91 VanDerWaalsContact O-CG1 3.24Å; K87-I91 WeakPolarHBondContact O-CG1 3.31Å; K87-I91 PolarHBondContact O-N 3.21Å; Q88-I91 PolarHBondContact O-N 3.39Å; L89-I91 VanDerWaalsContact C-N 3.34Å; L89-I91 PolarHBondContact O-N 2.9Å; I91-N94 PolarHBondContact O-N 3.46Å; I91-S95 WeakPolarHBondContact O-CB 3.21Å; I91-S95 PolarHBondContact O-N 2.96Å
92	Y	74.4	Confident	68.5	Low	173 Å²	173	102.9 Å²	102.9	68%	0.678	55%	0.549	S	S	*	.	H	α-helix	trans	-62.7	-44.2	177.1	-171.7	-95.3	0	0	0	111.7	Q88 L89 S95	Q88-Y92 PolarHBondContact O-N 2.87Å; L89-Y92 PolarHBondContact O-N 3.47Å; Y92-S95 PolarHBondContact O-N 3.41Å; Y92-S95 PolarHBondContact O-OG 2.7Å
93	M	76.1	Confident	66.6	Low	109 Å²	109	103.9 Å²	103.9	54%	0.537	55%	0.554	S	S	.	*	H	α-helix	trans	-68.2	-34.7	177.1	-67.5	-65	-174.3	0	0	113.4	L89 T90 S96	L89-M93 HydrophobicContact CD1-CE 4.14Å; L89-M93 WeakPolarHBondContact O-CG 3.46Å; L89-M93 PolarHBondContact O-N 3.44Å; T90-M93 PolarHBondContact O-N 3.05Å; M93-S96 PolarHBondContact O-OG 3.37Å
94	N	70.6	Confident	64.7	Low	98 Å²	98	109.6 Å²	109.6	52%	0.524	58%	0.58	S	S	.	*	H	α-helix	trans	-80.1	-25.2	177	-71.3	-3	0	0	0	112.1	T90 I91 S96 Q97	T90-N94 WeakPolarHBondContact O-CB 3.15Å; T90-N94 VanDerWaalsContact O-CG 3.32Å; T90-N94 PolarHBondContact O-N 3.37Å; I91-N94 PolarHBondContact O-N 3.46Å; N94-S96 PolarHBondContact O-N 3.08Å; N94-Q97 CarbonylContact O-C 3.19Å; N94-Q97 WeakPolarHBondContact O-CA 3.15Å; N94-Q97 PolarHBondContact O-N 2.99Å
95	S	65.5	Low	62.9	Low	89 Å²	89	114.6 Å²	114.6	62%	0.622	62%	0.615	S	S	*	*	H	α-helix	trans	-65.7	-23.8	176.8	71.8	0	0	0	0	113.3	I91 Y92	I91-S95 WeakPolarHBondContact O-CB 3.21Å; I91-S95 PolarHBondContact O-N 2.96Å; Y92-S95 PolarHBondContact O-N 3.41Å; Y92-S95 PolarHBondContact O-OG 2.7Å
96	S	61.7	Low	61.3	Low	97 Å²	97	121.6 Å²	121.6	68%	0.678	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-8.4	171	59.7	0	0	0	0	113	M93 N94	M93-S96 PolarHBondContact O-OG 3.37Å; N94-S96 PolarHBondContact O-N 3.08Å
97	Q	56.6	Low	59.7	Low	149 Å²	149	122 Å²	122	70%	0.696	63%	0.627	S	S	*	*	S	Bend	trans	-137.4	94	-173.4	-133.3	161.6	24.8	0	0	110.5	N94	N94-Q97 CarbonylContact O-C 3.19Å; N94-Q97 WeakPolarHBondContact O-CA 3.15Å; N94-Q97 PolarHBondContact O-N 2.99Å
98	S	48.6	Very low	58.5	Low	116 Å²	116	126.3 Å²	126.3	81%	0.811	65%	0.645	S	S	*	*			trans	104	110.7	164.3	73.6	0	0	0	0	118.4
99	D	41	Very low	57.3	Low	146 Å²	146	126.9 Å²	126.9	78%	0.781	65%	0.648	S	S	*	*			trans	-53.4	157.9	142.8	-66.7	-57	0	0	0	111.3
100	T	41.9	Very low	56.5	Low	132 Å²	132	126.7 Å²	126.7	81%	0.81	64%	0.644	S	S	*	*			trans	89.4	106.3	158.9	72	0	0	0	0	118.9
101	Y	40.6	Very low	55.7	Low	183 Å²	183	129.1 Å²	129.1	72%	0.718	65%	0.651	S	S	*	*				85.3	105.2	119	-138.9	-108.8	0	0	0	119.6
102	Y	43.1	Very low	55.2	Low	172 Å²	172	129 Å²	129	68%	0.675	66%	0.657	S	S	*	*			trans	92.4	153.9	140	-77.5	-134.2	0	0	0	120.3
103	P	48	Very low	54.7	Low	82 Å²	82	122.3 Å²	122.3	53%	0.532	63%	0.631	S	S	.	*			cis	-135.6	141.8	-32.7	35.1	-16.6	0	0	0	115.8	S105	P103-S105 VanDerWaalsContact C-N 3.32Å; P103-S105 PolarHBondContact O-N 2.89Å
104	I	47.3	Very low	54.4	Low	154 Å²	154	124.2 Å²	124.2	79%	0.79	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	34	-25.3	140.5	-60.4	166	0	0	0	123.1
105	S	49.4	Very low	54.3	Low	112 Å²	112	125 Å²	125	78%	0.783	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-15.1	-176.5	-171.1	0	0	0	0	115	P103	P103-S105 VanDerWaalsContact C-N 3.32Å; P103-S105 PolarHBondContact O-N 2.89Å
106	Y	49	Very low	54.4	Low	185 Å²	185	125.2 Å²	125.2	73%	0.725	63%	0.629	S	S	*	*	S	Bend	trans	-88.1	-7.2	179.5	-66.3	-82.4	0	0	0	113.4	K108 E110	Y106-K108 PolarHBondContact O-N 3.07Å; Y106-E110 WeakPolarHBondContact O-CB 3.23Å; Y106-E110 PolarHBondContact O-N 3.01Å
107	H	50.8	Low	55	Low	100 Å²	100	122 Å²	122	46%	0.463	61%	0.607	S	S	.	*	H	α-helix	trans	-63.8	-31.9	-168.1	-112.3	-58.2	0	0	0	114.6	Q111	H107-Q111 WeakPolarHBondContact O-CB 3.49Å; H107-Q111 WeakPolarHBondContact O-CG 3.41Å; H107-Q111 PolarHBondContact O-N 3.45Å
108	K	54.8	Low	56.1	Low	179 Å²	179	119.7 Å²	119.7	78%	0.778	60%	0.596	S	S	*	*	H	α-helix	trans	-71.3	-44.1	-174.6	-166.4	175.3	-177.7	178.9	0	112.6	Y106 E110 S112	Y106-K108 PolarHBondContact O-N 3.07Å; K108-E110 VanDerWaalsContact C-N 3.33Å; K108-S112 PolarHBondContact O-N 3.02Å; K108-S112 PolarHBondContact O-OG 3.33Å
109	H	54.1	Low	57.6	Low	145 Å²	145	119.3 Å²	119.3	67%	0.671	59%	0.589	S	S	*	*	H	α-helix	trans	-73.1	-30.5	177.4	-164	-63.2	0	0	0	111.4	S112 F113	H109-S112 PolarHBondContact O-OG 3.33Å; H109-F113 VanDerWaalsContact O-CB 3.25Å; H109-F113 WeakPolarHBondContact O-CB 3.41Å; H109-F113 PolarHBondContact O-N 2.96Å
110	E	60.1	Low	59.7	Low	97 Å²	97	115 Å²	115	45%	0.453	57%	0.571	S	S	.	*	H	α-helix	trans	-74.7	-38.6	176	-152.7	177.5	-173.8	0	0	112	Y106 K108 F113 R114	Y106-E110 WeakPolarHBondContact O-CB 3.23Å; Y106-E110 PolarHBondContact O-N 3.01Å; K108-E110 VanDerWaalsContact C-N 3.33Å; E110-F113 PolarHBondContact O-N 2.93Å; E110-R114 WeakPolarHBondContact O-CB 3.37Å; E110-R114 WeakPolarHBondContact O-CG 3.46Å; E110-R114 PolarHBondContact O-N 2.77Å
111	Q	61.6	Low	61.8	Low	119 Å²	119	110.1 Å²	110.1	56%	0.556	54%	0.541	S	S	*	.	H	α-helix	trans	-65.3	-47.8	177	-80.9	173.1	7.4	0	0	112.8	H107 F113 R114 L115	H107-Q111 WeakPolarHBondContact O-CB 3.49Å; H107-Q111 WeakPolarHBondContact O-CG 3.41Å; H107-Q111 PolarHBondContact O-N 3.45Å; Q111-F113 VanDerWaalsContact C-N 3.26Å; Q111-F113 PolarHBondContact O-N 2.94Å; Q111-R114 PolarHBondContact O-N 2.79Å; Q111-L115 PolarHBondContact O-N 2.9Å
112	S	63.9	Low	64	Low	72 Å²	72	103.6 Å²	103.6	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-36.1	176.7	44.9	0	0	0	0	111.6	K108 H109 L116	K108-S112 PolarHBondContact O-N 3.02Å; K108-S112 PolarHBondContact O-OG 3.33Å; H109-S112 PolarHBondContact O-OG 3.33Å; S112-L116 PolarHBondContact O-N 3.43Å
113	F	64.3	Low	66.2	Low	32 Å²	32	100.9 Å²	100.9	14%	0.14	52%	0.515	C	S	.	.	H	α-helix	trans	-68.2	-39.2	173.1	-167	-92.3	0	0	0	112.7	C84 K87 H109 E110 Q111 L115 L116 C117	C84-F113 HydrophobicContact CB-CE1 4.44Å; C84-F113 HydrophobicContact CB-CZ 4.19Å; K87-F113 HydrophobicContact CB-CE1 4.18Å; K87-F113 HydrophobicContact CD-CD1 3.97Å; K87-F113 HydrophobicContact CD-CE1 3.41Å; K87-F113 VanDerWaalsContact CD-CE1 3.41Å; K87-F113 HydrophobicContact CD-CZ 3.82Å; K87-F113 HydrophobicContact CG-CE1 4.24Å; H109-F113 VanDerWaalsContact O-CB 3.25Å; H109-F113 WeakPolarHBondContact O-CB 3.41Å; H109-F113 PolarHBondContact O-N 2.96Å; E110-F113 PolarHBondContact O-N 2.93Å; Q111-F113 VanDerWaalsContact C-N 3.26Å; Q111-F113 PolarHBondContact O-N 2.94Å; F113-L115 VanDerWaalsContact C-N 3.33Å; F113-L115 PolarHBondContact O-N 2.71Å; F113-L116 PolarHBondContact O-N 2.79Å; F113-C117 WeakPolarHBondContact CE1-SG 3.38Å; F113-C117 WeakPolarHBondContact O-CB 3.44Å; F113-C117 PolarHBondContact O-N 2.83Å; F113-C117 PolarHBondContact O-SG 2.85Å
114	R	68.6	Low	68.3	Low	149 Å²	149	102.3 Å²	102.3	56%	0.562	52%	0.517	S	S	*	.	H	α-helix	trans	-62.7	-37.9	175.4	-72.9	-90.5	-85.9	-133.7	-1.5	112.1	E110 Q111 C117 Q118	E110-R114 WeakPolarHBondContact O-CB 3.37Å; E110-R114 WeakPolarHBondContact O-CG 3.46Å; E110-R114 PolarHBondContact O-N 2.77Å; Q111-R114 PolarHBondContact O-N 2.79Å; R114-C117 CarbonylContact O-C 3.48Å; R114-C117 PolarHBondContact O-N 2.81Å; R114-Q118 PolarHBondContact O-N 3.1Å; R114-Q118 VanDerWaalsContact O-N 3.13Å
115	L	68.4	Low	70.3	Confident	114 Å²	114	97.3 Å²	97.3	60%	0.597	49%	0.494	S	S	*	.	H	α-helix	trans	-64.9	-40.2	174.9	-175.4	67.1	0	0	0	111.8	Q111 F113 C117 Q118 S121	Q111-L115 PolarHBondContact O-N 2.9Å; F113-L115 VanDerWaalsContact C-N 3.33Å; F113-L115 PolarHBondContact O-N 2.71Å; L115-C117 VanDerWaalsContact C-N 3.28Å; L115-C117 PolarHBondContact O-N 2.91Å; L115-Q118 WeakPolarHBondContact O-CB 3.39Å; L115-Q118 PolarHBondContact O-N 2.84Å; L115-S121 WeakPolarHBondContact O-CB 3.36Å; L115-S121 PolarHBondContact O-OG 2.91Å
116	L	68.3	Low	72.3	Confident	94 Å²	94	94.9 Å²	94.9	49%	0.492	47%	0.472	S	S	.	.	H	α-helix	trans	-68.8	-30.8	175.8	-151.1	72.8	0	0	0	112	S112 F113 Q118 S121	S112-L116 PolarHBondContact O-N 3.43Å; F113-L116 PolarHBondContact O-N 2.79Å; L116-Q118 VanDerWaalsContact C-N 3.32Å; L116-S121 WeakPolarHBondContact O-CB 3.42Å
117	C	74.6	Confident	74.5	Confident	30 Å²	30	87.7 Å²	87.7	20%	0.203	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	2.1	175.7	-80.5	0	0	0	0	115.3	C84 F113 R114 L115	C84-C117 VanDerWaalsContact CA-SG 3.52Å; C84-C117 HydrophobicContact CB-CB 4.41Å; C84-C117 WeakPolarHBondContact CB-SG 3.39Å; C84-C117 WeakPolarHBondContact SG-CA 3.3Å; C84-C117 WeakPolarHBondContact SG-CB 3.42Å; C84-C117 CovalentContact SG-SG 2.02Å; C84-C117 PolarHBondContact SG-SG 3.24Å; F113-C117 WeakPolarHBondContact CE1-SG 3.38Å; F113-C117 WeakPolarHBondContact O-CB 3.44Å; F113-C117 PolarHBondContact O-N 2.83Å; F113-C117 PolarHBondContact O-SG 2.85Å; R114-C117 CarbonylContact O-C 3.48Å; R114-C117 PolarHBondContact O-N 2.81Å; L115-C117 VanDerWaalsContact C-N 3.28Å; L115-C117 PolarHBondContact O-N 2.91Å
118	Q	80.2	Confident	76.5	Confident	100 Å²	100	87.9 Å²	87.9	47%	0.467	46%	0.458	S	S	.	.	S	Bend	trans	-65.4	138.1	173.1	-171.4	176.3	-19.5	0	0	109.6	R114 L115 L116 S120 S121 L122	R114-Q118 PolarHBondContact O-N 3.1Å; R114-Q118 VanDerWaalsContact O-N 3.13Å; L115-Q118 WeakPolarHBondContact O-CB 3.39Å; L115-Q118 PolarHBondContact O-N 2.84Å; L116-Q118 VanDerWaalsContact C-N 3.32Å; Q118-S120 PolarHBondContact NE2-OG 2.85Å; Q118-S120 PolarHBondContact O-N 3.43Å; Q118-S120 VanDerWaalsContact O-N 3.1Å; Q118-S121 WeakPolarHBondContact O-CA 3.49Å; Q118-S121 WeakPolarHBondContact O-CB 3.31Å; Q118-S121 PolarHBondContact O-N 3.39Å; Q118-L122 PolarHBondContact O-N 3.07Å
119	T	79.2	Confident	78.4	Confident	108 Å²	108	80.5 Å²	80.5	66%	0.663	43%	0.427	S	S	*	.	H	α-helix	trans	-50.6	-40.5	-176.4	-49.4	0	0	0	0	113.1	L122 L123	T119-L122 PolarHBondContact O-N 3.45Å; T119-L123 WeakPolarHBondContact O-CG 3.14Å; T119-L123 PolarHBondContact O-N 3.02Å; T119-L123 VanDerWaalsContact O-N 3.1Å
120	S	85.2	Confident	80.3	Confident	57 Å²	57	79.4 Å²	79.4	40%	0.399	42%	0.421	S	S	.	.	H	α-helix	trans	-64	-45.6	176.5	48.7	0	0	0	0	112.6	Q118 L123 I124	Q118-S120 PolarHBondContact NE2-OG 2.85Å; Q118-S120 PolarHBondContact O-N 3.43Å; Q118-S120 VanDerWaalsContact O-N 3.1Å; S120-L123 PolarHBondContact O-N 3.17Å; S120-I124 WeakPolarHBondContact O-CG1 3.32Å; S120-I124 PolarHBondContact O-N 3.08Å
121	S	86.6	Confident	82	Confident	28 Å²	28	79.7 Å²	79.7	20%	0.196	43%	0.425	C	S	.	.	H	α-helix	trans	-61.6	-43.2	177.1	-51	0	0	0	0	111.5	L115 L116 Q118 L123 I124 V125	L115-S121 WeakPolarHBondContact O-CB 3.36Å; L115-S121 PolarHBondContact O-OG 2.91Å; L116-S121 WeakPolarHBondContact O-CB 3.42Å; Q118-S121 WeakPolarHBondContact O-CA 3.49Å; Q118-S121 WeakPolarHBondContact O-CB 3.31Å; Q118-S121 PolarHBondContact O-N 3.39Å; S121-L123 PolarHBondContact O-N 3.3Å; S121-I124 PolarHBondContact O-N 2.83Å; S121-V125 WeakPolarHBondContact O-CG2 3.06Å; S121-V125 PolarHBondContact O-N 2.97Å
122	L	86.3	Confident	83.5	Confident	46 Å²	46	75.9 Å²	75.9	24%	0.241	41%	0.41	C	S	.	.	H	α-helix	trans	-65.6	-37.5	179.7	-173.2	137.1	0	0	0	112.3	V81 Q118 T119 N126	V81-L122 HydrophobicContact CG1-CD1 4.29Å; Q118-L122 PolarHBondContact O-N 3.07Å; T119-L122 PolarHBondContact O-N 3.45Å; L122-N126 WeakPolarHBondContact CD2-ND2 3.29Å; L122-N126 VanDerWaalsContact O-CB 3.24Å; L122-N126 WeakPolarHBondContact O-CB 3.28Å; L122-N126 PolarHBondContact O-N 3.14Å; L122-N126 PolarHBondContact O-ND2 3.15Å
123	L	89.9	Confident	84.9	Confident	115 Å²	115	75.3 Å²	75.3	60%	0.602	40%	0.397	S	S	*	.	H	α-helix	trans	-63.4	-43.4	173.3	-74	171.9	0	0	0	112.1	T119 S120 S121 N126 G127	T119-L123 WeakPolarHBondContact O-CG 3.14Å; T119-L123 PolarHBondContact O-N 3.02Å; T119-L123 VanDerWaalsContact O-N 3.1Å; S120-L123 PolarHBondContact O-N 3.17Å; S121-L123 PolarHBondContact O-N 3.3Å; L123-N126 PolarHBondContact O-N 3.26Å; L123-G127 PolarHBondContact O-N 2.84Å
124	I	91.1	Very high	86.4	Confident	113 Å²	113	77.1 Å²	77.1	58%	0.579	41%	0.408	S	S	*	.	H	α-helix	trans	-63.3	-48.5	177.7	-66.1	162	0	0	0	110.4	S120 S121 N126 G127 L128	S120-I124 WeakPolarHBondContact O-CG1 3.32Å; S120-I124 PolarHBondContact O-N 3.08Å; S121-I124 PolarHBondContact O-N 2.83Å; I124-N126 PolarHBondContact O-N 3.44Å; I124-G127 PolarHBondContact O-N 2.95Å; I124-L128 HydrophobicContact CG2-CD1 4.32Å; I124-L128 WeakPolarHBondContact O-CG 3.48Å; I124-L128 PolarHBondContact O-N 3.44Å
125	V	90.7	Very high	87.6	Confident	48 Å²	48	73.7 Å²	73.7	29%	0.291	40%	0.403	S	S	.	.	H	α-helix	trans	-62.2	-43.3	178.8	173.1	0	0	0	0	111.1	V81 S121 G127 L128 L129	V81-V125 HydrophobicContact CG2-CG1 3.98Å; S121-V125 WeakPolarHBondContact O-CG2 3.06Å; S121-V125 PolarHBondContact O-N 2.97Å; V125-G127 VanDerWaalsContact C-N 3.34Å; V125-G127 PolarHBondContact O-N 3.24Å; V125-L128 PolarHBondContact O-N 2.89Å; V125-L129 HydrophobicContact CG1-CD1 3.97Å; V125-L129 HydrophobicContact CG1-CG 4.39Å; V125-L129 WeakPolarHBondContact O-CB 3.37Å; V125-L129 WeakPolarHBondContact O-CG 3.41Å; V125-L129 PolarHBondContact O-N 3.43Å
126	N	91.4	Very high	88.8	Confident	61 Å²	61	68.3 Å²	68.3	33%	0.326	38%	0.375	S	S	.	.	H	α-helix	trans	-64	-38.7	175.7	-75.9	-19	0	0	0	112.3	L122 L123 I124 L129 F130	L122-N126 WeakPolarHBondContact CD2-ND2 3.29Å; L122-N126 VanDerWaalsContact O-CB 3.24Å; L122-N126 WeakPolarHBondContact O-CB 3.28Å; L122-N126 PolarHBondContact O-N 3.14Å; L122-N126 PolarHBondContact O-ND2 3.15Å; L123-N126 PolarHBondContact O-N 3.26Å; I124-N126 PolarHBondContact O-N 3.44Å; N126-L129 PolarHBondContact O-N 3.34Å; N126-F130 WeakPolarHBondContact O-CB 3.14Å; N126-F130 PolarHBondContact O-N 3.44Å
127	G	93.9	Very high	89.9	Confident	35 Å²	35	66.7 Å²	66.7	36%	0.361	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-43.5	173.8	0	0	0	0	0	112.2	L123 I124 V125 F130 L131	L123-G127 PolarHBondContact O-N 2.84Å; I124-G127 PolarHBondContact O-N 2.95Å; V125-G127 VanDerWaalsContact C-N 3.34Å; V125-G127 PolarHBondContact O-N 3.24Å; G127-F130 WeakPolarHBondContact O-CB 3.44Å; G127-F130 PolarHBondContact O-N 3.09Å; G127-L131 WeakPolarHBondContact O-CG 3.47Å; G127-L131 PolarHBondContact O-N 3.12Å
128	L	94	Very high	90.7	Very high	103 Å²	103	70.4 Å²	70.4	54%	0.539	38%	0.383	S	S	.	.	H	α-helix	trans	-65.3	-43.6	175	-68.5	175.1	0	0	0	112	I124 V125 F130 L131 V132	I124-L128 HydrophobicContact CG2-CD1 4.32Å; I124-L128 WeakPolarHBondContact O-CG 3.48Å; I124-L128 PolarHBondContact O-N 3.44Å; V125-L128 PolarHBondContact O-N 2.89Å; L128-F130 VanDerWaalsContact C-N 3.28Å; L128-F130 PolarHBondContact O-N 2.96Å; L128-L131 PolarHBondContact O-N 3.38Å; L128-V132 WeakPolarHBondContact O-CG2 3.45Å; L128-V132 PolarHBondContact O-N 2.98Å
129	L	93.9	Very high	91.2	Very high	25 Å²	25	67 Å²	67	13%	0.131	37%	0.367	C	S	.	.	H	α-helix	trans	-62.4	-36.9	175.5	-72.8	170.9	0	0	0	111.9	L74 V81 V125 N126 V132 Y133	L74-L129 HydrophobicContact CD2-CD2 4.29Å; L74-L129 WeakPolarHBondContact CD2-O 3.33Å; V81-L129 HydrophobicContact CG2-CD1 3.93Å; V125-L129 HydrophobicContact CG1-CD1 3.97Å; V125-L129 HydrophobicContact CG1-CG 4.39Å; V125-L129 WeakPolarHBondContact O-CB 3.37Å; V125-L129 WeakPolarHBondContact O-CG 3.41Å; V125-L129 PolarHBondContact O-N 3.43Å; N126-L129 PolarHBondContact O-N 3.34Å; L129-V132 PolarHBondContact O-N 3.11Å; L129-Y133 VanDerWaalsContact O-CB 3.26Å; L129-Y133 WeakPolarHBondContact O-CB 3.45Å; L129-Y133 PolarHBondContact O-N 3.22Å
130	F	94.2	Very high	91.7	Very high	121 Å²	121	61.9 Å²	61.9	53%	0.531	34%	0.336	S	S	.	.	H	α-helix	trans	-63.5	-44.3	174.1	177.8	-102.1	0	0	0	111.9	N126 G127 L128 Y133 L134	N126-F130 WeakPolarHBondContact O-CB 3.14Å; N126-F130 PolarHBondContact O-N 3.44Å; G127-F130 WeakPolarHBondContact O-CB 3.44Å; G127-F130 PolarHBondContact O-N 3.09Å; L128-F130 VanDerWaalsContact C-N 3.28Å; L128-F130 PolarHBondContact O-N 2.96Å; F130-Y133 WeakPolarHBondContact O-CB 3.4Å; F130-Y133 PolarHBondContact O-N 3.34Å; F130-L134 HydrophobicContact CD1-CD1 4.24Å; F130-L134 HydrophobicContact CE1-CD1 3.63Å; F130-L134 HydrophobicContact CE1-CG 4.1Å; F130-L134 HydrophobicContact CE2-CD2 4.46Å; F130-L134 HydrophobicContact CZ-CD1 3.97Å; F130-L134 HydrophobicContact CZ-CD2 4.12Å; F130-L134 HydrophobicContact CZ-CG 4.11Å; F130-L134 WeakPolarHBondContact O-CG 3.48Å; F130-L134 PolarHBondContact O-N 3.4Å
131	L	95	Very high	91.8	Very high	103 Å²	103	67 Å²	67	54%	0.539	35%	0.347	S	S	.	.	H	α-helix	trans	-62.3	-45	175.4	-69.9	176.5	0	0	0	112	G127 L128 Y133 L134 V135	G127-L131 WeakPolarHBondContact O-CG 3.47Å; G127-L131 PolarHBondContact O-N 3.12Å; L128-L131 PolarHBondContact O-N 3.38Å; L131-Y133 VanDerWaalsContact C-N 3.26Å; L131-Y133 PolarHBondContact O-N 3.07Å; L131-L134 PolarHBondContact O-N 3.42Å; L131-V135 PolarHBondContact O-N 2.87Å; L131-V135 VanDerWaalsContact O-N 3.11Å
132	V	94	Very high	91.8	Very high	40 Å²	40	71.6 Å²	71.6	24%	0.242	37%	0.365	C	S	.	.	H	α-helix	trans	-62.3	-36.8	175.2	176.2	0	0	0	0	110.9	L70 V73 L74 L128 L129 V135 Y136	L70-V132 HydrophobicContact CD2-CG1 3.88Å; V73-V132 HydrophobicContact CG1-CG1 4.19Å; L74-V132 HydrophobicContact CD2-CB 4.06Å; L74-V132 HydrophobicContact CD2-CG1 3.8Å; L74-V132 HydrophobicContact CG-CG1 3.88Å; L128-V132 WeakPolarHBondContact O-CG2 3.45Å; L128-V132 PolarHBondContact O-N 2.98Å; L129-V132 PolarHBondContact O-N 3.11Å; V132-V135 PolarHBondContact O-N 3.38Å; V132-Y136 WeakPolarHBondContact O-CB 2.8Å; V132-Y136 PolarHBondContact O-N 3.17Å
133	Y	93.9	Very high	91.6	Very high	60 Å²	60	70.4 Å²	70.4	24%	0.235	36%	0.361	C	S	.	.	H	α-helix	trans	-65.9	-39.4	176.2	180	-108.5	0	0	0	112.2	L74 L129 F130 L131 Y136 L137 L375	L74-Y133 HydrophobicContact CD1-CD2 4.19Å; L129-Y133 VanDerWaalsContact O-CB 3.26Å; L129-Y133 WeakPolarHBondContact O-CB 3.45Å; L129-Y133 PolarHBondContact O-N 3.22Å; F130-Y133 WeakPolarHBondContact O-CB 3.4Å; F130-Y133 PolarHBondContact O-N 3.34Å; L131-Y133 VanDerWaalsContact C-N 3.26Å; L131-Y133 PolarHBondContact O-N 3.07Å; Y133-Y136 AromaticContact CD2-CD1 3.95Å; Y133-Y136 HydrophobicContact CD2-CD1 3.95Å; Y133-Y136 HydrophobicContact CE2-CD1 4.01Å; Y133-Y136 HydrophobicContact CE2-CE1 4.23Å; Y133-Y136 CarbonylContact O-C 3.57Å; Y133-Y136 WeakPolarHBondContact O-CB 3.21Å; Y133-Y136 PolarHBondContact O-N 2.82Å; Y133-L137 HydrophobicContact CD1-CD1 4.15Å; Y133-L137 HydrophobicContact CD1-CG 4.33Å; Y133-L137 HydrophobicContact CE1-CD1 3.65Å; Y133-L137 HydrophobicContact CE1-CD2 4.28Å; Y133-L137 HydrophobicContact CE1-CG 3.96Å; Y133-L137 HydrophobicContact CE2-CD2 4.28Å; Y133-L137 HydrophobicContact CE2-CG 4.45Å; Y133-L137 WeakPolarHBondContact O-CG 3.26Å; Y133-L137 PolarHBondContact O-N 2.92Å; Y133-L375 HydrophobicContact CE2-CD1 4.22Å
134	L	94.1	Very high	91.3	Very high	69 Å²	69	68.7 Å²	68.7	36%	0.361	35%	0.346	S	S	.	.	H	α-helix	trans	-61.9	-43.5	172.9	-69.9	-178.5	0	0	0	112	F130 L131 Y136 L137 I138	F130-L134 HydrophobicContact CD1-CD1 4.24Å; F130-L134 HydrophobicContact CE1-CD1 3.63Å; F130-L134 HydrophobicContact CE1-CG 4.1Å; F130-L134 HydrophobicContact CE2-CD2 4.46Å; F130-L134 HydrophobicContact CZ-CD1 3.97Å; F130-L134 HydrophobicContact CZ-CD2 4.12Å; F130-L134 HydrophobicContact CZ-CG 4.11Å; F130-L134 WeakPolarHBondContact O-CG 3.48Å; F130-L134 PolarHBondContact O-N 3.4Å; L131-L134 PolarHBondContact O-N 3.42Å; L134-Y136 VanDerWaalsContact C-N 3.3Å; L134-Y136 PolarHBondContact O-N 2.88Å; L134-L137 HydrophobicContact CD2-CD1 4.4Å; L134-L137 WeakPolarHBondContact O-CB 3.35Å; L134-L137 PolarHBondContact O-N 2.88Å; L134-I138 WeakPolarHBondContact O-CG1 3.23Å; L134-I138 PolarHBondContact O-N 2.9Å
135	V	94.1	Very high	90.8	Very high	78 Å²	78	65.3 Å²	65.3	47%	0.473	33%	0.329	S	S	.	.	H	α-helix	trans	-60.6	-42.5	174.4	175.6	0	0	0	0	110.7	L70 L131 V132 L137 I138 E139	L70-V135 HydrophobicContact CD1-CG1 4.04Å; L70-V135 HydrophobicContact CD2-CG1 4.19Å; L131-V135 PolarHBondContact O-N 2.87Å; L131-V135 VanDerWaalsContact O-N 3.11Å; V132-V135 PolarHBondContact O-N 3.38Å; V135-L137 PolarHBondContact O-N 2.74Å; V135-I138 PolarHBondContact O-N 2.81Å; V135-E139 WeakPolarHBondContact O-CB 3.47Å; V135-E139 PolarHBondContact O-N 2.87Å
136	Y	94	Very high	90.2	Very high	0 Å²	0	70 Å²	70	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-61.7	-38.4	174.5	166.4	-96.8	0	0	0	113.1	L70 T71 L74 V132 Y133 L134 S140 T372 L375 S377	L70-Y136 HydrophobicContact CB-CD2 4.26Å; T71-Y136 HydrophobicContact CG2-CD2 4.1Å; T71-Y136 HydrophobicContact CG2-CE2 3.48Å; T71-Y136 VanDerWaalsContact CG2-CE2 3.48Å; L74-Y136 HydrophobicContact CD1-CD1 4.13Å; L74-Y136 HydrophobicContact CD1-CD2 4.34Å; L74-Y136 HydrophobicContact CD1-CG 3.82Å; V132-Y136 WeakPolarHBondContact O-CB 2.8Å; V132-Y136 PolarHBondContact O-N 3.17Å; Y133-Y136 AromaticContact CD2-CD1 3.95Å; Y133-Y136 HydrophobicContact CD2-CD1 3.95Å; Y133-Y136 HydrophobicContact CE2-CD1 4.01Å; Y133-Y136 HydrophobicContact CE2-CE1 4.23Å; Y133-Y136 CarbonylContact O-C 3.57Å; Y133-Y136 WeakPolarHBondContact O-CB 3.21Å; Y133-Y136 PolarHBondContact O-N 2.82Å; L134-Y136 VanDerWaalsContact C-N 3.3Å; L134-Y136 PolarHBondContact O-N 2.88Å; Y136-S140 WeakPolarHBondContact O-CB 2.95Å; Y136-S140 PolarHBondContact O-N 2.81Å; Y136-S140 PolarHBondContact O-OG 3.19Å; Y136-T372 HydrophobicContact CE1-CG2 3.77Å; Y136-T372 WeakPolarHBondContact CE1-O 3.33Å; Y136-T372 PolarHBondContact OH-O 2.78Å; Y136-L375 WeakPolarHBondContact OH-CA 3.31Å; Y136-S377 WeakPolarHBondContact CE2-OG 3.12Å; Y136-S377 VanDerWaalsContact CZ-OG 3.3Å; Y136-S377 WeakPolarHBondContact OH-CB 3.43Å; Y136-S377 PolarHBondContact OH-N 3.47Å; Y136-S377 PolarHBondContact OH-OG 2.8Å
137	L	91.5	Very high	89.4	Confident	60 Å²	60	69.8 Å²	69.8	31%	0.314	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-42.9	173.8	-71.7	-176.8	0	0	0	111.8	Y133 L134 V135 S140 W141 T372	Y133-L137 HydrophobicContact CD1-CD1 4.15Å; Y133-L137 HydrophobicContact CD1-CG 4.33Å; Y133-L137 HydrophobicContact CE1-CD1 3.65Å; Y133-L137 HydrophobicContact CE1-CD2 4.28Å; Y133-L137 HydrophobicContact CE1-CG 3.96Å; Y133-L137 HydrophobicContact CE2-CD2 4.28Å; Y133-L137 HydrophobicContact CE2-CG 4.45Å; Y133-L137 WeakPolarHBondContact O-CG 3.26Å; Y133-L137 PolarHBondContact O-N 2.92Å; L134-L137 HydrophobicContact CD2-CD1 4.4Å; L134-L137 WeakPolarHBondContact O-CB 3.35Å; L134-L137 PolarHBondContact O-N 2.88Å; V135-L137 PolarHBondContact O-N 2.74Å; L137-S140 PolarHBondContact O-N 3.16Å; L137-W141 VanDerWaalsContact O-CB 3.22Å; L137-W141 WeakPolarHBondContact O-CB 3.1Å; L137-W141 PolarHBondContact O-N 2.56Å; L137-T372 HydrophobicContact CD2-CG2 3.37Å
138	I	92	Very high	88.3	Confident	108 Å²	108	73.9 Å²	73.9	55%	0.554	35%	0.35	S	S	*	.	H	α-helix	trans	-64.7	-46.3	177.8	-66.2	165.5	0	0	0	110.3	L134 V135 S140 W141 Q142	L134-I138 WeakPolarHBondContact O-CG1 3.23Å; L134-I138 PolarHBondContact O-N 2.9Å; V135-I138 PolarHBondContact O-N 2.81Å; I138-S140 VanDerWaalsContact C-N 3.34Å; I138-S140 PolarHBondContact O-N 2.78Å; I138-W141 PolarHBondContact O-N 2.94Å; I138-W141 VanDerWaalsContact O-N 3.16Å; I138-Q142 WeakPolarHBondContact O-CB 3.36Å; I138-Q142 PolarHBondContact O-N 2.85Å
139	E	90.9	Very high	87.4	Confident	29 Å²	29	74 Å²	74	14%	0.136	36%	0.355	C	S	.	.	H	α-helix	trans	-63.2	-41.1	178.4	-171.1	-87.4	162.8	0	0	111.2	C67 L70 V135 Q142 S143 R381	C67-E139 VanDerWaalsContact CB-OE1 3.28Å; C67-E139 WeakPolarHBondContact CB-OE1 3.39Å; C67-E139 WeakPolarHBondContact CB-OE2 3.37Å; C67-E139 PolarHBondContact SG-OE2 3.08Å; L70-E139 HydrophobicContact CD1-CB 4.15Å; L70-E139 HydrophobicContact CD1-CG 4.24Å; V135-E139 WeakPolarHBondContact O-CB 3.47Å; V135-E139 PolarHBondContact O-N 2.87Å; E139-Q142 PolarHBondContact O-N 2.93Å; E139-S143 WeakPolarHBondContact O-CB 3.22Å; E139-S143 PolarHBondContact O-N 3.16Å; E139-R381 IonicContact OE1-CZ 3.57Å; E139-R381 IonicContact OE1-NH1 2.9Å; E139-R381 PolarHBondContact OE1-NH1 2.92Å; E139-R381 IonicContact OE1-NH2 3.55Å; E139-R381 PolarHBondContact OE1-NH2 2.88Å; E139-R381 IonicContact OE2-CZ 3.6Å; E139-R381 IonicContact OE2-NH1 2.78Å; E139-R381 IonicContact OE2-NH2 3.48Å; E139-R381 PolarHBondContact OE2-NH2 3.12Å
140	S	88.7	Confident	86.7	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.007	36%	0.356	C	S	.	.	H	α-helix	trans	-65	-39.6	172.1	-64.6	0	0	0	0	112.4	Y136 L137 I138 R144 Y368 S377 R381	Y136-S140 WeakPolarHBondContact O-CB 2.95Å; Y136-S140 PolarHBondContact O-N 2.81Å; Y136-S140 PolarHBondContact O-OG 3.19Å; L137-S140 PolarHBondContact O-N 3.16Å; I138-S140 VanDerWaalsContact C-N 3.34Å; I138-S140 PolarHBondContact O-N 2.78Å; S140-R144 PolarHBondContact O-N 2.8Å; S140-Y368 VanDerWaalsContact CA-OH 3.26Å; S140-Y368 WeakPolarHBondContact CA-OH 3.47Å; S140-Y368 WeakPolarHBondContact CB-OH 3.45Å; S140-Y368 WeakPolarHBondContact O-CE1 3.4Å; S140-Y368 VanDerWaalsContact O-CZ 3.27Å; S140-Y368 PolarHBondContact O-OH 3.36Å; S140-S377 PolarHBondContact OG-OG 3.2Å; S140-R381 VanDerWaalsContact CA-NH2 3.3Å; S140-R381 PolarHBondContact OG-NH2 3.46Å
141	W	87.2	Confident	86	Confident	164 Å²	164	75.8 Å²	75.8	62%	0.621	36%	0.359	S	S	*	.	H	α-helix	trans	-68.3	-44.4	177	-178.5	73.1	0	0	0	111.9	L137 I138 S143 R144 N145	L137-W141 VanDerWaalsContact O-CB 3.22Å; L137-W141 WeakPolarHBondContact O-CB 3.1Å; L137-W141 PolarHBondContact O-N 2.56Å; I138-W141 PolarHBondContact O-N 2.94Å; I138-W141 VanDerWaalsContact O-N 3.16Å; W141-S143 PolarHBondContact O-N 3.18Å; W141-R144 PolarHBondContact O-N 3.46Å; W141-N145 VanDerWaalsContact CD2-ND2 3.33Å; W141-N145 WeakPolarHBondContact CH2-ND2 3.32Å; W141-N145 WeakPolarHBondContact CZ2-ND2 3.16Å; W141-N145 VanDerWaalsContact CZ3-ND2 3.35Å; W141-N145 WeakPolarHBondContact CZ3-ND2 2.76Å; W141-N145 VanDerWaalsContact O-CG 3.31Å; W141-N145 PolarHBondContact O-N 3.05Å; W141-N145 PolarHBondContact O-OD1 2.81Å
142	Q	86.9	Confident	85.6	Confident	124 Å²	124	76 Å²	76	58%	0.579	36%	0.36	S	S	*	.	H	α-helix	trans	-60	-45.2	176.6	-176.5	179.2	-1.4	0	0	111.7	I138 E139 R144 N145 W146	I138-Q142 WeakPolarHBondContact O-CB 3.36Å; I138-Q142 PolarHBondContact O-N 2.85Å; E139-Q142 PolarHBondContact O-N 2.93Å; Q142-R144 VanDerWaalsContact C-N 3.31Å; Q142-R144 PolarHBondContact O-N 2.8Å; Q142-N145 PolarHBondContact O-N 3.13Å; Q142-W146 PolarHBondContact O-N 3.25Å
143	S	83.5	Confident	85.3	Confident	22 Å²	22	74.4 Å²	74.4	15%	0.154	35%	0.351	C	S	.	.	H	α-helix	trans	-59.8	-41.6	176.8	-179	0	0	0	0	111.9	E139 W141 W146 I147 R381	E139-S143 WeakPolarHBondContact O-CB 3.22Å; E139-S143 PolarHBondContact O-N 3.16Å; W141-S143 PolarHBondContact O-N 3.18Å; S143-W146 PolarHBondContact O-N 3.3Å; S143-I147 PolarHBondContact O-N 3.11Å; S143-R381 PolarHBondContact OG-NE 3.29Å; S143-R381 PolarHBondContact OG-NH1 3.34Å
144	R	82.9	Confident	85.2	Confident	78 Å²	78	74.2 Å²	74.2	29%	0.294	35%	0.354	S	S	.	.	H	α-helix	trans	-65.8	-41.6	174.8	177.6	174.7	171	-176.6	-5	112.1	S140 W141 Q142 W146 I147 Q148 G365 Y368	S140-R144 PolarHBondContact O-N 2.8Å; W141-R144 PolarHBondContact O-N 3.46Å; Q142-R144 VanDerWaalsContact C-N 3.31Å; Q142-R144 PolarHBondContact O-N 2.8Å; R144-W146 VanDerWaalsContact C-N 3.27Å; R144-W146 PolarHBondContact O-N 3.1Å; R144-I147 WeakPolarHBondContact O-CG2 3.48Å; R144-I147 PolarHBondContact O-N 3.34Å; R144-Q148 PolarHBondContact O-N 2.88Å; R144-G365 PolarHBondContact NH1-O 3.25Å; R144-Y368 HydrophobicContact CB-CD1 4.36Å; R144-Y368 HydrophobicContact CB-CE1 3.91Å
145	N	79.7	Confident	85	Confident	43 Å²	43	71.8 Å²	71.8	23%	0.23	34%	0.341	C	S	.	.	H	α-helix	trans	-61.3	-39.5	177.5	-70.1	-13.1	0	0	0	111	W141 Q142 I147 Q148 T149	W141-N145 VanDerWaalsContact CD2-ND2 3.33Å; W141-N145 WeakPolarHBondContact CH2-ND2 3.32Å; W141-N145 WeakPolarHBondContact CZ2-ND2 3.16Å; W141-N145 VanDerWaalsContact CZ3-ND2 3.35Å; W141-N145 WeakPolarHBondContact CZ3-ND2 2.76Å; W141-N145 VanDerWaalsContact O-CG 3.31Å; W141-N145 PolarHBondContact O-N 3.05Å; W141-N145 PolarHBondContact O-OD1 2.81Å; Q142-N145 PolarHBondContact O-N 3.13Å; N145-I147 VanDerWaalsContact C-N 3.28Å; N145-I147 PolarHBondContact O-N 2.84Å; N145-Q148 CarbonylContact O-C 3.6Å; N145-Q148 WeakPolarHBondContact O-CA 3.06Å; N145-Q148 WeakPolarHBondContact O-CB 3.29Å; N145-Q148 PolarHBondContact O-N 2.87Å; N145-T149 WeakPolarHBondContact O-CG2 3.47Å; N145-T149 PolarHBondContact O-N 3.45Å; N145-T149 PolarHBondContact O-OG1 3.49Å
146	W	79.1	Confident	84.9	Confident	145 Å²	145	75.2 Å²	75.2	55%	0.549	35%	0.35	S	S	.	.	H	α-helix	trans	-60.4	-36.1	176.8	-172.5	81.6	0	0	0	113	Q142 S143 R144 Q148 T149 T150	Q142-W146 PolarHBondContact O-N 3.25Å; S143-W146 PolarHBondContact O-N 3.3Å; R144-W146 VanDerWaalsContact C-N 3.27Å; R144-W146 PolarHBondContact O-N 3.1Å; W146-Q148 VanDerWaalsContact C-N 3.29Å; W146-Q148 PolarHBondContact O-N 2.84Å; W146-T149 WeakPolarHBondContact CA-OG1 3.49Å; W146-T149 PolarHBondContact O-OG1 3.32Å; W146-T150 PolarHBondContact O-N 3Å; W146-T150 PolarHBondContact O-OG1 2.86Å; W146-T150 VanDerWaalsContact O-OG1 3.08Å
147	I	74.4	Confident	84.7	Confident	57 Å²	57	80.5 Å²	80.5	29%	0.292	38%	0.376	S	S	.	.	H	α-helix	trans	-70.4	-27.6	174.5	-128	141.2	0	0	0	112.4	S143 R144 N145	S143-I147 PolarHBondContact O-N 3.11Å; R144-I147 WeakPolarHBondContact O-CG2 3.48Å; R144-I147 PolarHBondContact O-N 3.34Å; N145-I147 VanDerWaalsContact C-N 3.28Å; N145-I147 PolarHBondContact O-N 2.84Å
148	Q	71.7	Confident	84.8	Confident	122 Å²	122	77.7 Å²	77.7	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-83.5	-28.8	177.9	-68.4	-174.6	-28.5	0	0	113	R144 N145 W146	R144-Q148 PolarHBondContact O-N 2.88Å; N145-Q148 CarbonylContact O-C 3.6Å; N145-Q148 WeakPolarHBondContact O-CA 3.06Å; N145-Q148 WeakPolarHBondContact O-CB 3.29Å; N145-Q148 PolarHBondContact O-N 2.87Å; W146-Q148 VanDerWaalsContact C-N 3.29Å; W146-Q148 PolarHBondContact O-N 2.84Å
149	T	74.3	Confident	84.8	Confident	106 Å²	106	75.8 Å²	75.8	65%	0.65	35%	0.348	S	S	*	.	H	α-helix	trans	-75.7	-14.7	173.4	57.1	0	0	0	0	112.5	N145 W146	N145-T149 WeakPolarHBondContact O-CG2 3.47Å; N145-T149 PolarHBondContact O-N 3.45Å; N145-T149 PolarHBondContact O-OG1 3.49Å; W146-T149 WeakPolarHBondContact CA-OG1 3.49Å; W146-T149 PolarHBondContact O-OG1 3.32Å
150	T	78.5	Confident	84.9	Confident	22 Å²	22	78.4 Å²	78.4	14%	0.135	36%	0.363	C	S	.	.	S	Bend	trans	-66.5	137.1	171.6	-55.5	0	0	0	0	110.1	W146 L152 L351	W146-T150 PolarHBondContact O-N 3Å; W146-T150 PolarHBondContact O-OG1 2.86Å; W146-T150 VanDerWaalsContact O-OG1 3.08Å; T150-L152 PolarHBondContact O-N 3.48Å; T150-L351 HydrophobicContact CG2-CB 3.84Å
151	W	80.1	Confident	84.9	Confident	160 Å²	160	79.7 Å²	79.7	61%	0.606	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	109.1	179.7	-70.8	85.4	0	0	0	111.6	P347 F350 L351	W151-P347 HydrophobicContact CB-CG 4.23Å; W151-P347 HydrophobicContact CD2-CG 3.89Å; W151-P347 HydrophobicContact CG-CB 4.01Å; W151-P347 HydrophobicContact CG-CG 3.55Å; W151-F350 HydrophobicContact CB-CD1 3.55Å; W151-F350 HydrophobicContact CB-CE1 4.04Å; W151-F350 HydrophobicContact CB-CG 4.47Å; W151-F350 HydrophobicContact CG-CD1 4.37Å; W151-F350 HydrophobicContact CG-CE1 4.42Å; W151-L351 PolarHBondContact O-N 3.44Å
152	L	86.5	Confident	85.1	Confident	107 Å²	107	72.1 Å²	72.1	56%	0.56	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.3	179.9	-173.9	71.2	0	0	0	111.1	T150 L351 I353	T150-L152 PolarHBondContact O-N 3.48Å; L152-L351 WeakPolarHBondContact CA-O 3.11Å; L152-L351 HydrophobicContact CD1-CB 4.33Å; L152-L351 HydrophobicContact CD1-CD2 4.19Å; L152-L351 HydrophobicContact CD1-CG 4.28Å; L152-L351 WeakPolarHBondContact CD1-O 3.49Å; L152-I353 HydrophobicContact CD1-CB 4.14Å; L152-I353 HydrophobicContact CD1-CD1 3.23Å; L152-I353 HydrophobicContact CD1-CG1 3.5Å; L152-I353 VanDerWaalsContact CD1-CG1 3.5Å; L152-I353 HydrophobicContact CD2-CD1 4.12Å; L152-I353 HydrophobicContact CG-CD1 4.25Å
153	I	88.4	Confident	85.3	Confident	8 Å²	8	71 Å²	71	4%	0.041	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	141.3	-176	-65.7	-168.4	0	0	0	110.9	M157 A158 L161 F350 L351 I352 I353	I153-M157 HydrophobicContact CD1-CE 4.48Å; I153-M157 HydrophobicContact CG1-SD 4.41Å; I153-M157 HydrophobicContact CG2-CB 3.59Å; I153-M157 HydrophobicContact CG2-CG 3.62Å; I153-M157 HydrophobicContact CG2-SD 3.97Å; I153-A158 HydrophobicContact CG2-CB 4.09Å; I153-L161 HydrophobicContact CD1-CD2 4.01Å; I153-F350 HydrophobicContact CD1-CD1 3.16Å; I153-F350 HydrophobicContact CD1-CE1 3.4Å; I153-F350 HydrophobicContact CD1-CG 4.05Å; I153-F350 HydrophobicContact CD1-CZ 4.44Å; I153-F350 HydrophobicContact CG1-CD1 3.93Å; I153-F350 HydrophobicContact CG1-CE1 4.49Å; I153-L351 PolarHBondContact N-O 3.26Å; I153-I352 VanDerWaalsContact O-CA 3.24Å; I153-I352 WeakPolarHBondContact O-CA 3.43Å; I153-I353 PolarHBondContact O-N 2.98Å
154	D	90.4	Very high	85.5	Confident	56 Å²	56	74.3 Å²	74.3	30%	0.299	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	151.6	171.6	-80	-14.5	0	0	0	111.1	K156 M157 A158 K355	D154-K156 VanDerWaalsContact C-N 3.3Å; D154-K156 PolarHBondContact O-N 2.87Å; D154-M157 HydrophobicContact CB-CB 4.29Å; D154-M157 CarbonylContact O-C 3.54Å; D154-M157 WeakPolarHBondContact O-CA 3.48Å; D154-M157 WeakPolarHBondContact O-CB 3.42Å; D154-M157 PolarHBondContact O-N 3.1Å; D154-A158 PolarHBondContact O-N 3.3Å; D154-K355 WeakPolarHBondContact OD2-CD 3.3Å; D154-K355 IonicContact OD2-NZ 2.78Å; D154-K355 PolarHBondContact OD2-NZ 3.03Å
155	T	90.8	Very high	85.8	Confident	17 Å²	17	70.8 Å²	70.8	10%	0.104	34%	0.339	C	S	.	.	H	α-helix	trans	-51.2	-43.8	176.2	51	0	0	0	0	114.1	M157 A158 Y159 L289 I352 I353 H354	T155-M157 VanDerWaalsContact C-N 3.34Å; T155-M157 PolarHBondContact O-N 3.49Å; T155-A158 WeakPolarHBondContact O-CB 3.38Å; T155-A158 PolarHBondContact O-N 2.96Å; T155-Y159 VanDerWaalsContact O-CD2 3.23Å; T155-Y159 WeakPolarHBondContact O-CD2 3.47Å; T155-Y159 PolarHBondContact O-N 2.86Å; T155-Y159 VanDerWaalsContact O-N 3.08Å; T155-L289 HydrophobicContact CG2-CB 4.28Å; T155-I352 HydrophobicContact CG2-CG2 3.76Å; T155-I353 PolarHBondContact N-O 3.47Å; T155-H354 HydrophobicContact CG2-CB 4.41Å
156	K	91.6	Very high	86.2	Confident	151 Å²	151	70.2 Å²	70.2	66%	0.657	34%	0.335	S	S	*	.	H	α-helix	trans	-62.3	-40	175.4	-176.4	175.2	-179.4	176.8	0	112.4	D154 A158 N160	D154-K156 VanDerWaalsContact C-N 3.3Å; D154-K156 PolarHBondContact O-N 2.87Å; K156-A158 VanDerWaalsContact C-N 3.33Å; K156-N160 PolarHBondContact O-N 2.9Å
157	M	90.9	Very high	86.6	Confident	111 Å²	111	70.2 Å²	70.2	55%	0.547	34%	0.338	S	S	.	.	H	α-helix	trans	-71.7	-31.5	178.4	-177.5	-179.6	-179.9	0	0	111	I153 D154 T155 N160 L161	I153-M157 HydrophobicContact CD1-CE 4.48Å; I153-M157 HydrophobicContact CG1-SD 4.41Å; I153-M157 HydrophobicContact CG2-CB 3.59Å; I153-M157 HydrophobicContact CG2-CG 3.62Å; I153-M157 HydrophobicContact CG2-SD 3.97Å; D154-M157 HydrophobicContact CB-CB 4.29Å; D154-M157 CarbonylContact O-C 3.54Å; D154-M157 WeakPolarHBondContact O-CA 3.48Å; D154-M157 WeakPolarHBondContact O-CB 3.42Å; D154-M157 PolarHBondContact O-N 3.1Å; T155-M157 VanDerWaalsContact C-N 3.34Å; T155-M157 PolarHBondContact O-N 3.49Å; M157-N160 PolarHBondContact O-N 2.91Å; M157-L161 WeakPolarHBondContact O-CB 3.44Å; M157-L161 PolarHBondContact O-N 3.07Å
158	A	91.7	Very high	87.2	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.008	34%	0.337	C	S	.	.	H	α-helix	trans	-65.3	-44.5	173.1	0	0	0	0	0	112.3	I153 D154 T155 K156 L161 I162 L289 I352	I153-A158 HydrophobicContact CG2-CB 4.09Å; D154-A158 PolarHBondContact O-N 3.3Å; T155-A158 WeakPolarHBondContact O-CB 3.38Å; T155-A158 PolarHBondContact O-N 2.96Å; K156-A158 VanDerWaalsContact C-N 3.33Å; A158-L161 WeakPolarHBondContact O-CB 3.36Å; A158-L161 PolarHBondContact O-N 2.97Å; A158-I162 PolarHBondContact O-N 3.34Å; A158-L289 HydrophobicContact CB-CD1 3.9Å; A158-I352 HydrophobicContact CB-CD1 3.55Å; A158-I352 HydrophobicContact CB-CG1 3.93Å; A158-I352 HydrophobicContact CB-CG2 4.19Å
159	Y	93.2	Very high	87.9	Confident	68 Å²	68	69.7 Å²	69.7	27%	0.267	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-45.5	172.9	-74.9	-62.5	0	0	0	111.9	T155 L161 I162 H163 I286 E288 L289 E290	T155-Y159 VanDerWaalsContact O-CD2 3.23Å; T155-Y159 WeakPolarHBondContact O-CD2 3.47Å; T155-Y159 PolarHBondContact O-N 2.86Å; T155-Y159 VanDerWaalsContact O-N 3.08Å; Y159-L161 VanDerWaalsContact C-N 3.35Å; Y159-L161 PolarHBondContact O-N 3.07Å; Y159-I162 PolarHBondContact O-N 3.06Å; Y159-H163 WeakPolarHBondContact O-CB 3.3Å; Y159-H163 PolarHBondContact O-N 3.29Å; Y159-I286 HydrophobicContact CD1-CD1 3.46Å; Y159-I286 VanDerWaalsContact CD1-CD1 3.46Å; Y159-I286 HydrophobicContact CD1-CG1 3.91Å; Y159-I286 HydrophobicContact CE1-CD1 3.65Å; Y159-I286 HydrophobicContact CE1-CG1 3.99Å; Y159-I286 HydrophobicContact CG-CD1 4.31Å; Y159-E288 PolarHBondContact OH-N 2.78Å; Y159-L289 HydrophobicContact CD1-CD1 4.29Å; Y159-L289 HydrophobicContact CD2-CD1 4.26Å; Y159-L289 HydrophobicContact CE1-CD1 4.04Å; Y159-L289 HydrophobicContact CE1-CG 3.99Å; Y159-L289 HydrophobicContact CE2-CB 4.03Å; Y159-L289 HydrophobicContact CE2-CD1 4.03Å; Y159-L289 HydrophobicContact CE2-CG 4.14Å; Y159-L289 HydrophobicContact CG-CD1 4.39Å; Y159-L289 PolarHBondContact OH-N 2.86Å; Y159-E290 PolarHBondContact OH-OE2 3Å
160	N	92	Very high	88.5	Confident	84 Å²	84	64.8 Å²	64.8	45%	0.449	31%	0.309	S	S	.	.	H	α-helix	trans	-63	-40.9	176.7	-74.1	-6.5	0	0	0	112.1	K156 M157 H163 N164	K156-N160 PolarHBondContact O-N 2.9Å; M157-N160 PolarHBondContact O-N 2.91Å; N160-H163 PolarHBondContact O-N 2.92Å; N160-N164 VanDerWaalsContact O-CB 3.27Å; N160-N164 WeakPolarHBondContact O-CB 3.48Å; N160-N164 PolarHBondContact O-N 2.97Å; N160-N164 PolarHBondContact O-ND2 3.16Å
161	L	90	Very high	88.9	Confident	27 Å²	27	64.5 Å²	64.5	14%	0.141	31%	0.308	C	S	.	.	H	α-helix	trans	-57.8	-52.2	176.8	175.6	68.4	0	0	0	109.9	I153 M157 A158 Y159 N164 T165 L299 F346 F350	I153-L161 HydrophobicContact CD1-CD2 4.01Å; M157-L161 WeakPolarHBondContact O-CB 3.44Å; M157-L161 PolarHBondContact O-N 3.07Å; A158-L161 WeakPolarHBondContact O-CB 3.36Å; A158-L161 PolarHBondContact O-N 2.97Å; Y159-L161 VanDerWaalsContact C-N 3.35Å; Y159-L161 PolarHBondContact O-N 3.07Å; L161-N164 PolarHBondContact O-N 2.81Å; L161-T165 HydrophobicContact CD1-CG2 4.46Å; L161-T165 VanDerWaalsContact O-CG2 3.29Å; L161-T165 WeakPolarHBondContact O-CG2 3.31Å; L161-T165 PolarHBondContact O-N 2.83Å; L161-T165 PolarHBondContact O-OG1 2.8Å; L161-L299 HydrophobicContact CD2-CD1 4.45Å; L161-F346 HydrophobicContact CD1-CD1 4.5Å; L161-F346 HydrophobicContact CD1-CE1 4.2Å; L161-F350 HydrophobicContact CD2-CD2 4.36Å; L161-F350 HydrophobicContact CD2-CE1 4.1Å; L161-F350 HydrophobicContact CD2-CE2 3.96Å; L161-F350 HydrophobicContact CD2-CZ 3.77Å
162	I	90.3	Very high	89.3	Confident	5 Å²	5	56.9 Å²	56.9	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-65.3	-45.2	-178.2	-71.7	162.4	0	0	0	110.7	A158 Y159 N164 T165 H166 I286 L297	A158-I162 PolarHBondContact O-N 3.34Å; Y159-I162 PolarHBondContact O-N 3.06Å; I162-N164 VanDerWaalsContact C-N 3.29Å; I162-N164 PolarHBondContact O-N 2.92Å; I162-T165 WeakPolarHBondContact CA-OG1 3.48Å; I162-T165 PolarHBondContact O-N 3.41Å; I162-T165 VanDerWaalsContact O-N 3.1Å; I162-T165 PolarHBondContact O-OG1 3.35Å; I162-H166 WeakPolarHBondContact CG2-NE2 3.39Å; I162-H166 PolarHBondContact O-CD2 2.98Å; I162-H166 PolarHBondContact O-N 2.99Å; I162-I286 HydrophobicContact CB-CD1 4.46Å; I162-I286 HydrophobicContact CB-CG1 4.41Å; I162-I286 HydrophobicContact CD1-CB 4.31Å; I162-I286 HydrophobicContact CD1-CD1 3.23Å; I162-I286 HydrophobicContact CD1-CG1 3.61Å; I162-I286 HydrophobicContact CD1-CG2 3.82Å; I162-I286 HydrophobicContact CG1-CD1 4.39Å; I162-I286 HydrophobicContact CG2-CG1 4.21Å; I162-L297 HydrophobicContact CD1-CD1 4.31Å; I162-L297 HydrophobicContact CD1-CD2 4.03Å
163	H	90.6	Very high	89.5	Confident	100 Å²	100	53.4 Å²	53.4	46%	0.463	26%	0.261	S	S	.	.	H	α-helix	trans	-58.7	-39.6	175.8	-174.9	71.2	0	0	0	113.1	Y159 N160 H166 K167	Y159-H163 WeakPolarHBondContact O-CB 3.3Å; Y159-H163 PolarHBondContact O-N 3.29Å; N160-H163 PolarHBondContact O-N 2.92Å; H163-H166 PolarHBondContact O-N 3.25Å; H163-K167 WeakPolarHBondContact NE2-CE 3.46Å; H163-K167 PolarHBondContact NE2-NZ 2.96Å
164	N	89.4	Confident	89.7	Confident	92 Å²	92	53.1 Å²	53.1	49%	0.492	26%	0.259	S	S	.	.	H	α-helix	trans	-69	-41.4	175.9	-71	-12.6	0	0	0	111.1	N160 L161 I162 H166 K167 L168	N160-N164 VanDerWaalsContact O-CB 3.27Å; N160-N164 WeakPolarHBondContact O-CB 3.48Å; N160-N164 PolarHBondContact O-N 2.97Å; N160-N164 PolarHBondContact O-ND2 3.16Å; L161-N164 PolarHBondContact O-N 2.81Å; I162-N164 VanDerWaalsContact C-N 3.29Å; I162-N164 PolarHBondContact O-N 2.92Å; N164-H166 PolarHBondContact O-N 3.21Å; N164-K167 PolarHBondContact O-N 3.21Å; N164-L168 WeakPolarHBondContact O-CG 3.35Å; N164-L168 PolarHBondContact O-N 2.79Å
165	T	87.5	Confident	89.7	Confident	4 Å²	4	51.6 Å²	51.6	3%	0.025	25%	0.25	C	C	.	.	H	α-helix	trans	-62.4	-27.7	176.3	60	0	0	0	0	113.3	L161 I162 K167 L168 I395 K397	L161-T165 HydrophobicContact CD1-CG2 4.46Å; L161-T165 VanDerWaalsContact O-CG2 3.29Å; L161-T165 WeakPolarHBondContact O-CG2 3.31Å; L161-T165 PolarHBondContact O-N 2.83Å; L161-T165 PolarHBondContact O-OG1 2.8Å; I162-T165 WeakPolarHBondContact CA-OG1 3.48Å; I162-T165 PolarHBondContact O-N 3.41Å; I162-T165 VanDerWaalsContact O-N 3.1Å; I162-T165 PolarHBondContact O-OG1 3.35Å; T165-K167 VanDerWaalsContact C-N 3.25Å; T165-K167 PolarHBondContact O-N 2.83Å; T165-L168 HydrophobicContact CG2-CD1 4.3Å; T165-L168 PolarHBondContact O-N 3.33Å; T165-I395 HydrophobicContact CG2-CD1 4.08Å; T165-K397 PolarHBondContact O-NZ 3.46Å
166	H	88.7	Confident	89.7	Confident	31 Å²	31	50.8 Å²	50.8	14%	0.144	25%	0.245	C	C	.	.	H	α-helix	trans	-67	-28.9	174.5	-70.3	-158.7	0	0	0	112	I162 H163 N164 D281 S283 D284 N285 K397	I162-H166 WeakPolarHBondContact CG2-NE2 3.39Å; I162-H166 PolarHBondContact O-CD2 2.98Å; I162-H166 PolarHBondContact O-N 2.99Å; H163-H166 PolarHBondContact O-N 3.25Å; N164-H166 PolarHBondContact O-N 3.21Å; H166-D281 WeakPolarHBondContact CB-OD2 3.38Å; H166-D281 IonicContact CG-OD2 2.77Å; H166-D281 IonicContact ND1-OD2 3.61Å; H166-S283 WeakPolarHBondContact NE2-CB 3.12Å; H166-D284 PolarHBondContact CE1-O 2.83Å; H166-D284 PolarHBondContact NE2-O 3.47Å; H166-N285 PolarHBondContact CE1-OD1 3.02Å; H166-K397 VanDerWaalsContact C-NZ 3.35Å; H166-K397 PolarHBondContact O-NZ 2.86Å
167	K	87.9	Confident	89.7	Confident	145 Å²	145	45.7 Å²	45.7	63%	0.63	22%	0.223	S	C	*	.	H	α-helix	trans	-87.6	-13	178.2	-61.8	179.4	-175.1	172.8	0	113.9	H163 N164 T165	H163-K167 WeakPolarHBondContact NE2-CE 3.46Å; H163-K167 PolarHBondContact NE2-NZ 2.96Å; N164-K167 PolarHBondContact O-N 3.21Å; T165-K167 VanDerWaalsContact C-N 3.25Å; T165-K167 PolarHBondContact O-N 2.83Å
168	L	86.6	Confident	89.7	Confident	51 Å²	51	40.4 Å²	40.4	27%	0.267	20%	0.197	S	C	.	.	S	Bend	trans	-73.1	140.9	-179	-69.3	176	0	0	0	111.5	N164 T165 F340 F346 K397	N164-L168 WeakPolarHBondContact O-CG 3.35Å; N164-L168 PolarHBondContact O-N 2.79Å; T165-L168 HydrophobicContact CG2-CD1 4.3Å; T165-L168 PolarHBondContact O-N 3.33Å; L168-F340 HydrophobicContact CB-CB 4.04Å; L168-F340 WeakPolarHBondContact CB-O 3.3Å; L168-F340 HydrophobicContact CD1-CB 3.94Å; L168-F346 HydrophobicContact CD1-CE2 4.05Å; L168-F346 HydrophobicContact CD1-CZ 3.91Å; L168-K397 WeakPolarHBondContact O-CE 3.13Å
169	I	86.3	Confident	89.6	Confident	118 Å²	118	40.6 Å²	40.6	61%	0.605	20%	0.197	S	C	*	.	P	Polyproline II helix	trans	-80.8	127.2	172.6	-61.4	168.2	0	0	0	108.1	L273 I279	I169-L273 HydrophobicContact CG2-CD2 3.67Å; I169-I279 HydrophobicContact CG2-CD1 4.44Å
170	P	86.8	Confident	89.4	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.019	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-67	139.8	174.1	26.1	-32.9	0	0	0	112	I279 F340 K397 F399	P170-I279 HydrophobicContact CG-CG2 4.29Å; P170-F340 HydrophobicContact CB-CD1 3.92Å; P170-F340 HydrophobicContact CB-CE1 3.63Å; P170-F340 HydrophobicContact CG-CE1 4.43Å; P170-K397 HydrophobicContact CB-CB 4.48Å; P170-K397 HydrophobicContact CB-CG 4.19Å; P170-K397 HydrophobicContact CG-CB 3.88Å; P170-K397 HydrophobicContact CG-CG 3.8Å; P170-F399 HydrophobicContact CB-CZ 3.96Å; P170-F399 HydrophobicContact CG-CE1 3.91Å; P170-F399 HydrophobicContact CG-CE2 4.22Å; P170-F399 HydrophobicContact CG-CZ 3.42Å; P170-F399 VanDerWaalsContact CG-CZ 3.42Å
171	S	86.5	Confident	89.1	Confident	16 Å²	16	38 Å²	38	11%	0.112	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	116.4	167.2	-172	0	0	0	0	108.2	T339 D342	S171-T339 PolarHBondContact N-O 3.41Å; S171-T339 PolarHBondContact O-N 3.32Å; S171-D342 PolarHBondContact OG-OD1 3.41Å; S171-D342 VanDerWaalsContact OG-OD1 3.1Å
172	I	88.9	Confident	88.8	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121	173	-57.1	167.5	0	0	0	107.2	S270 F271 F303 F314 Q336 F399	I172-S270 CarbonylContact O-C 3.43Å; I172-S270 WeakPolarHBondContact O-CA 3.13Å; I172-F271 HydrophobicContact CB-CB 3.98Å; I172-F271 HydrophobicContact CD1-CD1 4.08Å; I172-F271 PolarHBondContact O-N 3.44Å; I172-F303 HydrophobicContact CD1-CD1 3.86Å; I172-F303 HydrophobicContact CD1-CD2 3.85Å; I172-F303 HydrophobicContact CD1-CE1 3.83Å; I172-F303 HydrophobicContact CD1-CE2 3.8Å; I172-F303 HydrophobicContact CD1-CG 3.9Å; I172-F303 HydrophobicContact CD1-CZ 3.79Å; I172-F303 HydrophobicContact CG1-CD1 4.01Å; I172-F303 HydrophobicContact CG1-CE1 3.94Å; I172-F303 HydrophobicContact CG1-CG 4.48Å; I172-F303 HydrophobicContact CG1-CZ 4.34Å; I172-F303 HydrophobicContact CG2-CE1 4.26Å; I172-F303 HydrophobicContact CG2-CZ 4.32Å; I172-F314 HydrophobicContact CD1-CD2 4.39Å; I172-F314 HydrophobicContact CD1-CE2 3.87Å; I172-F314 HydrophobicContact CG2-CE2 3.9Å; I172-F314 HydrophobicContact CG2-CZ 4.39Å; I172-Q336 HydrophobicContact CG2-CG 4.17Å; I172-F399 HydrophobicContact CD1-CD2 4.41Å; I172-F399 HydrophobicContact CD1-CE2 3.57Å; I172-F399 HydrophobicContact CD1-CZ 3.67Å; I172-F399 HydrophobicContact CG1-CE2 4.39Å; I172-F399 HydrophobicContact CG1-CZ 4.19Å
173	L	90.2	Very high	88.3	Confident	34 Å²	34	42.9 Å²	42.9	18%	0.178	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	138.5	-178.7	-64	152.9	0	0	0	109.1	I268 C269 Q336 I337 T339	L173-I268 HydrophobicContact CB-CG2 4.3Å; L173-I268 HydrophobicContact CD2-CG2 3.91Å; L173-C269 CarbonylContact C-O 3.57Å; L173-C269 WeakPolarHBondContact CA-O 3.27Å; L173-Q336 CarbonylContact O-C 3.58Å; L173-Q336 WeakPolarHBondContact O-CA 3.48Å; L173-I337 HydrophobicContact CB-CB 4.29Å; L173-I337 PolarHBondContact N-O 3.41Å; L173-I337 PolarHBondContact O-N 2.97Å; L173-T339 HydrophobicContact CD1-CG2 4.34Å
174	W	92.3	Very high	87.3	Confident	1 Å²	1	42.6 Å²	42.6	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	126.3	168.3	-56.4	-47.6	0	0	0	108.7	I268 C269 F271 F314 Q317 K318 F321 F322 E335	W174-I268 CarbonylContact O-C 3.55Å; W174-I268 VanDerWaalsContact O-CA 3.28Å; W174-I268 WeakPolarHBondContact O-CA 3.41Å; W174-C269 PolarHBondContact N-O 3.15Å; W174-C269 PolarHBondContact O-N 3.48Å; W174-F271 HydrophobicContact CH2-CB 4.12Å; W174-F271 AromaticContact CH2-CD2 3.7Å; W174-F271 HydrophobicContact CH2-CD2 3.7Å; W174-F271 HydrophobicContact CH2-CG 4.27Å; W174-F271 HydrophobicContact CZ2-CB 4.28Å; W174-F271 HydrophobicContact CZ2-CD2 4.21Å; W174-F271 HydrophobicContact CZ2-CG 4.48Å; W174-F314 AromaticContact CE2-CE2 3.96Å; W174-F314 HydrophobicContact CH2-CD2 4.4Å; W174-F314 HydrophobicContact CH2-CE2 4.44Å; W174-F314 AromaticContact CZ2-CD2 3.69Å; W174-F314 HydrophobicContact CZ2-CD2 3.69Å; W174-F314 HydrophobicContact CZ2-CE1 4.42Å; W174-F314 AromaticContact CZ2-CE2 3.38Å; W174-F314 HydrophobicContact CZ2-CE2 3.38Å; W174-F314 HydrophobicContact CZ2-CG 4.35Å; W174-F314 AromaticContact CZ2-CZ 3.78Å; W174-F314 HydrophobicContact CZ2-CZ 3.78Å; W174-F314 AromaticContact NE1-CE2 3.94Å; W174-F314 AromaticContact NE1-CZ 3.73Å; W174-Q317 HydrophobicContact CH2-CB 3.58Å; W174-Q317 HydrophobicContact CZ3-CB 3.76Å; W174-K318 HydrophobicContact CD2-CB 4.25Å; W174-K318 HydrophobicContact CD2-CG 4.22Å; W174-K318 HydrophobicContact CE3-CB 4.48Å; W174-K318 HydrophobicContact CH2-CB 3.85Å; W174-K318 VanDerWaalsContact CH2-N 3.26Å; W174-K318 HydrophobicContact CZ2-CB 3.53Å; W174-K318 HydrophobicContact CZ2-CG 4.15Å; W174-K318 HydrophobicContact CZ3-CB 4.31Å; W174-F321 HydrophobicContact CB-CD1 3.85Å; W174-F321 HydrophobicContact CB-CE1 3.88Å; W174-F321 HydrophobicContact CE3-CB 4.36Å; W174-F321 HydrophobicContact CE3-CD1 4.49Å; W174-F322 HydrophobicContact CB-CE1 4.11Å; W174-F322 HydrophobicContact CB-CZ 3.97Å; W174-F322 HydrophobicContact CG-CZ 4.3Å; W174-E335 CarbonylContact C-O 3.53Å; W174-E335 WeakPolarHBondContact CA-O 3.38Å
175	Q	91.1	Very high	85.8	Confident	24 Å²	24	43.7 Å²	43.7	11%	0.112	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	140.4	174.5	178.1	170.6	10	0	0	109.6	N266 K267 I268 T334 E335	Q175-N266 PolarHBondContact NE2-OD1 2.93Å; Q175-K267 CarbonylContact C-O 3.58Å; Q175-K267 VanDerWaalsContact CA-O 3.31Å; Q175-K267 WeakPolarHBondContact CA-O 3.41Å; Q175-I268 HydrophobicContact CB-CG1 3.98Å; Q175-I268 HydrophobicContact CG-CD1 4.47Å; Q175-I268 HydrophobicContact CG-CG1 3.84Å; Q175-T334 CarbonylContact O-C 3.39Å; Q175-T334 WeakPolarHBondContact O-CA 3.49Å; Q175-E335 HydrophobicContact CB-CB 4.23Å; Q175-E335 PolarHBondContact N-O 3.46Å; Q175-E335 PolarHBondContact O-N 3.38Å
176	I	91.2	Very high	84.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	130.5	175.3	-172.2	157	0	0	0	110.3	N266 K267 F321 F322 Y325 M332 E333 T334	I176-N266 WeakPolarHBondContact O-CA 3.35Å; I176-K267 HydrophobicContact CG2-CB 3.82Å; I176-K267 PolarHBondContact N-O 3.43Å; I176-K267 PolarHBondContact O-N 3.33Å; I176-F321 HydrophobicContact CB-CE1 4.08Å; I176-F321 HydrophobicContact CB-CZ 4.37Å; I176-F321 HydrophobicContact CG2-CE1 3.77Å; I176-F321 HydrophobicContact CG2-CE2 4.46Å; I176-F321 HydrophobicContact CG2-CZ 3.57Å; I176-F322 HydrophobicContact CB-CD1 4.28Å; I176-F322 HydrophobicContact CB-CE1 4.3Å; I176-F322 HydrophobicContact CD1-CD1 3.76Å; I176-Y325 HydrophobicContact CD1-CD2 4.45Å; I176-Y325 HydrophobicContact CD1-CG 4.32Å; I176-Y325 HydrophobicContact CG2-CD2 3.85Å; I176-Y325 HydrophobicContact CG2-CE2 4.36Å; I176-Y325 HydrophobicContact CG2-CG 4.09Å; I176-M332 HydrophobicContact CD1-CE 3.3Å; I176-M332 HydrophobicContact CG1-CE 4.26Å; I176-E333 CarbonylContact C-O 3.5Å; I176-E333 VanDerWaalsContact CA-O 3.3Å; I176-E333 WeakPolarHBondContact CA-O 3.46Å; I176-T334 HydrophobicContact CD1-CG2 4.27Å; I176-T334 HydrophobicContact CG1-CG2 4.47Å
177	K	91.4	Very high	82.1	Confident	45 Å²	45	53.8 Å²	53.8	20%	0.196	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	119.3	173.3	-61.5	169.2	-174.4	154.1	0	108.6	M265 M332 E333 E335	K177-M265 CarbonylContact C-O 3.59Å; K177-M265 VanDerWaalsContact CA-O 3.31Å; K177-M265 WeakPolarHBondContact CA-O 3.44Å; K177-M332 CarbonylContact O-C 3.59Å; K177-M332 VanDerWaalsContact O-CA 3.26Å; K177-M332 WeakPolarHBondContact O-CA 3.41Å; K177-E333 HydrophobicContact CB-CB 4.2Å; K177-E333 PolarHBondContact N-O 3.34Å; K177-E333 PolarHBondContact O-N 3.18Å; K177-E335 IonicContact NZ-OE1 2.99Å; K177-E335 PolarHBondContact NZ-OE1 3.18Å
178	C	91	Very high	80	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.8	173.5	-56.3	0	0	0	0	108.9	I263 T264 M265 F328 D329 Y331	C178-I263 CarbonylContact O-C 3.54Å; C178-I263 WeakPolarHBondContact O-CA 3.39Å; C178-T264 PolarHBondContact O-N 3.18Å; C178-T264 PolarHBondContact O-OG1 2.9Å; C178-T264 VanDerWaalsContact O-OG1 3.13Å; C178-M265 HydrophobicContact CB-CB 4.08Å; C178-M265 PolarHBondContact N-O 2.83Å; C178-M265 PolarHBondContact O-N 2.96Å; C178-F328 HydrophobicContact CB-CB 4.21Å; C178-D329 HydrophobicContact CB-CB 3.75Å; C178-Y331 WeakPolarHBondContact CA-O 3.46Å
179	Y	89.8	Confident	77.7	Confident	4 Å²	4	59.1 Å²	59.1	2%	0.016	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	160.2	-178.4	64.8	-87.4	0	0	0	113.7	Y181 R261 I262 D329 Y331 E333 V472	Y179-Y181 HydrophobicContact CD2-CE2 4.23Å; Y179-Y181 AromaticContact CE2-CE2 3.74Å; Y179-Y181 HydrophobicContact CE2-CE2 3.74Å; Y179-R261 HydrophobicContact CD2-CG 3.62Å; Y179-R261 HydrophobicContact CE2-CG 4.28Å; Y179-R261 HydrophobicContact CG-CG 3.91Å; Y179-I262 WeakPolarHBondContact CA-O 3.39Å; Y179-I262 WeakPolarHBondContact CB-O 3.41Å; Y179-D329 VanDerWaalsContact CA-OD2 3.29Å; Y179-D329 WeakPolarHBondContact CA-OD2 3.35Å; Y179-Y331 HydrophobicContact CD2-CD2 4.18Å; Y179-Y331 HydrophobicContact CD2-CG 4.37Å; Y179-Y331 HydrophobicContact CE2-CD2 4.05Å; Y179-Y331 AromaticContact CE2-CG 3.95Å; Y179-Y331 HydrophobicContact CE2-CG 3.95Å; Y179-Y331 PolarHBondContact N-O 3.21Å; Y179-Y331 WeakPolarHBondContact O-CB 3.49Å; Y179-Y331 PolarHBondContact O-N 2.97Å; Y179-Y331 VanDerWaalsContact O-N 3.08Å; Y179-E333 HydrophobicContact CE1-CB 4.28Å; Y179-E333 VanDerWaalsContact CE1-CD 3.45Å; Y179-E333 HydrophobicContact CE1-CG 3.73Å; Y179-E333 WeakPolarHBondContact CE1-OE1 3.32Å; Y179-E333 PolarHBondContact OH-OE1 3.3Å; Y179-V472 WeakPolarHBondContact OH-CG1 3.3Å
180	H	87.9	Confident	75.3	Confident	54 Å²	54	60.4 Å²	60.4	25%	0.25	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	163.7	165.9	58.2	-81.9	0	0	0	110.4	I262 T264 D329 I330	H180-I262 PolarHBondContact N-O 2.84Å; H180-I262 VanDerWaalsContact N-O 3.14Å; H180-I262 PolarHBondContact O-N 3.49Å; H180-T264 WeakPolarHBondContact CE1-CG2 3.49Å; H180-T264 WeakPolarHBondContact ND1-CG2 3.48Å; H180-D329 WeakPolarHBondContact CB-OD1 3.41Å; H180-D329 IonicContact CE1-OD2 2.81Å; H180-D329 IonicContact CG-OD1 3.81Å; H180-D329 IonicContact CG-OD2 2.71Å; H180-D329 PolarHBondContact N-OD2 3.46Å; H180-D329 IonicContact ND1-OD1 3.78Å; H180-D329 PolarHBondContact ND1-OD1 2.78Å; H180-D329 IonicContact ND1-OD2 2.76Å; H180-D329 PolarHBondContact ND1-OD2 3.24Å; H180-I330 HydrophobicContact CB-CD1 4.23Å
181	Y	86.1	Confident	72.8	Confident	45 Å²	45	67.9 Å²	67.9	18%	0.176	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	117.6	172.9	-70.1	-86.1	0	0	0	109.6	Y179 C259 H260 R261 Y331 D540 I543	Y179-Y181 HydrophobicContact CD2-CE2 4.23Å; Y179-Y181 AromaticContact CE2-CE2 3.74Å; Y179-Y181 HydrophobicContact CE2-CE2 3.74Å; Y181-C259 HydrophobicContact CD1-CB 4.12Å; Y181-H260 WeakPolarHBondContact CA-O 3.29Å; Y181-R261 HydrophobicContact CD1-CB 4.28Å; Y181-R261 HydrophobicContact CE1-CB 4.01Å; Y181-Y331 HydrophobicContact CD2-CD2 4.13Å; Y181-Y331 AromaticContact CD2-CE2 3.79Å; Y181-Y331 HydrophobicContact CD2-CE2 3.79Å; Y181-Y331 HydrophobicContact CE2-CD2 4.29Å; Y181-Y331 HydrophobicContact CE2-CE2 4.16Å; Y181-D540 PolarHBondContact OH-OD1 3.43Å; Y181-D540 VanDerWaalsContact OH-OD1 3.1Å; Y181-I543 HydrophobicContact CD2-CD1 4.46Å; Y181-I543 HydrophobicContact CE2-CD1 3.84Å
182	A	83.2	Confident	70.3	Confident	28 Å²	28	74.1 Å²	74.1	23%	0.231	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	134.4	169.4	0	0	0	0	0	109.7	C259 H260 I262	A182-C259 WeakPolarHBondContact O-CA 3.07Å; A182-H260 PolarHBondContact N-O 2.85Å; A182-H260 PolarHBondContact O-N 2.88Å; A182-I262 HydrophobicContact CB-CD1 3.45Å; A182-I262 VanDerWaalsContact CB-CD1 3.45Å; A182-I262 HydrophobicContact CB-CG1 4.13Å
183	H	79.9	Confident	67.4	Low	106 Å²	106	83 Å²	83	49%	0.491	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.1	171.3	-57.9	79.4	0	0	0	107.8	T185 M257 C259	H183-T185 PolarHBondContact O-N 3.01Å; H183-T185 VanDerWaalsContact O-N 3.1Å; H183-M257 HydrophobicContact CB-CE 3.67Å; H183-C259 PolarHBondContact CD2-SG 3.04Å
184	N	70.1	Confident	64.5	Low	93 Å²	93	88.3 Å²	88.3	50%	0.497	43%	0.434	S	S	.	.			trans	-71.7	106.2	161.7	-67.9	7.6	0	0	0	106	P186 H260	N184-P186 WeakPolarHBondContact O-CD 3.36Å; N184-P186 VanDerWaalsContact O-N 3.16Å; N184-H260 PolarHBondContact ND2-CE1 2.9Å; N184-H260 PolarHBondContact OD1-ND1 3.37Å
185	T	58.9	Low	61.7	Low	115 Å²	115	93.4 Å²	93.4	71%	0.706	47%	0.467	S	S	*	.			trans	-58.1	121.1	160.3	39.4	0	0	0	0	105.5	H183 Q187	H183-T185 PolarHBondContact O-N 3.01Å; H183-T185 VanDerWaalsContact O-N 3.1Å; T185-Q187 PolarHBondContact O-N 3.44Å
186	P	52.6	Low	58.5	Low	78 Å²	78	101.1 Å²	101.1	51%	0.506	50%	0.5	S	S	.	.			trans	-55.6	121.2	172.7	21.3	-29.3	0	0	0	106	N184 Y188	N184-P186 WeakPolarHBondContact O-CD 3.36Å; N184-P186 VanDerWaalsContact O-N 3.16Å; P186-Y188 HydrophobicContact CG-CE2 4.25Å; P186-Y188 PolarHBondContact O-N 2.93Å
187	Q	45.9	Very low	55.5	Low	170 Å²	170	109.6 Å²	109.6	79%	0.794	54%	0.539	S	S	*	.			trans	-60.6	102.8	166.7	-71.1	-152.3	-2.1	0	0	105.2	T185 N189	T185-Q187 PolarHBondContact O-N 3.44Å; Q187-N189 PolarHBondContact O-N 2.93Å
188	Y	43	Very low	52.2	Low	191 Å²	191	117.9 Å²	117.9	75%	0.749	57%	0.569	S	S	*	*			trans	-63	95.9	158.7	-76.5	-85.6	0	0	0	104.2	P186 H190	P186-Y188 HydrophobicContact CG-CE2 4.25Å; P186-Y188 PolarHBondContact O-N 2.93Å; Y188-H190 PolarHBondContact O-N 3.37Å
189	N	38	Very low	49	Very low	117 Å²	117	124.5 Å²	124.5	63%	0.626	61%	0.614	S	S	*	*			trans	-56.9	94.2	159.5	-74.3	-15.8	0	0	0	104.9	Q187 H191	Q187-N189 PolarHBondContact O-N 2.93Å; N189-H191 PolarHBondContact O-N 3.3Å
190	H	36.7	Very low	46	Very low	144 Å²	144	129.2 Å²	129.2	67%	0.667	64%	0.643	S	S	*	*			trans	-67.6	60.6	157.8	-77.7	-57.9	0	0	0	107.5	Y188 Q192	Y188-H190 PolarHBondContact O-N 3.37Å; H190-Q192 PolarHBondContact O-N 3.2Å
191	H	33.6	Very low	42.9	Very low	161 Å²	161	132.1 Å²	132.1	75%	0.745	67%	0.665	S	S	*	*			trans	-86.5	69.1	145	-63.9	-19.1	0	0	0	105	N189 Q193	N189-H191 PolarHBondContact O-N 3.3Å; H191-Q193 PolarHBondContact O-N 2.92Å; H191-Q193 VanDerWaalsContact O-N 3.11Å
192	Q	35	Very low	40.1	Very low	147 Å²	147	138.7 Å²	138.7	69%	0.687	70%	0.702	S	S	*	*			trans	-48.5	120.7	155.7	-78.7	-179.7	-17.1	0	0	106.3	H190 N194	H190-Q192 PolarHBondContact O-N 3.2Å; Q192-N194 VanDerWaalsContact C-N 3.35Å; Q192-N194 PolarHBondContact O-N 2.83Å
193	Q	27.5	Very low	37.3	Very low	185 Å²	185	144.4 Å²	144.4	86%	0.864	73%	0.729	S	S	*	*			trans	-51.6	97.6	169.8	-64.3	161.9	-0.5	0	0	108.3	H191 P195	H191-Q193 PolarHBondContact O-N 2.92Å; H191-Q193 VanDerWaalsContact O-N 3.11Å; Q193-P195 WeakPolarHBondContact O-CD 3.14Å
194	N	28.7	Very low	34.6	Very low	147 Å²	147	148 Å²	148	79%	0.786	75%	0.746	S	S	*	*			trans	-102.3	98	152.9	-83	-43.4	0	0	0	106.1	Q192 K196	Q192-N194 VanDerWaalsContact C-N 3.35Å; Q192-N194 PolarHBondContact O-N 2.83Å; N194-K196 PolarHBondContact O-N 2.76Å
195	P	35	Very low	32.5	Very low	108 Å²	108	150.6 Å²	150.6	70%	0.701	76%	0.76	S	S	*	*			trans	-75.3	111.8	178.6	30.7	-28.4	0	0	0	106.6	Q193	Q193-P195 WeakPolarHBondContact O-CD 3.14Å
196	K	23.9	Very low	31	Very low	186 Å²	186	153 Å²	153	81%	0.809	77%	0.769	S	S	*	*			trans	149.2	130.1	143.4	-79.8	158.1	-172.1	-176.2	0	110.8	N194	N194-K196 PolarHBondContact O-N 2.76Å
197	Q	27.1	Very low	29.8	Very low	177 Å²	177	156.4 Å²	156.4	83%	0.827	78%	0.782	S	S	*	*			trans	77.1	95.3	149.6	-68.4	171.4	-10.6	0	0	118.6
198	R	22.5	Very low	28.8	Very low	219 Å²	219	155.2 Å²	155.2	83%	0.826	78%	0.781	S	S	*	*				56.3	95.4	112.5	-160.9	-175.7	-150	168.6	6.1	116.8
199	C	23.9	Very low	28	Very low	140 Å²	140	155.6 Å²	155.6	95%	0.946	79%	0.786	S	S	*	*			trans	-129.9	114.8	136.8	-88.1	0	0	0	0	109.2
200	T	25.7	Very low	27.5	Very low	102 Å²	102	155.8 Å²	155.8	63%	0.626	79%	0.794	S	S	*	*			trans	-76.3	139.8	178.2	35.1	0	0	0	0	111.7
201	T	23.8	Very low	26.9	Very low	115 Å²	115	155.3 Å²	155.3	71%	0.706	80%	0.802	S	S	*	*			trans	52.8	109.7	140.1	62.8	0	0	0	0	119.1
202	L	26.1	Very low	26.4	Very low	183 Å²	183	157 Å²	157	96%	0.958	81%	0.807	S	S	*	*			trans	-137.9	133.9	132.9	-80.4	178.5	0	0	0	109
203	N	25.1	Very low	25.9	Very low	149 Å²	149	160.8 Å²	160.8	80%	0.797	82%	0.816	S	S	*	*			trans	-72.2	155.9	-161.8	-72.2	-25.7	0	0	0	114.7	N205	N203-N205 PolarHBondContact O-N 3.41Å
204	E	24	Very low	25.7	Very low	180 Å²	180	157.1 Å²	157.1	84%	0.841	81%	0.808	S	S	*	*			trans	-36.3	118.2	152.5	-72.5	165.4	135.6	0	0	112.5
205	N	25	Very low	25.4	Very low	149 Å²	149	158.6 Å²	158.6	80%	0.797	81%	0.808	S	S	*	*			trans	170.4	93.5	134.1	-85.1	-17.4	0	0	0	107.4	N203	N203-N205 PolarHBondContact O-N 3.41Å
206	D	28.9	Very low	25	Very low	165 Å²	165	160.7 Å²	160.7	88%	0.882	81%	0.812	S	S	*	*			trans	-168	89.7	140.5	-90.3	-27	0	0	0	110
207	L	27	Very low	24.8	Very low	150 Å²	150	158.9 Å²	158.9	79%	0.785	81%	0.807	S	S	*	*			trans	40.9	101.4	132.1	-157.4	68.9	0	0	0	118.5	K209	L207-K209 PolarHBondContact O-N 2.74Å
208	N	24.9	Very low	24.7	Very low	145 Å²	145	153 Å²	153	78%	0.775	79%	0.793	S	S	*	*				21	94.5	125.3	-66	-8.7	0	0	0	116.5
209	K	26.5	Very low	24.7	Very low	198 Å²	198	149.1 Å²	149.1	86%	0.861	79%	0.789	S	S	*	*			trans	-163.2	143	136.6	-106.3	162.7	-168.1	-174.3	0	111.6	L207	L207-K209 PolarHBondContact O-N 2.74Å
210	P	25.7	Very low	24.8	Very low	121 Å²	121	152.1 Å²	152.1	79%	0.786	79%	0.786	S	S	*	*			trans	-76.1	135.8	-163.7	29.7	-31.3	0	0	0	112.1	K212	P210-K212 PolarHBondContact O-N 2.56Å; P210-K212 VanDerWaalsContact O-N 3.09Å
211	T	24.6	Very low	24.6	Very low	135 Å²	135	154.6 Å²	154.6	83%	0.828	80%	0.796	S	S	*	*			trans	-65	100.2	-176.9	-37.7	0	0	0	0	110.9
212	K	23.4	Very low	24.5	Very low	196 Å²	196	156.5 Å²	156.5	85%	0.852	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-74.1	128.1	159.8	-91.1	179.6	175	178.8	0	108.5	P210	P210-K212 PolarHBondContact O-N 2.56Å; P210-K212 VanDerWaalsContact O-N 3.09Å
213	Y	25.7	Very low	24.3	Very low	226 Å²	226	153.5 Å²	153.5	89%	0.886	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-58.2	138	175.1	-76.5	-91.7	0	0	0	111.3
214	P	23.1	Very low	24	Very low	108 Å²	108	151.9 Å²	151.9	70%	0.701	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-80.7	123.8	-172.6	30.2	-31.4	0	0	0	111.7	I216	P214-I216 PolarHBondContact O-N 3Å
215	F	22.6	Very low	23.9	Very low	178 Å²	178	148.8 Å²	148.8	78%	0.781	78%	0.783	S	S	*	*			trans	-75.5	107.7	162.2	-175.9	-98.7	0	0	0	107.7	Q217	F215-Q217 HydrophobicContact CD1-CB 4.39Å; F215-Q217 HydrophobicContact CE1-CB 4.33Å; F215-Q217 PolarHBondContact O-N 2.87Å
216	I	25.1	Very low	23.8	Very low	152 Å²	152	150 Å²	150	78%	0.779	78%	0.784	S	S	*	*			trans	-81.5	100.5	176	-61.7	174.7	0	0	0	107.7	P214	P214-I216 PolarHBondContact O-N 3Å
217	Q	20.7	Very low	23.4	Very low	149 Å²	149	147.3 Å²	147.3	70%	0.696	77%	0.774	S	S	*	*			trans	-84.2	107	160.2	-173.9	130.3	-12.4	0	0	107	F215	F215-Q217 HydrophobicContact CD1-CB 4.39Å; F215-Q217 HydrophobicContact CE1-CB 4.33Å; F215-Q217 PolarHBondContact O-N 2.87Å
218	G	24.4	Very low	23.2	Very low	53 Å²	53	146.6 Å²	146.6	55%	0.546	77%	0.771	S	S	.	*			trans	-114.2	110.8	174.4	0	0	0	0	0	109.1
219	D	22.2	Very low	23	Very low	138 Å²	138	145 Å²	145	74%	0.738	77%	0.766	S	S	*	*			trans	-55.8	131.5	179.3	-62.9	-53.9	0	0	0	112.3
220	F	27.1	Very low	22.8	Very low	203 Å²	203	143.7 Å²	143.7	89%	0.89	76%	0.763	S	S	*	*			trans	-95.9	96.2	168.1	-92.3	-91.2	0	0	0	108.3	I222	F220-I222 PolarHBondContact O-N 3.42Å
221	D	21.6	Very low	22.5	Very low	154 Å²	154	145.1 Å²	145.1	82%	0.824	76%	0.764	S	S	*	*			trans	-72.2	124.4	165.6	-85.2	-32.5	0	0	0	110.2	S223	D221-S223 PolarHBondContact O-N 3.25Å
222	I	21.4	Very low	22.5	Very low	155 Å²	155	146 Å²	146	80%	0.795	76%	0.764	S	S	*	*			trans	-72.6	117.6	174.7	-64.2	164.9	0	0	0	107.9	F220 T224	F220-I222 PolarHBondContact O-N 3.42Å; I222-T224 HydrophobicContact CG2-CG2 4.27Å
223	S	21.4	Very low	22.3	Very low	120 Å²	120	145.3 Å²	145.3	84%	0.839	76%	0.764	S	S	*	*			trans	-126.6	105.4	154.7	52.3	0	0	0	0	109.6	D221	D221-S223 PolarHBondContact O-N 3.25Å
224	T	18.8	Very low	22.2	Very low	114 Å²	114	144.9 Å²	144.9	70%	0.699	76%	0.762	S	S	*	*			trans	-72.7	122.2	162.3	45.2	0	0	0	0	109.2	I222	I222-T224 HydrophobicContact CG2-CG2 4.27Å
225	T	21.7	Very low	22	Very low	115 Å²	115	145.2 Å²	145.2	71%	0.706	77%	0.767	S	S	*	*				175.4	128.8	127.5	23.6	0	0	0	0	111
226	E	23.3	Very low	21.9	Very low	174 Å²	174	145.2 Å²	145.2	81%	0.813	77%	0.771	S	S	*	*			trans	65.3	146.2	132.9	-66.8	174.4	-174.4	0	0	119.6
227	V	21.4	Very low	21.7	Very low	110 Å²	110	142.6 Å²	142.6	67%	0.667	77%	0.767	S	S	*	*			cis	-176.3	144.8	-10.9	129.7	0	0	0	0	103.3
228	N	21.1	Very low	21.8	Very low	135 Å²	135	144.9 Å²	144.9	72%	0.722	78%	0.775	S	S	*	*			trans	74.9	112.6	151.9	-78.7	-3.8	0	0	0	123.8
229	T	21.9	Very low	21.8	Very low	111 Å²	111	149.4 Å²	149.4	68%	0.681	79%	0.786	S	S	*	*				63.3	137.7	121.5	47.1	0	0	0	0	123.8
230	Q	21.4	Very low	21.8	Very low	171 Å²	171	152.3 Å²	152.3	80%	0.799	79%	0.792	S	S	*	*			trans	79.5	102.2	153.7	-74.7	167.4	-33.6	0	0	115.5
231	N	20.1	Very low	21.8	Very low	151 Å²	151	149.4 Å²	149.4	81%	0.807	79%	0.791	S	S	*	*				57	95.2	84.3	-72.8	-3.7	0	0	0	111.7
232	D	24.3	Very low	21.9	Very low	154 Å²	154	147.7 Å²	147.7	82%	0.824	79%	0.788	S	S	*	*			trans	-146.2	119.1	143.5	-90.7	-34	0	0	0	110.7
233	Q	19.3	Very low	22	Very low	180 Å²	180	149.6 Å²	149.6	84%	0.841	79%	0.794	S	S	*	*			trans	-79.1	121.4	174	-69.5	167.5	-49.1	0	0	108.6
234	Y	23.1	Very low	22.1	Very low	217 Å²	217	152.5 Å²	152.5	85%	0.851	80%	0.796	S	S	*	*			trans	-123.2	106.7	154.2	-81.7	-82.4	0	0	0	109.7
235	S	18.8	Very low	22.4	Very low	115 Å²	115	155.8 Å²	155.8	80%	0.804	80%	0.801	S	S	*	*			trans	-84.7	123	168.8	-58.5	0	0	0	0	107.9
236	M	21.7	Very low	22.6	Very low	178 Å²	178	155.5 Å²	155.5	88%	0.877	80%	0.804	S	S	*	*			trans	-125.7	128.7	166.4	-100.8	-73.8	-92.1	0	0	110.3
237	S	20.4	Very low	22.7	Very low	97 Å²	97	155.5 Å²	155.5	68%	0.678	80%	0.804	S	S	*	*			trans	-75.6	147.5	-166	46.5	0	0	0	0	114.3
238	F	22.5	Very low	23	Very low	198 Å²	198	155.8 Å²	155.8	87%	0.868	81%	0.81	S	S	*	*			trans	-48.6	133.9	170	-63.4	-95	0	0	0	114.1
239	N	24.1	Very low	23.4	Very low	148 Å²	148	155.9 Å²	155.9	79%	0.791	82%	0.821	S	S	*	*			trans	-152.6	119.5	152.1	-96.3	-28.9	0	0	0	112.4
240	K	23.2	Very low	23.8	Very low	199 Å²	199	153.1 Å²	153.1	87%	0.865	82%	0.815	S	S	*	*			trans	25.9	120.7	148.1	-76.7	173.7	171.3	177	0	119.8
241	V	25.7	Very low	24.2	Very low	141 Å²	141	152.4 Å²	152.4	86%	0.855	82%	0.817	S	S	*	*			trans	-138.6	139.1	151.8	179.8	0	0	0	0	108.5
242	P	25	Very low	25.1	Very low	118 Å²	118	151 Å²	151	77%	0.766	81%	0.814	S	S	*	*			trans	-100.5	158.5	-141.5	32.1	-23.7	0	0	0	116.4	M244	P242-M244 PolarHBondContact O-N 2.68Å
243	E	22.8	Very low	26	Very low	195 Å²	195	150.2 Å²	150.2	91%	0.911	81%	0.809	S	S	*	*			trans	-59.7	117.9	173.5	-75.3	170.6	142.6	0	0	112
244	M	23.4	Very low	27.3	Very low	181 Å²	181	148 Å²	148	89%	0.892	80%	0.802	S	S	*	*			trans	-114.1	99.2	167.1	-120.4	162	83.2	0	0	109.7	P242	P242-M244 PolarHBondContact O-N 2.68Å
245	F	26.1	Very low	28.6	Very low	184 Å²	184	143.8 Å²	143.8	81%	0.807	79%	0.794	S	S	*	*			trans	28.5	100.9	152.8	-69.5	-85.4	0	0	0	119.3	H247	F245-H247 PolarHBondContact O-N 3.39Å
246	S	24.1	Very low	30.2	Very low	109 Å²	109	146.3 Å²	146.3	76%	0.762	79%	0.794	S	S	*	*			trans	-86.8	86	159.3	54.9	0	0	0	0	111.1
247	H	25.7	Very low	31.8	Very low	174 Å²	174	143.3 Å²	143.3	81%	0.806	78%	0.779	S	S	*	*			trans	-144.3	80.8	162.4	-73.5	-63.8	0	0	0	109.9	F245	F245-H247 PolarHBondContact O-N 3.39Å
248	S	27.9	Very low	34.3	Very low	115 Å²	115	145.4 Å²	145.4	80%	0.804	78%	0.776	S	S	*	*			trans	-133.7	86.4	164.2	174	0	0	0	0	107.1	G250	S248-G250 PolarHBondContact O-N 3.34Å
249	S	30.3	Very low	36.8	Very low	137 Å²	137	138.5 Å²	138.5	96%	0.958	75%	0.751	S	S	*	*			trans	-68.2	85.8	161.7	170.6	0	0	0	0	107.1
250	G	28.9	Very low	39.5	Very low	53 Å²	53	134.7 Å²	134.7	55%	0.546	73%	0.729	S	S	.	*			trans	-134.3	110.1	-177.3	0	0	0	0	0	110.7	S248 T252	S248-G250 PolarHBondContact O-N 3.34Å; G250-T252 PolarHBondContact O-N 3.4Å
251	N	31.7	Very low	42.5	Very low	156 Å²	156	129.7 Å²	129.7	83%	0.834	70%	0.704	S	S	*	*			trans	21.2	96.7	161.4	-83	-18.1	0	0	0	115.4	N253	N251-N253 PolarHBondContact O-N 3.1Å
252	T	37.3	Very low	45.4	Very low	122 Å²	122	126.5 Å²	126.5	75%	0.748	68%	0.682	S	S	*	*			trans	-68.3	78.5	155.4	58.9	0	0	0	0	107.6	G250 I254	G250-T252 PolarHBondContact O-N 3.4Å; T252-I254 PolarHBondContact O-N 2.89Å
253	N	43.8	Very low	48.6	Very low	137 Å²	137	125.1 Å²	125.1	73%	0.733	67%	0.667	S	S	*	*			trans	-59.1	85.1	143.2	-100.7	-16.7	0	0	0	104.1	N251 N255	N251-N253 PolarHBondContact O-N 3.1Å; N253-N255 PolarHBondContact O-N 3.27Å
254	I	47	Very low	51.7	Low	134 Å²	134	118.8 Å²	118.8	69%	0.687	64%	0.642	S	S	*	*			trans	-65.1	86.4	164.2	-56.9	175	0	0	0	102.3	T252 Q256	T252-I254 PolarHBondContact O-N 2.89Å; I254-Q256 VanDerWaalsContact C-N 3.31Å; I254-Q256 PolarHBondContact O-N 2.99Å
255	N	49.7	Very low	54.9	Low	129 Å²	129	112.7 Å²	112.7	69%	0.69	61%	0.611	S	S	*	*			trans	-50	108.1	167.8	-72.7	-16	0	0	0	103.9	N253 M257	N253-N255 PolarHBondContact O-N 3.27Å; N255-M257 PolarHBondContact O-N 3.49Å
256	Q	53.2	Low	58.1	Low	168 Å²	168	107.9 Å²	107.9	79%	0.785	59%	0.594	S	S	*	*			trans	-56.4	107.6	-178.7	-70.6	178.3	-4.5	0	0	105.8	I254 K258	I254-Q256 VanDerWaalsContact C-N 3.31Å; I254-Q256 PolarHBondContact O-N 2.99Å; Q256-K258 PolarHBondContact O-N 3.38Å
257	M	55.2	Low	61.5	Low	115 Å²	115	107.2 Å²	107.2	57%	0.567	58%	0.578	S	S	*	*			trans	-70.4	104.8	-174.8	-162.4	154.2	161.1	0	0	106	H183 N255 C259	H183-M257 HydrophobicContact CB-CE 3.67Å; N255-M257 PolarHBondContact O-N 3.49Å; M257-C259 PolarHBondContact O-N 2.83Å
258	K	71.7	Confident	64.6	Low	141 Å²	141	103.7 Å²	103.7	61%	0.613	56%	0.564	S	S	*	*			trans	-72.5	113.5	-178.4	-168.4	-178	-177.1	-157.6	0	108.1	Q256 H260	Q256-K258 PolarHBondContact O-N 3.38Å; K258-H260 WeakPolarHBondContact CE-NE2 3.36Å; K258-H260 PolarHBondContact NZ-NE2 2.62Å
259	C	76.3	Confident	67.6	Low	52 Å²	52	100.3 Å²	100.3	35%	0.351	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	141.4	169.5	-60.3	0	0	0	0	108.9	Y181 A182 H183 M257	Y181-C259 HydrophobicContact CD1-CB 4.12Å; A182-C259 WeakPolarHBondContact O-CA 3.07Å; H183-C259 PolarHBondContact CD2-SG 3.04Å; M257-C259 PolarHBondContact O-N 2.83Å
260	H	80.8	Confident	70.5	Confident	69 Å²	69	96.9 Å²	96.9	32%	0.319	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	134.9	171.1	-62.4	92.7	0	0	0	109	Y181 A182 N184 K258	Y181-H260 WeakPolarHBondContact CA-O 3.29Å; A182-H260 PolarHBondContact N-O 2.85Å; A182-H260 PolarHBondContact O-N 2.88Å; N184-H260 PolarHBondContact ND2-CE1 2.9Å; N184-H260 PolarHBondContact OD1-ND1 3.37Å; K258-H260 WeakPolarHBondContact CE-NE2 3.36Å; K258-H260 PolarHBondContact NZ-NE2 2.62Å
261	R	86.4	Confident	73.5	Confident	94 Å²	94	94.6 Å²	94.6	36%	0.355	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	122.9	171	178.9	171.7	68.8	-160.5	-12.9	108.2	Y179 Y181 E333 D536	Y179-R261 HydrophobicContact CD2-CG 3.62Å; Y179-R261 HydrophobicContact CE2-CG 4.28Å; Y179-R261 HydrophobicContact CG-CG 3.91Å; Y181-R261 HydrophobicContact CD1-CB 4.28Å; Y181-R261 HydrophobicContact CE1-CB 4.01Å; R261-E333 IonicContact NH1-OE1 2.81Å; R261-D536 IonicContact CZ-OD1 3.21Å; R261-D536 IonicContact CZ-OD2 3.92Å; R261-D536 IonicContact NH1-OD1 3.85Å; R261-D536 PolarHBondContact NH1-OD1 2.88Å; R261-D536 IonicContact NH1-OD2 3.69Å; R261-D536 IonicContact NH2-OD1 3.82Å; R261-D536 IonicContact NH2-OD2 2.8Å; R261-D536 PolarHBondContact NH2-OD2 3.47Å
262	I	86.5	Confident	76.3	Confident	74 Å²	74	90.3 Å²	90.3	38%	0.379	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	114.9	173.2	-59.7	-176.5	0	0	0	107.7	Y179 H180 A182 T264	Y179-I262 WeakPolarHBondContact CA-O 3.39Å; Y179-I262 WeakPolarHBondContact CB-O 3.41Å; H180-I262 PolarHBondContact N-O 2.84Å; H180-I262 VanDerWaalsContact N-O 3.14Å; H180-I262 PolarHBondContact O-N 3.49Å; A182-I262 HydrophobicContact CB-CD1 3.45Å; A182-I262 VanDerWaalsContact CB-CD1 3.45Å; A182-I262 HydrophobicContact CB-CG1 4.13Å; I262-T264 HydrophobicContact CG2-CG2 4.49Å; I262-T264 PolarHBondContact O-N 2.9Å
263	I	90.8	Very high	78.7	Confident	88 Å²	88	86.8 Å²	86.8	45%	0.451	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	114.7	173.3	-58.6	171.6	0	0	0	107.6	C178 N266	C178-I263 CarbonylContact O-C 3.54Å; C178-I263 WeakPolarHBondContact O-CA 3.39Å; I263-N266 HydrophobicContact CG2-CB 4.42Å
264	T	89.2	Confident	80.8	Confident	63 Å²	63	84.8 Å²	84.8	39%	0.387	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-25.1	179.5	49.6	0	0	0	0	112.6	C178 H180 I262 D329	C178-T264 PolarHBondContact O-N 3.18Å; C178-T264 PolarHBondContact O-OG1 2.9Å; C178-T264 VanDerWaalsContact O-OG1 3.13Å; H180-T264 WeakPolarHBondContact CE1-CG2 3.49Å; H180-T264 WeakPolarHBondContact ND1-CG2 3.48Å; I262-T264 HydrophobicContact CG2-CG2 4.49Å; I262-T264 PolarHBondContact O-N 2.9Å; T264-D329 WeakPolarHBondContact CB-OD2 3.12Å; T264-D329 WeakPolarHBondContact CG2-OD2 3.22Å; T264-D329 PolarHBondContact OG1-OD2 3.5Å
265	M	90.8	Very high	82.5	Confident	52 Å²	52	83.4 Å²	83.4	26%	0.256	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	139.6	178.4	-174.5	61	70.4	0	0	110.7	K177 C178 K267 Y325 F328	K177-M265 CarbonylContact C-O 3.59Å; K177-M265 VanDerWaalsContact CA-O 3.31Å; K177-M265 WeakPolarHBondContact CA-O 3.44Å; C178-M265 HydrophobicContact CB-CB 4.08Å; C178-M265 PolarHBondContact N-O 2.83Å; C178-M265 PolarHBondContact O-N 2.96Å; M265-K267 HydrophobicContact CG-CG 4Å; M265-K267 HydrophobicContact SD-CD 4.36Å; M265-K267 HydrophobicContact SD-CG 3.79Å; M265-Y325 HydrophobicContact CG-CD1 4.19Å; M265-Y325 HydrophobicContact CG-CE1 4.23Å; M265-F328 HydrophobicContact CE-CD1 4.09Å; M265-F328 HydrophobicContact CE-CE1 3.85Å
266	N	93.3	Very high	84.2	Confident	84 Å²	84	78.3 Å²	78.3	45%	0.449	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	119.8	170.4	-178.3	14.1	0	0	0	108.8	Q175 I176 I263	Q175-N266 PolarHBondContact NE2-OD1 2.93Å; I176-N266 WeakPolarHBondContact O-CA 3.35Å; I263-N266 HydrophobicContact CG2-CB 4.42Å
267	K	94	Very high	85.6	Confident	95 Å²	95	76 Å²	76	41%	0.413	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	146.1	-177.9	-73.5	-67.9	-176.4	-174.5	0	111.6	Q175 I176 M265 F321 Y325	Q175-K267 CarbonylContact C-O 3.58Å; Q175-K267 VanDerWaalsContact CA-O 3.31Å; Q175-K267 WeakPolarHBondContact CA-O 3.41Å; I176-K267 HydrophobicContact CG2-CB 3.82Å; I176-K267 PolarHBondContact N-O 3.43Å; I176-K267 PolarHBondContact O-N 3.33Å; M265-K267 HydrophobicContact CG-CG 4Å; M265-K267 HydrophobicContact SD-CD 4.36Å; M265-K267 HydrophobicContact SD-CG 3.79Å; K267-F321 HydrophobicContact CB-CE2 4.48Å; K267-F321 HydrophobicContact CB-CZ 4.24Å; K267-Y325 HydrophobicContact CB-CE1 4.39Å; K267-Y325 HydrophobicContact CB-CE2 4.32Å; K267-Y325 HydrophobicContact CG-CE1 3.83Å
268	I	92	Very high	87.1	Confident	99 Å²	99	75.2 Å²	75.2	51%	0.508	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	138.6	177.3	-56.8	175.3	0	0	0	108	L173 W174 Q175	L173-I268 HydrophobicContact CB-CG2 4.3Å; L173-I268 HydrophobicContact CD2-CG2 3.91Å; W174-I268 CarbonylContact O-C 3.55Å; W174-I268 VanDerWaalsContact O-CA 3.28Å; W174-I268 WeakPolarHBondContact O-CA 3.41Å; Q175-I268 HydrophobicContact CB-CG1 3.98Å; Q175-I268 HydrophobicContact CG-CD1 4.47Å; Q175-I268 HydrophobicContact CG-CG1 3.84Å
269	C	91.4	Very high	87.9	Confident	44 Å²	44	71.5 Å²	71.5	30%	0.297	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136.3	175.7	178.9	0	0	0	0	109.4	L173 W174 F321	L173-C269 CarbonylContact C-O 3.57Å; L173-C269 WeakPolarHBondContact CA-O 3.27Å; W174-C269 PolarHBondContact N-O 3.15Å; W174-C269 PolarHBondContact O-N 3.48Å; C269-F321 HydrophobicContact CB-CD1 4.32Å; C269-F321 HydrophobicContact CB-CD2 3.45Å; C269-F321 VanDerWaalsContact CB-CD2 3.45Å; C269-F321 HydrophobicContact CB-CE1 4.2Å; C269-F321 HydrophobicContact CB-CE2 3.3Å; C269-F321 HydrophobicContact CB-CG 3.97Å; C269-F321 HydrophobicContact CB-CZ 3.71Å
270	S	91.3	Very high	88.5	Confident	66 Å²	66	70.4 Å²	70.4	46%	0.462	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	147.8	172	53.1	0	0	0	0	110.8	I172 D272	I172-S270 CarbonylContact O-C 3.43Å; I172-S270 WeakPolarHBondContact O-CA 3.13Å; S270-D272 PolarHBondContact O-N 3.36Å
271	F	90.8	Very high	88.9	Confident	5 Å²	5	70 Å²	70	2%	0.022	37%	0.365	C	S	.	.			trans	-65.9	129.7	170	177.6	-134.8	0	0	0	109.8	I172 W174 L273 I276 F314 Q317	I172-F271 HydrophobicContact CB-CB 3.98Å; I172-F271 HydrophobicContact CD1-CD1 4.08Å; I172-F271 PolarHBondContact O-N 3.44Å; W174-F271 HydrophobicContact CH2-CB 4.12Å; W174-F271 AromaticContact CH2-CD2 3.7Å; W174-F271 HydrophobicContact CH2-CD2 3.7Å; W174-F271 HydrophobicContact CH2-CG 4.27Å; W174-F271 HydrophobicContact CZ2-CB 4.28Å; W174-F271 HydrophobicContact CZ2-CD2 4.21Å; W174-F271 HydrophobicContact CZ2-CG 4.48Å; F271-L273 HydrophobicContact CD1-CD1 4.02Å; F271-L273 WeakPolarHBondContact O-CD1 3.33Å; F271-L273 PolarHBondContact O-N 2.96Å; F271-I276 HydrophobicContact CD1-CD1 4.24Å; F271-I276 HydrophobicContact CE1-CD1 3.24Å; F271-I276 HydrophobicContact CE1-CG1 4.4Å; F271-I276 HydrophobicContact CZ-CD1 3.55Å; F271-I276 HydrophobicContact CZ-CG1 4.27Å; F271-F314 AromaticContact CD1-CD2 3.94Å; F271-F314 HydrophobicContact CD1-CD2 3.94Å; F271-F314 HydrophobicContact CD1-CE2 4.49Å; F271-F314 AromaticContact CD2-CD2 3.91Å; F271-F314 HydrophobicContact CD2-CD2 3.91Å; F271-F314 HydrophobicContact CE1-CB 4.45Å; F271-F314 AromaticContact CE1-CD2 3.87Å; F271-F314 HydrophobicContact CE1-CD2 3.87Å; F271-F314 HydrophobicContact CE2-CB 3.94Å; F271-F314 AromaticContact CE2-CD2 3.93Å; F271-F314 HydrophobicContact CE2-CD2 3.93Å; F271-F314 HydrophobicContact CE2-CG 4.42Å; F271-F314 AromaticContact CG-CD2 3.94Å; F271-F314 HydrophobicContact CG-CD2 3.94Å; F271-F314 HydrophobicContact CG-CE2 4.41Å; F271-F314 HydrophobicContact CZ-CB 3.8Å; F271-F314 AromaticContact CZ-CD2 3.9Å; F271-F314 HydrophobicContact CZ-CD2 3.9Å; F271-F314 HydrophobicContact CZ-CG 4.37Å; F271-Q317 HydrophobicContact CD2-CB 4.48Å
272	D	90.2	Very high	89	Confident	65 Å²	65	69.8 Å²	69.8	35%	0.348	37%	0.369	S	S	.	.			trans	-78.6	107.4	179.7	178.5	14.9	0	0	0	110.7	S270 S274	S270-D272 PolarHBondContact O-N 3.36Å; D272-S274 VanDerWaalsContact C-N 3.26Å; D272-S274 PolarHBondContact O-N 3.03Å; D272-S274 WeakPolarHBondContact OD1-CB 3.27Å; D272-S274 PolarHBondContact OD1-N 3.11Å; D272-S274 PolarHBondContact OD1-OG 2.9Å; D272-S274 PolarHBondContact OD2-OG 2.81Å
273	L	87.9	Confident	89.2	Confident	48 Å²	48	67 Å²	67	25%	0.251	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-74.6	-11.4	178.2	-85.3	65.9	0	0	0	113.2	I169 F271 K275 I276 I279 F399	I169-L273 HydrophobicContact CG2-CD2 3.67Å; F271-L273 HydrophobicContact CD1-CD1 4.02Å; F271-L273 WeakPolarHBondContact O-CD1 3.33Å; F271-L273 PolarHBondContact O-N 2.96Å; L273-K275 PolarHBondContact O-N 3.1Å; L273-K275 VanDerWaalsContact O-N 3.12Å; L273-I276 HydrophobicContact CG-CD1 4.44Å; L273-I276 PolarHBondContact O-N 3.03Å; L273-I276 VanDerWaalsContact O-N 3.13Å; L273-I279 HydrophobicContact CD2-CD1 3.47Å; L273-I279 VanDerWaalsContact CD2-CD1 3.47Å; L273-I279 HydrophobicContact CG-CD1 4.12Å; L273-F399 HydrophobicContact CD2-CE1 4.47Å; L273-F399 HydrophobicContact CG-CE1 4.36Å
274	S	87.4	Confident	89.1	Confident	95 Å²	95	65 Å²	65	66%	0.664	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-63	-22.2	-174.4	71.3	0	0	0	0	114.1	D272	D272-S274 VanDerWaalsContact C-N 3.26Å; D272-S274 PolarHBondContact O-N 3.03Å; D272-S274 WeakPolarHBondContact OD1-CB 3.27Å; D272-S274 PolarHBondContact OD1-N 3.11Å; D272-S274 PolarHBondContact OD1-OG 2.9Å; D272-S274 PolarHBondContact OD2-OG 2.81Å
275	K	83.7	Confident	89.2	Confident	106 Å²	106	64.9 Å²	64.9	46%	0.461	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-92.7	2.3	-178.7	-66.1	175.9	178.3	169.4	0	114.1	L273 E313	L273-K275 PolarHBondContact O-N 3.1Å; L273-K275 VanDerWaalsContact O-N 3.12Å; K275-E313 HydrophobicContact CB-CG 4.3Å; K275-E313 HydrophobicContact CD-CG 4.05Å; K275-E313 WeakPolarHBondContact CD-OE1 3.43Å; K275-E313 IonicContact NZ-OE1 2.9Å; K275-E313 PolarHBondContact NZ-OE1 2.91Å
276	I	84.9	Confident	89.2	Confident	22 Å²	22	63.1 Å²	63.1	11%	0.113	34%	0.335	C	S	.	.			trans	-107.5	130.4	-176.5	-50.6	174.8	0	0	0	108.4	F271 L273 E278 T310 F399	F271-I276 HydrophobicContact CD1-CD1 4.24Å; F271-I276 HydrophobicContact CE1-CD1 3.24Å; F271-I276 HydrophobicContact CE1-CG1 4.4Å; F271-I276 HydrophobicContact CZ-CD1 3.55Å; F271-I276 HydrophobicContact CZ-CG1 4.27Å; L273-I276 HydrophobicContact CG-CD1 4.44Å; L273-I276 PolarHBondContact O-N 3.03Å; L273-I276 VanDerWaalsContact O-N 3.13Å; I276-E278 WeakPolarHBondContact CG2-O 3.2Å; I276-T310 HydrophobicContact CD1-CG2 4.16Å; I276-T310 HydrophobicContact CG1-CG2 4.08Å; I276-T310 HydrophobicContact CG2-CG2 3.99Å; I276-F399 HydrophobicContact CD1-CB 4.48Å; I276-F399 HydrophobicContact CD1-CD1 3.72Å; I276-F399 HydrophobicContact CD1-CE1 4.4Å; I276-F399 HydrophobicContact CD1-CG 4.46Å; I276-F399 HydrophobicContact CG2-CB 4.48Å
277	D	82.3	Confident	89.1	Confident	120 Å²	120	60.7 Å²	60.7	64%	0.642	33%	0.325	S	S	*	.	S	Bend	trans	-71.7	-44.7	-174.4	-57.3	-44.7	0	0	0	112.1
278	E	87.2	Confident	88.9	Confident	97 Å²	97	60.3 Å²	60.3	45%	0.453	33%	0.325	S	S	.	.			trans	-145.8	151.9	-175.1	-67.2	-179.9	174	0	0	112.4	I276 G400 K402	I276-E278 WeakPolarHBondContact CG2-O 3.2Å; E278-G400 CarbonylContact O-C 3.55Å; E278-G400 PolarHBondContact O-N 3.23Å; E278-K402 WeakPolarHBondContact OE2-CB 3.46Å; E278-K402 PolarHBondContact OE2-N 2.9Å
279	I	89.5	Confident	88.7	Confident	63 Å²	63	55.6 Å²	55.6	32%	0.323	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	129.4	170.1	-58.2	172.8	0	0	0	107.4	I169 P170 L273 K397 I398 F399	I169-I279 HydrophobicContact CG2-CD1 4.44Å; P170-I279 HydrophobicContact CG-CG2 4.29Å; L273-I279 HydrophobicContact CD2-CD1 3.47Å; L273-I279 VanDerWaalsContact CD2-CD1 3.47Å; L273-I279 HydrophobicContact CG-CD1 4.12Å; I279-K397 HydrophobicContact CG2-CB 4.44Å; I279-I398 WeakPolarHBondContact CA-O 3.25Å; I279-F399 HydrophobicContact CD1-CD1 3.86Å; I279-F399 HydrophobicContact CD1-CE1 3.68Å; I279-F399 HydrophobicContact CG1-CD1 3.76Å; I279-F399 HydrophobicContact CG1-CE1 4.08Å
280	W	89.2	Confident	88.6	Confident	29 Å²	29	57.9 Å²	57.9	11%	0.11	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	155	-179.1	50.5	-70.8	0	0	0	111.7	I398 G400 K402 Y409 L412	W280-I398 HydrophobicContact CD2-CB 3.93Å; W280-I398 HydrophobicContact CD2-CD1 4.2Å; W280-I398 HydrophobicContact CD2-CG2 4.26Å; W280-I398 VanDerWaalsContact CE2-CG2 3.48Å; W280-I398 HydrophobicContact CE3-CB 4.41Å; W280-I398 HydrophobicContact CE3-CD1 3.84Å; W280-I398 HydrophobicContact CG-CB 4.33Å; W280-I398 HydrophobicContact CH2-CB 4.46Å; W280-I398 HydrophobicContact CH2-CD1 3.43Å; W280-I398 VanDerWaalsContact CH2-CD1 3.43Å; W280-I398 HydrophobicContact CH2-CG2 4.26Å; W280-I398 HydrophobicContact CZ2-CB 4.01Å; W280-I398 HydrophobicContact CZ2-CD1 3.84Å; W280-I398 HydrophobicContact CZ2-CG2 3.51Å; W280-I398 HydrophobicContact CZ3-CD1 3.41Å; W280-I398 VanDerWaalsContact CZ3-CD1 3.41Å; W280-I398 PolarHBondContact N-O 2.89Å; W280-I398 PolarHBondContact O-N 2.54Å; W280-G400 PolarHBondContact NE1-O 3.49Å; W280-K402 HydrophobicContact CD2-CG 4.5Å; W280-Y409 HydrophobicContact CE3-CE1 4.09Å; W280-Y409 AromaticContact CH2-CD1 3.96Å; W280-Y409 HydrophobicContact CH2-CD1 3.96Å; W280-Y409 AromaticContact CH2-CE1 3.63Å; W280-Y409 HydrophobicContact CH2-CE1 3.63Å; W280-Y409 AromaticContact CZ3-CD1 3.88Å; W280-Y409 HydrophobicContact CZ3-CD1 3.88Å; W280-Y409 AromaticContact CZ3-CE1 3.36Å; W280-Y409 HydrophobicContact CZ3-CE1 3.36Å; W280-L412 HydrophobicContact CH2-CD2 3.78Å; W280-L412 HydrophobicContact CZ2-CD2 3.8Å
281	D	89	Confident	88.5	Confident	62 Å²	62	59.9 Å²	59.9	33%	0.332	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	132.7	-171.4	-168.3	35.8	0	0	0	111.4	H166 S283 K397	H166-D281 WeakPolarHBondContact CB-OD2 3.38Å; H166-D281 IonicContact CG-OD2 2.77Å; H166-D281 IonicContact ND1-OD2 3.61Å; D281-S283 VanDerWaalsContact OD1-CB 3.3Å; D281-S283 WeakPolarHBondContact OD1-CB 3.36Å; D281-S283 PolarHBondContact OD1-N 3.02Å; D281-S283 PolarHBondContact OD1-OG 3.2Å; D281-K397 HydrophobicContact CB-CD 4.32Å; D281-K397 VanDerWaalsContact OD1-CD 3.3Å; D281-K397 WeakPolarHBondContact OD1-CD 3.5Å; D281-K397 WeakPolarHBondContact OD1-CE 3.49Å; D281-K397 IonicContact OD1-NZ 3.75Å; D281-K397 PolarHBondContact OD1-NZ 3.32Å; D281-K397 IonicContact OD2-NZ 3.75Å
282	M	87.7	Confident	88.4	Confident	89 Å²	89	61.7 Å²	61.7	44%	0.438	32%	0.32	S	S	.	.			trans	-129.9	28.1	171.4	-159.7	175.2	68.6	0	0	110.4	H396 I398 L414	M282-H396 CarbonylContact C-O 3.59Å; M282-H396 WeakPolarHBondContact CE-CE1 3.16Å; M282-H396 WeakPolarHBondContact CE-ND1 3.45Å; M282-H396 PolarHBondContact N-O 2.86Å; M282-I398 HydrophobicContact CB-CD1 3.74Å; M282-I398 HydrophobicContact CB-CG1 4.42Å; M282-I398 HydrophobicContact CE-CD1 3.97Å; M282-I398 HydrophobicContact CG-CD1 4.34Å; M282-I398 HydrophobicContact SD-CD1 3.79Å; M282-L414 HydrophobicContact CE-CD1 3.7Å; M282-L414 HydrophobicContact SD-CD1 4.4Å
283	S	90.2	Very high	88.4	Confident	14 Å²	14	61.5 Å²	61.5	10%	0.098	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-65.6	151.3	179.9	-60.9	0	0	0	0	112.5	H166 D281 N285 K394 I395 H396	H166-S283 WeakPolarHBondContact NE2-CB 3.12Å; D281-S283 VanDerWaalsContact OD1-CB 3.3Å; D281-S283 WeakPolarHBondContact OD1-CB 3.36Å; D281-S283 PolarHBondContact OD1-N 3.02Å; D281-S283 PolarHBondContact OD1-OG 3.2Å; S283-N285 PolarHBondContact O-N 3.29Å; S283-K394 WeakPolarHBondContact CA-O 3.49Å; S283-I395 VanDerWaalsContact OG-CA 3.31Å; S283-I395 WeakPolarHBondContact OG-CA 3.24Å; S283-I395 WeakPolarHBondContact OG-CG2 3.33Å; S283-H396 PolarHBondContact N-O 2.96Å; S283-H396 PolarHBondContact OG-N 2.95Å
284	D	90.4	Very high	88.5	Confident	47 Å²	47	59.3 Å²	59.3	25%	0.251	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-66.7	128.5	176	-66.4	-33.9	0	0	0	110.3	H166 K394	H166-D284 PolarHBondContact CE1-O 2.83Å; H166-D284 PolarHBondContact NE2-O 3.47Å; D284-K394 PolarHBondContact N-O 3.18Å; D284-K394 VanDerWaalsContact OD2-CB 3.3Å; D284-K394 WeakPolarHBondContact OD2-CB 3.42Å; D284-K394 WeakPolarHBondContact OD2-CG 3.37Å; D284-K394 PolarHBondContact OD2-N 2.92Å
285	N	90.2	Very high	88.8	Confident	60 Å²	60	54.8 Å²	54.8	32%	0.321	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-84.4	140.5	168	-72.3	-34.7	0	0	0	109.5	T46 L47 H166 S283	T46-N285 CarbonylContact C-O 3.57Å; T46-N285 WeakPolarHBondContact CA-O 3.37Å; T46-N285 HydrophobicContact CG2-CB 4.41Å; L47-N285 PolarHBondContact N-O 3.39Å; H166-N285 PolarHBondContact CE1-OD1 3.02Å; S283-N285 PolarHBondContact O-N 3.29Å
286	I	91.7	Very high	89.2	Confident	15 Å²	15	50.7 Å²	50.7	8%	0.077	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-103.6	152.6	177.8	56	149	0	0	0	111.6	L47 Y159 I162 L289 L391 C393	L47-I286 WeakPolarHBondContact O-CA 3.28Å; Y159-I286 HydrophobicContact CD1-CD1 3.46Å; Y159-I286 VanDerWaalsContact CD1-CD1 3.46Å; Y159-I286 HydrophobicContact CD1-CG1 3.91Å; Y159-I286 HydrophobicContact CE1-CD1 3.65Å; Y159-I286 HydrophobicContact CE1-CG1 3.99Å; Y159-I286 HydrophobicContact CG-CD1 4.31Å; I162-I286 HydrophobicContact CB-CD1 4.46Å; I162-I286 HydrophobicContact CB-CG1 4.41Å; I162-I286 HydrophobicContact CD1-CB 4.31Å; I162-I286 HydrophobicContact CD1-CD1 3.23Å; I162-I286 HydrophobicContact CD1-CG1 3.61Å; I162-I286 HydrophobicContact CD1-CG2 3.82Å; I162-I286 HydrophobicContact CG1-CD1 4.39Å; I162-I286 HydrophobicContact CG2-CG1 4.21Å; I286-L289 HydrophobicContact CD1-CD1 3.42Å; I286-L289 VanDerWaalsContact CD1-CD1 3.42Å; I286-L289 HydrophobicContact CD1-CD2 4.2Å; I286-L289 HydrophobicContact CD1-CG 3.93Å; I286-L391 HydrophobicContact CG2-CD1 4.49Å; I286-L391 HydrophobicContact CG2-CD2 3.98Å; I286-C393 HydrophobicContact CG2-CB 4.43Å
287	S	90.2	Very high	89.6	Confident	34 Å²	34	49.7 Å²	49.7	24%	0.238	25%	0.251	C	S	.	.			trans	-150.6	166.4	176.1	-59.3	0	0	0	0	111	T46 L47 L289	T46-S287 WeakPolarHBondContact CB-OG 3.25Å; T46-S287 WeakPolarHBondContact CG2-OG 3.47Å; L47-S287 PolarHBondContact O-N 3.27Å; L47-S287 VanDerWaalsContact O-N 3.12Å; S287-L289 VanDerWaalsContact C-N 3.26Å; S287-L289 PolarHBondContact O-N 3.48Å
288	E	89.1	Confident	90	Very high	87 Å²	87	45.6 Å²	45.6	41%	0.407	23%	0.229	S	C	.	.			trans	59.8	28.2	172.5	-61.1	178.9	-147.1	0	0	115.1	V48 Y159 E290 N291	V48-E288 HydrophobicContact CG1-CB 4.02Å; V48-E288 HydrophobicContact CG2-CB 4.22Å; V48-E288 HydrophobicContact CG2-CG 4.24Å; Y159-E288 PolarHBondContact OH-N 2.78Å; E288-E290 PolarHBondContact O-N 3.34Å; E288-N291 PolarHBondContact O-N 3.38Å; E288-N291 PolarHBondContact OE2-ND2 3.41Å
289	L	89	Confident	90.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-62.5	-29.5	175.2	-60.9	-171.1	0	0	0	112.3	P49 T155 A158 Y159 I286 S287 N291 F292 I295 I352 L391	P49-L289 HydrophobicContact CG-CD2 3.7Å; T155-L289 HydrophobicContact CG2-CB 4.28Å; A158-L289 HydrophobicContact CB-CD1 3.9Å; Y159-L289 HydrophobicContact CD1-CD1 4.29Å; Y159-L289 HydrophobicContact CD2-CD1 4.26Å; Y159-L289 HydrophobicContact CE1-CD1 4.04Å; Y159-L289 HydrophobicContact CE1-CG 3.99Å; Y159-L289 HydrophobicContact CE2-CB 4.03Å; Y159-L289 HydrophobicContact CE2-CD1 4.03Å; Y159-L289 HydrophobicContact CE2-CG 4.14Å; Y159-L289 HydrophobicContact CG-CD1 4.39Å; Y159-L289 PolarHBondContact OH-N 2.86Å; I286-L289 HydrophobicContact CD1-CD1 3.42Å; I286-L289 VanDerWaalsContact CD1-CD1 3.42Å; I286-L289 HydrophobicContact CD1-CD2 4.2Å; I286-L289 HydrophobicContact CD1-CG 3.93Å; S287-L289 VanDerWaalsContact C-N 3.26Å; S287-L289 PolarHBondContact O-N 3.48Å; L289-N291 PolarHBondContact O-N 2.89Å; L289-F292 PolarHBondContact O-N 3.11Å; L289-I295 HydrophobicContact CB-CD1 3.97Å; L289-I295 HydrophobicContact CD2-CD1 3.8Å; L289-I295 HydrophobicContact CG-CD1 4.42Å; L289-I295 WeakPolarHBondContact O-CD1 3.44Å; L289-I352 HydrophobicContact CD1-CD1 4.21Å; L289-L391 HydrophobicContact CD2-CD2 3.56Å
290	E	88.7	Confident	90	Very high	91 Å²	91	39.5 Å²	39.5	43%	0.425	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-65.7	-21.4	179.3	56	-82.6	-177.8	0	0	114.2	Y159 E288 F292	Y159-E290 PolarHBondContact OH-OE2 3Å; E288-E290 PolarHBondContact O-N 3.34Å; E290-F292 PolarHBondContact O-N 2.83Å
291	N	89.5	Confident	89.9	Confident	108 Å²	108	39.9 Å²	39.9	58%	0.578	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-73.7	-14	179.1	-68.8	-18.8	0	0	0	112.8	E288 L289	E288-N291 PolarHBondContact O-N 3.38Å; E288-N291 PolarHBondContact OE2-ND2 3.41Å; L289-N291 PolarHBondContact O-N 2.89Å
292	F	89.7	Confident	89.8	Confident	43 Å²	43	37.5 Å²	37.5	19%	0.189	19%	0.194	C	C	.	.			trans	-119	136.9	-175.5	-60.6	-89.4	0	0	0	111.2	V48 P49 L289 E290 I295 A389	V48-F292 HydrophobicContact CG1-CE2 4.16Å; P49-F292 HydrophobicContact CB-CD2 3.73Å; P49-F292 HydrophobicContact CB-CE2 3.73Å; P49-F292 HydrophobicContact CB-CG 4.2Å; P49-F292 HydrophobicContact CB-CZ 4.2Å; P49-F292 HydrophobicContact CG-CD2 3.75Å; P49-F292 HydrophobicContact CG-CE2 3.95Å; P49-F292 WeakPolarHBondContact O-CZ 3.34Å; L289-F292 PolarHBondContact O-N 3.11Å; E290-F292 PolarHBondContact O-N 2.83Å; F292-I295 HydrophobicContact CB-CD1 3.97Å; F292-I295 HydrophobicContact CB-CG1 3.7Å; F292-A389 HydrophobicContact CB-CB 4.23Å; F292-A389 HydrophobicContact CD1-CB 3.6Å; F292-A389 HydrophobicContact CE1-CB 4.13Å; F292-A389 HydrophobicContact CG-CB 3.97Å
293	Q	89.4	Confident	89.8	Confident	61 Å²	61	33.4 Å²	33.4	29%	0.285	17%	0.174	S	C	.	.	S	Bend	trans	-78.1	-31.9	-178.6	-169.5	166	29.2	0	0	113.1	H354 S357 P360 Y362	Q293-H354 PolarHBondContact O-N 3.08Å; Q293-S357 PolarHBondContact NE2-OG 3.01Å; Q293-P360 VanDerWaalsContact CD-CG 3.46Å; Q293-P360 HydrophobicContact CG-CG 4.07Å; Q293-Y362 PolarHBondContact OE1-OH 2.89Å
294	L	90.2	Very high	89.8	Confident	2 Å²	2	33 Å²	33	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	122.4	-175.8	-171.7	69.2	0	0	0	110.2	L351 I352 I353 L363 I384 K388 A389	L294-L351 HydrophobicContact CD1-CD1 3.6Å; L294-L351 HydrophobicContact CD1-CD2 4.01Å; L294-L351 HydrophobicContact CD1-CG 3.75Å; L294-L351 HydrophobicContact CG-CD1 3.98Å; L294-I352 WeakPolarHBondContact CA-O 3.4Å; L294-I353 HydrophobicContact CD1-CD1 4.35Å; L294-I353 HydrophobicContact CD1-CG1 3.72Å; L294-L363 HydrophobicContact CD1-CD1 4Å; L294-L363 HydrophobicContact CD2-CD1 4.37Å; L294-L363 HydrophobicContact CD2-CD2 4.26Å; L294-I384 HydrophobicContact CD2-CG2 4.26Å; L294-K388 HydrophobicContact CD2-CB 4.04Å; L294-K388 HydrophobicContact CD2-CG 4.05Å; L294-K388 HydrophobicContact CG-CB 4.47Å; L294-K388 HydrophobicContact CG-CG 4.08Å; L294-A389 PolarHBondContact O-N 3.39Å
295	I	92.8	Very high	89.8	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	134.1	-176.3	-47.5	165.1	0	0	0	110	P49 L289 F292 L351 I352 A389 L391	P49-I295 HydrophobicContact CB-CG2 4.16Å; P49-I295 HydrophobicContact CG-CD1 3.91Å; P49-I295 HydrophobicContact CG-CG1 4.45Å; P49-I295 HydrophobicContact CG-CG2 4.25Å; L289-I295 HydrophobicContact CB-CD1 3.97Å; L289-I295 HydrophobicContact CD2-CD1 3.8Å; L289-I295 HydrophobicContact CG-CD1 4.42Å; L289-I295 WeakPolarHBondContact O-CD1 3.44Å; F292-I295 HydrophobicContact CB-CD1 3.97Å; F292-I295 HydrophobicContact CB-CG1 3.7Å; I295-L351 CarbonylContact O-C 3.53Å; I295-L351 WeakPolarHBondContact O-CA 3.45Å; I295-I352 HydrophobicContact CB-CB 4.13Å; I295-I352 HydrophobicContact CB-CD1 4.44Å; I295-I352 PolarHBondContact N-O 3.43Å; I295-I352 PolarHBondContact O-N 3.45Å; I295-A389 CarbonylContact C-O 3.56Å; I295-A389 WeakPolarHBondContact CA-O 3.49Å; I295-A389 HydrophobicContact CG1-CB 4.26Å; I295-A389 HydrophobicContact CG2-CB 4.44Å; I295-L391 HydrophobicContact CG2-CB 3.75Å; I295-L391 HydrophobicContact CG2-CD2 4.45Å
296	E	92.7	Very high	89.7	Confident	21 Å²	21	29.1 Å²	29.1	10%	0.098	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	105.2	166.8	-164.7	-178.5	118.5	0	0	109.3	R52 N298 Q349 K388 A389 L391	R52-E296 IonicContact CZ-OE2 3.45Å; R52-E296 IonicContact NH2-OE1 3.37Å; R52-E296 PolarHBondContact NH2-OE1 3.27Å; R52-E296 IonicContact NH2-OE2 2.7Å; R52-E296 PolarHBondContact NH2-OE2 2.86Å; E296-N298 PolarHBondContact OE1-ND2 3.19Å; E296-Q349 HydrophobicContact CG-CG 4.18Å; E296-Q349 VanDerWaalsContact CG-NE2 3.32Å; E296-Q349 PolarHBondContact OE1-NE2 2.91Å; E296-K388 HydrophobicContact CB-CD 3.72Å; E296-K388 HydrophobicContact CB-CG 4.13Å; E296-K388 HydrophobicContact CG-CD 4.32Å; E296-K388 WeakPolarHBondContact OE2-CD 3.36Å; E296-K388 IonicContact OE2-NZ 2.89Å; E296-A389 PolarHBondContact N-O 2.91Å; E296-L391 PolarHBondContact O-N 3.47Å; E296-L391 VanDerWaalsContact O-O 3.06Å
297	L	92.7	Very high	89.5	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	112.6	174.8	172.5	67.8	0	0	0	109.1	I162 L299 Q349 F350 I352 L391 C393	I162-L297 HydrophobicContact CD1-CD1 4.31Å; I162-L297 HydrophobicContact CD1-CD2 4.03Å; L297-L299 HydrophobicContact CD1-CD2 3.8Å; L297-L299 HydrophobicContact CD2-CD2 3.99Å; L297-L299 HydrophobicContact CD2-CG 4.36Å; L297-L299 HydrophobicContact CG-CD2 3.9Å; L297-L299 HydrophobicContact CG-CG 4.26Å; L297-Q349 CarbonylContact O-C 3.59Å; L297-Q349 WeakPolarHBondContact O-CA 3.39Å; L297-F350 HydrophobicContact CB-CB 4.23Å; L297-F350 HydrophobicContact CD2-CB 4.48Å; L297-F350 HydrophobicContact CD2-CD2 4.34Å; L297-F350 PolarHBondContact N-O 3.33Å; L297-F350 PolarHBondContact O-N 3.36Å; L297-I352 HydrophobicContact CB-CD1 3.73Å; L297-I352 HydrophobicContact CB-CG1 4.23Å; L297-I352 HydrophobicContact CD2-CD1 4.01Å; L297-I352 HydrophobicContact CG-CD1 4.42Å; L297-L391 CarbonylContact C-O 3.56Å; L297-L391 WeakPolarHBondContact CA-O 3.26Å; L297-L391 HydrophobicContact CD1-CB 4.34Å; L297-L391 HydrophobicContact CD1-CD2 3.77Å; L297-L391 HydrophobicContact CD1-CG 3.89Å; L297-C393 HydrophobicContact CD1-CB 3.9Å
298	N	91.4	Very high	89.4	Confident	33 Å²	33	36.2 Å²	36.2	18%	0.176	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.6	170	-68.2	-55.9	0	0	0	108.6	E296 K348 Q349 L391 H392 C393	E296-N298 PolarHBondContact OE1-ND2 3.19Å; N298-K348 WeakPolarHBondContact CA-O 3.21Å; N298-Q349 WeakPolarHBondContact OD1-CG 3.29Å; N298-L391 PolarHBondContact N-O 3.3Å; N298-H392 CarbonylContact O-C 3.55Å; N298-H392 WeakPolarHBondContact O-CA 3.49Å; N298-C393 PolarHBondContact O-N 3.44Å
299	L	90.1	Very high	89.5	Confident	20 Å²	20	39.2 Å²	39.2	11%	0.105	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	128.4	174.6	-63.2	-173.4	0	0	0	109.4	L161 L297 K348 F350 C393 I395	L161-L299 HydrophobicContact CD2-CD1 4.45Å; L297-L299 HydrophobicContact CD1-CD2 3.8Å; L297-L299 HydrophobicContact CD2-CD2 3.99Å; L297-L299 HydrophobicContact CD2-CG 4.36Å; L297-L299 HydrophobicContact CG-CD2 3.9Å; L297-L299 HydrophobicContact CG-CG 4.26Å; L299-K348 PolarHBondContact N-O 3.22Å; L299-F350 HydrophobicContact CD1-CD2 4.18Å; L299-F350 HydrophobicContact CD1-CE2 3.59Å; L299-F350 HydrophobicContact CG-CD2 4.29Å; L299-F350 HydrophobicContact CG-CE2 4.14Å; L299-C393 HydrophobicContact CD2-CB 3.81Å; L299-I395 HydrophobicContact CD1-CD1 4.28Å
300	S	86.8	Confident	89.5	Confident	13 Å²	13	39.7 Å²	39.7	9%	0.091	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	133.7	172.4	58	0	0	0	0	109.6	H392 C393 K394 I395	S300-H392 PolarHBondContact OG-CE1 3.25Å; S300-C393 PolarHBondContact N-O 3.02Å; S300-C393 PolarHBondContact OG-O 2.92Å; S300-K394 WeakPolarHBondContact O-CA 3.41Å; S300-K394 WeakPolarHBondContact OG-CA 3.43Å; S300-K394 WeakPolarHBondContact OG-CG 3.48Å; S300-I395 PolarHBondContact O-N 3.23Å
301	T	86.4	Confident	89.6	Confident	36 Å²	36	38.3 Å²	38.3	22%	0.221	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	131	178.6	64.3	0	0	0	0	108.8	C338 F340	T301-C338 PolarHBondContact OG1-O 3.21Å; T301-C338 VanDerWaalsContact OG1-O 3.07Å; T301-F340 HydrophobicContact CG2-CD2 3.72Å; T301-F340 HydrophobicContact CG2-CE2 3.35Å; T301-F340 HydrophobicContact CG2-CZ 4.46Å
302	L	86.1	Confident	89.7	Confident	13 Å²	13	35.8 Å²	35.8	7%	0.068	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	144.6	-177.8	-176.9	68.9	0	0	0	109.6	I395 H396 K397 L464 N467	L302-I395 PolarHBondContact N-O 3.31Å; L302-I395 VanDerWaalsContact O-O 3.11Å; L302-H396 HydrophobicContact CB-CB 4.29Å; L302-H396 HydrophobicContact CD2-CB 4.12Å; L302-H396 VanDerWaalsContact O-CA 3.29Å; L302-H396 WeakPolarHBondContact O-CA 3.38Å; L302-K397 PolarHBondContact O-N 3.38Å; L302-L464 HydrophobicContact CD1-CD2 3.58Å; L302-L464 HydrophobicContact CD1-CG 4.22Å; L302-L464 HydrophobicContact CD2-CD2 3.28Å; L302-L464 HydrophobicContact CG-CD2 4.02Å; L302-N467 WeakPolarHBondContact CD1-OD1 3.29Å
303	F	89	Confident	89.8	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.009	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	154.7	168.5	67.8	-96.7	0	0	0	112.4	I172 F305 F314 Q336 C338 K397 F399 N467	I172-F303 HydrophobicContact CD1-CD1 3.86Å; I172-F303 HydrophobicContact CD1-CD2 3.85Å; I172-F303 HydrophobicContact CD1-CE1 3.83Å; I172-F303 HydrophobicContact CD1-CE2 3.8Å; I172-F303 HydrophobicContact CD1-CG 3.9Å; I172-F303 HydrophobicContact CD1-CZ 3.79Å; I172-F303 HydrophobicContact CG1-CD1 4.01Å; I172-F303 HydrophobicContact CG1-CE1 3.94Å; I172-F303 HydrophobicContact CG1-CG 4.48Å; I172-F303 HydrophobicContact CG1-CZ 4.34Å; I172-F303 HydrophobicContact CG2-CE1 4.26Å; I172-F303 HydrophobicContact CG2-CZ 4.32Å; F303-F305 AromaticContact CD2-CE2 3.98Å; F303-F305 HydrophobicContact CD2-CE2 3.98Å; F303-F305 AromaticContact CD2-CZ 3.97Å; F303-F305 HydrophobicContact CD2-CZ 3.97Å; F303-F305 AromaticContact CE2-CE2 3.73Å; F303-F305 HydrophobicContact CE2-CE2 3.73Å; F303-F305 AromaticContact CE2-CZ 3.74Å; F303-F305 HydrophobicContact CE2-CZ 3.74Å; F303-F314 HydrophobicContact CE2-CE2 4.36Å; F303-F314 HydrophobicContact CE2-CZ 4.15Å; F303-F314 HydrophobicContact CZ-CE2 4.37Å; F303-F314 HydrophobicContact CZ-CZ 4.04Å; F303-Q336 VanDerWaalsContact CZ-NE2 3.33Å; F303-C338 HydrophobicContact CD1-CB 4.04Å; F303-C338 HydrophobicContact CE1-CB 4.16Å; F303-K397 CarbonylContact C-O 3.55Å; F303-K397 WeakPolarHBondContact CA-O 3.41Å; F303-F399 HydrophobicContact CB-CD2 4.06Å; F303-F399 HydrophobicContact CB-CE2 3.58Å; F303-F399 HydrophobicContact CD2-CD2 4.35Å; F303-F399 HydrophobicContact CD2-CE2 4.18Å; F303-F399 AromaticContact CG-CE2 3.99Å; F303-F399 HydrophobicContact CG-CE2 3.99Å; F303-N467 HydrophobicContact CD1-CB 4.21Å; F303-N467 WeakPolarHBondContact CD1-ND2 3.28Å; F303-N467 HydrophobicContact CE1-CB 3.83Å; F303-N467 WeakPolarHBondContact CE1-ND2 3.38Å; F303-N467 VanDerWaalsContact CG-ND2 3.33Å; F303-N467 WeakPolarHBondContact CG-ND2 3.37Å; F303-N467 PolarHBondContact N-ND2 2.81Å; F303-N467 PolarHBondContact O-ND2 3.2Å
304	S	89.7	Confident	89.9	Confident	5 Å²	5	32.8 Å²	32.8	4%	0.035	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	171.1	173.2	-56.3	0	0	0	0	110.5	H396 K397 I398 F399	S304-H396 WeakPolarHBondContact CB-NE2 3.38Å; S304-H396 PolarHBondContact OG-CE1 3.02Å; S304-H396 PolarHBondContact OG-NE2 2.77Å; S304-K397 PolarHBondContact N-O 3.23Å; S304-I398 VanDerWaalsContact O-CA 3.31Å; S304-I398 WeakPolarHBondContact O-CA 3.46Å; S304-F399 PolarHBondContact O-N 2.78Å
305	F	90.3	Very high	89.9	Confident	3 Å²	3	35.1 Å²	35.1	1%	0.013	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	136.4	-179.4	-57.1	-84.2	0	0	0	110	F303 T310 Y311 F314 F399 I415	F303-F305 AromaticContact CD2-CE2 3.98Å; F303-F305 HydrophobicContact CD2-CE2 3.98Å; F303-F305 AromaticContact CD2-CZ 3.97Å; F303-F305 HydrophobicContact CD2-CZ 3.97Å; F303-F305 AromaticContact CE2-CE2 3.73Å; F303-F305 HydrophobicContact CE2-CE2 3.73Å; F303-F305 AromaticContact CE2-CZ 3.74Å; F303-F305 HydrophobicContact CE2-CZ 3.74Å; F305-T310 HydrophobicContact CD1-CG2 3.77Å; F305-T310 HydrophobicContact CE1-CG2 4.26Å; F305-Y311 AromaticContact CD2-CD2 3.6Å; F305-Y311 HydrophobicContact CD2-CD2 3.6Å; F305-Y311 HydrophobicContact CD2-CG 4.4Å; F305-Y311 AromaticContact CE2-CD2 3.87Å; F305-Y311 HydrophobicContact CE2-CD2 3.87Å; F305-Y311 HydrophobicContact CG-CD2 4.26Å; F305-F314 HydrophobicContact CE1-CB 3.82Å; F305-F314 HydrophobicContact CE1-CD2 4.19Å; F305-F314 AromaticContact CE1-CG 3.97Å; F305-F314 HydrophobicContact CE1-CG 3.97Å; F305-F314 HydrophobicContact CE2-CD1 4.13Å; F305-F314 HydrophobicContact CE2-CE1 4.49Å; F305-F314 HydrophobicContact CE2-CG 4.27Å; F305-F314 HydrophobicContact CZ-CB 3.75Å; F305-F314 AromaticContact CZ-CD1 3.71Å; F305-F314 HydrophobicContact CZ-CD1 3.71Å; F305-F314 AromaticContact CZ-CD2 3.67Å; F305-F314 HydrophobicContact CZ-CD2 3.67Å; F305-F314 HydrophobicContact CZ-CE1 4.21Å; F305-F314 HydrophobicContact CZ-CE2 4.15Å; F305-F314 AromaticContact CZ-CG 3.41Å; F305-F314 HydrophobicContact CZ-CG 3.41Å; F305-F314 VanDerWaalsContact CZ-CG 3.41Å; F305-F314 HydrophobicContact CZ-CZ 4.41Å; F305-F399 CarbonylContact C-O 3.59Å; F305-F399 WeakPolarHBondContact CA-O 3.48Å; F305-F399 HydrophobicContact CD1-CB 3.77Å; F305-F399 HydrophobicContact CE1-CB 4.03Å; F305-F399 HydrophobicContact CE1-CD2 4.24Å; F305-F399 HydrophobicContact CE1-CG 4.34Å; F305-I415 PolarHBondContact O-N 3.1Å
306	S	88.4	Confident	89.9	Confident	24 Å²	24	39.8 Å²	39.8	17%	0.168	19%	0.192	C	C	.	.	S	Bend	trans	-79.2	-28.2	177.1	69.9	0	0	0	0	112.4	F399 G400 P401	S306-F399 PolarHBondContact N-O 3.32Å; S306-F399 PolarHBondContact OG-O 2.69Å; S306-G400 VanDerWaalsContact OG-CA 3.26Å; S306-G400 WeakPolarHBondContact OG-CA 3.49Å; S306-P401 WeakPolarHBondContact OG-CD 3.45Å; S306-P401 PolarHBondContact OG-O 3.32Å; S306-P401 VanDerWaalsContact OG-O 3.1Å
307	D	87.1	Confident	90	Very high	35 Å²	35	39.6 Å²	39.6	19%	0.187	19%	0.191	C	C	.	.	S	Bend	trans	-134.9	156.5	-175.5	72.5	-62.1	0	0	0	112.9	K309 T310 Y311	D307-K309 VanDerWaalsContact C-N 3.31Å; D307-K309 PolarHBondContact O-N 3.48Å; D307-K309 WeakPolarHBondContact OD2-CA 3.37Å; D307-K309 VanDerWaalsContact OD2-CB 3.23Å; D307-K309 WeakPolarHBondContact OD2-CB 3.21Å; D307-K309 PolarHBondContact OD2-N 3.4Å; D307-K309 VanDerWaalsContact OD2-N 3.09Å; D307-T310 VanDerWaalsContact CG-OG1 3.24Å; D307-T310 WeakPolarHBondContact OD1-CB 3.46Å; D307-T310 PolarHBondContact OD1-OG1 3.02Å; D307-T310 PolarHBondContact OD2-N 3.47Å; D307-T310 PolarHBondContact OD2-OG1 3.32Å; D307-Y311 PolarHBondContact O-N 3.28Å
308	K	88.3	Confident	89.9	Confident	162 Å²	162	40.6 Å²	40.6	70%	0.704	20%	0.195	S	C	*	.	H	α-helix	trans	-69.6	-27.6	179.8	-172.2	175.9	179.3	-179.6	0	112.7	S312 I415	K308-S312 WeakPolarHBondContact O-CB 3.38Å; K308-S312 PolarHBondContact O-N 3.12Å; K308-S312 PolarHBondContact O-OG 2.9Å; K308-I415 HydrophobicContact CB-CD1 4.43Å
309	K	90.4	Very high	89.9	Confident	151 Å²	151	45.1 Å²	45.1	66%	0.657	22%	0.215	S	C	*	.	H	α-helix	trans	-69.5	-48.7	-178.8	172.1	-164.7	174.4	-159.4	0	109.7	D307 Y311 S312 E313	D307-K309 VanDerWaalsContact C-N 3.31Å; D307-K309 PolarHBondContact O-N 3.48Å; D307-K309 WeakPolarHBondContact OD2-CA 3.37Å; D307-K309 VanDerWaalsContact OD2-CB 3.23Å; D307-K309 WeakPolarHBondContact OD2-CB 3.21Å; D307-K309 PolarHBondContact OD2-N 3.4Å; D307-K309 VanDerWaalsContact OD2-N 3.09Å; K309-Y311 VanDerWaalsContact C-N 3.34Å; K309-Y311 PolarHBondContact O-N 3.4Å; K309-S312 PolarHBondContact O-N 2.76Å; K309-S312 VanDerWaalsContact O-N 3.14Å; K309-E313 PolarHBondContact O-N 3.15Å
310	T	90.2	Very high	90	Very high	10 Å²	10	49.2 Å²	49.2	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-60.5	-42.9	174.7	-53.7	0	0	0	0	111.7	I276 F305 D307 S312 E313 F314 F399	I276-T310 HydrophobicContact CD1-CG2 4.16Å; I276-T310 HydrophobicContact CG1-CG2 4.08Å; I276-T310 HydrophobicContact CG2-CG2 3.99Å; F305-T310 HydrophobicContact CD1-CG2 3.77Å; F305-T310 HydrophobicContact CE1-CG2 4.26Å; D307-T310 VanDerWaalsContact CG-OG1 3.24Å; D307-T310 WeakPolarHBondContact OD1-CB 3.46Å; D307-T310 PolarHBondContact OD1-OG1 3.02Å; D307-T310 PolarHBondContact OD2-N 3.47Å; D307-T310 PolarHBondContact OD2-OG1 3.32Å; T310-S312 VanDerWaalsContact C-N 3.34Å; T310-S312 PolarHBondContact O-N 3.34Å; T310-E313 PolarHBondContact O-N 3.34Å; T310-F314 WeakPolarHBondContact O-CB 3.47Å; T310-F314 PolarHBondContact O-N 2.8Å; T310-F399 HydrophobicContact CG2-CB 3.94Å
311	Y	90.4	Very high	90.3	Very high	61 Å²	61	49.6 Å²	49.6	24%	0.239	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-42.3	173.8	175.4	-101.4	0	0	0	112.6	F305 D307 K309 F314 Q315 I415	F305-Y311 AromaticContact CD2-CD2 3.6Å; F305-Y311 HydrophobicContact CD2-CD2 3.6Å; F305-Y311 HydrophobicContact CD2-CG 4.4Å; F305-Y311 AromaticContact CE2-CD2 3.87Å; F305-Y311 HydrophobicContact CE2-CD2 3.87Å; F305-Y311 HydrophobicContact CG-CD2 4.26Å; D307-Y311 PolarHBondContact O-N 3.28Å; K309-Y311 VanDerWaalsContact C-N 3.34Å; K309-Y311 PolarHBondContact O-N 3.4Å; Y311-F314 WeakPolarHBondContact O-CB 3.28Å; Y311-F314 PolarHBondContact O-N 3.21Å; Y311-Q315 HydrophobicContact CD1-CG 4.27Å; Y311-Q315 HydrophobicContact CD2-CG 4.47Å; Y311-Q315 HydrophobicContact CE1-CG 3.81Å; Y311-Q315 HydrophobicContact CE2-CG 4.05Å; Y311-Q315 WeakPolarHBondContact O-CG 3.47Å; Y311-Q315 PolarHBondContact O-N 3.42Å; Y311-Q315 PolarHBondContact OH-NE2 3.09Å; Y311-I415 HydrophobicContact CD1-CD1 4.3Å; Y311-I415 HydrophobicContact CD2-CG2 4.14Å; Y311-I415 HydrophobicContact CE2-CG2 4.16Å; Y311-I415 HydrophobicContact CG-CD1 3.99Å; Y311-I415 HydrophobicContact CG-CG2 4.44Å
312	S	91	Very high	90.4	Very high	56 Å²	56	49 Å²	49	39%	0.392	23%	0.229	S	C	.	.	H	α-helix	trans	-67.2	-38.7	179.7	-56.6	0	0	0	0	111.5	K308 K309 T310 Q315 R316	K308-S312 WeakPolarHBondContact O-CB 3.38Å; K308-S312 PolarHBondContact O-N 3.12Å; K308-S312 PolarHBondContact O-OG 2.9Å; K309-S312 PolarHBondContact O-N 2.76Å; K309-S312 VanDerWaalsContact O-N 3.14Å; T310-S312 VanDerWaalsContact C-N 3.34Å; T310-S312 PolarHBondContact O-N 3.34Å; S312-Q315 PolarHBondContact O-N 3.44Å; S312-R316 VanDerWaalsContact O-CB 3.3Å; S312-R316 WeakPolarHBondContact O-CB 3.38Å; S312-R316 PolarHBondContact O-N 3.31Å
313	E	91.7	Very high	90.6	Very high	40 Å²	40	51.7 Å²	51.7	19%	0.187	25%	0.245	C	C	.	.	H	α-helix	trans	-66.1	-40.1	175.7	-178.4	55.8	-157.7	0	0	111.8	K275 K309 T310 R316 Q317	K275-E313 HydrophobicContact CB-CG 4.3Å; K275-E313 HydrophobicContact CD-CG 4.05Å; K275-E313 WeakPolarHBondContact CD-OE1 3.43Å; K275-E313 IonicContact NZ-OE1 2.9Å; K275-E313 PolarHBondContact NZ-OE1 2.91Å; K309-E313 PolarHBondContact O-N 3.15Å; T310-E313 PolarHBondContact O-N 3.34Å; E313-R316 PolarHBondContact O-N 2.86Å; E313-R316 IonicContact OE1-CZ 3.68Å; E313-R316 IonicContact OE1-NE 3.39Å; E313-R316 PolarHBondContact OE1-NE 3.43Å; E313-R316 IonicContact OE1-NH2 3.83Å; E313-R316 PolarHBondContact OE1-NH2 3.06Å; E313-R316 IonicContact OE2-CZ 3.55Å; E313-R316 IonicContact OE2-NE 3.41Å; E313-R316 PolarHBondContact OE2-NE 3.13Å; E313-R316 IonicContact OE2-NH2 3.59Å; E313-Q317 WeakPolarHBondContact O-CG 3.33Å; E313-Q317 PolarHBondContact O-N 3.11Å; E313-Q317 PolarHBondContact OE1-NE2 2.89Å
314	F	91.8	Very high	90.6	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58	-50.3	171.3	173.6	-93.8	0	0	0	112	I172 W174 F271 F303 F305 T310 Y311 R316 Q317 K318	I172-F314 HydrophobicContact CD1-CD2 4.39Å; I172-F314 HydrophobicContact CD1-CE2 3.87Å; I172-F314 HydrophobicContact CG2-CE2 3.9Å; I172-F314 HydrophobicContact CG2-CZ 4.39Å; W174-F314 AromaticContact CE2-CE2 3.96Å; W174-F314 HydrophobicContact CH2-CD2 4.4Å; W174-F314 HydrophobicContact CH2-CE2 4.44Å; W174-F314 AromaticContact CZ2-CD2 3.69Å; W174-F314 HydrophobicContact CZ2-CD2 3.69Å; W174-F314 HydrophobicContact CZ2-CE1 4.42Å; W174-F314 AromaticContact CZ2-CE2 3.38Å; W174-F314 HydrophobicContact CZ2-CE2 3.38Å; W174-F314 HydrophobicContact CZ2-CG 4.35Å; W174-F314 AromaticContact CZ2-CZ 3.78Å; W174-F314 HydrophobicContact CZ2-CZ 3.78Å; W174-F314 AromaticContact NE1-CE2 3.94Å; W174-F314 AromaticContact NE1-CZ 3.73Å; F271-F314 AromaticContact CD1-CD2 3.94Å; F271-F314 HydrophobicContact CD1-CD2 3.94Å; F271-F314 HydrophobicContact CD1-CE2 4.49Å; F271-F314 AromaticContact CD2-CD2 3.91Å; F271-F314 HydrophobicContact CD2-CD2 3.91Å; F271-F314 HydrophobicContact CE1-CB 4.45Å; F271-F314 AromaticContact CE1-CD2 3.87Å; F271-F314 HydrophobicContact CE1-CD2 3.87Å; F271-F314 HydrophobicContact CE2-CB 3.94Å; F271-F314 AromaticContact CE2-CD2 3.93Å; F271-F314 HydrophobicContact CE2-CD2 3.93Å; F271-F314 HydrophobicContact CE2-CG 4.42Å; F271-F314 AromaticContact CG-CD2 3.94Å; F271-F314 HydrophobicContact CG-CD2 3.94Å; F271-F314 HydrophobicContact CG-CE2 4.41Å; F271-F314 HydrophobicContact CZ-CB 3.8Å; F271-F314 AromaticContact CZ-CD2 3.9Å; F271-F314 HydrophobicContact CZ-CD2 3.9Å; F271-F314 HydrophobicContact CZ-CG 4.37Å; F303-F314 HydrophobicContact CE2-CE2 4.36Å; F303-F314 HydrophobicContact CE2-CZ 4.15Å; F303-F314 HydrophobicContact CZ-CE2 4.37Å; F303-F314 HydrophobicContact CZ-CZ 4.04Å; F305-F314 HydrophobicContact CE1-CB 3.82Å; F305-F314 HydrophobicContact CE1-CD2 4.19Å; F305-F314 AromaticContact CE1-CG 3.97Å; F305-F314 HydrophobicContact CE1-CG 3.97Å; F305-F314 HydrophobicContact CE2-CD1 4.13Å; F305-F314 HydrophobicContact CE2-CE1 4.49Å; F305-F314 HydrophobicContact CE2-CG 4.27Å; F305-F314 HydrophobicContact CZ-CB 3.75Å; F305-F314 AromaticContact CZ-CD1 3.71Å; F305-F314 HydrophobicContact CZ-CD1 3.71Å; F305-F314 AromaticContact CZ-CD2 3.67Å; F305-F314 HydrophobicContact CZ-CD2 3.67Å; F305-F314 HydrophobicContact CZ-CE1 4.21Å; F305-F314 HydrophobicContact CZ-CE2 4.15Å; F305-F314 AromaticContact CZ-CG 3.41Å; F305-F314 HydrophobicContact CZ-CG 3.41Å; F305-F314 VanDerWaalsContact CZ-CG 3.41Å; F305-F314 HydrophobicContact CZ-CZ 4.41Å; T310-F314 WeakPolarHBondContact O-CB 3.47Å; T310-F314 PolarHBondContact O-N 2.8Å; Y311-F314 WeakPolarHBondContact O-CB 3.28Å; Y311-F314 PolarHBondContact O-N 3.21Å; F314-R316 VanDerWaalsContact C-N 3.32Å; F314-R316 PolarHBondContact O-N 2.8Å; F314-Q317 PolarHBondContact O-N 3.08Å; F314-K318 HydrophobicContact CE1-CD 4.2Å; F314-K318 HydrophobicContact CZ-CD 4.5Å; F314-K318 WeakPolarHBondContact O-CB 3.44Å; F314-K318 PolarHBondContact O-N 3.17Å
315	Q	90.7	Very high	90.6	Very high	52 Å²	52	56.6 Å²	56.6	24%	0.243	27%	0.271	C	S	.	.	H	α-helix	trans	-63.3	-39.1	178.6	-69.7	-61.7	-19.6	0	0	112.3	Y311 S312 K318 Q319	Y311-Q315 HydrophobicContact CD1-CG 4.27Å; Y311-Q315 HydrophobicContact CD2-CG 4.47Å; Y311-Q315 HydrophobicContact CE1-CG 3.81Å; Y311-Q315 HydrophobicContact CE2-CG 4.05Å; Y311-Q315 WeakPolarHBondContact O-CG 3.47Å; Y311-Q315 PolarHBondContact O-N 3.42Å; Y311-Q315 PolarHBondContact OH-NE2 3.09Å; S312-Q315 PolarHBondContact O-N 3.44Å; Q315-K318 PolarHBondContact O-N 2.84Å; Q315-Q319 VanDerWaalsContact O-CB 3.26Å; Q315-Q319 WeakPolarHBondContact O-CB 3.34Å; Q315-Q319 PolarHBondContact O-N 2.77Å
316	R	93.8	Very high	90.2	Very high	97 Å²	97	59.4 Å²	59.4	37%	0.366	28%	0.284	S	S	.	.	H	α-helix	trans	-59.8	-50	177.8	-169	-164.2	67.7	64.3	11.1	111.1	S312 E313 F314 Q319 E320	S312-R316 VanDerWaalsContact O-CB 3.3Å; S312-R316 WeakPolarHBondContact O-CB 3.38Å; S312-R316 PolarHBondContact O-N 3.31Å; E313-R316 PolarHBondContact O-N 2.86Å; E313-R316 IonicContact OE1-CZ 3.68Å; E313-R316 IonicContact OE1-NE 3.39Å; E313-R316 PolarHBondContact OE1-NE 3.43Å; E313-R316 IonicContact OE1-NH2 3.83Å; E313-R316 PolarHBondContact OE1-NH2 3.06Å; E313-R316 IonicContact OE2-CZ 3.55Å; E313-R316 IonicContact OE2-NE 3.41Å; E313-R316 PolarHBondContact OE2-NE 3.13Å; E313-R316 IonicContact OE2-NH2 3.59Å; F314-R316 VanDerWaalsContact C-N 3.32Å; F314-R316 PolarHBondContact O-N 2.8Å; R316-Q319 PolarHBondContact O-N 2.94Å; R316-E320 IonicContact CZ-OE2 3.7Å; R316-E320 IonicContact NH1-OE2 3.72Å; R316-E320 PolarHBondContact NH1-OE2 2.88Å; R316-E320 IonicContact NH2-OE2 3.05Å; R316-E320 VanDerWaalsContact O-CB 3.27Å; R316-E320 WeakPolarHBondContact O-CB 3.26Å; R316-E320 PolarHBondContact O-N 3.31Å
317	Q	93.5	Very high	90	Very high	17 Å²	17	66 Å²	66	8%	0.079	31%	0.31	C	S	.	.	H	α-helix	trans	-64.6	-42.2	178	-71.5	-176.5	35.5	0	0	112.2	W174 F271 E313 F314 Q319 E320 F321	W174-Q317 HydrophobicContact CH2-CB 3.58Å; W174-Q317 HydrophobicContact CZ3-CB 3.76Å; F271-Q317 HydrophobicContact CD2-CB 4.48Å; E313-Q317 WeakPolarHBondContact O-CG 3.33Å; E313-Q317 PolarHBondContact O-N 3.11Å; E313-Q317 PolarHBondContact OE1-NE2 2.89Å; F314-Q317 PolarHBondContact O-N 3.08Å; Q317-Q319 PolarHBondContact O-N 3.43Å; Q317-E320 PolarHBondContact O-N 2.83Å; Q317-F321 WeakPolarHBondContact O-CB 3.5Å; Q317-F321 PolarHBondContact O-N 2.75Å
318	K	91.3	Very high	89.8	Confident	22 Å²	22	68.6 Å²	68.6	10%	0.096	32%	0.32	C	S	.	.	H	α-helix	trans	-58.8	-47.9	176.2	-173.9	174.3	177.4	171.9	0	111.2	W174 F314 Q315 F321 F322 Q336 E469	W174-K318 HydrophobicContact CD2-CB 4.25Å; W174-K318 HydrophobicContact CD2-CG 4.22Å; W174-K318 HydrophobicContact CE3-CB 4.48Å; W174-K318 HydrophobicContact CH2-CB 3.85Å; W174-K318 VanDerWaalsContact CH2-N 3.26Å; W174-K318 HydrophobicContact CZ2-CB 3.53Å; W174-K318 HydrophobicContact CZ2-CG 4.15Å; W174-K318 HydrophobicContact CZ3-CB 4.31Å; F314-K318 HydrophobicContact CE1-CD 4.2Å; F314-K318 HydrophobicContact CZ-CD 4.5Å; F314-K318 WeakPolarHBondContact O-CB 3.44Å; F314-K318 PolarHBondContact O-N 3.17Å; Q315-K318 PolarHBondContact O-N 2.84Å; K318-F321 PolarHBondContact O-N 3.2Å; K318-F322 HydrophobicContact CD-CE2 4.13Å; K318-F322 HydrophobicContact CG-CD2 3.89Å; K318-F322 HydrophobicContact CG-CE2 3.49Å; K318-F322 VanDerWaalsContact CG-CE2 3.49Å; K318-F322 HydrophobicContact CG-CZ 4.31Å; K318-F322 WeakPolarHBondContact O-CD2 3.45Å; K318-F322 WeakPolarHBondContact O-CG 3.36Å; K318-F322 PolarHBondContact O-N 3.39Å; K318-F322 VanDerWaalsContact O-N 3.08Å; K318-Q336 VanDerWaalsContact NZ-OE1 3.08Å; K318-E469 IonicContact NZ-OE1 3.69Å
319	Q	90.6	Very high	89.7	Confident	129 Å²	129	61.6 Å²	61.6	60%	0.603	29%	0.29	S	S	*	.	H	α-helix	trans	-66.7	-43.9	179.9	-174.7	173.3	14.9	0	0	111.6	Q315 R316 Q317 F321 F322 T323	Q315-Q319 VanDerWaalsContact O-CB 3.26Å; Q315-Q319 WeakPolarHBondContact O-CB 3.34Å; Q315-Q319 PolarHBondContact O-N 2.77Å; R316-Q319 PolarHBondContact O-N 2.94Å; Q317-Q319 PolarHBondContact O-N 3.43Å; Q319-F321 VanDerWaalsContact C-N 3.31Å; Q319-F321 PolarHBondContact O-N 3.43Å; Q319-F322 PolarHBondContact O-N 2.96Å; Q319-T323 HydrophobicContact CG-CG2 3.88Å; Q319-T323 VanDerWaalsContact O-CB 3.31Å; Q319-T323 WeakPolarHBondContact O-CB 3.39Å; Q319-T323 WeakPolarHBondContact O-CG2 3.38Å; Q319-T323 PolarHBondContact O-N 2.88Å; Q319-T323 PolarHBondContact O-OG1 3.34Å
320	E	93	Very high	89.3	Confident	105 Å²	105	57 Å²	57	49%	0.491	27%	0.272	S	S	.	.	H	α-helix	trans	-57.4	-45.2	176.1	-178.4	174.6	-170.1	0	0	111.4	R316 Q317 T323 T324	R316-E320 IonicContact CZ-OE2 3.7Å; R316-E320 IonicContact NH1-OE2 3.72Å; R316-E320 PolarHBondContact NH1-OE2 2.88Å; R316-E320 IonicContact NH2-OE2 3.05Å; R316-E320 VanDerWaalsContact O-CB 3.27Å; R316-E320 WeakPolarHBondContact O-CB 3.26Å; R316-E320 PolarHBondContact O-N 3.31Å; Q317-E320 PolarHBondContact O-N 2.83Å; E320-T323 PolarHBondContact O-OG1 3.19Å; E320-T324 PolarHBondContact O-N 3.02Å; E320-T324 PolarHBondContact O-OG1 2.85Å
321	F	92.3	Very high	89.1	Confident	21 Å²	21	59.2 Å²	59.2	9%	0.092	28%	0.28	C	S	.	.	H	α-helix	trans	-60.4	-52.4	175.8	178	-113.2	0	0	0	111.9	W174 I176 K267 C269 Q317 K318 Q319 T324 Y325	W174-F321 HydrophobicContact CB-CD1 3.85Å; W174-F321 HydrophobicContact CB-CE1 3.88Å; W174-F321 HydrophobicContact CE3-CB 4.36Å; W174-F321 HydrophobicContact CE3-CD1 4.49Å; I176-F321 HydrophobicContact CB-CE1 4.08Å; I176-F321 HydrophobicContact CB-CZ 4.37Å; I176-F321 HydrophobicContact CG2-CE1 3.77Å; I176-F321 HydrophobicContact CG2-CE2 4.46Å; I176-F321 HydrophobicContact CG2-CZ 3.57Å; K267-F321 HydrophobicContact CB-CE2 4.48Å; K267-F321 HydrophobicContact CB-CZ 4.24Å; C269-F321 HydrophobicContact CB-CD1 4.32Å; C269-F321 HydrophobicContact CB-CD2 3.45Å; C269-F321 VanDerWaalsContact CB-CD2 3.45Å; C269-F321 HydrophobicContact CB-CE1 4.2Å; C269-F321 HydrophobicContact CB-CE2 3.3Å; C269-F321 HydrophobicContact CB-CG 3.97Å; C269-F321 HydrophobicContact CB-CZ 3.71Å; Q317-F321 WeakPolarHBondContact O-CB 3.5Å; Q317-F321 PolarHBondContact O-N 2.75Å; K318-F321 PolarHBondContact O-N 3.2Å; Q319-F321 VanDerWaalsContact C-N 3.31Å; Q319-F321 PolarHBondContact O-N 3.43Å; F321-T324 WeakPolarHBondContact O-CB 3.45Å; F321-T324 PolarHBondContact O-N 2.99Å; F321-Y325 HydrophobicContact CD2-CD2 4.36Å; F321-Y325 AromaticContact CD2-CE2 3.89Å; F321-Y325 HydrophobicContact CD2-CE2 3.89Å; F321-Y325 HydrophobicContact CE2-CD2 4.13Å; F321-Y325 AromaticContact CE2-CE2 3.53Å; F321-Y325 HydrophobicContact CE2-CE2 3.53Å; F321-Y325 HydrophobicContact CZ-CD2 4.46Å; F321-Y325 HydrophobicContact CZ-CE2 4.18Å; F321-Y325 VanDerWaalsContact O-CD2 3.23Å; F321-Y325 WeakPolarHBondContact O-CD2 3.38Å
322	F	89.7	Confident	88.9	Confident	25 Å²	25	56.5 Å²	56.5	11%	0.11	27%	0.269	C	S	.	.	H	α-helix	trans	-71.5	-38.2	-176	-64.5	-36.2	0	0	0	114.2	W174 I176 K318 Q319 T324 Y325 E326 M332 T334	W174-F322 HydrophobicContact CB-CE1 4.11Å; W174-F322 HydrophobicContact CB-CZ 3.97Å; W174-F322 HydrophobicContact CG-CZ 4.3Å; I176-F322 HydrophobicContact CB-CD1 4.28Å; I176-F322 HydrophobicContact CB-CE1 4.3Å; I176-F322 HydrophobicContact CD1-CD1 3.76Å; K318-F322 HydrophobicContact CD-CE2 4.13Å; K318-F322 HydrophobicContact CG-CD2 3.89Å; K318-F322 HydrophobicContact CG-CE2 3.49Å; K318-F322 VanDerWaalsContact CG-CE2 3.49Å; K318-F322 HydrophobicContact CG-CZ 4.31Å; K318-F322 WeakPolarHBondContact O-CD2 3.45Å; K318-F322 WeakPolarHBondContact O-CG 3.36Å; K318-F322 PolarHBondContact O-N 3.39Å; K318-F322 VanDerWaalsContact O-N 3.08Å; Q319-F322 PolarHBondContact O-N 2.96Å; F322-T324 PolarHBondContact O-N 2.92Å; F322-Y325 PolarHBondContact O-N 2.86Å; F322-E326 PolarHBondContact O-N 2.77Å; F322-E326 VanDerWaalsContact O-N 3.09Å; F322-M332 HydrophobicContact CB-CE 4.22Å; F322-T334 HydrophobicContact CD1-CG2 3.64Å; F322-T334 HydrophobicContact CD2-CG2 4.1Å; F322-T334 HydrophobicContact CE1-CG2 3.6Å; F322-T334 HydrophobicContact CE2-CG2 4.04Å; F322-T334 HydrophobicContact CG-CG2 3.91Å; F322-T334 HydrophobicContact CZ-CG2 3.82Å
323	T	88.6	Confident	88.7	Confident	68 Å²	68	55 Å²	55	42%	0.417	26%	0.256	S	S	.	.	H	α-helix	trans	-63.9	-30.5	176.6	52.7	0	0	0	0	112.1	Q319 E320 Y325 E326	Q319-T323 HydrophobicContact CG-CG2 3.88Å; Q319-T323 VanDerWaalsContact O-CB 3.31Å; Q319-T323 WeakPolarHBondContact O-CB 3.39Å; Q319-T323 WeakPolarHBondContact O-CG2 3.38Å; Q319-T323 PolarHBondContact O-N 2.88Å; Q319-T323 PolarHBondContact O-OG1 3.34Å; E320-T323 PolarHBondContact O-OG1 3.19Å; T323-Y325 PolarHBondContact O-N 3.21Å; T323-E326 PolarHBondContact O-N 3.36Å
324	T	90.4	Very high	88.4	Confident	70 Å²	70	53.7 Å²	53.7	43%	0.429	25%	0.251	S	S	.	.	H	α-helix	trans	-57.9	-36.7	173.1	-61.8	0	0	0	0	111.4	E320 F321 F322 F328	E320-T324 PolarHBondContact O-N 3.02Å; E320-T324 PolarHBondContact O-OG1 2.85Å; F321-T324 WeakPolarHBondContact O-CB 3.45Å; F321-T324 PolarHBondContact O-N 2.99Å; F322-T324 PolarHBondContact O-N 2.92Å; T324-F328 VanDerWaalsContact O-CE2 3.3Å; T324-F328 WeakPolarHBondContact O-CE2 3.22Å
325	Y	88.1	Confident	88.1	Confident	41 Å²	41	56 Å²	56	16%	0.161	26%	0.261	C	S	.	.	H	α-helix	trans	-100.8	-5.5	-174.2	-66.6	-75.9	0	0	0	115.5	I176 M265 K267 F321 F322 T323 K327 F328	I176-Y325 HydrophobicContact CD1-CD2 4.45Å; I176-Y325 HydrophobicContact CD1-CG 4.32Å; I176-Y325 HydrophobicContact CG2-CD2 3.85Å; I176-Y325 HydrophobicContact CG2-CE2 4.36Å; I176-Y325 HydrophobicContact CG2-CG 4.09Å; M265-Y325 HydrophobicContact CG-CD1 4.19Å; M265-Y325 HydrophobicContact CG-CE1 4.23Å; K267-Y325 HydrophobicContact CB-CE1 4.39Å; K267-Y325 HydrophobicContact CB-CE2 4.32Å; K267-Y325 HydrophobicContact CG-CE1 3.83Å; F321-Y325 HydrophobicContact CD2-CD2 4.36Å; F321-Y325 AromaticContact CD2-CE2 3.89Å; F321-Y325 HydrophobicContact CD2-CE2 3.89Å; F321-Y325 HydrophobicContact CE2-CD2 4.13Å; F321-Y325 AromaticContact CE2-CE2 3.53Å; F321-Y325 HydrophobicContact CE2-CE2 3.53Å; F321-Y325 HydrophobicContact CZ-CD2 4.46Å; F321-Y325 HydrophobicContact CZ-CE2 4.18Å; F321-Y325 VanDerWaalsContact O-CD2 3.23Å; F321-Y325 WeakPolarHBondContact O-CD2 3.38Å; F322-Y325 PolarHBondContact O-N 2.86Å; T323-Y325 PolarHBondContact O-N 3.21Å; Y325-K327 PolarHBondContact O-N 3.48Å; Y325-K327 VanDerWaalsContact O-N 3.08Å; Y325-F328 VanDerWaalsContact CA-CD2 3.44Å; Y325-F328 AromaticContact CD1-CD2 3.79Å; Y325-F328 HydrophobicContact CD1-CD2 3.79Å; Y325-F328 HydrophobicContact CD1-CE1 4.49Å; Y325-F328 AromaticContact CD1-CE2 3.54Å; Y325-F328 HydrophobicContact CD1-CE2 3.54Å; Y325-F328 HydrophobicContact CD1-CG 4.31Å; Y325-F328 AromaticContact CD1-CZ 3.93Å; Y325-F328 HydrophobicContact CD1-CZ 3.93Å; Y325-F328 HydrophobicContact CE1-CE2 4.15Å; Y325-F328 HydrophobicContact CE1-CZ 4.12Å; Y325-F328 HydrophobicContact CG-CD2 4.38Å; Y325-F328 HydrophobicContact CG-CE2 4.29Å; Y325-F328 WeakPolarHBondContact O-CD2 3.19Å; Y325-F328 PolarHBondContact O-N 3.42Å; Y325-F328 VanDerWaalsContact O-N 3.12Å
326	E	83.7	Confident	87.8	Confident	62 Å²	62	53.7 Å²	53.7	29%	0.29	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.4	-179.5	-172.4	177.5	-176.8	0	0	113.5	F322 T323 M332 N475 H477	F322-E326 PolarHBondContact O-N 2.77Å; F322-E326 VanDerWaalsContact O-N 3.09Å; T323-E326 PolarHBondContact O-N 3.36Å; E326-M332 HydrophobicContact CB-SD 4.4Å; E326-M332 HydrophobicContact CG-SD 4.39Å; E326-N475 VanDerWaalsContact O-CG 3.22Å; E326-N475 PolarHBondContact O-ND2 2.96Å; E326-H477 IonicContact OE1-CD2 3.31Å; E326-H477 PolarHBondContact OE1-CD2 3.35Å; E326-H477 VanDerWaalsContact OE1-CD2 3.31Å; E326-H477 IonicContact OE1-NE2 3.8Å
327	K	84.2	Confident	87.2	Confident	161 Å²	161	51.4 Å²	51.4	70%	0.7	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-5	-178.2	66.7	-177.6	177.2	-176.2	0	115.1	Y325	Y325-K327 PolarHBondContact O-N 3.48Å; Y325-K327 VanDerWaalsContact O-N 3.08Å
328	F	83	Confident	86.6	Confident	91 Å²	91	50.8 Å²	50.8	40%	0.399	24%	0.243	S	C	.	.	S	Bend	trans	-81.1	-35.6	-168.1	-79.7	-103.5	0	0	0	113.4	C178 M265 T324 Y325	C178-F328 HydrophobicContact CB-CB 4.21Å; M265-F328 HydrophobicContact CE-CD1 4.09Å; M265-F328 HydrophobicContact CE-CE1 3.85Å; T324-F328 VanDerWaalsContact O-CE2 3.3Å; T324-F328 WeakPolarHBondContact O-CE2 3.22Å; Y325-F328 VanDerWaalsContact CA-CD2 3.44Å; Y325-F328 AromaticContact CD1-CD2 3.79Å; Y325-F328 HydrophobicContact CD1-CD2 3.79Å; Y325-F328 HydrophobicContact CD1-CE1 4.49Å; Y325-F328 AromaticContact CD1-CE2 3.54Å; Y325-F328 HydrophobicContact CD1-CE2 3.54Å; Y325-F328 HydrophobicContact CD1-CG 4.31Å; Y325-F328 AromaticContact CD1-CZ 3.93Å; Y325-F328 HydrophobicContact CD1-CZ 3.93Å; Y325-F328 HydrophobicContact CE1-CE2 4.15Å; Y325-F328 HydrophobicContact CE1-CZ 4.12Å; Y325-F328 HydrophobicContact CG-CD2 4.38Å; Y325-F328 HydrophobicContact CG-CE2 4.29Å; Y325-F328 WeakPolarHBondContact O-CD2 3.19Å; Y325-F328 PolarHBondContact O-N 3.42Å; Y325-F328 VanDerWaalsContact O-N 3.12Å
329	D	85.5	Confident	86.1	Confident	15 Å²	15	51.6 Å²	51.6	8%	0.08	25%	0.25	C	C	.	.			trans	-156.7	167.9	-178.6	-144.6	-23.1	0	0	0	113.6	C178 Y179 H180 T264 Y331 N475 I478	C178-D329 HydrophobicContact CB-CB 3.75Å; Y179-D329 VanDerWaalsContact CA-OD2 3.29Å; Y179-D329 WeakPolarHBondContact CA-OD2 3.35Å; H180-D329 WeakPolarHBondContact CB-OD1 3.41Å; H180-D329 IonicContact CE1-OD2 2.81Å; H180-D329 IonicContact CG-OD1 3.81Å; H180-D329 IonicContact CG-OD2 2.71Å; H180-D329 PolarHBondContact N-OD2 3.46Å; H180-D329 IonicContact ND1-OD1 3.78Å; H180-D329 PolarHBondContact ND1-OD1 2.78Å; H180-D329 IonicContact ND1-OD2 2.76Å; H180-D329 PolarHBondContact ND1-OD2 3.24Å; T264-D329 WeakPolarHBondContact CB-OD2 3.12Å; T264-D329 WeakPolarHBondContact CG2-OD2 3.22Å; T264-D329 PolarHBondContact OG1-OD2 3.5Å; D329-Y331 VanDerWaalsContact C-N 3.31Å; D329-Y331 PolarHBondContact O-N 3.4Å; D329-N475 PolarHBondContact O-ND2 3.49Å; D329-I478 WeakPolarHBondContact O-CD1 3.49Å
330	I	82.7	Confident	85.3	Confident	54 Å²	54	45.8 Å²	45.8	28%	0.277	22%	0.223	S	C	.	.	S	Bend	trans	-61.3	-40.4	-175.6	-57.2	172.5	0	0	0	111.4	H180 N475 I478	H180-I330 HydrophobicContact CB-CD1 4.23Å; I330-N475 PolarHBondContact O-N 3.44Å; I330-I478 HydrophobicContact CG1-CG2 3.75Å
331	Y	86	Confident	83.9	Confident	56 Å²	56	43.1 Å²	43.1	22%	0.22	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	144.8	178.6	-55.2	-76.6	0	0	0	110.1	C178 Y179 Y181 D329 C474	C178-Y331 WeakPolarHBondContact CA-O 3.46Å; Y179-Y331 HydrophobicContact CD2-CD2 4.18Å; Y179-Y331 HydrophobicContact CD2-CG 4.37Å; Y179-Y331 HydrophobicContact CE2-CD2 4.05Å; Y179-Y331 AromaticContact CE2-CG 3.95Å; Y179-Y331 HydrophobicContact CE2-CG 3.95Å; Y179-Y331 PolarHBondContact N-O 3.21Å; Y179-Y331 WeakPolarHBondContact O-CB 3.49Å; Y179-Y331 PolarHBondContact O-N 2.97Å; Y179-Y331 VanDerWaalsContact O-N 3.08Å; Y181-Y331 HydrophobicContact CD2-CD2 4.13Å; Y181-Y331 AromaticContact CD2-CE2 3.79Å; Y181-Y331 HydrophobicContact CD2-CE2 3.79Å; Y181-Y331 HydrophobicContact CE2-CD2 4.29Å; Y181-Y331 HydrophobicContact CE2-CE2 4.16Å; D329-Y331 VanDerWaalsContact C-N 3.31Å; D329-Y331 PolarHBondContact O-N 3.4Å; Y331-C474 HydrophobicContact CD1-CB 4.27Å; Y331-C474 HydrophobicContact CE1-CB 4.32Å
332	M	85.7	Confident	82.3	Confident	5 Å²	5	47.4 Å²	47.4	3%	0.025	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	135.5	170.8	63.8	-176.2	-80.8	0	0	110.3	I176 K177 F322 E326 T334 V472 L473 N475	I176-M332 HydrophobicContact CD1-CE 3.3Å; I176-M332 HydrophobicContact CG1-CE 4.26Å; K177-M332 CarbonylContact O-C 3.59Å; K177-M332 VanDerWaalsContact O-CA 3.26Å; K177-M332 WeakPolarHBondContact O-CA 3.41Å; F322-M332 HydrophobicContact CB-CE 4.22Å; E326-M332 HydrophobicContact CB-SD 4.4Å; E326-M332 HydrophobicContact CG-SD 4.39Å; M332-T334 HydrophobicContact CE-CG2 3.54Å; M332-V472 CarbonylContact O-C 3.58Å; M332-V472 WeakPolarHBondContact O-CA 3.43Å; M332-L473 HydrophobicContact CE-CD1 3.9Å; M332-L473 HydrophobicContact CG-CB 3.64Å; M332-L473 HydrophobicContact CG-CD1 4.16Å; M332-L473 PolarHBondContact N-O 3.4Å; M332-L473 PolarHBondContact O-N 2.72Å; M332-L473 HydrophobicContact SD-CB 4.33Å; M332-L473 HydrophobicContact SD-CD1 4.22Å; M332-N475 PolarHBondContact SD-OD1 3.25Å
333	E	86.6	Confident	80.3	Confident	24 Å²	24	54.5 Å²	54.5	11%	0.112	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.8	170.7	-90.2	161.1	-150.3	0	0	108.5	I176 K177 Y179 R261 V471 V472	I176-E333 CarbonylContact C-O 3.5Å; I176-E333 VanDerWaalsContact CA-O 3.3Å; I176-E333 WeakPolarHBondContact CA-O 3.46Å; K177-E333 HydrophobicContact CB-CB 4.2Å; K177-E333 PolarHBondContact N-O 3.34Å; K177-E333 PolarHBondContact O-N 3.18Å; Y179-E333 HydrophobicContact CE1-CB 4.28Å; Y179-E333 VanDerWaalsContact CE1-CD 3.45Å; Y179-E333 HydrophobicContact CE1-CG 3.73Å; Y179-E333 WeakPolarHBondContact CE1-OE1 3.32Å; Y179-E333 PolarHBondContact OH-OE1 3.3Å; R261-E333 IonicContact NH1-OE1 2.81Å; E333-V471 WeakPolarHBondContact CA-O 2.9Å; E333-V472 HydrophobicContact CG-CB 4.37Å; E333-V472 HydrophobicContact CG-CG1 4.49Å; E333-V472 HydrophobicContact CG-CG2 3.68Å
334	T	86.4	Confident	78.6	Confident	13 Å²	13	57.3 Å²	57.3	8%	0.08	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	124.9	174	60.1	0	0	0	0	109.3	Q175 I176 F322 M332 A470 V471 L473	Q175-T334 CarbonylContact O-C 3.39Å; Q175-T334 WeakPolarHBondContact O-CA 3.49Å; I176-T334 HydrophobicContact CD1-CG2 4.27Å; I176-T334 HydrophobicContact CG1-CG2 4.47Å; F322-T334 HydrophobicContact CD1-CG2 3.64Å; F322-T334 HydrophobicContact CD2-CG2 4.1Å; F322-T334 HydrophobicContact CE1-CG2 3.6Å; F322-T334 HydrophobicContact CE2-CG2 4.04Å; F322-T334 HydrophobicContact CG-CG2 3.91Å; F322-T334 HydrophobicContact CZ-CG2 3.82Å; M332-T334 HydrophobicContact CE-CG2 3.54Å; T334-A470 CarbonylContact O-C 3.59Å; T334-A470 WeakPolarHBondContact O-CA 3.5Å; T334-V471 PolarHBondContact N-O 2.99Å; T334-V471 PolarHBondContact O-N 3.41Å; T334-V471 PolarHBondContact OG1-O 3.23Å; T334-L473 HydrophobicContact CG2-CD1 4Å
335	E	85	Confident	77.3	Confident	47 Å²	47	64.1 Å²	64.1	22%	0.22	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141.1	175	-65.9	178.5	-150.4	0	0	109.7	W174 Q175 K177 E469 A470	W174-E335 CarbonylContact C-O 3.53Å; W174-E335 WeakPolarHBondContact CA-O 3.38Å; Q175-E335 HydrophobicContact CB-CB 4.23Å; Q175-E335 PolarHBondContact N-O 3.46Å; Q175-E335 PolarHBondContact O-N 3.38Å; K177-E335 IonicContact NZ-OE1 2.99Å; K177-E335 PolarHBondContact NZ-OE1 3.18Å; E335-E469 WeakPolarHBondContact CA-O 3.35Å; E335-A470 HydrophobicContact CG-CB 3.8Å
336	Q	83.1	Confident	76.4	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.019	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	135	169.3	-176.3	179.3	-75.1	0	0	108.7	I172 L173 F303 K318 N467 N468 E469	I172-Q336 HydrophobicContact CG2-CG 4.17Å; L173-Q336 CarbonylContact O-C 3.58Å; L173-Q336 WeakPolarHBondContact O-CA 3.48Å; F303-Q336 VanDerWaalsContact CZ-NE2 3.33Å; K318-Q336 VanDerWaalsContact NZ-OE1 3.08Å; Q336-N467 PolarHBondContact NE2-O 3.23Å; Q336-N468 VanDerWaalsContact O-CA 3.23Å; Q336-N468 WeakPolarHBondContact O-CA 3.35Å; Q336-N468 PolarHBondContact O-OD1 2.97Å; Q336-E469 PolarHBondContact N-O 3.41Å; Q336-E469 VanDerWaalsContact N-O 3.11Å
337	I	82	Confident	76.1	Confident	49 Å²	49	64.3 Å²	64.3	25%	0.251	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	123.6	-177.1	-52.7	171.9	0	0	0	107.8	L173 T339 N468	L173-I337 HydrophobicContact CB-CB 4.29Å; L173-I337 PolarHBondContact N-O 3.41Å; L173-I337 PolarHBondContact O-N 2.97Å; I337-T339 HydrophobicContact CG2-CG2 3.74Å; I337-N468 WeakPolarHBondContact CA-OD1 2.98Å
338	C	81.5	Confident	75.9	Confident	5 Å²	5	63.6 Å²	63.6	3%	0.034	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	113.7	169.9	-175.4	0	0	0	0	110	T301 F303 N468	T301-C338 PolarHBondContact OG1-O 3.21Å; T301-C338 VanDerWaalsContact OG1-O 3.07Å; F303-C338 HydrophobicContact CD1-CB 4.04Å; F303-C338 HydrophobicContact CE1-CB 4.16Å; C338-N468 PolarHBondContact N-OD1 2.8Å
339	T	80.3	Confident	76.1	Confident	38 Å²	38	62.1 Å²	62.1	23%	0.233	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	165.1	173.6	65.3	0	0	0	0	110.7	S171 L173 I337	S171-T339 PolarHBondContact N-O 3.41Å; S171-T339 PolarHBondContact O-N 3.32Å; L173-T339 HydrophobicContact CD1-CG2 4.34Å; I337-T339 HydrophobicContact CG2-CG2 3.74Å
340	F	73.3	Confident	76.2	Confident	8 Å²	8	61.8 Å²	61.8	4%	0.035	30%	0.295	C	S	.	.	S	Bend	trans	-111.5	8.7	-179.1	-72.8	-68.1	0	0	0	113.9	L168 P170 T301 I395 K397	L168-F340 HydrophobicContact CB-CB 4.04Å; L168-F340 WeakPolarHBondContact CB-O 3.3Å; L168-F340 HydrophobicContact CD1-CB 3.94Å; P170-F340 HydrophobicContact CB-CD1 3.92Å; P170-F340 HydrophobicContact CB-CE1 3.63Å; P170-F340 HydrophobicContact CG-CE1 4.43Å; T301-F340 HydrophobicContact CG2-CD2 3.72Å; T301-F340 HydrophobicContact CG2-CE2 3.35Å; T301-F340 HydrophobicContact CG2-CZ 4.46Å; F340-I395 HydrophobicContact CD2-CD1 4.29Å; F340-I395 HydrophobicContact CD2-CG2 4.13Å; F340-I395 HydrophobicContact CE1-CG2 3.93Å; F340-I395 HydrophobicContact CE2-CB 3.66Å; F340-I395 HydrophobicContact CE2-CD1 4.16Å; F340-I395 HydrophobicContact CE2-CG2 3.4Å; F340-I395 HydrophobicContact CZ-CB 3.93Å; F340-I395 HydrophobicContact CZ-CG2 3.31Å; F340-K397 HydrophobicContact CE1-CD 4.32Å; F340-K397 HydrophobicContact CE1-CG 3.51Å; F340-K397 HydrophobicContact CZ-CG 4.06Å
341	T	63.8	Low	76.5	Confident	48 Å²	48	59.9 Å²	59.9	29%	0.294	29%	0.285	S	S	.	.			trans	-167.8	144.1	170.2	-50.3	0	0	0	0	107.2	F343	T341-F343 PolarHBondContact O-N 3.03Å
342	D	58.3	Low	76.7	Confident	112 Å²	112	57.2 Å²	57.2	60%	0.599	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-22	178.3	-60.3	-33.2	0	0	0	112.8	S171	S171-D342 PolarHBondContact OG-OD1 3.41Å; S171-D342 VanDerWaalsContact OG-OD1 3.1Å
343	F	47.8	Very low	76.8	Confident	173 Å²	173	58.7 Å²	58.7	76%	0.759	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-3.1	-166.3	-64.3	-71.7	0	0	0	116.3	T341	T341-F343 PolarHBondContact O-N 3.03Å
344	M	54.4	Low	76.9	Confident	127 Å²	127	59.5 Å²	59.5	63%	0.626	29%	0.286	S	S	*	.			trans	-136.8	109.7	-178.9	-67.1	-69.2	143	0	0	110.9	F346	M344-F346 VanDerWaalsContact C-N 3.29Å; M344-F346 HydrophobicContact CB-CE2 4.5Å; M344-F346 WeakPolarHBondContact O-CD2 3.44Å; M344-F346 PolarHBondContact O-N 2.86Å
345	K	62.6	Low	76.5	Confident	213 Å²	213	65.8 Å²	65.8	93%	0.926	31%	0.312	S	S	*	.			trans	-64.4	93.4	163.9	-74	-179.7	-179.3	174.7	0	107.5
346	F	68.7	Low	76.1	Confident	76 Å²	76	68.7 Å²	68.7	33%	0.333	34%	0.338	S	S	.	.			trans	-61.8	129.4	170.2	-73	-80.8	0	0	0	108.7	L161 L168 M344 K348	L161-F346 HydrophobicContact CD1-CD1 4.5Å; L161-F346 HydrophobicContact CD1-CE1 4.2Å; L168-F346 HydrophobicContact CD1-CE2 4.05Å; L168-F346 HydrophobicContact CD1-CZ 3.91Å; M344-F346 VanDerWaalsContact C-N 3.29Å; M344-F346 HydrophobicContact CB-CE2 4.5Å; M344-F346 WeakPolarHBondContact O-CD2 3.44Å; M344-F346 PolarHBondContact O-N 2.86Å; F346-K348 PolarHBondContact O-N 3.41Å
347	P	76.4	Confident	75.3	Confident	31 Å²	31	71 Å²	71	20%	0.201	35%	0.354	C	S	.	.			trans	-64.3	140	171.5	30.7	-35.6	0	0	0	108.5	W151 Q349 F350	W151-P347 HydrophobicContact CB-CG 4.23Å; W151-P347 HydrophobicContact CD2-CG 3.89Å; W151-P347 HydrophobicContact CG-CB 4.01Å; W151-P347 HydrophobicContact CG-CG 3.55Å; P347-Q349 PolarHBondContact O-N 2.96Å; P347-F350 HydrophobicContact CG-CD1 4.07Å; P347-F350 HydrophobicContact CG-CE1 3.35Å; P347-F350 HydrophobicContact CG-CE2 3.97Å; P347-F350 HydrophobicContact CG-CZ 3.33Å; P347-F350 WeakPolarHBondContact O-CE2 3.42Å
348	K	81.3	Confident	74.9	Confident	147 Å²	147	77.5 Å²	77.5	64%	0.639	38%	0.381	S	S	*	.	S	Bend	trans	-72.7	-18.8	-179.3	-66.9	178.4	-179.6	170.9	0	112.5	N298 L299 F346	N298-K348 WeakPolarHBondContact CA-O 3.21Å; L299-K348 PolarHBondContact N-O 3.22Å; F346-K348 PolarHBondContact O-N 3.41Å
349	Q	86.1	Confident	74.6	Confident	59 Å²	59	80.8 Å²	80.8	28%	0.276	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	132.1	-174	-175.2	175.7	22.1	0	0	110.6	E296 L297 N298 P347	E296-Q349 HydrophobicContact CG-CG 4.18Å; E296-Q349 VanDerWaalsContact CG-NE2 3.32Å; E296-Q349 PolarHBondContact OE1-NE2 2.91Å; L297-Q349 CarbonylContact O-C 3.59Å; L297-Q349 WeakPolarHBondContact O-CA 3.39Å; N298-Q349 WeakPolarHBondContact OD1-CG 3.29Å; P347-Q349 PolarHBondContact O-N 2.96Å
350	F	88.8	Confident	74.6	Confident	9 Å²	9	79.6 Å²	79.6	4%	0.039	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	148.9	176.2	-62.3	-90.6	0	0	0	110.3	W151 I153 L161 L297 L299 P347	W151-F350 HydrophobicContact CB-CD1 3.55Å; W151-F350 HydrophobicContact CB-CE1 4.04Å; W151-F350 HydrophobicContact CB-CG 4.47Å; W151-F350 HydrophobicContact CG-CD1 4.37Å; W151-F350 HydrophobicContact CG-CE1 4.42Å; I153-F350 HydrophobicContact CD1-CD1 3.16Å; I153-F350 HydrophobicContact CD1-CE1 3.4Å; I153-F350 HydrophobicContact CD1-CG 4.05Å; I153-F350 HydrophobicContact CD1-CZ 4.44Å; I153-F350 HydrophobicContact CG1-CD1 3.93Å; I153-F350 HydrophobicContact CG1-CE1 4.49Å; L161-F350 HydrophobicContact CD2-CD2 4.36Å; L161-F350 HydrophobicContact CD2-CE1 4.1Å; L161-F350 HydrophobicContact CD2-CE2 3.96Å; L161-F350 HydrophobicContact CD2-CZ 3.77Å; L297-F350 HydrophobicContact CB-CB 4.23Å; L297-F350 HydrophobicContact CD2-CB 4.48Å; L297-F350 HydrophobicContact CD2-CD2 4.34Å; L297-F350 PolarHBondContact N-O 3.33Å; L297-F350 PolarHBondContact O-N 3.36Å; L299-F350 HydrophobicContact CD1-CD2 4.18Å; L299-F350 HydrophobicContact CD1-CE2 3.59Å; L299-F350 HydrophobicContact CG-CD2 4.29Å; L299-F350 HydrophobicContact CG-CE2 4.14Å; P347-F350 HydrophobicContact CG-CD1 4.07Å; P347-F350 HydrophobicContact CG-CE1 3.35Å; P347-F350 HydrophobicContact CG-CE2 3.97Å; P347-F350 HydrophobicContact CG-CZ 3.33Å; P347-F350 WeakPolarHBondContact O-CE2 3.42Å
351	L	89.1	Confident	75.1	Confident	13 Å²	13	85.9 Å²	85.9	7%	0.068	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	115.1	170.2	-169.5	67.6	0	0	0	108.6	T150 W151 L152 I153 L294 I295 K388	T150-L351 HydrophobicContact CG2-CB 3.84Å; W151-L351 PolarHBondContact O-N 3.44Å; L152-L351 WeakPolarHBondContact CA-O 3.11Å; L152-L351 HydrophobicContact CD1-CB 4.33Å; L152-L351 HydrophobicContact CD1-CD2 4.19Å; L152-L351 HydrophobicContact CD1-CG 4.28Å; L152-L351 WeakPolarHBondContact CD1-O 3.49Å; I153-L351 PolarHBondContact N-O 3.26Å; L294-L351 HydrophobicContact CD1-CD1 3.6Å; L294-L351 HydrophobicContact CD1-CD2 4.01Å; L294-L351 HydrophobicContact CD1-CG 3.75Å; L294-L351 HydrophobicContact CG-CD1 3.98Å; I295-L351 CarbonylContact O-C 3.53Å; I295-L351 WeakPolarHBondContact O-CA 3.45Å; L351-K388 HydrophobicContact CD1-CD 4.12Å
352	I	90	Very high	76.1	Confident	1 Å²	1	85.2 Å²	85.2	1%	0.005	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	128.5	178.4	-52.3	166.8	0	0	0	108.9	I153 T155 A158 L289 L294 I295 L297	I153-I352 VanDerWaalsContact O-CA 3.24Å; I153-I352 WeakPolarHBondContact O-CA 3.43Å; T155-I352 HydrophobicContact CG2-CG2 3.76Å; A158-I352 HydrophobicContact CB-CD1 3.55Å; A158-I352 HydrophobicContact CB-CG1 3.93Å; A158-I352 HydrophobicContact CB-CG2 4.19Å; L289-I352 HydrophobicContact CD1-CD1 4.21Å; L294-I352 WeakPolarHBondContact CA-O 3.4Å; I295-I352 HydrophobicContact CB-CB 4.13Å; I295-I352 HydrophobicContact CB-CD1 4.44Å; I295-I352 PolarHBondContact N-O 3.43Å; I295-I352 PolarHBondContact O-N 3.45Å; L297-I352 HydrophobicContact CB-CD1 3.73Å; L297-I352 HydrophobicContact CB-CG1 4.23Å; L297-I352 HydrophobicContact CD2-CD1 4.01Å; L297-I352 HydrophobicContact CG-CD1 4.42Å
353	I	88.2	Confident	77.3	Confident	35 Å²	35	82.3 Å²	82.3	18%	0.179	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	138.5	171.5	-70.6	177.8	0	0	0	109.9	L152 I153 T155 L294 K355 L363	L152-I353 HydrophobicContact CD1-CB 4.14Å; L152-I353 HydrophobicContact CD1-CD1 3.23Å; L152-I353 HydrophobicContact CD1-CG1 3.5Å; L152-I353 VanDerWaalsContact CD1-CG1 3.5Å; L152-I353 HydrophobicContact CD2-CD1 4.12Å; L152-I353 HydrophobicContact CG-CD1 4.25Å; I153-I353 PolarHBondContact O-N 2.98Å; T155-I353 PolarHBondContact N-O 3.47Å; L294-I353 HydrophobicContact CD1-CD1 4.35Å; L294-I353 HydrophobicContact CD1-CG1 3.72Å; I353-K355 PolarHBondContact O-N 2.86Å; I353-L363 HydrophobicContact CD1-CD1 4.29Å
354	H	88.2	Confident	79.1	Confident	41 Å²	41	78.6 Å²	78.6	19%	0.19	39%	0.386	C	S	.	.			trans	-71.3	112.3	174.6	-174.8	-109.4	0	0	0	112	T155 Q293 S356 S357	T155-H354 HydrophobicContact CG2-CB 4.41Å; Q293-H354 PolarHBondContact O-N 3.08Å; H354-S356 PolarHBondContact O-N 3.18Å; H354-S357 PolarHBondContact O-N 2.88Å
355	K	78.5	Confident	80.6	Confident	146 Å²	146	73.9 Å²	73.9	64%	0.635	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-37.7	-174.5	-171.6	-179	-165.7	122.3	0	114.3	D154 I353 S357	D154-K355 WeakPolarHBondContact OD2-CD 3.3Å; D154-K355 IonicContact OD2-NZ 2.78Å; D154-K355 PolarHBondContact OD2-NZ 3.03Å; I353-K355 PolarHBondContact O-N 2.86Å; K355-S357 PolarHBondContact O-N 3.23Å
356	S	75	Confident	81.8	Confident	108 Å²	108	69.7 Å²	69.7	76%	0.755	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-4.6	-173.5	-171.9	0	0	0	0	113.5	H354	H354-S356 PolarHBondContact O-N 3.18Å
357	S	66.2	Low	82.8	Confident	52 Å²	52	67.9 Å²	67.9	36%	0.364	35%	0.352	S	S	.	.	S	Bend	trans	-105.9	131.2	177.2	-167.1	0	0	0	0	109.6	Q293 H354 K355	Q293-S357 PolarHBondContact NE2-OG 3.01Å; H354-S357 PolarHBondContact O-N 2.88Å; K355-S357 PolarHBondContact O-N 3.23Å
358	K	74	Confident	83.3	Confident	185 Å²	185	67.6 Å²	67.6	80%	0.804	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-48.6	138.1	164.7	-68.5	176	-178.7	173.1	0	107.4	P360	K358-P360 VanDerWaalsContact O-N 3.11Å
359	P	75.6	Confident	83.7	Confident	74 Å²	74	65.8 Å²	65.8	48%	0.481	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-54.5	128.4	179.8	23	-33	0	0	0	107.9
360	P	80.9	Confident	84	Confident	14 Å²	14	67.1 Å²	67.1	9%	0.091	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-57.9	151.9	-175.8	23.7	-30.3	0	0	0	109.4	Q293 K358 Y362 L363	Q293-P360 VanDerWaalsContact CD-CG 3.46Å; Q293-P360 HydrophobicContact CG-CG 4.07Å; K358-P360 VanDerWaalsContact O-N 3.11Å; P360-Y362 HydrophobicContact CB-CD1 3.66Å; P360-Y362 HydrophobicContact CB-CD2 4.45Å; P360-Y362 HydrophobicContact CB-CE1 3.27Å; P360-Y362 HydrophobicContact CB-CE2 4.15Å; P360-Y362 HydrophobicContact CB-CG 4.24Å; P360-Y362 HydrophobicContact CG-CD1 4.18Å; P360-Y362 HydrophobicContact CG-CD2 4.11Å; P360-Y362 HydrophobicContact CG-CE1 3.63Å; P360-Y362 HydrophobicContact CG-CE2 3.56Å; P360-Y362 HydrophobicContact CG-CG 4.4Å; P360-Y362 WeakPolarHBondContact CG-OH 3.39Å; P360-Y362 PolarHBondContact O-N 3.44Å; P360-L363 HydrophobicContact CG-CB 4.19Å; P360-L363 HydrophobicContact CG-CD1 3.69Å; P360-L363 HydrophobicContact CG-CG 3.83Å; P360-L363 PolarHBondContact O-N 3.11Å
361	M	83.8	Confident	84.1	Confident	139 Å²	139	67.2 Å²	67.2	69%	0.685	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-54.4	-35.8	-175.2	-68.3	179.9	67.5	0	0	112	L363 K364 T367	M361-L363 VanDerWaalsContact C-N 3.26Å; M361-L363 PolarHBondContact O-N 3.16Å; M361-K364 WeakPolarHBondContact O-CB 3.47Å; M361-K364 PolarHBondContact O-N 2.78Å; M361-K364 VanDerWaalsContact O-N 3.12Å; M361-T367 WeakPolarHBondContact O-CB 3.48Å; M361-T367 PolarHBondContact O-OG1 3.5Å
362	Y	84.5	Confident	84.2	Confident	35 Å²	35	67.1 Å²	67.1	14%	0.137	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-67.2	-18	178.8	61	-102.9	0	0	0	115	Q293 P360 F383 I384	Q293-Y362 PolarHBondContact OE1-OH 2.89Å; P360-Y362 HydrophobicContact CB-CD1 3.66Å; P360-Y362 HydrophobicContact CB-CD2 4.45Å; P360-Y362 HydrophobicContact CB-CE1 3.27Å; P360-Y362 HydrophobicContact CB-CE2 4.15Å; P360-Y362 HydrophobicContact CB-CG 4.24Å; P360-Y362 HydrophobicContact CG-CD1 4.18Å; P360-Y362 HydrophobicContact CG-CD2 4.11Å; P360-Y362 HydrophobicContact CG-CE1 3.63Å; P360-Y362 HydrophobicContact CG-CE2 3.56Å; P360-Y362 HydrophobicContact CG-CG 4.4Å; P360-Y362 WeakPolarHBondContact CG-OH 3.39Å; P360-Y362 PolarHBondContact O-N 3.44Å; Y362-F383 AromaticContact CD1-CE1 3.77Å; Y362-F383 HydrophobicContact CD1-CE1 3.77Å; Y362-F383 HydrophobicContact CE1-CE1 4.45Å; Y362-F383 HydrophobicContact CG-CD1 4.36Å; Y362-F383 AromaticContact CG-CE1 3.98Å; Y362-F383 HydrophobicContact CG-CE1 3.98Å; Y362-I384 HydrophobicContact CD2-CG1 4Å
363	L	83.7	Confident	84.1	Confident	51 Å²	51	72.3 Å²	72.3	27%	0.267	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-93.7	-7.9	173.7	-68.1	180	0	0	0	113.1	L294 I353 P360 M361 I384	L294-L363 HydrophobicContact CD1-CD1 4Å; L294-L363 HydrophobicContact CD2-CD1 4.37Å; L294-L363 HydrophobicContact CD2-CD2 4.26Å; I353-L363 HydrophobicContact CD1-CD1 4.29Å; P360-L363 HydrophobicContact CG-CB 4.19Å; P360-L363 HydrophobicContact CG-CD1 3.69Å; P360-L363 HydrophobicContact CG-CG 3.83Å; P360-L363 PolarHBondContact O-N 3.11Å; M361-L363 VanDerWaalsContact C-N 3.26Å; M361-L363 PolarHBondContact O-N 3.16Å; L363-I384 HydrophobicContact CD2-CG2 4.21Å
364	K	85.7	Confident	84.2	Confident	95 Å²	95	76.1 Å²	76.1	41%	0.413	40%	0.401	S	S	.	.	S	Bend	trans	-71.3	140.6	179.5	-66.3	-177	178.8	-179.8	0	110.9	M361 I366 T367 Y368	M361-K364 WeakPolarHBondContact O-CB 3.47Å; M361-K364 PolarHBondContact O-N 2.78Å; M361-K364 VanDerWaalsContact O-N 3.12Å; K364-I366 PolarHBondContact O-N 3.47Å; K364-T367 PolarHBondContact O-N 3.46Å; K364-T367 VanDerWaalsContact O-N 3.16Å; K364-Y368 PolarHBondContact O-N 2.9Å
365	G	85.2	Confident	84.3	Confident	28 Å²	28	75.6 Å²	75.6	29%	0.289	40%	0.4	S	S	.	.	H	α-helix	trans	-59.8	-30.4	177.8	0	0	0	0	0	114.8	R144 L369	R144-G365 PolarHBondContact NH1-O 3.25Å; G365-L369 PolarHBondContact O-N 3.23Å; G365-L369 VanDerWaalsContact O-N 3.16Å
366	I	88.5	Confident	84.9	Confident	124 Å²	124	71.3 Å²	71.3	64%	0.636	39%	0.388	S	S	*	.	H	α-helix	trans	-70.3	-42.6	177.4	-63	168.6	0	0	0	110.9	K364 Y368 L369 I370	K364-I366 PolarHBondContact O-N 3.47Å; I366-Y368 PolarHBondContact O-N 2.95Å; I366-L369 WeakPolarHBondContact O-CB 3.22Å; I366-L369 PolarHBondContact O-N 2.94Å; I366-I370 HydrophobicContact CG2-CD1 3.87Å; I366-I370 HydrophobicContact CG2-CG1 4.37Å; I366-I370 WeakPolarHBondContact O-CG1 3.33Å; I366-I370 PolarHBondContact O-N 3.36Å
367	T	88.9	Confident	85.6	Confident	39 Å²	39	66.2 Å²	66.2	24%	0.239	35%	0.352	C	S	.	.	H	α-helix	trans	-60.9	-38.9	177.3	-51.3	0	0	0	0	111	M361 K364 I370 A371	M361-T367 WeakPolarHBondContact O-CB 3.48Å; M361-T367 PolarHBondContact O-OG1 3.5Å; K364-T367 PolarHBondContact O-N 3.46Å; K364-T367 VanDerWaalsContact O-N 3.16Å; T367-I370 PolarHBondContact O-N 2.79Å; T367-A371 VanDerWaalsContact O-CB 3.29Å; T367-A371 WeakPolarHBondContact O-CB 3.23Å; T367-A371 PolarHBondContact O-N 3.42Å
368	Y	88.3	Confident	86.7	Confident	24 Å²	24	65.6 Å²	65.6	9%	0.094	34%	0.343	C	S	.	.	H	α-helix	trans	-61.8	-42.9	173.1	-166.9	-96.2	0	0	0	112.5	S140 R144 K364 I366 A371 T372 L380	S140-Y368 VanDerWaalsContact CA-OH 3.26Å; S140-Y368 WeakPolarHBondContact CA-OH 3.47Å; S140-Y368 WeakPolarHBondContact CB-OH 3.45Å; S140-Y368 WeakPolarHBondContact O-CE1 3.4Å; S140-Y368 VanDerWaalsContact O-CZ 3.27Å; S140-Y368 PolarHBondContact O-OH 3.36Å; R144-Y368 HydrophobicContact CB-CD1 4.36Å; R144-Y368 HydrophobicContact CB-CE1 3.91Å; K364-Y368 PolarHBondContact O-N 2.9Å; I366-Y368 PolarHBondContact O-N 2.95Å; Y368-A371 PolarHBondContact O-N 3.23Å; Y368-T372 WeakPolarHBondContact CE1-OG1 3.36Å; Y368-T372 WeakPolarHBondContact O-CB 3.23Å; Y368-T372 PolarHBondContact O-N 3Å; Y368-T372 PolarHBondContact O-OG1 3.04Å; Y368-L380 HydrophobicContact CD2-CD2 3.92Å
369	L	88.8	Confident	87.6	Confident	110 Å²	110	60.2 Å²	60.2	58%	0.576	33%	0.327	S	S	*	.	H	α-helix	trans	-61.7	-48.3	177	-173	162.1	0	0	0	111	G365 I366 A371 T372 L373	G365-L369 PolarHBondContact O-N 3.23Å; G365-L369 VanDerWaalsContact O-N 3.16Å; I366-L369 WeakPolarHBondContact O-CB 3.22Å; I366-L369 PolarHBondContact O-N 2.94Å; L369-A371 PolarHBondContact O-N 3.44Å; L369-T372 WeakPolarHBondContact O-CB 3.37Å; L369-T372 PolarHBondContact O-N 3.19Å; L369-L373 PolarHBondContact O-N 3.15Å
370	I	91.4	Very high	88.3	Confident	87 Å²	87	57.7 Å²	57.7	45%	0.446	31%	0.309	S	S	.	.	H	α-helix	trans	-61.2	-46	178	-65.2	168	0	0	0	110.6	I366 T367 T372 L373 L374	I366-I370 HydrophobicContact CG2-CD1 3.87Å; I366-I370 HydrophobicContact CG2-CG1 4.37Å; I366-I370 WeakPolarHBondContact O-CG1 3.33Å; I366-I370 PolarHBondContact O-N 3.36Å; T367-I370 PolarHBondContact O-N 2.79Å; I370-T372 VanDerWaalsContact C-N 3.28Å; I370-T372 PolarHBondContact O-N 3.45Å; I370-L373 PolarHBondContact O-N 3.34Å; I370-L374 HydrophobicContact CG2-CD1 3.99Å; I370-L374 WeakPolarHBondContact O-CG 3.24Å; I370-L374 PolarHBondContact O-N 2.81Å
371	A	91.7	Very high	88.8	Confident	10 Å²	10	57.5 Å²	57.5	8%	0.083	31%	0.307	C	S	.	.	H	α-helix	trans	-62.4	-37.7	177.3	0	0	0	0	0	111.8	T367 Y368 L369 L374 L375 C376 S377 L380	T367-A371 VanDerWaalsContact O-CB 3.29Å; T367-A371 WeakPolarHBondContact O-CB 3.23Å; T367-A371 PolarHBondContact O-N 3.42Å; Y368-A371 PolarHBondContact O-N 3.23Å; L369-A371 PolarHBondContact O-N 3.44Å; A371-L374 PolarHBondContact O-N 2.92Å; A371-L375 PolarHBondContact O-N 2.72Å; A371-C376 HydrophobicContact CB-CB 4.34Å; A371-C376 CarbonylContact O-C 3.47Å; A371-C376 WeakPolarHBondContact O-CA 3.45Å; A371-C376 PolarHBondContact O-N 3.34Å; A371-S377 PolarHBondContact O-N 3.27Å; A371-L380 HydrophobicContact CB-CB 4.18Å; A371-L380 HydrophobicContact CB-CD2 3.49Å; A371-L380 VanDerWaalsContact CB-CD2 3.49Å; A371-L380 HydrophobicContact CB-CG 4.4Å
372	T	90.9	Very high	89.1	Confident	12 Å²	12	53 Å²	53	7%	0.074	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-45.5	176	-56	0	0	0	0	111	Y136 L137 Y368 L369 I370 L374 L375	Y136-T372 HydrophobicContact CE1-CG2 3.77Å; Y136-T372 WeakPolarHBondContact CE1-O 3.33Å; Y136-T372 PolarHBondContact OH-O 2.78Å; L137-T372 HydrophobicContact CD2-CG2 3.37Å; Y368-T372 WeakPolarHBondContact CE1-OG1 3.36Å; Y368-T372 WeakPolarHBondContact O-CB 3.23Å; Y368-T372 PolarHBondContact O-N 3Å; Y368-T372 PolarHBondContact O-OG1 3.04Å; L369-T372 WeakPolarHBondContact O-CB 3.37Å; L369-T372 PolarHBondContact O-N 3.19Å; I370-T372 VanDerWaalsContact C-N 3.28Å; I370-T372 PolarHBondContact O-N 3.45Å; T372-L374 VanDerWaalsContact C-N 3.29Å; T372-L374 PolarHBondContact O-N 3.21Å; T372-L375 PolarHBondContact O-N 2.88Å; T372-L375 VanDerWaalsContact O-N 3.15Å
373	L	88.2	Confident	89.5	Confident	110 Å²	110	56.3 Å²	56.3	58%	0.576	30%	0.3	S	S	*	.	H	α-helix	trans	-60.1	-38.1	176.9	-177.1	67.4	0	0	0	112.3	L369 I370 L375	L369-L373 PolarHBondContact O-N 3.15Å; I370-L373 PolarHBondContact O-N 3.34Å; L373-L375 VanDerWaalsContact C-N 3.28Å; L373-L375 PolarHBondContact O-N 3.42Å
374	L	90.1	Very high	89.8	Confident	114 Å²	114	54.7 Å²	54.7	60%	0.597	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	8.1	179.4	-65.7	177.7	0	0	0	114.1	I370 A371 T372 C376	I370-L374 HydrophobicContact CG2-CD1 3.99Å; I370-L374 WeakPolarHBondContact O-CG 3.24Å; I370-L374 PolarHBondContact O-N 2.81Å; A371-L374 PolarHBondContact O-N 2.92Å; T372-L374 VanDerWaalsContact C-N 3.29Å; T372-L374 PolarHBondContact O-N 3.21Å; L374-C376 HydrophobicContact CB-CB 4.41Å; L374-C376 PolarHBondContact O-N 3.33Å; L374-C376 VanDerWaalsContact O-N 3.13Å; L374-C376 PolarHBondContact O-SG 3.06Å
375	L	90.6	Very high	90	Very high	31 Å²	31	51.6 Å²	51.6	16%	0.162	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	21.2	-173.4	-79.2	64.4	0	0	0	113.7	L74 V75 I78 Y133 Y136 A371 T372 L373	L74-L375 HydrophobicContact CB-CD2 3.57Å; L74-L375 HydrophobicContact CD1-CD2 4.25Å; L74-L375 HydrophobicContact CD1-CG 4.49Å; V75-L375 HydrophobicContact CG2-CD2 3.99Å; I78-L375 HydrophobicContact CD1-CD2 3.77Å; Y133-L375 HydrophobicContact CE2-CD1 4.22Å; Y136-L375 WeakPolarHBondContact OH-CA 3.31Å; A371-L375 PolarHBondContact O-N 2.72Å; T372-L375 PolarHBondContact O-N 2.88Å; T372-L375 VanDerWaalsContact O-N 3.15Å; L373-L375 VanDerWaalsContact C-N 3.28Å; L373-L375 PolarHBondContact O-N 3.42Å
376	C	90.5	Very high	90.3	Very high	56 Å²	56	51.7 Å²	51.7	38%	0.378	28%	0.276	S	S	.	.			trans	-97.5	16.1	179.1	-69.5	0	0	0	0	112.8	A371 L374 F378 P379 L380	A371-C376 HydrophobicContact CB-CB 4.34Å; A371-C376 CarbonylContact O-C 3.47Å; A371-C376 WeakPolarHBondContact O-CA 3.45Å; A371-C376 PolarHBondContact O-N 3.34Å; L374-C376 HydrophobicContact CB-CB 4.41Å; L374-C376 PolarHBondContact O-N 3.33Å; L374-C376 VanDerWaalsContact O-N 3.13Å; L374-C376 PolarHBondContact O-SG 3.06Å; C376-F378 VanDerWaalsContact C-N 3.35Å; C376-F378 PolarHBondContact O-N 2.77Å; C376-P379 WeakPolarHBondContact O-CD 3.43Å; C376-L380 VanDerWaalsContact O-CB 3.3Å; C376-L380 WeakPolarHBondContact O-CB 3.29Å; C376-L380 PolarHBondContact O-N 3.12Å
377	S	89.6	Confident	90.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-40.9	-179.9	75.7	0	0	0	0	111.6	Y136 S140 A371 L380 R381	Y136-S377 WeakPolarHBondContact CE2-OG 3.12Å; Y136-S377 VanDerWaalsContact CZ-OG 3.3Å; Y136-S377 WeakPolarHBondContact OH-CB 3.43Å; Y136-S377 PolarHBondContact OH-N 3.47Å; Y136-S377 PolarHBondContact OH-OG 2.8Å; S140-S377 PolarHBondContact OG-OG 3.2Å; A371-S377 PolarHBondContact O-N 3.27Å; S377-L380 PolarHBondContact O-N 3.29Å; S377-R381 WeakPolarHBondContact O-CG 3.44Å; S377-R381 PolarHBondContact O-N 2.81Å
378	F	91	Very high	90.5	Very high	39 Å²	39	47.3 Å²	47.3	17%	0.171	25%	0.251	C	S	.	.	H	α-helix	trans	-63.7	-53.1	178.7	174.7	-106.8	0	0	0	113	A61 E64 C67 A68 T71 C376 L380 R381 I382	A61-F378 HydrophobicContact CB-CZ 4.1Å; E64-F378 HydrophobicContact CB-CE2 4.29Å; C67-F378 HydrophobicContact CB-CD2 4.18Å; A68-F378 HydrophobicContact CB-CD2 4.25Å; A68-F378 HydrophobicContact CB-CE1 4.24Å; A68-F378 HydrophobicContact CB-CE2 3.83Å; A68-F378 HydrophobicContact CB-CZ 3.8Å; T71-F378 HydrophobicContact CG2-CB 4.18Å; C376-F378 VanDerWaalsContact C-N 3.35Å; C376-F378 PolarHBondContact O-N 2.77Å; F378-L380 VanDerWaalsContact C-N 3.26Å; F378-L380 PolarHBondContact O-N 3.38Å; F378-R381 PolarHBondContact O-N 3.39Å; F378-R381 VanDerWaalsContact O-N 3.14Å; F378-I382 HydrophobicContact CD1-CD1 4.01Å; F378-I382 HydrophobicContact CD2-CD1 4.42Å; F378-I382 HydrophobicContact CE1-CD1 3.52Å; F378-I382 HydrophobicContact CE2-CD1 3.98Å; F378-I382 HydrophobicContact CE2-CG1 4.45Å; F378-I382 HydrophobicContact CG-CD1 4.45Å; F378-I382 HydrophobicContact CZ-CD1 3.52Å; F378-I382 HydrophobicContact CZ-CG1 4.44Å; F378-I382 PolarHBondContact O-N 3.25Å; F378-I382 VanDerWaalsContact O-N 3.12Å
379	P	92	Very high	90.7	Very high	73 Å²	73	46.1 Å²	46.1	47%	0.474	25%	0.247	S	C	.	.	H	α-helix	trans	-55.5	-38.9	171.4	-26.7	33.2	0	0	0	113.5	C376 I382 F383	C376-P379 WeakPolarHBondContact O-CD 3.43Å; P379-I382 PolarHBondContact O-N 2.9Å; P379-F383 WeakPolarHBondContact O-CB 3.2Å; P379-F383 PolarHBondContact O-N 3.12Å
380	L	91.1	Very high	90.9	Very high	21 Å²	21	44.5 Å²	44.5	11%	0.11	24%	0.235	C	C	.	.	H	α-helix	trans	-63.8	-41.7	177.2	179.8	65	0	0	0	111.7	Y368 A371 C376 S377 F378 F383 I384	Y368-L380 HydrophobicContact CD2-CD2 3.92Å; A371-L380 HydrophobicContact CB-CB 4.18Å; A371-L380 HydrophobicContact CB-CD2 3.49Å; A371-L380 VanDerWaalsContact CB-CD2 3.49Å; A371-L380 HydrophobicContact CB-CG 4.4Å; C376-L380 VanDerWaalsContact O-CB 3.3Å; C376-L380 WeakPolarHBondContact O-CB 3.29Å; C376-L380 PolarHBondContact O-N 3.12Å; S377-L380 PolarHBondContact O-N 3.29Å; F378-L380 VanDerWaalsContact C-N 3.26Å; F378-L380 PolarHBondContact O-N 3.38Å; L380-F383 WeakPolarHBondContact O-CB 3.41Å; L380-F383 PolarHBondContact O-N 3.11Å; L380-I384 HydrophobicContact CD1-CD1 4.25Å; L380-I384 HydrophobicContact CD1-CG1 4.33Å; L380-I384 HydrophobicContact CG-CD1 3.95Å; L380-I384 HydrophobicContact CG-CG1 4.46Å; L380-I384 VanDerWaalsContact O-CG1 3.28Å; L380-I384 WeakPolarHBondContact O-CG1 3.2Å; L380-I384 PolarHBondContact O-N 3.38Å
381	R	89.7	Confident	91	Very high	10 Å²	10	40.5 Å²	40.5	4%	0.038	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-45.1	176.1	-71.5	-179.7	-160.1	175.8	14.5	111.5	E64 C67 E139 S140 S143 S377 F378 F383 I384 Y385	E64-R381 IonicContact OE2-NH1 3.55Å; E64-R381 PolarHBondContact OE2-NH1 3.15Å; C67-R381 VanDerWaalsContact SG-CZ 3.56Å; C67-R381 PolarHBondContact SG-NH2 2.85Å; C67-R381 VanDerWaalsContact SG-NH2 3.36Å; E139-R381 IonicContact OE1-CZ 3.57Å; E139-R381 IonicContact OE1-NH1 2.9Å; E139-R381 PolarHBondContact OE1-NH1 2.92Å; E139-R381 IonicContact OE1-NH2 3.55Å; E139-R381 PolarHBondContact OE1-NH2 2.88Å; E139-R381 IonicContact OE2-CZ 3.6Å; E139-R381 IonicContact OE2-NH1 2.78Å; E139-R381 IonicContact OE2-NH2 3.48Å; E139-R381 PolarHBondContact OE2-NH2 3.12Å; S140-R381 VanDerWaalsContact CA-NH2 3.3Å; S140-R381 PolarHBondContact OG-NH2 3.46Å; S143-R381 PolarHBondContact OG-NE 3.29Å; S143-R381 PolarHBondContact OG-NH1 3.34Å; S377-R381 WeakPolarHBondContact O-CG 3.44Å; S377-R381 PolarHBondContact O-N 2.81Å; F378-R381 PolarHBondContact O-N 3.39Å; F378-R381 VanDerWaalsContact O-N 3.14Å; R381-F383 VanDerWaalsContact C-N 3.32Å; R381-F383 PolarHBondContact O-N 3.39Å; R381-I384 PolarHBondContact O-N 3.06Å; R381-Y385 WeakPolarHBondContact O-CB 3.47Å; R381-Y385 PolarHBondContact O-N 2.97Å
382	I	90.9	Very high	91.1	Very high	45 Å²	45	42.8 Å²	42.8	23%	0.231	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-43.4	176	-64	166.7	0	0	0	110.3	A61 F378 P379 Y385 A386	A61-I382 HydrophobicContact CB-CD1 3.76Å; A61-I382 HydrophobicContact CB-CG1 4.05Å; F378-I382 HydrophobicContact CD1-CD1 4.01Å; F378-I382 HydrophobicContact CD2-CD1 4.42Å; F378-I382 HydrophobicContact CE1-CD1 3.52Å; F378-I382 HydrophobicContact CE2-CD1 3.98Å; F378-I382 HydrophobicContact CE2-CG1 4.45Å; F378-I382 HydrophobicContact CG-CD1 4.45Å; F378-I382 HydrophobicContact CZ-CD1 3.52Å; F378-I382 HydrophobicContact CZ-CG1 4.44Å; F378-I382 PolarHBondContact O-N 3.25Å; F378-I382 VanDerWaalsContact O-N 3.12Å; P379-I382 PolarHBondContact O-N 2.9Å; I382-Y385 PolarHBondContact O-N 3.24Å; I382-A386 VanDerWaalsContact O-CB 3.29Å; I382-A386 WeakPolarHBondContact O-CB 3.34Å; I382-A386 PolarHBondContact O-N 2.96Å
383	F	92.1	Very high	91.1	Very high	103 Å²	103	42.2 Å²	42.2	45%	0.452	22%	0.22	S	C	.	.	H	α-helix	trans	-62.5	-43.6	178.2	-178.1	-101.6	0	0	0	112.5	Y362 P379 L380 R381 A386 N387	Y362-F383 AromaticContact CD1-CE1 3.77Å; Y362-F383 HydrophobicContact CD1-CE1 3.77Å; Y362-F383 HydrophobicContact CE1-CE1 4.45Å; Y362-F383 HydrophobicContact CG-CD1 4.36Å; Y362-F383 AromaticContact CG-CE1 3.98Å; Y362-F383 HydrophobicContact CG-CE1 3.98Å; P379-F383 WeakPolarHBondContact O-CB 3.2Å; P379-F383 PolarHBondContact O-N 3.12Å; L380-F383 WeakPolarHBondContact O-CB 3.41Å; L380-F383 PolarHBondContact O-N 3.11Å; R381-F383 VanDerWaalsContact C-N 3.32Å; R381-F383 PolarHBondContact O-N 3.39Å; F383-A386 PolarHBondContact O-N 3.26Å; F383-N387 WeakPolarHBondContact CE1-ND2 3.18Å; F383-N387 WeakPolarHBondContact CZ-ND2 3.4Å; F383-N387 PolarHBondContact O-N 3.01Å
384	I	90.1	Very high	91.1	Very high	17 Å²	17	41.1 Å²	41.1	9%	0.087	21%	0.211	C	C	.	.	H	α-helix	trans	-62.1	-45.3	175.1	-67.2	166.6	0	0	0	110.3	L294 Y362 L363 L380 R381 N387 K388	L294-I384 HydrophobicContact CD2-CG2 4.26Å; Y362-I384 HydrophobicContact CD2-CG1 4Å; L363-I384 HydrophobicContact CD2-CG2 4.21Å; L380-I384 HydrophobicContact CD1-CD1 4.25Å; L380-I384 HydrophobicContact CD1-CG1 4.33Å; L380-I384 HydrophobicContact CG-CD1 3.95Å; L380-I384 HydrophobicContact CG-CG1 4.46Å; L380-I384 VanDerWaalsContact O-CG1 3.28Å; L380-I384 WeakPolarHBondContact O-CG1 3.2Å; L380-I384 PolarHBondContact O-N 3.38Å; R381-I384 PolarHBondContact O-N 3.06Å; I384-N387 PolarHBondContact O-N 2.9Å; I384-K388 WeakPolarHBondContact O-CB 3.37Å; I384-K388 PolarHBondContact O-N 3.48Å; I384-K388 VanDerWaalsContact O-N 3.11Å
385	Y	90.8	Very high	91.1	Very high	31 Å²	31	35.9 Å²	35.9	12%	0.122	18%	0.183	C	C	.	.	H	α-helix	trans	-62.6	-43.3	177.9	-175.6	-92.1	0	0	0	111.9	R52 E56 Y60 R381 I382 N387 K388	R52-Y385 HydrophobicContact CG-CE1 4.33Å; R52-Y385 PolarHBondContact NH1-OH 3.44Å; R52-Y385 VanDerWaalsContact NH1-OH 3.13Å; E56-Y385 HydrophobicContact CB-CE1 4.47Å; Y60-Y385 AromaticContact CD1-CD1 3.87Å; Y60-Y385 HydrophobicContact CD1-CD1 3.87Å; Y60-Y385 AromaticContact CD1-CD2 3.85Å; Y60-Y385 HydrophobicContact CD1-CD2 3.85Å; Y60-Y385 HydrophobicContact CD1-CE2 4.5Å; Y60-Y385 AromaticContact CD1-CG 3.5Å; Y60-Y385 HydrophobicContact CD1-CG 3.5Å; Y60-Y385 VanDerWaalsContact CD1-CG 3.5Å; Y60-Y385 AromaticContact CD2-CD2 3.61Å; Y60-Y385 HydrophobicContact CD2-CD2 3.61Å; Y60-Y385 AromaticContact CD2-CE2 3.64Å; Y60-Y385 HydrophobicContact CD2-CE2 3.64Å; Y60-Y385 HydrophobicContact CD2-CG 4.12Å; Y60-Y385 HydrophobicContact CE1-CD2 4.06Å; Y60-Y385 AromaticContact CE1-CG 3.89Å; Y60-Y385 HydrophobicContact CE1-CG 3.89Å; Y60-Y385 AromaticContact CE2-CD2 3.86Å; Y60-Y385 HydrophobicContact CE2-CD2 3.86Å; Y60-Y385 HydrophobicContact CE2-CE2 4.22Å; Y60-Y385 HydrophobicContact CE2-CG 4.48Å; Y60-Y385 AromaticContact CG-CD1 3.83Å; Y60-Y385 HydrophobicContact CG-CD1 3.83Å; Y60-Y385 AromaticContact CG-CD2 3.62Å; Y60-Y385 HydrophobicContact CG-CD2 3.62Å; Y60-Y385 HydrophobicContact CG-CE1 4.03Å; Y60-Y385 AromaticContact CG-CE2 3.82Å; Y60-Y385 HydrophobicContact CG-CE2 3.82Å; Y60-Y385 AromaticContact CG-CG 3.62Å; Y60-Y385 HydrophobicContact CG-CG 3.62Å; R381-Y385 WeakPolarHBondContact O-CB 3.47Å; R381-Y385 PolarHBondContact O-N 2.97Å; I382-Y385 PolarHBondContact O-N 3.24Å; Y385-N387 VanDerWaalsContact C-N 3.3Å; Y385-N387 PolarHBondContact O-N 3.41Å; Y385-K388 WeakPolarHBondContact O-CB 3.49Å; Y385-K388 PolarHBondContact O-N 2.87Å; Y385-K388 VanDerWaalsContact O-N 3.12Å
386	A	91	Very high	91.1	Very high	30 Å²	30	35.2 Å²	35.2	25%	0.248	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-35.5	178.9	0	0	0	0	0	112.6	Q51 I382 F383 K388	Q51-A386 PolarHBondContact NE2-O 2.72Å; I382-A386 VanDerWaalsContact O-CB 3.29Å; I382-A386 WeakPolarHBondContact O-CB 3.34Å; I382-A386 PolarHBondContact O-N 2.96Å; F383-A386 PolarHBondContact O-N 3.26Å; A386-K388 VanDerWaalsContact C-N 3.35Å
387	N	90.2	Very high	91.1	Very high	54 Å²	54	32.8 Å²	32.8	29%	0.289	16%	0.162	S	C	.	.	H	α-helix	trans	-82	-10.9	176.4	-70.9	-16.4	0	0	0	113.7	F383 I384 Y385 A389	F383-N387 WeakPolarHBondContact CE1-ND2 3.18Å; F383-N387 WeakPolarHBondContact CZ-ND2 3.4Å; F383-N387 PolarHBondContact O-N 3.01Å; I384-N387 PolarHBondContact O-N 2.9Å; Y385-N387 VanDerWaalsContact C-N 3.3Å; Y385-N387 PolarHBondContact O-N 3.41Å; N387-A389 PolarHBondContact O-N 3.14Å
388	K	90.8	Very high	91.1	Very high	16 Å²	16	32.8 Å²	32.8	7%	0.07	16%	0.162	C	C	.	.			trans	-80.8	111.6	-179.7	-171	-174.1	-51.7	-174.3	0	110.3	R52 L294 E296 L351 I384 Y385 A386	R52-K388 WeakPolarHBondContact CG-O 3.35Å; R52-K388 PolarHBondContact NE-O 2.74Å; L294-K388 HydrophobicContact CD2-CB 4.04Å; L294-K388 HydrophobicContact CD2-CG 4.05Å; L294-K388 HydrophobicContact CG-CB 4.47Å; L294-K388 HydrophobicContact CG-CG 4.08Å; E296-K388 HydrophobicContact CB-CD 3.72Å; E296-K388 HydrophobicContact CB-CG 4.13Å; E296-K388 HydrophobicContact CG-CD 4.32Å; E296-K388 WeakPolarHBondContact OE2-CD 3.36Å; E296-K388 IonicContact OE2-NZ 2.89Å; L351-K388 HydrophobicContact CD1-CD 4.12Å; I384-K388 WeakPolarHBondContact O-CB 3.37Å; I384-K388 PolarHBondContact O-N 3.48Å; I384-K388 VanDerWaalsContact O-N 3.11Å; Y385-K388 WeakPolarHBondContact O-CB 3.49Å; Y385-K388 PolarHBondContact O-N 2.87Å; Y385-K388 VanDerWaalsContact O-N 3.12Å; A386-K388 VanDerWaalsContact C-N 3.35Å
389	A	93.3	Very high	91.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	148.6	173.7	0	0	0	0	0	111.2	P49 A50 F292 L294 I295 E296 N387	P49-A389 HydrophobicContact CB-CB 3.89Å; A50-A389 CarbonylContact O-C 3.52Å; A50-A389 WeakPolarHBondContact O-CA 3.28Å; F292-A389 HydrophobicContact CB-CB 4.23Å; F292-A389 HydrophobicContact CD1-CB 3.6Å; F292-A389 HydrophobicContact CE1-CB 4.13Å; F292-A389 HydrophobicContact CG-CB 3.97Å; L294-A389 PolarHBondContact O-N 3.39Å; I295-A389 CarbonylContact C-O 3.56Å; I295-A389 WeakPolarHBondContact CA-O 3.49Å; I295-A389 HydrophobicContact CG1-CB 4.26Å; I295-A389 HydrophobicContact CG2-CB 4.44Å; E296-A389 PolarHBondContact N-O 2.91Å; N387-A389 PolarHBondContact O-N 3.14Å
390	K	93.3	Very high	91.1	Very high	76 Å²	76	27.5 Å²	27.5	33%	0.33	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.5	177.7	-165.6	-176.9	-166.7	174.4	0	109.6	A50 E56	A50-K390 PolarHBondContact N-O 3.09Å; A50-K390 PolarHBondContact O-N 3.09Å; E56-K390 IonicContact OE1-NZ 2.89Å; E56-K390 PolarHBondContact OE1-NZ 3.29Å
391	L	94.1	Very high	90.9	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.016	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	121.2	172.1	-176.6	62.3	0	0	0	108.7	L47 P49 I286 L289 I295 E296 L297 N298	L47-L391 HydrophobicContact CB-CD1 4.27Å; L47-L391 HydrophobicContact CD2-CD1 3.43Å; L47-L391 VanDerWaalsContact CD2-CD1 3.43Å; L47-L391 HydrophobicContact CD2-CG 4.39Å; L47-L391 HydrophobicContact CG-CD1 3.54Å; P49-L391 HydrophobicContact CG-CD1 4.5Å; P49-L391 HydrophobicContact CG-CD2 4.31Å; I286-L391 HydrophobicContact CG2-CD1 4.49Å; I286-L391 HydrophobicContact CG2-CD2 3.98Å; L289-L391 HydrophobicContact CD2-CD2 3.56Å; I295-L391 HydrophobicContact CG2-CB 3.75Å; I295-L391 HydrophobicContact CG2-CD2 4.45Å; E296-L391 PolarHBondContact O-N 3.47Å; E296-L391 VanDerWaalsContact O-O 3.06Å; L297-L391 CarbonylContact C-O 3.56Å; L297-L391 WeakPolarHBondContact CA-O 3.26Å; L297-L391 HydrophobicContact CD1-CB 4.34Å; L297-L391 HydrophobicContact CD1-CD2 3.77Å; L297-L391 HydrophobicContact CD1-CG 3.89Å; N298-L391 PolarHBondContact N-O 3.3Å
392	H	92	Very high	90.6	Very high	58 Å²	58	34.3 Å²	34.3	27%	0.269	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	96.7	177.1	-179.6	-76.1	0	0	0	109.1	L47 N298 S300 Y466	L47-H392 WeakPolarHBondContact CD2-O 3.45Å; N298-H392 CarbonylContact O-C 3.55Å; N298-H392 WeakPolarHBondContact O-CA 3.49Å; S300-H392 PolarHBondContact OG-CE1 3.25Å; H392-Y466 PolarHBondContact NE2-OH 3.32Å
393	C	91	Very high	90	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	130.5	-178.7	177.7	0	0	0	0	110.1	I286 L297 N298 L299 S300	I286-C393 HydrophobicContact CG2-CB 4.43Å; L297-C393 HydrophobicContact CD1-CB 3.9Å; N298-C393 PolarHBondContact O-N 3.44Å; L299-C393 HydrophobicContact CD2-CB 3.81Å; S300-C393 PolarHBondContact N-O 3.02Å; S300-C393 PolarHBondContact OG-O 2.92Å
394	K	89.9	Confident	89.3	Confident	87 Å²	87	38.2 Å²	38.2	38%	0.378	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	119.2	173.7	-54.4	-176.5	179.3	177.7	0	109.4	S283 D284 S300 H396	S283-K394 WeakPolarHBondContact CA-O 3.49Å; D284-K394 PolarHBondContact N-O 3.18Å; D284-K394 VanDerWaalsContact OD2-CB 3.3Å; D284-K394 WeakPolarHBondContact OD2-CB 3.42Å; D284-K394 WeakPolarHBondContact OD2-CG 3.37Å; D284-K394 PolarHBondContact OD2-N 2.92Å; S300-K394 WeakPolarHBondContact O-CA 3.41Å; S300-K394 WeakPolarHBondContact OG-CA 3.43Å; S300-K394 WeakPolarHBondContact OG-CG 3.48Å; K394-H396 PolarHBondContact O-N 3.49Å
395	I	89.6	Confident	88.5	Confident	4 Å²	4	42 Å²	42	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	102	168.9	-54.9	166.6	0	0	0	106.3	T165 S283 L299 S300 L302 F340	T165-I395 HydrophobicContact CG2-CD1 4.08Å; S283-I395 VanDerWaalsContact OG-CA 3.31Å; S283-I395 WeakPolarHBondContact OG-CA 3.24Å; S283-I395 WeakPolarHBondContact OG-CG2 3.33Å; L299-I395 HydrophobicContact CD1-CD1 4.28Å; S300-I395 PolarHBondContact O-N 3.23Å; L302-I395 PolarHBondContact N-O 3.31Å; L302-I395 VanDerWaalsContact O-O 3.11Å; F340-I395 HydrophobicContact CD2-CD1 4.29Å; F340-I395 HydrophobicContact CD2-CG2 4.13Å; F340-I395 HydrophobicContact CE1-CG2 3.93Å; F340-I395 HydrophobicContact CE2-CB 3.66Å; F340-I395 HydrophobicContact CE2-CD1 4.16Å; F340-I395 HydrophobicContact CE2-CG2 3.4Å; F340-I395 HydrophobicContact CZ-CB 3.93Å; F340-I395 HydrophobicContact CZ-CG2 3.31Å
396	H	89.9	Confident	87.2	Confident	17 Å²	17	48.4 Å²	48.4	8%	0.079	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	113.4	-173.2	-170.8	-179.7	0	0	0	110.8	M282 S283 L302 S304 K394	M282-H396 CarbonylContact C-O 3.59Å; M282-H396 WeakPolarHBondContact CE-CE1 3.16Å; M282-H396 WeakPolarHBondContact CE-ND1 3.45Å; M282-H396 PolarHBondContact N-O 2.86Å; S283-H396 PolarHBondContact N-O 2.96Å; S283-H396 PolarHBondContact OG-N 2.95Å; L302-H396 HydrophobicContact CB-CB 4.29Å; L302-H396 HydrophobicContact CD2-CB 4.12Å; L302-H396 VanDerWaalsContact O-CA 3.29Å; L302-H396 WeakPolarHBondContact O-CA 3.38Å; S304-H396 WeakPolarHBondContact CB-NE2 3.38Å; S304-H396 PolarHBondContact OG-CE1 3.02Å; S304-H396 PolarHBondContact OG-NE2 2.77Å; K394-H396 PolarHBondContact O-N 3.49Å
397	K	90.9	Very high	85.7	Confident	5 Å²	5	52.1 Å²	52.1	2%	0.022	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	141.9	172.6	-56.9	-57.9	-176.2	-169.6	0	112.1	T165 H166 L168 P170 I279 D281 L302 F303 S304 F340	T165-K397 PolarHBondContact O-NZ 3.46Å; H166-K397 VanDerWaalsContact C-NZ 3.35Å; H166-K397 PolarHBondContact O-NZ 2.86Å; L168-K397 WeakPolarHBondContact O-CE 3.13Å; P170-K397 HydrophobicContact CB-CB 4.48Å; P170-K397 HydrophobicContact CB-CG 4.19Å; P170-K397 HydrophobicContact CG-CB 3.88Å; P170-K397 HydrophobicContact CG-CG 3.8Å; I279-K397 HydrophobicContact CG2-CB 4.44Å; D281-K397 HydrophobicContact CB-CD 4.32Å; D281-K397 VanDerWaalsContact OD1-CD 3.3Å; D281-K397 WeakPolarHBondContact OD1-CD 3.5Å; D281-K397 WeakPolarHBondContact OD1-CE 3.49Å; D281-K397 IonicContact OD1-NZ 3.75Å; D281-K397 PolarHBondContact OD1-NZ 3.32Å; D281-K397 IonicContact OD2-NZ 3.75Å; L302-K397 PolarHBondContact O-N 3.38Å; F303-K397 CarbonylContact C-O 3.55Å; F303-K397 WeakPolarHBondContact CA-O 3.41Å; S304-K397 PolarHBondContact N-O 3.23Å; F340-K397 HydrophobicContact CE1-CD 4.32Å; F340-K397 HydrophobicContact CE1-CG 3.51Å; F340-K397 HydrophobicContact CZ-CG 4.06Å
398	I	90.6	Very high	84.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127	177.5	-58.7	165	0	0	0	108.8	I279 W280 M282 S304 L414	I279-I398 WeakPolarHBondContact CA-O 3.25Å; W280-I398 HydrophobicContact CD2-CB 3.93Å; W280-I398 HydrophobicContact CD2-CD1 4.2Å; W280-I398 HydrophobicContact CD2-CG2 4.26Å; W280-I398 VanDerWaalsContact CE2-CG2 3.48Å; W280-I398 HydrophobicContact CE3-CB 4.41Å; W280-I398 HydrophobicContact CE3-CD1 3.84Å; W280-I398 HydrophobicContact CG-CB 4.33Å; W280-I398 HydrophobicContact CH2-CB 4.46Å; W280-I398 HydrophobicContact CH2-CD1 3.43Å; W280-I398 VanDerWaalsContact CH2-CD1 3.43Å; W280-I398 HydrophobicContact CH2-CG2 4.26Å; W280-I398 HydrophobicContact CZ2-CB 4.01Å; W280-I398 HydrophobicContact CZ2-CD1 3.84Å; W280-I398 HydrophobicContact CZ2-CG2 3.51Å; W280-I398 HydrophobicContact CZ3-CD1 3.41Å; W280-I398 VanDerWaalsContact CZ3-CD1 3.41Å; W280-I398 PolarHBondContact N-O 2.89Å; W280-I398 PolarHBondContact O-N 2.54Å; M282-I398 HydrophobicContact CB-CD1 3.74Å; M282-I398 HydrophobicContact CB-CG1 4.42Å; M282-I398 HydrophobicContact CE-CD1 3.97Å; M282-I398 HydrophobicContact CG-CD1 4.34Å; M282-I398 HydrophobicContact SD-CD1 3.79Å; S304-I398 VanDerWaalsContact O-CA 3.31Å; S304-I398 WeakPolarHBondContact O-CA 3.46Å; I398-L414 HydrophobicContact CD1-CD1 4.11Å; I398-L414 HydrophobicContact CD1-CD2 3.8Å; I398-L414 HydrophobicContact CG1-CD2 4.04Å; I398-L414 HydrophobicContact CG2-CD2 3.74Å
399	F	91.2	Very high	82.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	133.2	176.4	-64.9	-88.4	0	0	0	110.1	P170 I172 L273 I276 I279 F303 S304 F305 S306 T310	P170-F399 HydrophobicContact CB-CZ 3.96Å; P170-F399 HydrophobicContact CG-CE1 3.91Å; P170-F399 HydrophobicContact CG-CE2 4.22Å; P170-F399 HydrophobicContact CG-CZ 3.42Å; P170-F399 VanDerWaalsContact CG-CZ 3.42Å; I172-F399 HydrophobicContact CD1-CD2 4.41Å; I172-F399 HydrophobicContact CD1-CE2 3.57Å; I172-F399 HydrophobicContact CD1-CZ 3.67Å; I172-F399 HydrophobicContact CG1-CE2 4.39Å; I172-F399 HydrophobicContact CG1-CZ 4.19Å; L273-F399 HydrophobicContact CD2-CE1 4.47Å; L273-F399 HydrophobicContact CG-CE1 4.36Å; I276-F399 HydrophobicContact CD1-CB 4.48Å; I276-F399 HydrophobicContact CD1-CD1 3.72Å; I276-F399 HydrophobicContact CD1-CE1 4.4Å; I276-F399 HydrophobicContact CD1-CG 4.46Å; I276-F399 HydrophobicContact CG2-CB 4.48Å; I279-F399 HydrophobicContact CD1-CD1 3.86Å; I279-F399 HydrophobicContact CD1-CE1 3.68Å; I279-F399 HydrophobicContact CG1-CD1 3.76Å; I279-F399 HydrophobicContact CG1-CE1 4.08Å; F303-F399 HydrophobicContact CB-CD2 4.06Å; F303-F399 HydrophobicContact CB-CE2 3.58Å; F303-F399 HydrophobicContact CD2-CD2 4.35Å; F303-F399 HydrophobicContact CD2-CE2 4.18Å; F303-F399 AromaticContact CG-CE2 3.99Å; F303-F399 HydrophobicContact CG-CE2 3.99Å; S304-F399 PolarHBondContact O-N 2.78Å; F305-F399 CarbonylContact C-O 3.59Å; F305-F399 WeakPolarHBondContact CA-O 3.48Å; F305-F399 HydrophobicContact CD1-CB 3.77Å; F305-F399 HydrophobicContact CE1-CB 4.03Å; F305-F399 HydrophobicContact CE1-CD2 4.24Å; F305-F399 HydrophobicContact CE1-CG 4.34Å; S306-F399 PolarHBondContact N-O 3.32Å; S306-F399 PolarHBondContact OG-O 2.69Å; T310-F399 HydrophobicContact CG2-CB 3.94Å
400	G	90.1	Very high	80.7	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	31%	0.311	C	S	.	.	S	Bend	trans	113.7	174.9	179.7	0	0	0	0	0	112.6	E278 W280 S306	E278-G400 CarbonylContact O-C 3.55Å; E278-G400 PolarHBondContact O-N 3.23Å; W280-G400 PolarHBondContact NE1-O 3.49Å; S306-G400 VanDerWaalsContact OG-CA 3.26Å; S306-G400 WeakPolarHBondContact OG-CA 3.49Å
401	P	86.9	Confident	78.7	Confident	57 Å²	57	67.4 Å²	67.4	37%	0.37	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-62	141.6	-170.4	25.7	-34.9	0	0	0	112.1	S306	S306-P401 WeakPolarHBondContact OG-CD 3.45Å; S306-P401 PolarHBondContact OG-O 3.32Å; S306-P401 VanDerWaalsContact OG-O 3.1Å
402	K	83	Confident	76.9	Confident	118 Å²	118	69.5 Å²	69.5	51%	0.513	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-72.4	134.3	172.8	-167.5	174.9	180	179.7	0	109.9	E278 W280 K404 Y409	E278-K402 WeakPolarHBondContact OE2-CB 3.46Å; E278-K402 PolarHBondContact OE2-N 2.9Å; W280-K402 HydrophobicContact CD2-CG 4.5Å; K402-K404 PolarHBondContact O-N 3.48Å; K402-Y409 WeakPolarHBondContact CD-OH 3.28Å; K402-Y409 WeakPolarHBondContact CE-OH 3.1Å; K402-Y409 WeakPolarHBondContact CG-OH 3.3Å
403	P	79.7	Confident	75.7	Confident	21 Å²	21	75.9 Å²	75.9	14%	0.136	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-64.5	133.5	175.9	26.7	-34.2	0	0	0	110.5	N405 L408 Y409 L412	P403-N405 VanDerWaalsContact C-N 3.3Å; P403-N405 PolarHBondContact O-N 3.27Å; P403-L408 HydrophobicContact CB-CB 4Å; P403-Y409 HydrophobicContact CG-CD1 3.69Å; P403-Y409 HydrophobicContact CG-CD2 4.46Å; P403-Y409 HydrophobicContact CG-CE1 3.33Å; P403-Y409 HydrophobicContact CG-CE2 4.16Å; P403-Y409 HydrophobicContact CG-CG 4.21Å; P403-L412 HydrophobicContact CB-CD1 3.8Å; P403-L412 HydrophobicContact CG-CD1 3.8Å; P403-L412 HydrophobicContact CG-CD2 4.29Å
404	K	76.6	Confident	74.7	Confident	208 Å²	208	77.4 Å²	77.4	90%	0.904	37%	0.372	S	S	*	.	S	Bend	trans	-68.2	-27.3	-179.3	-64.7	-177	179.2	-178.5	0	113.7	K402	K402-K404 PolarHBondContact O-N 3.48Å
405	N	73.3	Confident	73.5	Confident	97 Å²	97	75.6 Å²	75.6	52%	0.519	37%	0.366	S	S	.	.	S	Bend	trans	-110.2	128.9	-178.5	-69	-6.1	0	0	0	110.5	P403 T407 L408	P403-N405 VanDerWaalsContact C-N 3.3Å; P403-N405 PolarHBondContact O-N 3.27Å; N405-T407 PolarHBondContact O-N 2.85Å; N405-L408 HydrophobicContact CB-CD1 4.13Å; N405-L408 HydrophobicContact CB-CG 4.22Å; N405-L408 WeakPolarHBondContact O-CB 3.49Å; N405-L408 PolarHBondContact O-N 3.38Å
406	E	63.1	Low	71.8	Confident	166 Å²	166	77.5 Å²	77.5	78%	0.776	38%	0.379	S	S	*	.	H	α-helix	trans	-60.6	-30.7	179.2	-68.2	-177.3	161.9	0	0	113.2	L408 Y409	E406-L408 PolarHBondContact O-N 3.21Å; E406-Y409 HydrophobicContact CB-CD2 4.24Å; E406-Y409 HydrophobicContact CG-CD2 4.46Å; E406-Y409 HydrophobicContact CG-CE2 4.33Å; E406-Y409 WeakPolarHBondContact O-CB 3.48Å; E406-Y409 WeakPolarHBondContact O-CD2 3.2Å; E406-Y409 PolarHBondContact O-N 2.83Å
407	T	60.1	Low	69.9	Low	108 Å²	108	77.9 Å²	77.9	66%	0.663	38%	0.38	S	S	*	.	H	α-helix	trans	-61.6	-25.5	175.6	54	0	0	0	0	112.9	N405	N405-T407 PolarHBondContact O-N 2.85Å
408	L	59.1	Low	67.5	Low	82 Å²	82	81.6 Å²	81.6	43%	0.429	40%	0.4	S	S	.	.	H	α-helix	trans	-75.4	-23.9	175.8	-69	171.8	0	0	0	112.3	P403 N405 E406 R410 S411 L412	P403-L408 HydrophobicContact CB-CB 4Å; N405-L408 HydrophobicContact CB-CD1 4.13Å; N405-L408 HydrophobicContact CB-CG 4.22Å; N405-L408 WeakPolarHBondContact O-CB 3.49Å; N405-L408 PolarHBondContact O-N 3.38Å; E406-L408 PolarHBondContact O-N 3.21Å; L408-R410 PolarHBondContact O-N 3.4Å; L408-S411 CarbonylContact O-C 3.6Å; L408-S411 PolarHBondContact O-N 3.21Å; L408-L412 HydrophobicContact CB-CD1 4.04Å; L408-L412 WeakPolarHBondContact O-CD1 3.39Å; L408-L412 PolarHBondContact O-N 3.27Å
409	Y	58	Low	65	Low	56 Å²	56	85.2 Å²	85.2	22%	0.22	42%	0.42	C	S	.	.	H	α-helix	trans	-55.8	-42.2	176	-77.4	-64.8	0	0	0	112.3	W280 K402 P403 E406 S411 L412	W280-Y409 HydrophobicContact CE3-CE1 4.09Å; W280-Y409 AromaticContact CH2-CD1 3.96Å; W280-Y409 HydrophobicContact CH2-CD1 3.96Å; W280-Y409 AromaticContact CH2-CE1 3.63Å; W280-Y409 HydrophobicContact CH2-CE1 3.63Å; W280-Y409 AromaticContact CZ3-CD1 3.88Å; W280-Y409 HydrophobicContact CZ3-CD1 3.88Å; W280-Y409 AromaticContact CZ3-CE1 3.36Å; W280-Y409 HydrophobicContact CZ3-CE1 3.36Å; K402-Y409 WeakPolarHBondContact CD-OH 3.28Å; K402-Y409 WeakPolarHBondContact CE-OH 3.1Å; K402-Y409 WeakPolarHBondContact CG-OH 3.3Å; P403-Y409 HydrophobicContact CG-CD1 3.69Å; P403-Y409 HydrophobicContact CG-CD2 4.46Å; P403-Y409 HydrophobicContact CG-CE1 3.33Å; P403-Y409 HydrophobicContact CG-CE2 4.16Å; P403-Y409 HydrophobicContact CG-CG 4.21Å; E406-Y409 HydrophobicContact CB-CD2 4.24Å; E406-Y409 HydrophobicContact CG-CD2 4.46Å; E406-Y409 HydrophobicContact CG-CE2 4.33Å; E406-Y409 WeakPolarHBondContact O-CB 3.48Å; E406-Y409 WeakPolarHBondContact O-CD2 3.2Å; E406-Y409 PolarHBondContact O-N 2.83Å; Y409-S411 PolarHBondContact O-N 3.31Å; Y409-L412 PolarHBondContact O-N 3.18Å
410	R	53.5	Low	62.1	Low	236 Å²	236	93.9 Å²	93.9	89%	0.891	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-25	-179.8	-157.2	178.2	-166.4	-143.7	2.1	112.7	L408	L408-R410 PolarHBondContact O-N 3.4Å
411	S	50.1	Low	59.3	Low	93 Å²	93	96.4 Å²	96.4	65%	0.65	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-3.4	-179.7	-51.9	0	0	0	0	112.8	L408 Y409 K413	L408-S411 CarbonylContact O-C 3.6Å; L408-S411 PolarHBondContact O-N 3.21Å; Y409-S411 PolarHBondContact O-N 3.31Å; S411-K413 PolarHBondContact O-N 2.94Å
412	L	57	Low	56.6	Low	46 Å²	46	98.7 Å²	98.7	24%	0.241	50%	0.499	C	S	.	.			trans	-67.4	100.3	-179.4	-117.9	83.3	0	0	0	107.8	W280 P403 L408 Y409 L414	W280-L412 HydrophobicContact CH2-CD2 3.78Å; W280-L412 HydrophobicContact CZ2-CD2 3.8Å; P403-L412 HydrophobicContact CB-CD1 3.8Å; P403-L412 HydrophobicContact CG-CD1 3.8Å; P403-L412 HydrophobicContact CG-CD2 4.29Å; L408-L412 HydrophobicContact CB-CD1 4.04Å; L408-L412 WeakPolarHBondContact O-CD1 3.39Å; L408-L412 PolarHBondContact O-N 3.27Å; Y409-L412 PolarHBondContact O-N 3.18Å; L412-L414 HydrophobicContact CD2-CD2 4.45Å; L412-L414 PolarHBondContact O-N 3.39Å
413	K	65.9	Low	53.9	Low	192 Å²	192	100.3 Å²	100.3	84%	0.835	51%	0.514	S	S	*	.			trans	-71.8	82.9	161.9	-166.9	174.7	-174	178.3	0	106.5	S411 I415	S411-K413 PolarHBondContact O-N 2.94Å; K413-I415 PolarHBondContact O-N 3.49Å
414	L	70.9	Confident	51.4	Low	33 Å²	33	102.5 Å²	102.5	17%	0.173	53%	0.529	C	S	.	.			trans	-49.1	140.8	162.1	-69.7	163.7	0	0	0	106.5	M282 I398 L412 P416	M282-L414 HydrophobicContact CE-CD1 3.7Å; M282-L414 HydrophobicContact SD-CD1 4.4Å; I398-L414 HydrophobicContact CD1-CD1 4.11Å; I398-L414 HydrophobicContact CD1-CD2 3.8Å; I398-L414 HydrophobicContact CG1-CD2 4.04Å; I398-L414 HydrophobicContact CG2-CD2 3.74Å; L412-L414 HydrophobicContact CD2-CD2 4.45Å; L412-L414 PolarHBondContact O-N 3.39Å; L414-P416 WeakPolarHBondContact O-CD 3.16Å; L414-P416 VanDerWaalsContact O-N 3.12Å
415	I	63.1	Low	49	Very low	49 Å²	49	99.3 Å²	99.3	25%	0.251	52%	0.522	S	S	.	.	B	Isolated β-bridge	trans	-75.1	99.6	168.6	-60.9	169.8	0	0	0	104.4	F305 K308 Y311 K413 F417	F305-I415 PolarHBondContact O-N 3.1Å; K308-I415 HydrophobicContact CB-CD1 4.43Å; Y311-I415 HydrophobicContact CD1-CD1 4.3Å; Y311-I415 HydrophobicContact CD2-CG2 4.14Å; Y311-I415 HydrophobicContact CE2-CG2 4.16Å; Y311-I415 HydrophobicContact CG-CD1 3.99Å; Y311-I415 HydrophobicContact CG-CG2 4.44Å; K413-I415 PolarHBondContact O-N 3.49Å; I415-F417 PolarHBondContact O-N 3.48Å
416	P	55.7	Low	46.8	Very low	44 Å²	44	99.5 Å²	99.5	29%	0.286	53%	0.53	S	S	.	.			trans	-60.5	144	166	30.8	-35.9	0	0	0	106.2	L414 N418 L464	L414-P416 WeakPolarHBondContact O-CD 3.16Å; L414-P416 VanDerWaalsContact O-N 3.12Å; P416-N418 PolarHBondContact O-N 2.97Å; P416-L464 HydrophobicContact CB-CD1 3.65Å
417	F	49.4	Very low	45	Very low	25 Å²	25	99 Å²	99	11%	0.11	53%	0.532	C	S	.	.			trans	-69.5	87.3	166.1	-164.1	-92.2	0	0	0	107.6	I415 N419 P465	I415-F417 PolarHBondContact O-N 3.48Å; F417-N419 WeakPolarHBondContact CE1-OD1 3.35Å; F417-P465 VanDerWaalsContact O-CG 3.32Å; F417-P465 WeakPolarHBondContact O-CG 3.05Å
418	N	40.3	Very low	43.4	Very low	83 Å²	83	99.6 Å²	99.6	44%	0.444	53%	0.53	S	S	.	.			trans	-88	130.3	163.7	-78.4	0.7	0	0	0	106.7	P416 E420	P416-N418 PolarHBondContact O-N 2.97Å; N418-E420 PolarHBondContact O-N 2.96Å
419	N	37.6	Very low	41.8	Very low	75 Å²	75	102.7 Å²	102.7	40%	0.401	55%	0.547	S	S	.	.			trans	-62.1	91	158.3	-81.9	-12.8	0	0	0	108.1	F417 G421 T422	F417-N419 WeakPolarHBondContact CE1-OD1 3.35Å; N419-G421 PolarHBondContact O-N 3.22Å; N419-G421 VanDerWaalsContact O-N 3.08Å; N419-T422 HydrophobicContact CB-CG2 4.39Å
420	E	30.6	Very low	40.3	Very low	183 Å²	183	104.1 Å²	104.1	86%	0.855	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	4.5	155.6	-78.2	-164.9	159.7	0	0	111.6	N418 S424	N418-E420 PolarHBondContact O-N 2.96Å; E420-S424 PolarHBondContact O-OG 2.88Å
421	G	32.4	Very low	39	Very low	53 Å²	53	102 Å²	102	55%	0.546	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.4	-11.8	177.4	0	0	0	0	0	117.7	N419	N419-G421 PolarHBondContact O-N 3.22Å; N419-G421 VanDerWaalsContact O-N 3.08Å
422	T	30.3	Very low	37.7	Very low	105 Å²	105	102 Å²	102	64%	0.644	56%	0.559	S	S	*	*	S	Bend	trans	-101.4	-5.6	-177.1	48.8	0	0	0	0	115.6	N419	N419-T422 HydrophobicContact CB-CG2 4.39Å
423	N	25.1	Very low	36.2	Very low	152 Å²	152	106.1 Å²	106.1	81%	0.813	59%	0.587	S	S	*	*	S	Bend	trans	-121.1	9.6	167	-89.9	-4.9	0	0	0	114	N425	N423-N425 PolarHBondContact O-N 3.47Å
424	S	28.4	Very low	34.1	Very low	66 Å²	66	107.6 Å²	107.6	46%	0.462	59%	0.588	S	S	.	*			trans	-76.9	78.4	152.5	45.2	0	0	0	0	107.5	E420 C426	E420-S424 PolarHBondContact O-OG 2.88Å; S424-C426 VanDerWaalsContact C-N 3.26Å; S424-C426 PolarHBondContact O-N 3.47Å
425	N	26.1	Very low	32	Very low	141 Å²	141	111.4 Å²	111.4	75%	0.754	61%	0.614	S	S	*	*			trans	-40.7	104.8	147.7	-79.1	-34.9	0	0	0	106.9	N423 L427	N423-N425 PolarHBondContact O-N 3.47Å; N425-L427 VanDerWaalsContact C-N 3.34Å; N425-L427 PolarHBondContact O-N 3.32Å
426	C	26.3	Very low	30.2	Very low	102 Å²	102	116.1 Å²	116.1	69%	0.689	64%	0.637	S	S	*	*			trans	23.7	70.3	152.9	-160.9	0	0	0	0	113	S424 L428	S424-C426 VanDerWaalsContact C-N 3.26Å; S424-C426 PolarHBondContact O-N 3.47Å; C426-L428 PolarHBondContact O-N 2.88Å
427	L	24.6	Very low	28.5	Very low	156 Å²	156	120.3 Å²	120.3	82%	0.817	67%	0.665	S	S	*	*			trans	-77.3	45.7	161.4	-81.6	176.2	0	0	0	109.7	N425	N425-L427 VanDerWaalsContact C-N 3.34Å; N425-L427 PolarHBondContact O-N 3.32Å
428	L	28	Very low	27.4	Very low	119 Å²	119	124.3 Å²	124.3	62%	0.623	70%	0.696	S	S	*	*			trans	-109.1	42.7	153.6	-103.9	149	0	0	0	108.3	C426 T430	C426-L428 PolarHBondContact O-N 2.88Å; L428-T430 PolarHBondContact O-N 2.85Å
429	N	25.8	Very low	26.6	Very low	147 Å²	147	128.1 Å²	128.1	79%	0.786	72%	0.716	S	S	*	*			trans	-76	72.6	142	-95.1	-0.1	0	0	0	108.3
430	T	24.8	Very low	25.9	Very low	87 Å²	87	129.8 Å²	129.8	53%	0.534	73%	0.729	S	S	.	*	S	Bend	trans	-165.7	98	150.9	21.5	0	0	0	0	109	L428	L428-T430 PolarHBondContact O-N 2.85Å
431	F	26.2	Very low	25.6	Very low	192 Å²	192	126.3 Å²	126.3	84%	0.842	72%	0.719	S	S	*	*			trans	56	113	145.1	-52.5	-78.8	0	0	0	116.6
432	S	23.5	Very low	25.2	Very low	92 Å²	92	131.5 Å²	131.5	64%	0.643	73%	0.73	S	S	*	*				-174.1	89.8	60.8	40.4	0	0	0	0	109.6	Y434	S432-Y434 PolarHBondContact O-N 3.33Å
433	T	24.6	Very low	24.8	Very low	132 Å²	132	135.8 Å²	135.8	81%	0.81	74%	0.739	S	S	*	*			trans	-72	104.5	155	28.5	0	0	0	0	107.3	T435	T433-T435 VanDerWaalsContact C-N 3.26Å; T433-T435 PolarHBondContact O-N 3.31Å; T433-T435 PolarHBondContact O-OG1 3.32Å; T433-T435 VanDerWaalsContact O-OG1 3.09Å
434	Y	23.2	Very low	24.7	Very low	223 Å²	223	138 Å²	138	88%	0.875	75%	0.747	S	S	*	*			trans	-52	93.9	163.4	-75.7	-89.9	0	0	0	109	S432	S432-Y434 PolarHBondContact O-N 3.33Å
435	T	25.3	Very low	24.4	Very low	114 Å²	114	139.9 Å²	139.9	70%	0.699	76%	0.76	S	S	*	*			trans	-113.6	100.1	170.2	-26.8	0	0	0	0	105.9	T433	T433-T435 VanDerWaalsContact C-N 3.26Å; T433-T435 PolarHBondContact O-N 3.31Å; T433-T435 PolarHBondContact O-OG1 3.32Å; T433-T435 VanDerWaalsContact O-OG1 3.09Å
436	I	25.3	Very low	24.2	Very low	147 Å²	147	137.2 Å²	137.2	75%	0.754	75%	0.753	S	S	*	*			trans	10.8	121.4	153.9	-56.2	173.3	0	0	0	115.1	S438	I436-S438 PolarHBondContact O-N 3.25Å
437	P	22	Very low	24.1	Very low	132 Å²	132	140.4 Å²	140.4	86%	0.857	76%	0.763	S	S	*	*			trans	-72.2	119.8	-176.4	29.7	-31.5	0	0	0	110.5
438	S	24.7	Very low	24.1	Very low	110 Å²	110	144.3 Å²	144.3	77%	0.769	77%	0.768	S	S	*	*			trans	-136.5	109.2	158.2	51.6	0	0	0	0	109.3	I436	I436-S438 PolarHBondContact O-N 3.25Å
439	L	23.8	Very low	23.8	Very low	163 Å²	163	142 Å²	142	85%	0.853	77%	0.774	S	S	*	*			trans	45.5	118.1	143.1	-117	73.9	0	0	0	120.1
440	T	23.4	Very low	23.7	Very low	110 Å²	110	145.2 Å²	145.2	68%	0.675	78%	0.781	S	S	*	*			trans	88.7	97.7	134.7	-3.9	0	0	0	0	119.3
441	V	24.3	Very low	23.7	Very low	109 Å²	109	146.1 Å²	146.1	66%	0.661	79%	0.79	S	S	*	*				81.5	116.4	117.8	172.5	0	0	0	0	120.2
442	Q	23	Very low	23.7	Very low	163 Å²	163	144.4 Å²	144.4	76%	0.762	79%	0.79	S	S	*	*			trans	81.6	109.1	141.3	-77.4	164.5	18.5	0	0	121.6
443	K	21.7	Very low	23.6	Very low	194 Å²	194	147.4 Å²	147.4	84%	0.843	79%	0.793	S	S	*	*				48.8	109.1	123.5	-68.8	-179.3	177.4	179	0	117.1
444	M	23.7	Very low	23.7	Very low	198 Å²	198	147.1 Å²	147.1	98%	0.975	79%	0.786	S	S	*	*				-137.7	128.1	129	-103	-176.8	174.4	0	0	110.5
445	S	23.1	Very low	23.9	Very low	106 Å²	106	143.8 Å²	143.8	74%	0.741	78%	0.782	S	S	*	*			trans	-80.3	150.4	-175.1	-161.1	0	0	0	0	111.3
446	S	21.9	Very low	23.8	Very low	85 Å²	85	145.1 Å²	145.1	59%	0.594	79%	0.785	S	S	*	*			trans	10.1	122.5	147.1	62.5	0	0	0	0	118.6
447	N	23.6	Very low	23.9	Very low	169 Å²	169	143.5 Å²	143.5	90%	0.904	78%	0.778	S	S	*	*			trans	-139.6	104.4	139.9	-98	-18.6	0	0	0	109.8	G449	N447-G449 PolarHBondContact O-N 3.23Å
448	Y	23.2	Very low	24	Very low	239 Å²	239	143.8 Å²	143.8	94%	0.937	78%	0.777	S	S	*	*			trans	-65.6	120.2	159.4	-86.4	-94	0	0	0	108.3
449	G	23.5	Very low	24.2	Very low	71 Å²	71	144 Å²	144	73%	0.732	77%	0.77	S	S	*	*			trans	-137.2	93.2	173.2	0	0	0	0	0	109.9	N447 S451	N447-G449 PolarHBondContact O-N 3.23Å; G449-S451 PolarHBondContact O-N 3.25Å
450	K	22.8	Very low	24.4	Very low	214 Å²	214	145.3 Å²	145.3	93%	0.93	77%	0.772	S	S	*	*			trans	-52.9	124	162.4	-77.7	168.7	173	172.5	0	109.1
451	S	25.7	Very low	24.5	Very low	105 Å²	105	146.9 Å²	146.9	73%	0.734	78%	0.776	S	S	*	*			trans	-143.7	92.9	153.2	-171.6	0	0	0	0	108.6	G449 H453	G449-S451 PolarHBondContact O-N 3.25Å; S451-H453 PolarHBondContact O-N 3.3Å
452	N	24.3	Very low	24.8	Very low	156 Å²	156	148.5 Å²	148.5	83%	0.834	78%	0.781	S	S	*	*			trans	-76.7	98.6	159.7	-72.9	-22.2	0	0	0	106.5
453	H	23.3	Very low	25.1	Very low	155 Å²	155	149.7 Å²	149.7	72%	0.718	78%	0.783	S	S	*	*			trans	-152.4	113.8	162.4	-110.1	-82.8	0	0	0	111.1	S451	S451-H453 PolarHBondContact O-N 3.3Å
454	I	25.2	Very low	25.6	Very low	127 Å²	127	143.4 Å²	143.4	65%	0.651	76%	0.759	S	S	*	*			trans	63.6	97.1	145.4	-51.8	166.4	0	0	0	116.4	N456	I454-N456 HydrophobicContact CG2-CB 4.17Å
455	L	28.7	Very low	26.3	Very low	152 Å²	152	136.8 Å²	136.8	80%	0.796	73%	0.731	S	S	*	*			trans	-117.4	77.9	142	-102.8	137.7	0	0	0	107.2	D457	L455-D457 HydrophobicContact CD2-CB 4.28Å; L455-D457 VanDerWaalsContact CD2-OD2 3.29Å; L455-D457 WeakPolarHBondContact CD2-OD2 3.33Å; L455-D457 PolarHBondContact O-N 3.38Å; L455-D457 VanDerWaalsContact O-N 3.16Å
456	N	22.1	Very low	27.6	Very low	142 Å²	142	139.1 Å²	139.1	76%	0.759	72%	0.724	S	S	*	*			trans	-75.2	75.5	154.5	-89.5	-6.4	0	0	0	107	I454	I454-N456 HydrophobicContact CG2-CB 4.17Å
457	D	28.6	Very low	29.1	Very low	113 Å²	113	135.4 Å²	135.4	60%	0.604	70%	0.698	S	S	*	*			trans	-100.4	91.8	160.5	-84.9	-13.6	0	0	0	107.5	L455 N459	L455-D457 HydrophobicContact CD2-CB 4.28Å; L455-D457 VanDerWaalsContact CD2-OD2 3.29Å; L455-D457 WeakPolarHBondContact CD2-OD2 3.33Å; L455-D457 PolarHBondContact O-N 3.38Å; L455-D457 VanDerWaalsContact O-N 3.16Å; D457-N459 PolarHBondContact O-N 3.05Å
458	T	24	Very low	30.8	Very low	138 Å²	138	130.3 Å²	130.3	85%	0.847	67%	0.671	S	S	*	*			trans	-57.8	77.9	152.5	28.7	0	0	0	0	108.8
459	N	27.5	Very low	32.7	Very low	114 Å²	114	121.2 Å²	121.2	61%	0.61	64%	0.636	S	S	*	*			trans	-94.2	102	164.8	-96.3	-28.7	0	0	0	108.1	D457 N461	D457-N459 PolarHBondContact O-N 3.05Å; N459-N461 PolarHBondContact O-N 2.91Å
460	E	29.5	Very low	34.8	Very low	192 Å²	192	120.4 Å²	120.4	90%	0.897	62%	0.623	S	S	*	*	S	Bend	trans	-63.6	24.8	173.3	-75.3	-153.2	140.4	0	0	114.6
461	N	25.8	Very low	37.4	Very low	143 Å²	143	112.9 Å²	112.9	77%	0.765	60%	0.595	S	S	*	*			trans	-118.1	33.5	179.9	-73.1	-33.8	0	0	0	113.3	N459 K463	N459-N461 PolarHBondContact O-N 2.91Å; N461-K463 PolarHBondContact O-N 3.27Å
462	N	30.3	Very low	39.8	Very low	143 Å²	143	109.8 Å²	109.8	77%	0.765	57%	0.572	S	S	*	*			trans	-71.9	64.5	161.1	-76.1	-14.9	0	0	0	109.8	L464	N462-L464 PolarHBondContact O-N 3.32Å
463	K	28.2	Very low	42.3	Very low	187 Å²	187	106 Å²	106	81%	0.813	55%	0.551	S	S	*	*			trans	-66.4	96	160.9	-156.9	177.7	-170.3	-179.6	0	105	N461 P465	N461-K463 PolarHBondContact O-N 3.27Å; K463-P465 WeakPolarHBondContact O-CD 3.3Å; K463-P465 VanDerWaalsContact O-N 3.07Å
464	L	33.5	Very low	44.8	Very low	63 Å²	63	102.4 Å²	102.4	33%	0.33	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-47.8	117.8	177.6	-166.4	74.1	0	0	0	108.2	L302 P416 N462	L302-L464 HydrophobicContact CD1-CD2 3.58Å; L302-L464 HydrophobicContact CD1-CG 4.22Å; L302-L464 HydrophobicContact CD2-CD2 3.28Å; L302-L464 HydrophobicContact CG-CD2 4.02Å; P416-L464 HydrophobicContact CB-CD1 3.65Å; N462-L464 PolarHBondContact O-N 3.32Å
465	P	37.9	Very low	46.9	Very low	59 Å²	59	96.5 Å²	96.5	38%	0.383	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-66.5	150.4	-174.1	24.7	-30.8	0	0	0	110.5	F417 K463	F417-P465 VanDerWaalsContact O-CG 3.32Å; F417-P465 WeakPolarHBondContact O-CG 3.05Å; K463-P465 WeakPolarHBondContact O-CD 3.3Å; K463-P465 VanDerWaalsContact O-N 3.07Å
466	Y	49.9	Very low	48.5	Very low	154 Å²	154	95 Å²	95	60%	0.604	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-65.9	138.1	172.7	-69.1	-80.3	0	0	0	109.6	H392 N468	H392-Y466 PolarHBondContact NE2-OH 3.32Å; Y466-N468 PolarHBondContact O-N 3.33Å; Y466-N468 VanDerWaalsContact O-N 3.16Å
467	N	54.3	Low	50	Low	7 Å²	7	94.1 Å²	94.1	4%	0.037	49%	0.49	C	S	.	.	S	Bend	trans	-74.4	-3.3	-172.9	-74.9	6.5	0	0	0	115.4	L302 F303 Q336	L302-N467 WeakPolarHBondContact CD1-OD1 3.29Å; F303-N467 HydrophobicContact CD1-CB 4.21Å; F303-N467 WeakPolarHBondContact CD1-ND2 3.28Å; F303-N467 HydrophobicContact CE1-CB 3.83Å; F303-N467 WeakPolarHBondContact CE1-ND2 3.38Å; F303-N467 VanDerWaalsContact CG-ND2 3.33Å; F303-N467 WeakPolarHBondContact CG-ND2 3.37Å; F303-N467 PolarHBondContact N-ND2 2.81Å; F303-N467 PolarHBondContact O-ND2 3.2Å; Q336-N467 PolarHBondContact NE2-O 3.23Å
468	N	59.6	Low	51.3	Low	63 Å²	63	90.7 Å²	90.7	34%	0.337	47%	0.472	S	S	.	.			trans	-99.4	99.9	176.3	-57.2	-21.3	0	0	0	108.6	Q336 I337 C338 Y466	Q336-N468 VanDerWaalsContact O-CA 3.23Å; Q336-N468 WeakPolarHBondContact O-CA 3.35Å; Q336-N468 PolarHBondContact O-OD1 2.97Å; I337-N468 WeakPolarHBondContact CA-OD1 2.98Å; C338-N468 PolarHBondContact N-OD1 2.8Å; Y466-N468 PolarHBondContact O-N 3.33Å; Y466-N468 VanDerWaalsContact O-N 3.16Å
469	E	62.6	Low	52.7	Low	47 Å²	47	86 Å²	86	22%	0.22	45%	0.445	C	S	.	.			trans	-117	142	176.7	63.1	179.5	177.4	0	0	109.9	K318 E335 Q336	K318-E469 IonicContact NZ-OE1 3.69Å; E335-E469 WeakPolarHBondContact CA-O 3.35Å; Q336-E469 PolarHBondContact N-O 3.41Å; Q336-E469 VanDerWaalsContact N-O 3.11Å
470	A	67.7	Low	53.8	Low	54 Å²	54	86 Å²	86	45%	0.446	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.5	169.4	0	0	0	0	0	107.7	T334 E335	T334-A470 CarbonylContact O-C 3.59Å; T334-A470 WeakPolarHBondContact O-CA 3.5Å; E335-A470 HydrophobicContact CG-CB 3.8Å
471	V	77.3	Confident	54.5	Low	57 Å²	57	82.7 Å²	82.7	35%	0.345	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125.7	179.6	-176.1	0	0	0	0	108.8	E333 T334 L473	E333-V471 WeakPolarHBondContact CA-O 2.9Å; T334-V471 PolarHBondContact N-O 2.99Å; T334-V471 PolarHBondContact O-N 3.41Å; T334-V471 PolarHBondContact OG1-O 3.23Å; V471-L473 HydrophobicContact CG1-CD2 4.32Å; V471-L473 HydrophobicContact CG1-CG 4.2Å
472	V	76.2	Confident	55.2	Low	40 Å²	40	77.5 Å²	77.5	24%	0.242	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	122.7	171.4	-174.1	0	0	0	0	108.4	Y179 M332 E333 F539	Y179-V472 WeakPolarHBondContact OH-CG1 3.3Å; M332-V472 CarbonylContact O-C 3.58Å; M332-V472 WeakPolarHBondContact O-CA 3.43Å; E333-V472 HydrophobicContact CG-CB 4.37Å; E333-V472 HydrophobicContact CG-CG1 4.49Å; E333-V472 HydrophobicContact CG-CG2 3.68Å; V472-F539 HydrophobicContact CB-CE1 3.99Å; V472-F539 HydrophobicContact CB-CE2 4.12Å; V472-F539 HydrophobicContact CB-CZ 3.7Å; V472-F539 HydrophobicContact CG1-CE1 4.22Å; V472-F539 HydrophobicContact CG1-CZ 4.43Å; V472-F539 HydrophobicContact CG2-CD2 4.03Å; V472-F539 HydrophobicContact CG2-CE1 4.27Å; V472-F539 HydrophobicContact CG2-CE2 3.63Å; V472-F539 HydrophobicContact CG2-CZ 3.77Å
473	L	76.5	Confident	55.5	Low	76 Å²	76	74.1 Å²	74.1	40%	0.398	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	138.4	175.8	-61.6	151.9	0	0	0	108.7	M332 T334 V471	M332-L473 HydrophobicContact CE-CD1 3.9Å; M332-L473 HydrophobicContact CG-CB 3.64Å; M332-L473 HydrophobicContact CG-CD1 4.16Å; M332-L473 PolarHBondContact N-O 3.4Å; M332-L473 PolarHBondContact O-N 2.72Å; M332-L473 HydrophobicContact SD-CB 4.33Å; M332-L473 HydrophobicContact SD-CD1 4.22Å; T334-L473 HydrophobicContact CG2-CD1 4Å; V471-L473 HydrophobicContact CG1-CD2 4.32Å; V471-L473 HydrophobicContact CG1-CG 4.2Å
474	C	74.7	Confident	55.7	Low	80 Å²	80	73.3 Å²	73.3	54%	0.541	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121	169.9	-179.4	0	0	0	0	108	Y331 K476	Y331-C474 HydrophobicContact CD1-CB 4.27Å; Y331-C474 HydrophobicContact CE1-CB 4.32Å; C474-K476 PolarHBondContact O-N 2.96Å
475	N	70	Confident	55.6	Low	3 Å²	3	79.5 Å²	79.5	2%	0.016	40%	0.404	C	S	.	.			trans	-75	101.3	-175.1	-69.9	-22.1	0	0	0	109.7	E326 D329 I330 M332 H477 I478 S479	E326-N475 VanDerWaalsContact O-CG 3.22Å; E326-N475 PolarHBondContact O-ND2 2.96Å; D329-N475 PolarHBondContact O-ND2 3.49Å; I330-N475 PolarHBondContact O-N 3.44Å; M332-N475 PolarHBondContact SD-OD1 3.25Å; N475-H477 PolarHBondContact O-N 3.5Å; N475-I478 HydrophobicContact CB-CD1 4.13Å; N475-I478 PolarHBondContact O-N 2.92Å; N475-I478 VanDerWaalsContact O-N 3.15Å; N475-S479 PolarHBondContact O-N 2.76Å
476	K	62.1	Low	55.1	Low	119 Å²	119	81.6 Å²	81.6	52%	0.517	42%	0.416	S	S	.	.	H	α-helix	trans	-59.9	-36.6	-176.4	-161.5	-178.6	178.1	-171.6	0	111.5	C474 I478 S479 E480	C474-K476 PolarHBondContact O-N 2.96Å; K476-I478 VanDerWaalsContact C-N 3.27Å; K476-I478 PolarHBondContact O-N 2.93Å; K476-S479 PolarHBondContact O-N 3Å; K476-S479 VanDerWaalsContact O-N 3.09Å; K476-S479 PolarHBondContact O-OG 2.85Å; K476-E480 PolarHBondContact O-N 3.46Å
477	H	54	Low	54	Low	125 Å²	125	82.7 Å²	82.7	58%	0.579	42%	0.419	S	S	*	.	H	α-helix	trans	-59.9	-32.8	178.5	-65.7	-63	0	0	0	113.6	E326 N475	E326-H477 IonicContact OE1-CD2 3.31Å; E326-H477 PolarHBondContact OE1-CD2 3.35Å; E326-H477 VanDerWaalsContact OE1-CD2 3.31Å; E326-H477 IonicContact OE1-NE2 3.8Å; N475-H477 PolarHBondContact O-N 3.5Å
478	I	56.4	Low	52.7	Low	41 Å²	41	87.3 Å²	87.3	21%	0.21	44%	0.444	C	S	.	.	H	α-helix	trans	-84.3	-33.1	176	-65.6	161.7	0	0	0	110.3	D329 I330 N475 K476 E480 N481 A482	D329-I478 WeakPolarHBondContact O-CD1 3.49Å; I330-I478 HydrophobicContact CG1-CG2 3.75Å; N475-I478 HydrophobicContact CB-CD1 4.13Å; N475-I478 PolarHBondContact O-N 2.92Å; N475-I478 VanDerWaalsContact O-N 3.15Å; K476-I478 VanDerWaalsContact C-N 3.27Å; K476-I478 PolarHBondContact O-N 2.93Å; I478-E480 VanDerWaalsContact C-N 3.31Å; I478-E480 PolarHBondContact O-N 3.37Å; I478-N481 PolarHBondContact O-N 3.13Å; I478-A482 VanDerWaalsContact O-CB 3.28Å; I478-A482 WeakPolarHBondContact O-CB 3.43Å; I478-A482 PolarHBondContact O-N 2.76Å
479	S	52.6	Low	51.2	Low	40 Å²	40	92.5 Å²	92.5	28%	0.28	47%	0.466	S	S	.	.	H	α-helix	trans	-61.9	-35.7	179	80.4	0	0	0	0	113.1	N475 K476 A482 T483	N475-S479 PolarHBondContact O-N 2.76Å; K476-S479 PolarHBondContact O-N 3Å; K476-S479 VanDerWaalsContact O-N 3.09Å; K476-S479 PolarHBondContact O-OG 2.85Å; S479-A482 PolarHBondContact O-N 3.43Å; S479-T483 VanDerWaalsContact O-CG2 3.28Å; S479-T483 WeakPolarHBondContact O-CG2 3.39Å; S479-T483 PolarHBondContact O-N 3.15Å; S479-T483 PolarHBondContact O-OG1 3.38Å
480	E	51	Low	49.6	Very low	113 Å²	113	97.5 Å²	97.5	53%	0.528	49%	0.494	S	S	.	.	H	α-helix	trans	-66.4	-40.3	178	-70.1	177.2	-172.3	0	0	111.2	K476 I478 T483	K476-E480 PolarHBondContact O-N 3.46Å; I478-E480 VanDerWaalsContact C-N 3.31Å; I478-E480 PolarHBondContact O-N 3.37Å; E480-T483 PolarHBondContact O-OG1 3Å
481	N	44.6	Very low	47.7	Very low	123 Å²	123	102.3 Å²	102.3	66%	0.658	51%	0.505	S	S	*	.	H	α-helix	trans	-76.4	-34.3	174.8	-72.5	-11.7	0	0	0	113.3	I478 T483 Y484	I478-N481 PolarHBondContact O-N 3.13Å; N481-T483 VanDerWaalsContact C-N 3.29Å; N481-T483 PolarHBondContact O-N 3.28Å; N481-Y484 VanDerWaalsContact O-CB 3.25Å; N481-Y484 WeakPolarHBondContact O-CB 3.2Å; N481-Y484 PolarHBondContact O-N 3.39Å
482	A	40.4	Very low	45.3	Very low	34 Å²	34	108.9 Å²	108.9	28%	0.281	53%	0.529	S	S	.	.	H	α-helix	trans	-71.2	-24.6	175.3	0	0	0	0	0	112.4	I478 S479 Y484 Y485 T486	I478-A482 VanDerWaalsContact O-CB 3.28Å; I478-A482 WeakPolarHBondContact O-CB 3.43Å; I478-A482 PolarHBondContact O-N 2.76Å; S479-A482 PolarHBondContact O-N 3.43Å; A482-Y484 PolarHBondContact O-N 3.32Å; A482-Y485 PolarHBondContact O-N 2.86Å; A482-Y485 VanDerWaalsContact O-N 3.15Å; A482-T486 PolarHBondContact O-N 3.39Å; A482-T486 PolarHBondContact O-OG1 3.2Å; A482-T486 VanDerWaalsContact O-OG1 3.09Å
483	T	35.3	Very low	42.9	Very low	72 Å²	72	113.3 Å²	113.3	44%	0.442	56%	0.56	S	S	.	*	H	α-helix	trans	-67	-15.2	168.2	56.9	0	0	0	0	113.2	S479 E480 N481 T486 R487	S479-T483 VanDerWaalsContact O-CG2 3.28Å; S479-T483 WeakPolarHBondContact O-CG2 3.39Å; S479-T483 PolarHBondContact O-N 3.15Å; S479-T483 PolarHBondContact O-OG1 3.38Å; E480-T483 PolarHBondContact O-OG1 3Å; N481-T483 VanDerWaalsContact C-N 3.29Å; N481-T483 PolarHBondContact O-N 3.28Å; T483-T486 WeakPolarHBondContact CA-OG1 3.37Å; T483-R487 WeakPolarHBondContact O-CB 3.29Å; T483-R487 PolarHBondContact O-N 3.43Å; T483-R487 VanDerWaalsContact O-N 3.09Å
484	Y	32.6	Very low	40.4	Very low	170 Å²	170	116.6 Å²	116.6	67%	0.667	58%	0.578	S	S	*	*	H	α-helix	trans	-72.8	-37.7	168.9	-137.3	-94	0	0	0	111.9	N481 A482	N481-Y484 VanDerWaalsContact O-CB 3.25Å; N481-Y484 WeakPolarHBondContact O-CB 3.2Å; N481-Y484 PolarHBondContact O-N 3.39Å; A482-Y484 PolarHBondContact O-N 3.32Å
485	Y	32.8	Very low	38.1	Very low	193 Å²	193	122.1 Å²	122.1	76%	0.757	59%	0.592	S	S	*	*	H	α-helix	trans	-78.6	-29.5	177.8	-72.4	-75.1	0	0	0	113.8	A482	A482-Y485 PolarHBondContact O-N 2.86Å; A482-Y485 VanDerWaalsContact O-N 3.15Å
486	T	27.6	Very low	35.8	Very low	103 Å²	103	132.6 Å²	132.6	63%	0.632	63%	0.633	S	S	*	*	H	α-helix	trans	-86	-15.9	174.4	49.1	0	0	0	0	114	A482 T483	A482-T486 PolarHBondContact O-N 3.39Å; A482-T486 PolarHBondContact O-OG1 3.2Å; A482-T486 VanDerWaalsContact O-OG1 3.09Å; T483-T486 WeakPolarHBondContact CA-OG1 3.37Å
487	R	26.7	Very low	34	Very low	176 Å²	176	132.4 Å²	132.4	66%	0.664	64%	0.644	S	S	*	*	H	α-helix	trans	-82.9	-21.3	176.7	-166.4	170.1	-145.5	152.4	1.8	113.5	T483	T483-R487 WeakPolarHBondContact O-CB 3.29Å; T483-R487 PolarHBondContact O-N 3.43Å; T483-R487 VanDerWaalsContact O-N 3.09Å
488	N	26.9	Very low	32.5	Very low	105 Å²	105	131.6 Å²	131.6	56%	0.561	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-85.8	-7.2	-178.7	-82.7	-3.7	0	0	0	115.5	N490	N488-N490 VanDerWaalsContact C-N 3.27Å; N488-N490 PolarHBondContact O-N 3.49Å
489	H	28.1	Very low	31	Very low	172 Å²	172	135.9 Å²	135.9	80%	0.796	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-77.1	-9.5	169.1	-87.4	-71.3	0	0	0	114.3
490	N	28.7	Very low	29.6	Very low	151 Å²	151	141.1 Å²	141.1	81%	0.807	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-121.8	15.3	-178.8	-83.8	-20.3	0	0	0	115.7	N488	N488-N490 VanDerWaalsContact C-N 3.27Å; N488-N490 PolarHBondContact O-N 3.49Å
491	K	27.3	Very low	28.5	Very low	156 Å²	156	140.7 Å²	140.7	68%	0.678	71%	0.714	S	S	*	*	S	Bend	trans	-138.8	94.8	168.7	-73.3	-171.6	179.7	-179.6	0	111.6
492	K	26.9	Very low	27.5	Very low	195 Å²	195	143.8 Å²	143.8	85%	0.848	72%	0.721	S	S	*	*			trans	57.7	91.4	158.2	-66.5	179.3	176.1	-179.8	0	114.8	N494	K492-N494 PolarHBondContact O-N 2.87Å
493	C	24.8	Very low	26.8	Very low	132 Å²	132	149 Å²	149	89%	0.892	74%	0.744	S	S	*	*			trans	-54.8	92.3	138.9	-64.3	0	0	0	0	108.1
494	N	24.6	Very low	26.2	Very low	145 Å²	145	150.5 Å²	150.5	78%	0.775	76%	0.758	S	S	*	*			trans	-158.6	109.4	154.2	-97	-21.8	0	0	0	109.3	K492	K492-N494 PolarHBondContact O-N 2.87Å
495	K	26.8	Very low	26	Very low	196 Å²	196	153.3 Å²	153.3	85%	0.852	77%	0.769	S	S	*	*			trans	64.3	110.9	161.2	-80.9	175.7	171.9	175.9	0	118.6
496	Y	21.3	Very low	25.4	Very low	224 Å²	224	150 Å²	150	88%	0.878	77%	0.765	S	S	*	*			trans	-34.5	143.4	145.3	-64.4	-91.3	0	0	0	111.9
497	P	24.5	Very low	25.4	Very low	115 Å²	115	150.2 Å²	150.2	75%	0.747	77%	0.77	S	S	*	*				-132.9	138	95.2	30.7	-16.8	0	0	0	113.4	T499	P497-T499 PolarHBondContact O-N 2.71Å
498	S	23.3	Very low	25.2	Very low	108 Å²	108	146.2 Å²	146.2	76%	0.755	77%	0.769	S	S	*	*			trans	-59.8	119.7	153.5	49.2	0	0	0	0	110.3
499	T	23.8	Very low	25.2	Very low	131 Å²	131	149.4 Å²	149.4	80%	0.804	78%	0.78	S	S	*	*			trans	-136.9	117.6	149	47.3	0	0	0	0	108.6	P497	P497-T499 PolarHBondContact O-N 2.71Å
500	I	24.1	Very low	25.2	Very low	150 Å²	150	148.4 Å²	148.4	77%	0.769	78%	0.776	S	S	*	*			trans	-47.3	125.2	171.7	-67	150.7	0	0	0	110.9	K502	I500-K502 HydrophobicContact CG2-CB 4.36Å; I500-K502 HydrophobicContact CG2-CD 4.41Å; I500-K502 HydrophobicContact CG2-CG 3.96Å
501	S	26.5	Very low	24.9	Very low	103 Å²	103	150.1 Å²	150.1	72%	0.72	78%	0.776	S	S	*	*			trans	-118.6	95.6	146	59.3	0	0	0	0	107.2	D503	S501-D503 VanDerWaalsContact C-N 3.35Å; S501-D503 PolarHBondContact O-N 3.35Å; S501-D503 VanDerWaalsContact O-N 3.16Å
502	K	24.2	Very low	24.9	Very low	188 Å²	188	152.1 Å²	152.1	82%	0.817	78%	0.781	S	S	*	*			trans	-66.1	96.7	159.8	-85.8	170.7	168.9	170.8	0	106.4	I500	I500-K502 HydrophobicContact CG2-CB 4.36Å; I500-K502 HydrophobicContact CG2-CD 4.41Å; I500-K502 HydrophobicContact CG2-CG 3.96Å
503	D	26.1	Very low	24.8	Very low	144 Å²	144	149.5 Å²	149.5	77%	0.77	78%	0.776	S	S	*	*			trans	-107.1	107	158.1	-75	-30.3	0	0	0	108	S501 Y505	S501-D503 VanDerWaalsContact C-N 3.35Å; S501-D503 PolarHBondContact O-N 3.35Å; S501-D503 VanDerWaalsContact O-N 3.16Å; D503-Y505 PolarHBondContact O-N 3.25Å
504	S	23.5	Very low	24.9	Very low	103 Å²	103	150.1 Å²	150.1	72%	0.72	77%	0.771	S	S	*	*			trans	-49.7	122.7	170.4	50.8	0	0	0	0	111.6
505	Y	26.4	Very low	24.8	Very low	229 Å²	229	151.7 Å²	151.7	90%	0.898	77%	0.771	S	S	*	*			trans	-109.5	84.9	145.1	-104	-88.4	0	0	0	107.3	D503	D503-Y505 PolarHBondContact O-N 3.25Å
506	D	20.8	Very low	24.7	Very low	125 Å²	125	148.9 Å²	148.9	67%	0.668	76%	0.763	S	S	*	*			trans	-83.2	112.2	159.7	-158	-15.6	0	0	0	106.4	S508	D506-S508 PolarHBondContact OD1-N 3.43Å; D506-S508 PolarHBondContact OD1-OG 3.21Å; D506-S508 VanDerWaalsContact OD1-OG 3.07Å
507	S	27.8	Very low	24.8	Very low	107 Å²	107	144.2 Å²	144.2	75%	0.748	75%	0.754	S	S	*	*			trans	-142.7	67.9	160.1	-76.6	0	0	0	0	106.7	Q509	S507-Q509 PolarHBondContact O-N 3.16Å
508	S	22.1	Very low	24.9	Very low	92 Å²	92	145.9 Å²	145.9	64%	0.643	76%	0.755	S	S	*	*			trans	-54.4	106.8	145.7	43.2	0	0	0	0	109.2	D506	D506-S508 PolarHBondContact OD1-N 3.43Å; D506-S508 PolarHBondContact OD1-OG 3.21Å; D506-S508 VanDerWaalsContact OD1-OG 3.07Å
509	Q	28	Very low	25.1	Very low	171 Å²	171	151.1 Å²	151.1	80%	0.799	76%	0.76	S	S	*	*			trans	-154.6	109.5	151.6	-111.7	167.6	48.6	0	0	112.4	S507	S507-Q509 PolarHBondContact O-N 3.16Å
510	Q	26.7	Very low	25.2	Very low	152 Å²	152	153.3 Å²	153.3	71%	0.71	76%	0.761	S	S	*	*			trans	74	95.9	140.9	-69.2	175.7	-12.7	0	0	119.2	Y512	Q510-Y512 PolarHBondContact O-N 3.12Å
511	K	23.3	Very low	25.2	Very low	186 Å²	186	151.3 Å²	151.3	81%	0.809	76%	0.76	S	S	*	*			trans	-23.7	114.3	133.2	-81.4	177.5	167.8	-178.2	0	112.4
512	Y	28.2	Very low	25.1	Very low	199 Å²	199	152.3 Å²	152.3	78%	0.78	76%	0.762	S	S	*	*			trans	-119	108.3	138.3	-89.7	-83.8	0	0	0	107.3	Q510 N514	Q510-Y512 PolarHBondContact O-N 3.12Å; Y512-N514 PolarHBondContact O-N 3.46Å; Y512-N514 VanDerWaalsContact O-N 3.15Å
513	D	24.3	Very low	25.1	Very low	139 Å²	139	148.8 Å²	148.8	74%	0.743	76%	0.757	S	S	*	*			trans	-63	105.3	160.8	-72.3	-44.4	0	0	0	107.3
514	N	26.5	Very low	25.2	Very low	145 Å²	145	150.7 Å²	150.7	78%	0.775	76%	0.761	S	S	*	*			trans	-121	90.5	155.6	-99.9	-9.2	0	0	0	107.8	Y512 I516	Y512-N514 PolarHBondContact O-N 3.46Å; Y512-N514 VanDerWaalsContact O-N 3.15Å; N514-I516 PolarHBondContact O-N 3.5Å; N514-I516 VanDerWaalsContact O-N 3.17Å
515	K	22.3	Very low	25.7	Very low	179 Å²	179	153 Å²	153	78%	0.778	77%	0.765	S	S	*	*			trans	-66.4	99	168.3	-160.7	178.5	-172	-177.4	0	107.7
516	I	25.1	Very low	25.9	Very low	136 Å²	136	150.4 Å²	150.4	70%	0.697	76%	0.761	S	S	*	*			trans	-124.5	99.7	160	-61.7	179.1	0	0	0	105.4	N514 I518	N514-I516 PolarHBondContact O-N 3.5Å; N514-I516 VanDerWaalsContact O-N 3.17Å; I516-I518 HydrophobicContact CG2-CG1 4.31Å; I516-I518 PolarHBondContact O-N 2.02Å
517	D	23.2	Very low	26.4	Very low	127 Å²	127	151 Å²	151	68%	0.679	76%	0.764	S	S	*	*			trans	-63.9	98.3	176.7	-65.1	-45.1	0	0	0	108.8
518	I	27.2	Very low	26.7	Very low	150 Å²	150	152.9 Å²	152.9	77%	0.769	77%	0.766	S	S	*	*			trans	-98.9	107.3	163	-62.3	173.6	0	0	0	105.9	I516 Q520	I516-I518 HydrophobicContact CG2-CG1 4.31Å; I516-I518 PolarHBondContact O-N 2.02Å; I518-Q520 PolarHBondContact O-N 3.26Å; I518-Q520 VanDerWaalsContact O-N 3.15Å
519	Y	26.4	Very low	27.3	Very low	217 Å²	217	155.5 Å²	155.5	85%	0.851	77%	0.773	S	S	*	*			trans	-44.3	116.6	179.5	-80.9	-92.2	0	0	0	111.7	S521	Y519-S521 PolarHBondContact O-N 2.92Å; Y519-S521 VanDerWaalsContact O-N 3.16Å
520	Q	26.5	Very low	27.5	Very low	178 Å²	178	155.8 Å²	155.8	83%	0.832	77%	0.774	S	S	*	*			trans	-63.6	107.2	161.9	-80.2	167.6	-45.5	0	0	108	I518 T522	I518-Q520 PolarHBondContact O-N 3.26Å; I518-Q520 VanDerWaalsContact O-N 3.15Å; Q520-T522 VanDerWaalsContact C-N 3.31Å; Q520-T522 PolarHBondContact O-N 2.93Å; Q520-T522 VanDerWaalsContact O-N 3.08Å
521	S	24.7	Very low	27.9	Very low	107 Å²	107	155.7 Å²	155.7	75%	0.748	77%	0.773	S	S	*	*			trans	-72.2	93.3	158.5	57.8	0	0	0	0	107.7	Y519 T523	Y519-S521 PolarHBondContact O-N 2.92Å; Y519-S521 VanDerWaalsContact O-N 3.16Å; S521-T523 VanDerWaalsContact C-N 3.28Å; S521-T523 PolarHBondContact O-N 3.13Å; S521-T523 VanDerWaalsContact O-N 3.12Å
522	T	23	Very low	28.5	Very low	124 Å²	124	153.7 Å²	153.7	76%	0.761	77%	0.771	S	S	*	*			trans	-72	88	159.9	49.8	0	0	0	0	107.3	Q520	Q520-T522 VanDerWaalsContact C-N 3.31Å; Q520-T522 PolarHBondContact O-N 2.93Å; Q520-T522 VanDerWaalsContact O-N 3.08Å
523	T	26	Very low	28.8	Very low	115 Å²	115	148.7 Å²	148.7	71%	0.706	76%	0.757	S	S	*	*			trans	-88.8	111.3	157.3	39.9	0	0	0	0	106.1	S521 D525	S521-T523 VanDerWaalsContact C-N 3.28Å; S521-T523 PolarHBondContact O-N 3.13Å; S521-T523 VanDerWaalsContact O-N 3.12Å; T523-D525 PolarHBondContact O-N 3.16Å
524	E	28.3	Very low	29.5	Very low	183 Å²	183	146.3 Å²	146.3	86%	0.855	75%	0.752	S	S	*	*			trans	-51.4	124.9	169.5	-65.3	174.1	162.1	0	0	108.3	E526	E524-E526 PolarHBondContact O-N 3.06Å
525	D	32	Very low	30.1	Very low	151 Å²	151	144.1 Å²	144.1	81%	0.807	74%	0.739	S	S	*	*			trans	-64.3	98	178.6	-60.9	-59	0	0	0	108.6	T523	T523-D525 PolarHBondContact O-N 3.16Å
526	E	31.5	Very low	31.1	Very low	175 Å²	175	138.1 Å²	138.1	82%	0.818	72%	0.716	S	S	*	*			trans	-81.1	112.5	156.4	-74.7	-163.7	163.2	0	0	107.3	E524 D528	E524-E526 PolarHBondContact O-N 3.06Å; E526-D528 VanDerWaalsContact C-N 3.28Å; E526-D528 PolarHBondContact O-N 3.1Å
527	D	32.1	Very low	31.9	Very low	139 Å²	139	136.6 Å²	136.6	74%	0.743	71%	0.708	S	S	*	*			trans	-61.2	79.2	177.6	-64.5	-50.5	0	0	0	111.5	D529	D527-D529 PolarHBondContact O-N 2.76Å
528	D	32.6	Very low	32.8	Very low	145 Å²	145	139.4 Å²	139.4	78%	0.775	71%	0.709	S	S	*	*			trans	-92.2	77.9	161.7	-80.1	-27.4	0	0	0	108.9	E526 E530	E526-D528 VanDerWaalsContact C-N 3.28Å; E526-D528 PolarHBondContact O-N 3.1Å; D528-E530 PolarHBondContact O-N 3.45Å
529	D	35.9	Very low	33.4	Very low	148 Å²	148	136.2 Å²	136.2	79%	0.791	69%	0.69	S	S	*	*			trans	-66.2	72.4	167	-75.9	-35.5	0	0	0	110.3	D527 E531	D527-D529 PolarHBondContact O-N 2.76Å; D529-E531 VanDerWaalsContact C-N 3.26Å; D529-E531 PolarHBondContact O-N 3.07Å
530	E	32	Very low	34.1	Very low	176 Å²	176	129.6 Å²	129.6	82%	0.822	67%	0.669	S	S	*	*			trans	-71.4	90.8	160.9	-84.8	-89.6	171.3	0	0	108.3	D528 L532	D528-E530 PolarHBondContact O-N 3.45Å; E530-L532 PolarHBondContact O-N 3.18Å
531	E	34.9	Very low	34.9	Very low	150 Å²	150	126.7 Å²	126.7	70%	0.701	66%	0.655	S	S	*	*			trans	-35.6	88.4	172.5	-134.9	-173.7	160.9	0	0	113.9	D529 L533	D529-E531 VanDerWaalsContact C-N 3.26Å; D529-E531 PolarHBondContact O-N 3.07Å; E531-L533 HydrophobicContact CB-CG 4.23Å; E531-L533 HydrophobicContact CG-CD1 4.04Å; E531-L533 HydrophobicContact CG-CD2 4.04Å; E531-L533 HydrophobicContact CG-CG 3.7Å; E531-L533 PolarHBondContact O-N 3.16Å; E531-L533 WeakPolarHBondContact OE1-CD1 3.31Å; E531-L533 WeakPolarHBondContact OE1-CD2 3.5Å
532	L	35.7	Very low	35.8	Very low	145 Å²	145	128.2 Å²	128.2	76%	0.759	65%	0.646	S	S	*	*			trans	-76.5	68.3	171.1	-94.5	163.3	0	0	0	111.3	E530 S534	E530-L532 PolarHBondContact O-N 3.18Å; L532-S534 VanDerWaalsContact C-N 3.27Å; L532-S534 PolarHBondContact O-N 3.27Å
533	L	33.9	Very low	37	Very low	94 Å²	94	124.4 Å²	124.4	49%	0.492	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.4	2.4	-172.7	-78.6	171.9	0	0	0	117.7	E531 I537	E531-L533 HydrophobicContact CB-CG 4.23Å; E531-L533 HydrophobicContact CG-CD1 4.04Å; E531-L533 HydrophobicContact CG-CD2 4.04Å; E531-L533 HydrophobicContact CG-CG 3.7Å; E531-L533 PolarHBondContact O-N 3.16Å; E531-L533 WeakPolarHBondContact OE1-CD1 3.31Å; E531-L533 WeakPolarHBondContact OE1-CD2 3.5Å; L533-I537 WeakPolarHBondContact O-CD1 3.43Å; L533-I537 WeakPolarHBondContact O-CG1 3.38Å
534	S	39.3	Very low	37.8	Very low	89 Å²	89	124.9 Å²	124.9	62%	0.622	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-25.8	-167.7	71.8	0	0	0	0	116.4	L532	L532-S534 VanDerWaalsContact C-N 3.27Å; L532-S534 PolarHBondContact O-N 3.27Å
535	L	40	Very low	38.3	Very low	99 Å²	99	120.1 Å²	120.1	52%	0.518	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.5	-35.8	-179.4	-85.7	159.6	0	0	0	112.8	I537 R538	L535-I537 VanDerWaalsContact C-N 3.3Å; L535-I537 PolarHBondContact O-N 3.16Å; L535-R538 PolarHBondContact O-N 2.92Å
536	D	42.1	Very low	38.6	Very low	53 Å²	53	118.7 Å²	118.7	28%	0.283	58%	0.579	S	S	.	*	H	α-helix	trans	-60.1	-37.2	-177.8	-79.6	-12.3	0	0	0	112.1	R261 R538 F539 D540	R261-D536 IonicContact CZ-OD1 3.21Å; R261-D536 IonicContact CZ-OD2 3.92Å; R261-D536 IonicContact NH1-OD1 3.85Å; R261-D536 PolarHBondContact NH1-OD1 2.88Å; R261-D536 IonicContact NH1-OD2 3.69Å; R261-D536 IonicContact NH2-OD1 3.82Å; R261-D536 IonicContact NH2-OD2 2.8Å; R261-D536 PolarHBondContact NH2-OD2 3.47Å; D536-R538 VanDerWaalsContact C-N 3.3Å; D536-R538 PolarHBondContact O-N 3.16Å; D536-F539 PolarHBondContact O-N 3.26Å; D536-D540 WeakPolarHBondContact O-CB 3.13Å; D536-D540 PolarHBondContact O-N 2.59Å; D536-D540 VanDerWaalsContact O-N 3.07Å
537	I	41.9	Very low	38.9	Very low	104 Å²	104	113.6 Å²	113.6	53%	0.533	56%	0.563	S	S	.	*	H	α-helix	trans	-60	-38.6	179.3	-61.5	175	0	0	0	112	L533 L535 E541	L533-I537 WeakPolarHBondContact O-CD1 3.43Å; L533-I537 WeakPolarHBondContact O-CG1 3.38Å; L535-I537 VanDerWaalsContact C-N 3.3Å; L535-I537 PolarHBondContact O-N 3.16Å; I537-E541 WeakPolarHBondContact O-CB 3.44Å; I537-E541 PolarHBondContact O-N 3.15Å; I537-E541 VanDerWaalsContact O-N 3.17Å
538	R	42.6	Very low	39.2	Very low	186 Å²	186	110.9 Å²	110.9	70%	0.702	55%	0.547	S	S	*	.	H	α-helix	trans	-75.5	-32	-171.8	-146.2	-177.5	-61.3	-162.6	2.3	112.1	L535 D536 Y542	L535-R538 PolarHBondContact O-N 2.92Å; D536-R538 VanDerWaalsContact C-N 3.3Å; D536-R538 PolarHBondContact O-N 3.16Å; R538-Y542 PolarHBondContact O-N 2.91Å
539	F	39.2	Very low	39.3	Very low	82 Å²	82	111.6 Å²	111.6	36%	0.36	54%	0.543	S	S	.	.	H	α-helix	trans	-82.5	-39.9	177.4	-90.6	-81.6	0	0	0	112.6	V472 D536 E541 Y542 I543	V472-F539 HydrophobicContact CB-CE1 3.99Å; V472-F539 HydrophobicContact CB-CE2 4.12Å; V472-F539 HydrophobicContact CB-CZ 3.7Å; V472-F539 HydrophobicContact CG1-CE1 4.22Å; V472-F539 HydrophobicContact CG1-CZ 4.43Å; V472-F539 HydrophobicContact CG2-CD2 4.03Å; V472-F539 HydrophobicContact CG2-CE1 4.27Å; V472-F539 HydrophobicContact CG2-CE2 3.63Å; V472-F539 HydrophobicContact CG2-CZ 3.77Å; D536-F539 PolarHBondContact O-N 3.26Å; F539-E541 PolarHBondContact O-N 3.49Å; F539-Y542 PolarHBondContact O-N 2.91Å; F539-Y542 VanDerWaalsContact O-N 3.11Å; F539-I543 PolarHBondContact O-N 3Å
540	D	42.2	Very low	39.2	Very low	78 Å²	78	112.1 Å²	112.1	42%	0.417	54%	0.539	S	S	.	.	H	α-helix	trans	-60.8	-37.7	175.1	-76.2	-16.8	0	0	0	111.1	Y181 D536 K544	Y181-D540 PolarHBondContact OH-OD1 3.43Å; Y181-D540 VanDerWaalsContact OH-OD1 3.1Å; D536-D540 WeakPolarHBondContact O-CB 3.13Å; D536-D540 PolarHBondContact O-N 2.59Å; D536-D540 VanDerWaalsContact O-N 3.07Å; D540-K544 WeakPolarHBondContact O-CB 3.3Å; D540-K544 PolarHBondContact O-N 3.29Å
541	E	42.4	Very low	39.4	Very low	117 Å²	117	109.8 Å²	109.8	55%	0.547	53%	0.532	S	S	.	.	H	α-helix	trans	-67.9	-36.9	175.1	-163.6	173.3	-161.5	0	0	112.7	I537 F539 N545	I537-E541 WeakPolarHBondContact O-CB 3.44Å; I537-E541 PolarHBondContact O-N 3.15Å; I537-E541 VanDerWaalsContact O-N 3.17Å; F539-E541 PolarHBondContact O-N 3.49Å; E541-N545 WeakPolarHBondContact O-CB 3.43Å; E541-N545 VanDerWaalsContact O-CG 3.26Å; E541-N545 PolarHBondContact O-N 2.88Å; E541-N545 PolarHBondContact O-ND2 3.46Å
542	Y	43.9	Very low	39.2	Very low	140 Å²	140	110.2 Å²	110.2	55%	0.549	53%	0.531	S	S	.	.	H	α-helix	trans	-67.3	-44.7	175.9	-178	-95.4	0	0	0	112.3	R538 F539 N545 K546	R538-Y542 PolarHBondContact O-N 2.91Å; F539-Y542 PolarHBondContact O-N 2.91Å; F539-Y542 VanDerWaalsContact O-N 3.11Å; Y542-N545 PolarHBondContact O-N 3.48Å; Y542-K546 HydrophobicContact CE1-CD 4.32Å; Y542-K546 PolarHBondContact O-N 3.03Å
543	I	47.6	Very low	38.9	Very low	44 Å²	44	114.6 Å²	114.6	23%	0.226	54%	0.538	C	S	.	.	H	α-helix	trans	-66	-43.1	176.6	-65.6	-174.3	0	0	0	110.2	Y181 F539 N545 K546 C547	Y181-I543 HydrophobicContact CD2-CD1 4.46Å; Y181-I543 HydrophobicContact CE2-CD1 3.84Å; F539-I543 PolarHBondContact O-N 3Å; I543-N545 VanDerWaalsContact C-N 3.29Å; I543-N545 PolarHBondContact O-N 3.46Å; I543-K546 PolarHBondContact O-N 3.35Å; I543-K546 VanDerWaalsContact O-N 3.07Å; I543-C547 PolarHBondContact O-N 3.32Å; I543-C547 PolarHBondContact O-SG 3.49Å
544	K	42.7	Very low	38.7	Very low	125 Å²	125	115.1 Å²	115.1	54%	0.543	55%	0.549	S	S	.	.	H	α-helix	trans	-54.3	-45.5	173.7	-172.4	176.7	-175.9	179.4	0	111.4	D540 K546 C547 I548	D540-K544 WeakPolarHBondContact O-CB 3.3Å; D540-K544 PolarHBondContact O-N 3.29Å; K544-K546 PolarHBondContact O-N 3.26Å; K544-C547 PolarHBondContact O-N 3.49Å; K544-I548 HydrophobicContact CG-CD1 3.94Å; K544-I548 WeakPolarHBondContact O-CB 3.47Å; K544-I548 WeakPolarHBondContact O-CD1 3.36Å; K544-I548 WeakPolarHBondContact O-CG1 3.24Å; K544-I548 PolarHBondContact O-N 3Å
545	N	39.3	Very low	38.2	Very low	83 Å²	83	117.8 Å²	117.8	44%	0.444	56%	0.555	S	S	.	*	H	α-helix	trans	-68.3	-31	177.9	-76.1	-27.3	0	0	0	113.7	E541 Y542 I543 K549	E541-N545 WeakPolarHBondContact O-CB 3.43Å; E541-N545 VanDerWaalsContact O-CG 3.26Å; E541-N545 PolarHBondContact O-N 2.88Å; E541-N545 PolarHBondContact O-ND2 3.46Å; Y542-N545 PolarHBondContact O-N 3.48Å; I543-N545 VanDerWaalsContact C-N 3.29Å; I543-N545 PolarHBondContact O-N 3.46Å; N545-K549 WeakPolarHBondContact O-CG 3.33Å; N545-K549 PolarHBondContact O-N 2.9Å
546	K	39.6	Very low	37.6	Very low	120 Å²	120	116 Å²	116	52%	0.522	56%	0.561	S	S	.	*	H	α-helix	trans	-77.3	-35.4	176.7	-155.5	174.9	-174.4	176.1	0	112.2	Y542 I543 K544 K549 K550	Y542-K546 HydrophobicContact CE1-CD 4.32Å; Y542-K546 PolarHBondContact O-N 3.03Å; I543-K546 PolarHBondContact O-N 3.35Å; I543-K546 VanDerWaalsContact O-N 3.07Å; K544-K546 PolarHBondContact O-N 3.26Å; K546-K549 PolarHBondContact O-N 3.39Å; K546-K550 PolarHBondContact O-N 2.77Å
547	C	36.5	Very low	36.7	Very low	69 Å²	69	120.7 Å²	120.7	47%	0.466	59%	0.586	S	S	.	*	H	α-helix	trans	-67.9	-44.7	173.4	-68.5	0	0	0	0	111.2	I543 K544 K549 K550 D551	I543-C547 PolarHBondContact O-N 3.32Å; I543-C547 PolarHBondContact O-SG 3.49Å; K544-C547 PolarHBondContact O-N 3.49Å; C547-K549 PolarHBondContact O-N 2.86Å; C547-K550 PolarHBondContact O-N 2.88Å; C547-D551 PolarHBondContact O-N 2.92Å
548	I	39.6	Very low	35.8	Very low	82 Å²	82	122.5 Å²	122.5	42%	0.421	60%	0.597	S	S	.	*	H	α-helix	trans	-60	-34.3	174.7	-67.3	164.3	0	0	0	111.8	K544	K544-I548 HydrophobicContact CG-CD1 3.94Å; K544-I548 WeakPolarHBondContact O-CB 3.47Å; K544-I548 WeakPolarHBondContact O-CD1 3.36Å; K544-I548 WeakPolarHBondContact O-CG1 3.24Å; K544-I548 PolarHBondContact O-N 3Å
549	K	34.8	Very low	35	Very low	159 Å²	159	123.8 Å²	123.8	69%	0.691	60%	0.603	S	S	*	*	H	α-helix	trans	-73	-23.1	176.3	-78.8	-178.7	-179	-178	0	113.8	N545 K546 C547	N545-K549 WeakPolarHBondContact O-CG 3.33Å; N545-K549 PolarHBondContact O-N 2.9Å; K546-K549 PolarHBondContact O-N 3.39Å; C547-K549 PolarHBondContact O-N 2.86Å
550	K	33.3	Very low	34.4	Very low	160 Å²	160	123.7 Å²	123.7	70%	0.696	61%	0.612	S	S	*	*	H	α-helix	trans	-77.8	-31.4	175.9	-79.8	-174	175.7	-179.6	0	112.4	K546 C547 K552	K546-K550 PolarHBondContact O-N 2.77Å; C547-K550 PolarHBondContact O-N 2.88Å; K550-K552 VanDerWaalsContact C-N 3.33Å; K550-K552 PolarHBondContact O-N 3.42Å
551	D	35.5	Very low	33.5	Very low	127 Å²	127	127.6 Å²	127.6	68%	0.679	63%	0.633	S	S	*	*	H	α-helix	trans	-76.8	-18.4	177.7	-68.7	-21.9	0	0	0	113.5	C547 R553	C547-D551 PolarHBondContact O-N 2.92Å; D551-R553 PolarHBondContact O-N 3.29Å
552	K	31.3	Very low	32.8	Very low	158 Å²	158	132.3 Å²	132.3	69%	0.687	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-76.8	4.1	175.6	-73.1	-169.1	178	-172.8	0	115.2	K550	K550-K552 VanDerWaalsContact C-N 3.33Å; K550-K552 PolarHBondContact O-N 3.42Å
553	R	30.2	Very low	32.1	Very low	237 Å²	237	131.9 Å²	131.9	89%	0.894	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-92.7	6	176.8	-85.1	-171.7	-176.3	178.5	1.6	115.5	D551	D551-R553 PolarHBondContact O-N 3.29Å
554	S	29.6	Very low	31	Very low	105 Å²	105	137.7 Å²	137.7	73%	0.734	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-126.9	51	167.7	67.4	0	0	0	0	112.1
555	I	28.4	Very low	30.4	Very low	145 Å²	145	138.8 Å²	138.8	74%	0.744	69%	0.693	S	S	*	*			trans	-130.2	100.1	157.4	-61.5	175.7	0	0	0	105.5
556	G	26.1	Very low	29.9	Very low	63 Å²	63	138.8 Å²	138.8	65%	0.649	70%	0.696	S	S	*	*			trans	-62.9	133.8	169.1	0	0	0	0	0	109.9
557	N	23.7	Very low	29.4	Very low	150 Å²	150	139.6 Å²	139.6	80%	0.802	71%	0.711	S	S	*	*			trans	27.4	101.5	144.9	-58.2	-9.4	0	0	0	116.3
558	N	23.8	Very low	29	Very low	142 Å²	142	143.9 Å²	143.9	76%	0.759	73%	0.729	S	S	*	*				-175.9	145.4	125	-89.5	-21.6	0	0	0	110.7
559	Y	26	Very low	28.4	Very low	214 Å²	214	150.5 Å²	150.5	84%	0.839	75%	0.748	S	S	*	*			trans	81.2	84.5	177.4	-59.5	-77.3	0	0	0	115.3
560	S	26.2	Very low	28	Very low	79 Å²	79	151.1 Å²	151.1	55%	0.552	76%	0.759	S	S	*	*				95.9	108.4	73.3	61.7	0	0	0	0	110.2	Y562	S560-Y562 PolarHBondContact O-N 3.41Å; S560-Y562 VanDerWaalsContact O-N 3.09Å
561	N	23.8	Very low	27.8	Very low	160 Å²	160	147.6 Å²	147.6	86%	0.856	76%	0.755	S	S	*	*			trans	-42.8	109.1	164.4	-66.3	-28.2	0	0	0	110.3
562	Y	27.8	Very low	27.4	Very low	217 Å²	217	148.8 Å²	148.8	85%	0.851	76%	0.761	S	S	*	*			trans	-86.8	76.8	142.3	-73.3	-85.7	0	0	0	104	S560	S560-Y562 PolarHBondContact O-N 3.41Å; S560-Y562 VanDerWaalsContact O-N 3.09Å
563	E	27.3	Very low	27.2	Very low	131 Å²	131	149.5 Å²	149.5	61%	0.612	77%	0.772	S	S	*	*				52.8	67.7	88.5	-140.2	-173.1	-153.8	0	0	110.1	D565 T566	E563-D565 VanDerWaalsContact C-N 3.28Å; E563-T566 VanDerWaalsContact CD-OG1 3.24Å; E563-T566 HydrophobicContact CG-CG2 4.26Å; E563-T566 VanDerWaalsContact CG-OG1 3.29Å; E563-T566 WeakPolarHBondContact CG-OG1 3.49Å; E563-T566 WeakPolarHBondContact OE1-CG2 3.32Å; E563-T566 PolarHBondContact OE2-OG1 2.92Å
564	L	26.5	Very low	27.1	Very low	166 Å²	166	145.8 Å²	145.8	87%	0.869	77%	0.769	S	S	*	*	S	Bend	trans	-91	8.5	165.1	-146.8	89.5	0	0	0	111.5
565	D	28.9	Very low	27.2	Very low	147 Å²	147	147.2 Å²	147.2	79%	0.786	77%	0.773	S	S	*	*			trans	-112.1	5.8	-175.1	-82.5	-28.7	0	0	0	114.4	E563 V567	E563-D565 VanDerWaalsContact C-N 3.28Å; D565-V567 VanDerWaalsContact C-N 3.26Å; D565-V567 PolarHBondContact O-N 3.24Å
566	T	29.3	Very low	27	Very low	83 Å²	83	146.5 Å²	146.5	51%	0.509	78%	0.776	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81	5.8	177.8	8.8	0	0	0	0	114.9	E563	E563-T566 VanDerWaalsContact CD-OG1 3.24Å; E563-T566 HydrophobicContact CG-CG2 4.26Å; E563-T566 VanDerWaalsContact CG-OG1 3.29Å; E563-T566 WeakPolarHBondContact CG-OG1 3.49Å; E563-T566 WeakPolarHBondContact OE1-CG2 3.32Å; E563-T566 PolarHBondContact OE2-OG1 2.92Å
567	V	28.1	Very low	27	Very low	138 Å²	138	148.8 Å²	148.8	84%	0.836	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-2.2	178.2	-177.5	0	0	0	0	113.5	D565	D565-V567 VanDerWaalsContact C-N 3.26Å; D565-V567 PolarHBondContact O-N 3.24Å
568	L	29.7	Very low	27.3	Very low	159 Å²	159	153.3 Å²	153.3	83%	0.832	80%	0.804	S	S	*	*	S	Bend	trans	-124	27	-175.4	-79.3	175	0	0	0	117.3
569	R	26.8	Very low	27.5	Very low	220 Å²	220	153.9 Å²	153.9	83%	0.83	81%	0.806	S	S	*	*			trans	-144.2	26.7	174.6	-129.9	176.5	-175.8	179.6	0.4	119.1	S571	R569-S571 PolarHBondContact O-N 2.82Å; R569-S571 VanDerWaalsContact O-N 3.17Å
570	N	26	Very low	27.5	Very low	173 Å²	173	150.7 Å²	150.7	93%	0.925	80%	0.804	S	S	*	*			trans	-84.1	39.7	166.4	-79.5	-2.7	0	0	0	113.5
571	S	28.2	Very low	27.6	Very low	86 Å²	86	154.7 Å²	154.7	60%	0.601	82%	0.818	S	S	*	*	S	Bend	trans	-139.2	125.4	164.7	53.9	0	0	0	0	109.5	R569	R569-S571 PolarHBondContact O-N 2.82Å; R569-S571 VanDerWaalsContact O-N 3.17Å
572	N	26.9	Very low	27.8	Very low	152 Å²	152	154.4 Å²	154.4	81%	0.813	82%	0.816	S	S	*	*	S	Bend	trans	88.2	90.1	178.7	-49.3	-24.4	0	0	0	115.1
573	L	28.4	Very low	27.8	Very low	173 Å²	173	150.5 Å²	150.5	91%	0.906	81%	0.814	S	S	*	*				179.7	88.1	117.8	-91.5	153.4	0	0	0	109.5
574	D	28	Very low	27.9	Very low	159 Å²	159	151.8 Å²	151.8	85%	0.85	83%	0.827	S	S	*	*			trans	-142.5	82.1	155.9	-113	-13.6	0	0	0	107.2
575	V	30.3	Very low	28	Very low	134 Å²	134	150.8 Å²	150.8	81%	0.812	82%	0.824	S	S	*	*			trans	-134	100.5	157.6	-178.8	0	0	0	0	106.7
576	T	25.4	Very low	27.9	Very low	130 Å²	130	151.1 Å²	151.1	80%	0.798	83%	0.827	S	S	*	*			trans	-55.9	129.9	165.7	33.2	0	0	0	0	111.3
577	S	26	Very low	27.8	Very low	111 Å²	111	156.8 Å²	156.8	78%	0.776	85%	0.853	S	S	*	*			trans	-149.5	90.2	150.3	55.3	0	0	0	0	109
578	I	29.8	Very low	27.8	Very low	246 Å²	246	158.5 Å²	158.5	100%	1.262	86%	0.855	S	S	*	*				-164.5	0	120.5	-83.7	158.4	0	0	0	106.1

Retrieved 578 of 578 residues in 106.1 ms (Link to these results)

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