A0A087YD69_POEFO Loading...

RAR related orphan receptor C

AlphaFold DB , UniProt , Accession A0A087YD69, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 496 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	33.1	Very low	30.7	Very low	247 Å²	247	167.3 Å²	167.3	100%	1.217	86%	0.861	S	S	*	*				0	148.7	0	-156.3	168.3	-75	0	0	106.7
2	E	31.1	Very low	30.7	Very low	166 Å²	166	166.8 Å²	166.8	78%	0.776	86%	0.861	S	S	*	*			trans	-88.1	150.9	-158.5	-69.1	161.6	119	0	0	114.8
3	Y	28.8	Very low	31	Very low	214 Å²	214	163.5 Å²	163.5	84%	0.839	85%	0.853	S	S	*	*			trans	53.8	168.7	159.2	-64.7	-66.1	0	0	0	117.3
4	E	31.1	Very low	31.1	Very low	192 Å²	192	160.8 Å²	160.8	90%	0.897	85%	0.85	S	S	*	*			cis	-124.7	176.1	9.8	-77.7	-177.3	129.7	0	0	113.9
5	E	29.5	Very low	31.1	Very low	181 Å²	181	166.3 Å²	166.3	85%	0.846	86%	0.855	S	S	*	*			trans	-98.2	159.8	-177.1	-171.6	165.9	-141.2	0	0	111.1
6	S	29.4	Very low	31.1	Very low	113 Å²	113	168.9 Å²	168.9	79%	0.79	86%	0.858	S	S	*	*			trans	-151.1	124.1	168.1	49.9	0	0	0	0	113.2
7	D	29.7	Very low	31.2	Very low	140 Å²	140	171 Å²	171	75%	0.749	86%	0.86	S	S	*	*			trans	-75.6	140.2	-176.9	-83.2	-61	0	0	0	113.9
8	F	30.3	Very low	31.7	Very low	203 Å²	203	166.1 Å²	166.1	89%	0.89	86%	0.86	S	S	*	*			trans	-140.4	118.4	155.3	-94.9	-82.8	0	0	0	111.4
9	L	31	Very low	31.5	Very low	163 Å²	163	160.9 Å²	160.9	85%	0.853	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-80.8	130.3	-177.5	-65.6	168.6	0	0	0	112.4
10	P	33.6	Very low	31.9	Very low	123 Å²	123	158.2 Å²	158.2	80%	0.799	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-85.9	152.6	163.5	34	-32.1	0	0	0	112
11	A	30.5	Very low	32.1	Very low	98 Å²	98	157 Å²	157	81%	0.81	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-79.7	167.2	-166.7	0	0	0	0	0	116.3
12	D	30.1	Very low	32.3	Very low	162 Å²	162	148.9 Å²	148.9	87%	0.866	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-49.4	138	-177.3	-94.6	-61.5	0	0	0	115.9
13	T	34.6	Very low	32.7	Very low	123 Å²	123	150.4 Å²	150.4	76%	0.755	82%	0.822	S	S	*	*			trans	-116.9	120.5	164.9	48.2	0	0	0	0	110.7	R15	T13-R15 PolarHBondContact O-N 2.6Å; T13-R15 VanDerWaalsContact O-N 3.08Å
14	P	32.9	Very low	33.2	Very low	126 Å²	126	148.5 Å²	148.5	82%	0.818	82%	0.818	S	S	*	*			trans	-63.7	111.6	-174.1	-27.1	35.9	0	0	0	114.5	K16	P14-K16 PolarHBondContact O-N 2.65Å
15	R	30.5	Very low	34	Very low	243 Å²	243	144 Å²	144	92%	0.917	80%	0.804	S	S	*	*			trans	-58.5	107.1	172.1	-78.2	179.5	166.9	-176.6	-4.4	111.4	T13 K17	T13-R15 PolarHBondContact O-N 2.6Å; T13-R15 VanDerWaalsContact O-N 3.08Å; R15-K17 PolarHBondContact O-N 2.66Å
16	K	31.9	Very low	35.2	Very low	209 Å²	209	138.9 Å²	138.9	91%	0.909	78%	0.78	S	S	*	*			trans	-65.6	99.7	169.4	-73.5	-178.3	178	173.7	0	110.7	P14 G18	P14-K16 PolarHBondContact O-N 2.65Å; K16-G18 PolarHBondContact O-N 2.91Å
17	K	33	Very low	36.3	Very low	204 Å²	204	139.1 Å²	139.1	89%	0.887	77%	0.771	S	S	*	*			trans	-61.3	128.9	168.2	-72.4	-177.2	177.4	177.6	0	109.7	R15 G19	R15-K17 PolarHBondContact O-N 2.66Å; K17-G19 PolarHBondContact O-N 2.99Å
18	G	39.9	Very low	37.4	Very low	83 Å²	83	136.7 Å²	136.7	86%	0.856	76%	0.761	S	S	*	*			trans	-74.3	110.9	-179.1	0	0	0	0	0	112.6	K16	K16-G18 PolarHBondContact O-N 2.91Å
19	G	28.4	Very low	38.8	Very low	67 Å²	67	131.5 Å²	131.5	69%	0.691	74%	0.74	S	S	*	*			trans	-84.6	122	168.4	0	0	0	0	0	111.5	K17 V21	K17-G19 PolarHBondContact O-N 2.99Å; G19-V21 PolarHBondContact O-N 3.06Å
20	A	38.2	Very low	40.3	Very low	106 Å²	106	124.2 Å²	124.2	88%	0.876	70%	0.702	S	S	*	*			trans	-75.4	86.1	178.1	0	0	0	0	0	111.6	S22	A20-S22 PolarHBondContact O-N 3.11Å
21	V	36.6	Very low	41.8	Very low	135 Å²	135	122.5 Å²	122.5	82%	0.818	68%	0.683	S	S	*	*			trans	-61.5	120.2	178.5	-178.9	0	0	0	0	110.6	G19 K23	G19-V21 PolarHBondContact O-N 3.06Å; V21-K23 PolarHBondContact O-N 2.94Å
22	S	36.4	Very low	43.9	Very low	75 Å²	75	120.2 Å²	120.2	52%	0.524	66%	0.659	S	S	.	*			trans	-67.5	112.9	-172.7	-174.6	0	0	0	0	112.4	A20 K24	A20-S22 PolarHBondContact O-N 3.11Å; S22-K24 PolarHBondContact O-N 2.83Å
23	K	39.5	Very low	46.5	Very low	199 Å²	199	112.6 Å²	112.6	87%	0.865	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	2.6	-179.2	-64.4	-179.7	-179.3	172.2	0	114.9	V21	V21-K23 PolarHBondContact O-N 2.94Å
24	K	40.6	Very low	49.2	Very low	173 Å²	173	109.5 Å²	109.5	75%	0.752	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-21	-172.8	-81	-172.7	172.9	-178	0	115.3	S22 H26	S22-K24 PolarHBondContact O-N 2.83Å; K24-H26 PolarHBondContact O-N 3.32Å
25	T	47.4	Very low	52.1	Low	99 Å²	99	103.6 Å²	103.6	61%	0.607	56%	0.562	S	S	*	*	H	α-helix	trans	-72.1	-24.2	-169.9	49.5	0	0	0	0	115.3	T28	T25-T28 PolarHBondContact O-OG1 3.34Å
26	H	53.8	Low	55.2	Low	73 Å²	73	96 Å²	96	34%	0.338	54%	0.535	S	S	.	.	H	α-helix	trans	-86.3	-10	-169.5	-144.1	-35.2	0	0	0	114.4	K24	K24-H26 PolarHBondContact O-N 3.32Å
27	L	52.8	Low	58.3	Low	117 Å²	117	86 Å²	86	61%	0.613	49%	0.492	S	S	*	.	H	α-helix	trans	-86.9	-42.9	179.3	-75.3	167.3	0	0	0	112.3	Q29 I30	L27-Q29 PolarHBondContact O-N 3.26Å; L27-I30 PolarHBondContact O-N 3.14Å; L27-I30 VanDerWaalsContact O-N 3.16Å
28	T	53.2	Low	61.2	Low	89 Å²	89	76.5 Å²	76.5	55%	0.546	45%	0.451	S	S	.	.	H	α-helix	trans	-64.2	-24.4	-176.7	50.8	0	0	0	0	113.3	T25 I30	T25-T28 PolarHBondContact O-OG1 3.34Å; T28-I30 VanDerWaalsContact C-N 3.33Å; T28-I30 PolarHBondContact O-N 3.25Å
29	Q	60.7	Low	63.8	Low	94 Å²	94	75 Å²	75	44%	0.439	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-24	177.3	-67.3	177.6	-22.7	0	0	113.7	L27 V122	L27-Q29 PolarHBondContact O-N 3.26Å; Q29-V122 WeakPolarHBondContact O-CG2 3.32Å
30	I	62.1	Low	66.9	Low	11 Å²	11	73 Å²	73	6%	0.056	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-78.3	-25.8	-176.5	-52.5	175.4	0	0	0	111.1	L27 T28 V32 I33 S42 I50 L118	L27-I30 PolarHBondContact O-N 3.14Å; L27-I30 VanDerWaalsContact O-N 3.16Å; T28-I30 VanDerWaalsContact C-N 3.33Å; T28-I30 PolarHBondContact O-N 3.25Å; I30-V32 PolarHBondContact O-N 2.71Å; I30-I33 PolarHBondContact O-N 3.35Å; I30-S42 PolarHBondContact O-OG 3.17Å; I30-I50 HydrophobicContact CG2-CG2 3.96Å; I30-L118 HydrophobicContact CD1-CD2 4.3Å; I30-L118 HydrophobicContact CG1-CD2 4.35Å
31	E	65.6	Low	69.5	Low	87 Å²	87	73.9 Å²	73.9	41%	0.407	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-59.9	-19.3	-177.9	-64	-167.8	-175.5	0	0	114.5	I33 K41	E31-I33 VanDerWaalsContact C-N 3.34Å; E31-K41 WeakPolarHBondContact OE2-CE 3.18Å; E31-K41 IonicContact OE2-NZ 2.78Å; E31-K41 PolarHBondContact OE2-NZ 3.45Å
32	V	73.2	Confident	72.1	Confident	49 Å²	49	67.7 Å²	67.7	30%	0.297	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-69.9	-29.9	175.4	-175.4	0	0	0	0	111.7	I30 H125	I30-V32 PolarHBondContact O-N 2.71Å; V32-H125 HydrophobicContact CG1-CB 4.35Å
33	I	84.4	Confident	74.7	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.015	35%	0.346	C	S	.	.	S	Bend	trans	-89.2	125.6	-178.5	-58.4	176.6	0	0	0	109.7	I30 E31 S42 I50 L118 E121 V122	I30-I33 PolarHBondContact O-N 3.35Å; E31-I33 VanDerWaalsContact C-N 3.34Å; I33-S42 WeakPolarHBondContact O-CB 3.5Å; I33-S42 PolarHBondContact O-OG 3.3Å; I33-I50 HydrophobicContact CB-CD1 4.38Å; I33-I50 HydrophobicContact CB-CG2 4.18Å; I33-I50 HydrophobicContact CD1-CD1 3.81Å; I33-I50 HydrophobicContact CG2-CD1 3.84Å; I33-I50 HydrophobicContact CG2-CG2 3.97Å; I33-L118 HydrophobicContact CD1-CD1 3.9Å; I33-E121 HydrophobicContact CD1-CB 4.2Å; I33-E121 HydrophobicContact CD1-CG 4.11Å; I33-V122 HydrophobicContact CD1-CB 4.42Å; I33-V122 HydrophobicContact CD1-CG2 3.54Å; I33-V122 HydrophobicContact CG1-CG2 4.05Å
34	P	91.3	Very high	76.9	Confident	58 Å²	58	57 Å²	57	38%	0.377	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-69	153.5	177.5	28.3	-34.8	0	0	0	112.5	K36 G39	P34-K36 PolarHBondContact O-N 2.81Å; P34-K36 VanDerWaalsContact O-N 3.15Å; P34-G39 WeakPolarHBondContact CB-O 3.31Å
35	C	95.1	Very high	79.1	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.014	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-61.5	116.5	177.9	171.3	0	0	0	0	111.4	I37 C38 G39 D40 T51 C52	C35-I37 PolarHBondContact O-N 3.13Å; C35-C38 PolarHBondContact O-N 3.44Å; C35-G39 PolarHBondContact O-N 2.93Å; C35-D40 WeakPolarHBondContact CB-O 3.4Å; C35-D40 PolarHBondContact N-O 3.43Å; C35-T51 VanDerWaalsContact SG-CA 3.59Å; C35-C52 HydrophobicContact CB-CB 4.08Å; C35-C52 PolarHBondContact SG-N 2.64Å
36	K	94.4	Very high	81.1	Confident	82 Å²	82	47.8 Å²	47.8	36%	0.357	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-14.2	-176.7	-60.9	-160.5	174.2	-167.9	0	114.9	P34 V49 I50 E121	P34-K36 PolarHBondContact O-N 2.81Å; P34-K36 VanDerWaalsContact O-N 3.15Å; K36-V49 HydrophobicContact CB-CG1 4.22Å; K36-I50 PolarHBondContact N-O 3.44Å; K36-E121 WeakPolarHBondContact CE-OE1 3.23Å; K36-E121 IonicContact NZ-OE1 2.84Å; K36-E121 PolarHBondContact NZ-OE1 3.42Å
37	I	96.9	Very high	82.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-39.2	174.7	-46.9	-48.4	0	0	0	112.5	C35 T51 C55 I79 R91 K94 Q98 M100	C35-I37 PolarHBondContact O-N 3.13Å; I37-T51 HydrophobicContact CD1-CG2 4.48Å; I37-T51 HydrophobicContact CG1-CG2 3.76Å; I37-C55 HydrophobicContact CB-CB 4.3Å; I37-C55 HydrophobicContact CG1-CB 4.32Å; I37-I79 HydrophobicContact CG2-CG2 4.27Å; I37-I79 VanDerWaalsContact O-CG2 3.31Å; I37-I79 WeakPolarHBondContact O-CG2 3.45Å; I37-R91 HydrophobicContact CG2-CG 4.36Å; I37-K94 HydrophobicContact CG2-CB 4.49Å; I37-K94 HydrophobicContact CG2-CD 4.45Å; I37-K94 HydrophobicContact CG2-CG 4.41Å; I37-K94 VanDerWaalsContact O-CD 3.29Å; I37-K94 WeakPolarHBondContact O-CD 3.14Å; I37-K94 WeakPolarHBondContact O-CE 3.24Å; I37-K94 PolarHBondContact O-NZ 3.13Å; I37-Q98 HydrophobicContact CD1-CB 3.66Å; I37-Q98 HydrophobicContact CD1-CG 3.83Å; I37-M100 HydrophobicContact CD1-SD 4.1Å; I37-M100 HydrophobicContact CG1-SD 4.05Å
38	C	95.4	Very high	84.4	Confident	4 Å²	4	43.1 Å²	43.1	3%	0.027	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-146.8	9	-166.1	70.4	0	0	0	0	116.6	C35 D40 I79 D80 R81 R84	C35-C38 PolarHBondContact O-N 3.44Å; C38-D40 PolarHBondContact O-N 3.32Å; C38-I79 HydrophobicContact CB-CG2 4.11Å; C38-D80 CarbonylContact O-C 3.52Å; C38-D80 VanDerWaalsContact O-C 3.24Å; C38-D80 WeakPolarHBondContact O-CA 3.3Å; C38-R81 PolarHBondContact O-N 3.12Å; C38-R84 HydrophobicContact CB-CB 4.19Å; C38-R84 PolarHBondContact SG-NH1 3.37Å
39	G	93.3	Very high	86.1	Confident	52 Å²	52	39.3 Å²	39.3	54%	0.536	23%	0.226	S	C	.	.	S	Bend	trans	73.6	-17.3	177.9	0	0	0	0	0	116.2	P34 C35	P34-G39 WeakPolarHBondContact CB-O 3.31Å; C35-G39 PolarHBondContact O-N 2.93Å
40	D	94.3	Very high	87.6	Confident	24 Å²	24	35.5 Å²	35.5	13%	0.128	21%	0.208	C	C	.	.	S	Bend	trans	-61.2	154.8	177.6	-162.5	23.6	0	0	0	112.7	C35 C38 S42 C52 R81 R84	C35-D40 WeakPolarHBondContact CB-O 3.4Å; C35-D40 PolarHBondContact N-O 3.43Å; C38-D40 PolarHBondContact O-N 3.32Å; D40-S42 PolarHBondContact O-N 2.96Å; D40-C52 HydrophobicContact CB-CB 4.43Å; D40-R81 HydrophobicContact CB-CB 4.42Å; D40-R81 HydrophobicContact CB-CG 3.99Å; D40-R81 WeakPolarHBondContact OD1-CD 3.42Å; D40-R81 IonicContact OD1-CZ 3.69Å; D40-R81 IonicContact OD1-NE 3.92Å; D40-R81 PolarHBondContact OD1-NE 2.93Å; D40-R81 IonicContact OD1-NH2 3.68Å; D40-R84 IonicContact OD2-CZ 2.64Å; D40-R84 IonicContact OD2-NH1 2.67Å; D40-R84 PolarHBondContact OD2-NH1 2.95Å; D40-R84 IonicContact OD2-NH2 2.73Å; D40-R84 PolarHBondContact OD2-NH2 3.43Å
41	K	92.4	Very high	89.1	Confident	126 Å²	126	35 Å²	35	55%	0.548	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-54.2	126.3	-176.6	-173.5	179.3	179.5	-176.8	0	111	E31 C52	E31-K41 WeakPolarHBondContact OE2-CE 3.18Å; E31-K41 IonicContact OE2-NZ 2.78Å; E31-K41 PolarHBondContact OE2-NZ 3.45Å; K41-C52 WeakPolarHBondContact O-CB 3.26Å
42	S	92.2	Very high	90.6	Very high	4 Å²	4	31 Å²	31	3%	0.028	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-77.4	159.1	-179.2	79.9	0	0	0	0	112.2	I30 I33 D40	I30-S42 PolarHBondContact O-OG 3.17Å; I33-S42 WeakPolarHBondContact O-CB 3.5Å; I33-S42 PolarHBondContact O-OG 3.3Å; D40-S42 PolarHBondContact O-N 2.96Å
43	S	89.8	Confident	91.6	Very high	46 Å²	46	33.4 Å²	33.4	32%	0.322	20%	0.195	S	C	.	.			trans	-124.1	15.4	179.1	59.5	0	0	0	0	112.6	H46 T51 E53	S43-H46 PolarHBondContact O-NE2 3.3Å; S43-H46 PolarHBondContact OG-NE2 3.44Å; S43-T51 PolarHBondContact N-O 3.42Å; S43-T51 PolarHBondContact OG-O 2.97Å; S43-E53 WeakPolarHBondContact CB-OE1 3.26Å; S43-E53 WeakPolarHBondContact OG-CG 3.48Å; S43-E53 PolarHBondContact OG-N 3.19Å; S43-E53 PolarHBondContact OG-OE1 2.78Å
44	G	86.3	Confident	92.2	Very high	4 Å²	4	34.9 Å²	34.9	4%	0.041	21%	0.211	C	C	.	.	S	Bend	trans	127.4	-173.9	-175.7	0	0	0	0	0	114.2	H46 I50 T51	G44-H46 PolarHBondContact O-CD2 3.17Å; G44-I50 WeakPolarHBondContact O-CA 3.45Å; G44-T51 PolarHBondContact O-N 3.37Å
45	V	86.4	Confident	92.5	Very high	50 Å²	50	32.1 Å²	32.1	30%	0.303	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	115.1	172.3	-179.4	0	0	0	0	108.7	I50 M110 L118	V45-I50 HydrophobicContact CG2-CG1 4Å; V45-M110 HydrophobicContact CB-SD 4.33Å; V45-M110 HydrophobicContact CG1-SD 4.49Å; V45-M110 HydrophobicContact CG2-SD 3.93Å; V45-L118 HydrophobicContact CG2-CD2 4.35Å
46	H	89.7	Confident	92.5	Very high	29 Å²	29	34.7 Å²	34.7	13%	0.134	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	134.3	178.3	-50	-76.5	0	0	0	109.4	S43 G44 G48 V49 T51 E53 K56	S43-H46 PolarHBondContact O-NE2 3.3Å; S43-H46 PolarHBondContact OG-NE2 3.44Å; G44-H46 PolarHBondContact O-CD2 3.17Å; H46-G48 PolarHBondContact O-N 3.06Å; H46-G48 VanDerWaalsContact O-N 3.09Å; H46-V49 PolarHBondContact N-O 3.13Å; H46-V49 PolarHBondContact O-N 3.45Å; H46-V49 VanDerWaalsContact O-O 3.09Å; H46-T51 PolarHBondContact CD2-O 2.77Å; H46-T51 PolarHBondContact CD2-OG1 2.79Å; H46-E53 IonicContact CE1-OE1 3.9Å; H46-E53 PolarHBondContact CE1-OE1 2.91Å; H46-E53 IonicContact NE2-OE1 3.84Å; H46-E53 PolarHBondContact NE2-OE1 3.04Å; H46-K56 HydrophobicContact CB-CB 3.99Å; H46-K56 HydrophobicContact CB-CD 4.31Å; H46-K56 HydrophobicContact CB-CG 3.83Å; H46-K56 PolarHBondContact CE1-NZ 2.79Å; H46-K56 WeakPolarHBondContact ND1-CD 3.22Å; H46-K56 WeakPolarHBondContact ND1-CE 3.19Å
47	Y	89.3	Confident	92.5	Very high	45 Å²	45	31.4 Å²	31.4	18%	0.176	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	27.5	-177.3	-57.1	-77.5	0	0	0	113.9	K56 F59 R60 M100 S101 V105	Y47-K56 HydrophobicContact CE2-CG 4.15Å; Y47-F59 AromaticContact CD1-CD1 3.97Å; Y47-F59 HydrophobicContact CD1-CD1 3.97Å; Y47-F59 AromaticContact CD1-CE1 3.88Å; Y47-F59 HydrophobicContact CD1-CE1 3.88Å; Y47-F59 AromaticContact CD2-CD1 3.66Å; Y47-F59 HydrophobicContact CD2-CD1 3.66Å; Y47-F59 HydrophobicContact CD2-CE1 4.31Å; Y47-F59 HydrophobicContact CE1-CD1 4.38Å; Y47-F59 HydrophobicContact CE2-CD1 4.09Å; Y47-F59 AromaticContact CG-CD1 3.6Å; Y47-F59 HydrophobicContact CG-CD1 3.6Å; Y47-F59 AromaticContact CG-CE1 3.77Å; Y47-F59 HydrophobicContact CG-CE1 3.77Å; Y47-R60 HydrophobicContact CE2-CB 4.42Å; Y47-R60 WeakPolarHBondContact OH-CB 3.31Å; Y47-R60 WeakPolarHBondContact OH-CG 3.38Å; Y47-M100 HydrophobicContact CD2-CE 3.79Å; Y47-M100 HydrophobicContact CG-CE 4.26Å; Y47-M100 WeakPolarHBondContact O-CA 3.41Å; Y47-S101 WeakPolarHBondContact CB-O 3.47Å; Y47-S101 PolarHBondContact O-N 3.4Å; Y47-V105 HydrophobicContact CD1-CG2 3.52Å; Y47-V105 HydrophobicContact CE1-CG2 3.71Å; Y47-V105 HydrophobicContact CG-CG2 4.4Å
48	G	85.8	Confident	92.6	Very high	46 Å²	46	31.9 Å²	31.9	47%	0.474	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.9	-9.4	-177.7	0	0	0	0	0	115.8	H46	H46-G48 PolarHBondContact O-N 3.06Å; H46-G48 VanDerWaalsContact O-N 3.09Å
49	V	89.9	Confident	92.6	Very high	10 Å²	10	31.7 Å²	31.7	6%	0.061	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.8	-171.2	-171.5	0	0	0	0	112.4	K36 H46 T51 Q98 M100	K36-V49 HydrophobicContact CB-CG1 4.22Å; H46-V49 PolarHBondContact N-O 3.13Å; H46-V49 PolarHBondContact O-N 3.45Å; H46-V49 VanDerWaalsContact O-O 3.09Å; V49-T51 HydrophobicContact CB-CG2 4.15Å; V49-T51 HydrophobicContact CG1-CG2 4.02Å; V49-T51 PolarHBondContact O-N 3.15Å; V49-T51 VanDerWaalsContact O-N 3.1Å; V49-T51 PolarHBondContact O-OG1 2.84Å; V49-Q98 HydrophobicContact CG1-CB 4.45Å; V49-Q98 WeakPolarHBondContact CG2-O 3.46Å; V49-M100 HydrophobicContact CB-CG 3.8Å; V49-M100 HydrophobicContact CG2-CB 4.32Å; V49-M100 HydrophobicContact CG2-CG 3.53Å
50	I	91.3	Very high	92.6	Very high	13 Å²	13	36.9 Å²	36.9	7%	0.067	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	109.6	173.8	-54.8	168.2	0	0	0	109.3	I30 I33 K36 G44 V45 L118	I30-I50 HydrophobicContact CG2-CG2 3.96Å; I33-I50 HydrophobicContact CB-CD1 4.38Å; I33-I50 HydrophobicContact CB-CG2 4.18Å; I33-I50 HydrophobicContact CD1-CD1 3.81Å; I33-I50 HydrophobicContact CG2-CD1 3.84Å; I33-I50 HydrophobicContact CG2-CG2 3.97Å; K36-I50 PolarHBondContact N-O 3.44Å; G44-I50 WeakPolarHBondContact O-CA 3.45Å; V45-I50 HydrophobicContact CG2-CG1 4Å; I50-L118 HydrophobicContact CD1-CD1 3.46Å; I50-L118 VanDerWaalsContact CD1-CD1 3.46Å; I50-L118 HydrophobicContact CG1-CD1 4.09Å
51	T	94.6	Very high	92.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.217	C	C	.	.			trans	-144.6	161.1	-172.2	51.8	0	0	0	0	113.2	C35 I37 S43 G44 H46 V49 M100	C35-T51 VanDerWaalsContact SG-CA 3.59Å; I37-T51 HydrophobicContact CD1-CG2 4.48Å; I37-T51 HydrophobicContact CG1-CG2 3.76Å; S43-T51 PolarHBondContact N-O 3.42Å; S43-T51 PolarHBondContact OG-O 2.97Å; G44-T51 PolarHBondContact O-N 3.37Å; H46-T51 PolarHBondContact CD2-O 2.77Å; H46-T51 PolarHBondContact CD2-OG1 2.79Å; V49-T51 HydrophobicContact CB-CG2 4.15Å; V49-T51 HydrophobicContact CG1-CG2 4.02Å; V49-T51 PolarHBondContact O-N 3.15Å; V49-T51 VanDerWaalsContact O-N 3.1Å; V49-T51 PolarHBondContact O-OG1 2.84Å; T51-M100 HydrophobicContact CG2-CE 4.21Å; T51-M100 HydrophobicContact CG2-SD 4Å
52	C	95.9	Very high	92.7	Very high	4 Å²	4	36.7 Å²	36.7	3%	0.027	19%	0.193	C	C	.	.			trans	-86.3	158.5	170.9	69.8	0	0	0	0	111.2	C35 D40 K41 G54 C55 K56 R84	C35-C52 HydrophobicContact CB-CB 4.08Å; C35-C52 PolarHBondContact SG-N 2.64Å; D40-C52 HydrophobicContact CB-CB 4.43Å; K41-C52 WeakPolarHBondContact O-CB 3.26Å; C52-G54 PolarHBondContact O-N 3.46Å; C52-G54 VanDerWaalsContact O-N 3.09Å; C52-C55 PolarHBondContact O-N 2.97Å; C52-K56 PolarHBondContact O-N 3.25Å; C52-R84 PolarHBondContact SG-NH1 3.41Å; C52-R84 VanDerWaalsContact SG-NH1 3.44Å
53	E	95.4	Very high	92.3	Very high	99 Å²	99	39.4 Å²	39.4	46%	0.463	21%	0.205	S	C	.	.	H	α-helix	trans	-51	-35.7	175.8	-67.8	-56.9	115.5	0	0	112.8	S43 H46 C55 K56 G57	S43-E53 WeakPolarHBondContact CB-OE1 3.26Å; S43-E53 WeakPolarHBondContact OG-CG 3.48Å; S43-E53 PolarHBondContact OG-N 3.19Å; S43-E53 PolarHBondContact OG-OE1 2.78Å; H46-E53 IonicContact CE1-OE1 3.9Å; H46-E53 PolarHBondContact CE1-OE1 2.91Å; H46-E53 IonicContact NE2-OE1 3.84Å; H46-E53 PolarHBondContact NE2-OE1 3.04Å; E53-C55 VanDerWaalsContact C-N 3.35Å; E53-C55 PolarHBondContact O-N 3.37Å; E53-K56 WeakPolarHBondContact OE1-CD 3.39Å; E53-K56 IonicContact OE1-NZ 3.52Å; E53-K56 PolarHBondContact OE1-NZ 2.83Å; E53-K56 VanDerWaalsContact OE2-CD 3.25Å; E53-K56 WeakPolarHBondContact OE2-CD 3.29Å; E53-K56 WeakPolarHBondContact OE2-CE 3.43Å; E53-K56 IonicContact OE2-NZ 3.52Å; E53-K56 PolarHBondContact OE2-NZ 3.32Å; E53-G57 PolarHBondContact O-N 3.18Å
54	G	96.2	Very high	92	Very high	34 Å²	34	41.8 Å²	41.8	35%	0.351	21%	0.214	S	C	.	.	H	α-helix	trans	-64.4	-32.6	177.8	0	0	0	0	0	114.3	C52 F58 R91	C52-G54 PolarHBondContact O-N 3.46Å; C52-G54 VanDerWaalsContact O-N 3.09Å; G54-F58 VanDerWaalsContact O-CB 3.27Å; G54-F58 WeakPolarHBondContact O-CB 3.48Å; G54-F58 PolarHBondContact O-N 3.34Å; G54-R91 PolarHBondContact O-NH2 2.94Å; G54-R91 VanDerWaalsContact O-NH2 3.07Å
55	C	97.3	Very high	91.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-90	-36	177.2	-73.6	0	0	0	0	112.5	I37 C52 E53 F58 F59 R91	I37-C55 HydrophobicContact CB-CB 4.3Å; I37-C55 HydrophobicContact CG1-CB 4.32Å; C52-C55 PolarHBondContact O-N 2.97Å; E53-C55 VanDerWaalsContact C-N 3.35Å; E53-C55 PolarHBondContact O-N 3.37Å; C55-F58 PolarHBondContact O-N 2.84Å; C55-F59 WeakPolarHBondContact O-CB 3.24Å; C55-F59 PolarHBondContact O-N 2.9Å; C55-R91 PolarHBondContact SG-NH2 3.1Å
56	K	95.5	Very high	91.2	Very high	56 Å²	56	50.5 Å²	50.5	24%	0.243	27%	0.269	C	S	.	.	H	α-helix	trans	-53.8	-53.2	166.4	170.4	-159.9	-167.6	-179.6	0	111.8	H46 Y47 C52 E53 F59 R60	H46-K56 HydrophobicContact CB-CB 3.99Å; H46-K56 HydrophobicContact CB-CD 4.31Å; H46-K56 HydrophobicContact CB-CG 3.83Å; H46-K56 PolarHBondContact CE1-NZ 2.79Å; H46-K56 WeakPolarHBondContact ND1-CD 3.22Å; H46-K56 WeakPolarHBondContact ND1-CE 3.19Å; Y47-K56 HydrophobicContact CE2-CG 4.15Å; C52-K56 PolarHBondContact O-N 3.25Å; E53-K56 WeakPolarHBondContact OE1-CD 3.39Å; E53-K56 IonicContact OE1-NZ 3.52Å; E53-K56 PolarHBondContact OE1-NZ 2.83Å; E53-K56 VanDerWaalsContact OE2-CD 3.25Å; E53-K56 WeakPolarHBondContact OE2-CD 3.29Å; E53-K56 WeakPolarHBondContact OE2-CE 3.43Å; E53-K56 IonicContact OE2-NZ 3.52Å; E53-K56 PolarHBondContact OE2-NZ 3.32Å; K56-F59 PolarHBondContact O-N 2.81Å; K56-R60 WeakPolarHBondContact O-CB 3.43Å; K56-R60 PolarHBondContact O-N 3.4Å
57	G	95.4	Very high	90.9	Very high	14 Å²	14	51.4 Å²	51.4	14%	0.144	28%	0.276	C	S	.	.	H	α-helix	trans	-70.1	-31	-178.9	0	0	0	0	0	113.6	E53 R61	E53-G57 PolarHBondContact O-N 3.18Å; G57-R61 VanDerWaalsContact O-CZ 3.28Å; G57-R61 PolarHBondContact O-NH1 3.04Å
58	F	97.4	Very high	90.8	Very high	10 Å²	10	54.8 Å²	54.8	4%	0.044	31%	0.306	C	S	.	.	H	α-helix	trans	-63.5	-60.3	168.2	171.4	-98	0	0	0	110.5	G54 C55 R60 R61 S62 Y69 Q88 R91 L92	G54-F58 VanDerWaalsContact O-CB 3.27Å; G54-F58 WeakPolarHBondContact O-CB 3.48Å; G54-F58 PolarHBondContact O-N 3.34Å; C55-F58 PolarHBondContact O-N 2.84Å; F58-R60 VanDerWaalsContact C-N 3.27Å; F58-R60 PolarHBondContact O-N 3.47Å; F58-R61 PolarHBondContact O-N 3.32Å; F58-S62 WeakPolarHBondContact CE2-OG 3.25Å; F58-S62 VanDerWaalsContact CZ-OG 3.3Å; F58-S62 WeakPolarHBondContact CZ-OG 3.46Å; F58-S62 PolarHBondContact O-N 3.49Å; F58-S62 PolarHBondContact O-OG 3.23Å; F58-Y69 AromaticContact CE2-CE2 3.82Å; F58-Y69 HydrophobicContact CE2-CE2 3.82Å; F58-Y69 AromaticContact CE2-CZ 3.97Å; F58-Y69 HydrophobicContact CZ-CD2 4.36Å; F58-Y69 AromaticContact CZ-CE2 3.59Å; F58-Y69 HydrophobicContact CZ-CE2 3.59Å; F58-Q88 HydrophobicContact CE2-CB 4.1Å; F58-Q88 HydrophobicContact CE2-CG 4.19Å; F58-Q88 HydrophobicContact CZ-CB 4.31Å; F58-Q88 WeakPolarHBondContact CZ-O 3.44Å; F58-R91 HydrophobicContact CD1-CG 3.93Å; F58-R91 HydrophobicContact CE1-CB 3.92Å; F58-R91 HydrophobicContact CE1-CG 3.68Å; F58-R91 HydrophobicContact CZ-CB 3.99Å; F58-R91 HydrophobicContact CZ-CG 4.13Å; F58-L92 HydrophobicContact CE1-CB 4Å; F58-L92 HydrophobicContact CE1-CD1 4.44Å; F58-L92 HydrophobicContact CZ-CB 4.11Å
59	F	96.2	Very high	91.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-53.3	-43	-177.7	-174.1	-102.7	0	0	0	112.2	Y47 C55 K56 R61 S62 Q63 L92 C95 L96 M100	Y47-F59 AromaticContact CD1-CD1 3.97Å; Y47-F59 HydrophobicContact CD1-CD1 3.97Å; Y47-F59 AromaticContact CD1-CE1 3.88Å; Y47-F59 HydrophobicContact CD1-CE1 3.88Å; Y47-F59 AromaticContact CD2-CD1 3.66Å; Y47-F59 HydrophobicContact CD2-CD1 3.66Å; Y47-F59 HydrophobicContact CD2-CE1 4.31Å; Y47-F59 HydrophobicContact CE1-CD1 4.38Å; Y47-F59 HydrophobicContact CE2-CD1 4.09Å; Y47-F59 AromaticContact CG-CD1 3.6Å; Y47-F59 HydrophobicContact CG-CD1 3.6Å; Y47-F59 AromaticContact CG-CE1 3.77Å; Y47-F59 HydrophobicContact CG-CE1 3.77Å; C55-F59 WeakPolarHBondContact O-CB 3.24Å; C55-F59 PolarHBondContact O-N 2.9Å; K56-F59 PolarHBondContact O-N 2.81Å; F59-R61 VanDerWaalsContact C-N 3.28Å; F59-R61 PolarHBondContact O-N 3.09Å; F59-S62 CarbonylContact O-C 3.54Å; F59-S62 PolarHBondContact O-N 3.06Å; F59-Q63 HydrophobicContact CD1-CG 4.13Å; F59-Q63 HydrophobicContact CD2-CG 4.34Å; F59-Q63 HydrophobicContact CE1-CG 3.85Å; F59-Q63 HydrophobicContact CE2-CG 4.07Å; F59-Q63 HydrophobicContact CG-CG 4.37Å; F59-Q63 HydrophobicContact CZ-CG 3.82Å; F59-Q63 WeakPolarHBondContact O-CG 3.5Å; F59-Q63 PolarHBondContact O-N 3.49Å; F59-L92 HydrophobicContact CD2-CD1 4.01Å; F59-L92 HydrophobicContact CE2-CD1 4.25Å; F59-C95 HydrophobicContact CD2-CB 3.62Å; F59-C95 HydrophobicContact CE2-CB 4.09Å; F59-L96 HydrophobicContact CE2-CD2 3.87Å; F59-L96 HydrophobicContact CE2-CG 4.41Å; F59-L96 HydrophobicContact CZ-CD2 4.28Å; F59-M100 HydrophobicContact CB-CE 3.76Å; F59-M100 HydrophobicContact CB-SD 4.37Å; F59-M100 HydrophobicContact CD1-CB 4.3Å; F59-M100 HydrophobicContact CD1-CE 3.95Å; F59-M100 HydrophobicContact CD2-CB 4.04Å; F59-M100 HydrophobicContact CD2-CE 4.46Å; F59-M100 HydrophobicContact CD2-SD 4.36Å; F59-M100 HydrophobicContact CE1-CB 4.01Å; F59-M100 HydrophobicContact CE2-CB 3.74Å; F59-M100 HydrophobicContact CG-CB 4.31Å; F59-M100 HydrophobicContact CG-CE 3.8Å; F59-M100 HydrophobicContact CG-SD 4.27Å; F59-M100 HydrophobicContact CZ-CB 3.72Å; F59-M100 WeakPolarHBondContact CZ-O 3.45Å
60	R	94.1	Very high	91.1	Very high	161 Å²	161	59.1 Å²	59.1	61%	0.608	32%	0.324	S	S	*	.	H	α-helix	trans	-56	-37.4	175.9	-170.2	176.8	73.9	-176.4	3.9	113.9	Y47 K56 F58	Y47-R60 HydrophobicContact CE2-CB 4.42Å; Y47-R60 WeakPolarHBondContact OH-CB 3.31Å; Y47-R60 WeakPolarHBondContact OH-CG 3.38Å; K56-R60 WeakPolarHBondContact O-CB 3.43Å; K56-R60 PolarHBondContact O-N 3.4Å; F58-R60 VanDerWaalsContact C-N 3.27Å; F58-R60 PolarHBondContact O-N 3.47Å
61	R	94.1	Very high	91.2	Very high	140 Å²	140	59.7 Å²	59.7	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-80.2	-38.7	177.2	-67.7	-175	-62.7	-101	0.6	111.5	G57 F58 F59 Q63 L64	G57-R61 VanDerWaalsContact O-CZ 3.28Å; G57-R61 PolarHBondContact O-NH1 3.04Å; F58-R61 PolarHBondContact O-N 3.32Å; F59-R61 VanDerWaalsContact C-N 3.28Å; F59-R61 PolarHBondContact O-N 3.09Å; R61-Q63 PolarHBondContact O-N 3.38Å; R61-L64 WeakPolarHBondContact O-CG 3.45Å; R61-L64 PolarHBondContact O-N 2.79Å
62	S	93.1	Very high	91	Very high	5 Å²	5	65.3 Å²	65.3	4%	0.035	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	16.1	178.5	-46.9	0	0	0	0	114.6	F58 F59 Y69	F58-S62 WeakPolarHBondContact CE2-OG 3.25Å; F58-S62 VanDerWaalsContact CZ-OG 3.3Å; F58-S62 WeakPolarHBondContact CZ-OG 3.46Å; F58-S62 PolarHBondContact O-N 3.49Å; F58-S62 PolarHBondContact O-OG 3.23Å; F59-S62 CarbonylContact O-C 3.54Å; F59-S62 PolarHBondContact O-N 3.06Å; S62-Y69 VanDerWaalsContact OG-CE2 3.31Å; S62-Y69 WeakPolarHBondContact OG-CE2 3.5Å; S62-Y69 PolarHBondContact OG-OH 2.68Å
63	Q	85.1	Confident	90.7	Very high	62 Å²	62	74.1 Å²	74.1	29%	0.29	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	11.8	176.2	-69.6	-75.1	-81.4	0	0	111.3	F59 R61 R102	F59-Q63 HydrophobicContact CD1-CG 4.13Å; F59-Q63 HydrophobicContact CD2-CG 4.34Å; F59-Q63 HydrophobicContact CE1-CG 3.85Å; F59-Q63 HydrophobicContact CE2-CG 4.07Å; F59-Q63 HydrophobicContact CG-CG 4.37Å; F59-Q63 HydrophobicContact CZ-CG 3.82Å; F59-Q63 WeakPolarHBondContact O-CG 3.5Å; F59-Q63 PolarHBondContact O-N 3.49Å; R61-Q63 PolarHBondContact O-N 3.38Å; Q63-R102 HydrophobicContact CB-CG 4.5Å; Q63-R102 HydrophobicContact CG-CG 4.43Å
64	L	84	Confident	90.3	Very high	96 Å²	96	77.1 Å²	77.1	50%	0.503	42%	0.415	S	S	.	.	S	Bend	trans	-87.5	137.4	169.8	-65.1	172.6	0	0	0	109.3	R61 T66 V67	R61-L64 WeakPolarHBondContact O-CG 3.45Å; R61-L64 PolarHBondContact O-N 2.79Å; L64-T66 PolarHBondContact O-N 3.03Å; L64-V67 HydrophobicContact CB-CG2 4.06Å; L64-V67 PolarHBondContact O-N 3.32Å
65	P	74.5	Confident	89.9	Confident	107 Å²	107	78.6 Å²	78.6	70%	0.695	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.2	-177.1	-27	35.4	0	0	0	115.3	V67 L236	P65-V67 VanDerWaalsContact C-N 3.28Å; P65-V67 PolarHBondContact O-N 3.24Å; P65-L236 HydrophobicContact CB-CD2 4.37Å
66	T	79.9	Confident	89.7	Confident	130 Å²	130	83.3 Å²	83.3	80%	0.798	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-1.1	178.6	50	0	0	0	0	114.2	L64	L64-T66 PolarHBondContact O-N 3.03Å
67	V	83.9	Confident	89.6	Confident	47 Å²	47	82 Å²	82	29%	0.285	44%	0.442	S	S	.	.			trans	-113.7	98.8	-171.6	-178.4	0	0	0	0	111	L64 P65 Y69	L64-V67 HydrophobicContact CB-CG2 4.06Å; L64-V67 PolarHBondContact O-N 3.32Å; P65-V67 VanDerWaalsContact C-N 3.28Å; P65-V67 PolarHBondContact O-N 3.24Å; V67-Y69 HydrophobicContact CG1-CD1 4.3Å; V67-Y69 HydrophobicContact CG1-CE1 3.5Å; V67-Y69 VanDerWaalsContact CG1-CE1 3.5Å; V67-Y69 HydrophobicContact CG1-CE2 4.11Å; V67-Y69 WeakPolarHBondContact CG1-OH 3.28Å
68	S	86.7	Confident	89.5	Confident	117 Å²	117	88.8 Å²	88.8	82%	0.818	47%	0.471	S	S	*	.			trans	-108	147.5	168.8	-174	0	0	0	0	110.8
69	Y	93.6	Very high	89.5	Confident	39 Å²	39	88.7 Å²	88.7	15%	0.153	47%	0.47	C	S	.	.			trans	-131.1	131.4	175.9	-53.5	-48.8	0	0	0	110.4	F58 S62 V67 Q88 H89 L92	F58-Y69 AromaticContact CE2-CE2 3.82Å; F58-Y69 HydrophobicContact CE2-CE2 3.82Å; F58-Y69 AromaticContact CE2-CZ 3.97Å; F58-Y69 HydrophobicContact CZ-CD2 4.36Å; F58-Y69 AromaticContact CZ-CE2 3.59Å; F58-Y69 HydrophobicContact CZ-CE2 3.59Å; S62-Y69 VanDerWaalsContact OG-CE2 3.31Å; S62-Y69 WeakPolarHBondContact OG-CE2 3.5Å; S62-Y69 PolarHBondContact OG-OH 2.68Å; V67-Y69 HydrophobicContact CG1-CD1 4.3Å; V67-Y69 HydrophobicContact CG1-CE1 3.5Å; V67-Y69 VanDerWaalsContact CG1-CE1 3.5Å; V67-Y69 HydrophobicContact CG1-CE2 4.11Å; V67-Y69 WeakPolarHBondContact CG1-OH 3.28Å; Y69-Q88 HydrophobicContact CD1-CB 3.66Å; Y69-Q88 HydrophobicContact CD1-CG 4.45Å; Y69-Q88 HydrophobicContact CD2-CB 3.69Å; Y69-Q88 HydrophobicContact CE1-CB 3.83Å; Y69-Q88 HydrophobicContact CE1-CG 4.3Å; Y69-Q88 HydrophobicContact CE2-CB 3.84Å; Y69-Q88 HydrophobicContact CG-CB 3.59Å; Y69-H89 PolarHBondContact O-ND1 2.88Å; Y69-L92 HydrophobicContact CD2-CB 4.26Å; Y69-L92 HydrophobicContact CD2-CD2 3.97Å; Y69-L92 HydrophobicContact CE2-CB 4.44Å; Y69-L92 HydrophobicContact CE2-CD2 4.17Å
70	S	89.8	Confident	89.5	Confident	107 Å²	107	92.2 Å²	92.2	75%	0.748	49%	0.489	S	S	*	.			trans	-94.5	162.2	165.8	55.6	0	0	0	0	111.4	H89	S70-H89 WeakPolarHBondContact O-CB 3.45Å
71	C	93.8	Very high	89.4	Confident	26 Å²	26	92.8 Å²	92.8	18%	0.176	49%	0.491	C	S	.	.			trans	-104.3	132.4	164.5	-166.3	0	0	0	0	109	R73 S75 H89 C90	C71-R73 PolarHBondContact O-N 3.33Å; C71-R73 PolarHBondContact SG-N 2.68Å; C71-R73 VanDerWaalsContact SG-N 3.45Å; C71-R73 PolarHBondContact SG-O 3.11Å; C71-S75 WeakPolarHBondContact CB-OG 3.31Å; C71-H89 HydrophobicContact CB-CB 4.23Å; C71-C90 VanDerWaalsContact SG-SG 3.68Å
72	S	90.3	Very high	89.4	Confident	118 Å²	118	89.8 Å²	89.8	83%	0.825	50%	0.496	S	S	*	.	S	Bend	trans	-86.1	19.1	171	51.7	0	0	0	0	113
73	R	89.6	Confident	89.4	Confident	188 Å²	188	89.8 Å²	89.8	71%	0.709	50%	0.496	S	S	*	.	S	Bend	trans	-147.8	-172.3	-178.1	-58.5	-171.5	-178.5	-164.6	-3.5	108.7	C71 S75	C71-R73 PolarHBondContact O-N 3.33Å; C71-R73 PolarHBondContact SG-N 2.68Å; C71-R73 VanDerWaalsContact SG-N 3.45Å; C71-R73 PolarHBondContact SG-O 3.11Å; R73-S75 PolarHBondContact O-N 3.39Å
74	Q	86.6	Confident	89.8	Confident	163 Å²	163	88.7 Å²	88.7	76%	0.762	49%	0.49	S	S	*	.	S	Bend	trans	-71.4	29.8	-177.7	-59.8	167.4	-12.5	0	0	114.9	N76	Q74-N76 PolarHBondContact O-N 3.29Å; Q74-N76 PolarHBondContact OE1-ND2 3.42Å
75	S	87.9	Confident	90.3	Very high	65 Å²	65	89.9 Å²	89.9	46%	0.455	50%	0.496	S	S	.	.	S	Bend	trans	51.4	18.1	-178.3	-66.6	0	0	0	0	116.8	C71 R73 C90	C71-S75 WeakPolarHBondContact CB-OG 3.31Å; R73-S75 PolarHBondContact O-N 3.39Å; S75-C90 PolarHBondContact O-SG 3.39Å; S75-C90 VanDerWaalsContact O-SG 3.36Å
76	N	91.6	Very high	91.3	Very high	98 Å²	98	94.5 Å²	94.5	52%	0.524	50%	0.5	S	S	.	.			trans	-115.6	19.7	-173.7	61.2	0.8	0	0	0	113.2	Q74 Q78	Q74-N76 PolarHBondContact O-N 3.29Å; Q74-N76 PolarHBondContact OE1-ND2 3.42Å; N76-Q78 PolarHBondContact O-N 3.43Å
77	C	94.3	Very high	92	Very high	28 Å²	28	88.9 Å²	88.9	19%	0.189	47%	0.466	C	S	.	.			trans	-60.3	127.7	-176.9	-62.3	0	0	0	0	111.5	I79 C87 C90	C77-I79 WeakPolarHBondContact O-CG1 3.32Å; C77-C87 HydrophobicContact CB-CB 3.95Å; C77-C90 HydrophobicContact CB-CB 3.8Å; C77-C90 VanDerWaalsContact CB-SG 3.59Å; C77-C90 PolarHBondContact N-SG 2.93Å
78	Q	94.1	Very high	92.6	Very high	158 Å²	158	91.5 Å²	91.5	74%	0.738	48%	0.475	S	S	*	.			trans	-60.5	143.7	171.7	-67.8	-62.2	-14.2	0	0	111.5	N76 S83	N76-Q78 PolarHBondContact O-N 3.43Å; Q78-S83 PolarHBondContact O-OG 3.25Å; Q78-S83 VanDerWaalsContact O-OG 3.12Å
79	I	96.7	Very high	93.1	Very high	8 Å²	8	88 Å²	88	4%	0.041	45%	0.445	C	S	.	.			trans	-129.2	101.6	-175.5	-55.7	-63.3	0	0	0	109.1	I37 C38 C77 R84 C90 R91 K94	I37-I79 HydrophobicContact CG2-CG2 4.27Å; I37-I79 VanDerWaalsContact O-CG2 3.31Å; I37-I79 WeakPolarHBondContact O-CG2 3.45Å; C38-I79 HydrophobicContact CB-CG2 4.11Å; C77-I79 WeakPolarHBondContact O-CG1 3.32Å; I79-R84 HydrophobicContact CG2-CB 3.91Å; I79-C90 HydrophobicContact CD1-CB 4.13Å; I79-C90 HydrophobicContact CG1-CB 4.49Å; I79-R91 HydrophobicContact CD1-CB 4.02Å; I79-R91 HydrophobicContact CG2-CG 4.23Å; I79-K94 HydrophobicContact CB-CD 3.82Å; I79-K94 HydrophobicContact CG1-CD 4.17Å; I79-K94 HydrophobicContact CG2-CD 4.26Å; I79-K94 PolarHBondContact O-NZ 2.79Å
80	D	95.1	Very high	93.2	Very high	73 Å²	73	86.5 Å²	86.5	39%	0.39	44%	0.441	S	S	.	.			trans	-126.2	-176.9	176.1	66.4	67.2	0	0	0	110.8	C38 A82 S83 R84	C38-D80 CarbonylContact O-C 3.52Å; C38-D80 VanDerWaalsContact O-C 3.24Å; C38-D80 WeakPolarHBondContact O-CA 3.3Å; D80-A82 VanDerWaalsContact C-N 3.26Å; D80-A82 PolarHBondContact O-N 3.14Å; D80-A82 WeakPolarHBondContact OD1-CA 3.35Å; D80-A82 PolarHBondContact OD1-N 3.29Å; D80-S83 PolarHBondContact N-OG 3.02Å; D80-S83 PolarHBondContact O-N 2.9Å; D80-S83 PolarHBondContact OD1-N 3.12Å; D80-S83 PolarHBondContact OD1-OG 3.26Å; D80-S83 WeakPolarHBondContact OD2-CB 3.32Å; D80-S83 PolarHBondContact OD2-OG 3.12Å; D80-R84 WeakPolarHBondContact O-CB 3.44Å; D80-R84 VanDerWaalsContact O-CG 3.3Å; D80-R84 WeakPolarHBondContact O-CG 3.47Å; D80-R84 PolarHBondContact O-N 3.26Å
81	R	93.6	Very high	93.5	Very high	174 Å²	174	81.9 Å²	81.9	66%	0.657	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-35.3	-175.4	-172	175.9	-172.4	-140.8	-4.6	113.4	C38 D40 R84	C38-R81 PolarHBondContact O-N 3.12Å; D40-R81 HydrophobicContact CB-CB 4.42Å; D40-R81 HydrophobicContact CB-CG 3.99Å; D40-R81 WeakPolarHBondContact OD1-CD 3.42Å; D40-R81 IonicContact OD1-CZ 3.69Å; D40-R81 IonicContact OD1-NE 3.92Å; D40-R81 PolarHBondContact OD1-NE 2.93Å; D40-R81 IonicContact OD1-NH2 3.68Å; R81-R84 PolarHBondContact O-NE 2.98Å
82	A	92.8	Very high	93.7	Very high	77 Å²	77	81.8 Å²	81.8	64%	0.636	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-38.9	179.9	0	0	0	0	0	112.6	D80	D80-A82 VanDerWaalsContact C-N 3.26Å; D80-A82 PolarHBondContact O-N 3.14Å; D80-A82 WeakPolarHBondContact OD1-CA 3.35Å; D80-A82 PolarHBondContact OD1-N 3.29Å
83	S	93	Very high	93.9	Very high	4 Å²	4	80.7 Å²	80.7	3%	0.028	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-82.7	-18.3	-176.3	68.7	0	0	0	0	115	Q78 D80 N85 R86	Q78-S83 PolarHBondContact O-OG 3.25Å; Q78-S83 VanDerWaalsContact O-OG 3.12Å; D80-S83 PolarHBondContact N-OG 3.02Å; D80-S83 PolarHBondContact O-N 2.9Å; D80-S83 PolarHBondContact OD1-N 3.12Å; D80-S83 PolarHBondContact OD1-OG 3.26Å; D80-S83 WeakPolarHBondContact OD2-CB 3.32Å; D80-S83 PolarHBondContact OD2-OG 3.12Å; S83-N85 PolarHBondContact O-N 2.94Å; S83-R86 VanDerWaalsContact O-CB 3.26Å; S83-R86 WeakPolarHBondContact O-CB 3.18Å; S83-R86 WeakPolarHBondContact O-CG 3.13Å; S83-R86 PolarHBondContact O-N 3.22Å
84	R	94	Very high	94.2	Very high	40 Å²	40	74.9 Å²	74.9	15%	0.151	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-52.7	-17.7	-175.2	60.2	-172.6	178.2	177.4	-4.2	116.9	C38 D40 C52 I79 D80 R81 R91	C38-R84 HydrophobicContact CB-CB 4.19Å; C38-R84 PolarHBondContact SG-NH1 3.37Å; D40-R84 IonicContact OD2-CZ 2.64Å; D40-R84 IonicContact OD2-NH1 2.67Å; D40-R84 PolarHBondContact OD2-NH1 2.95Å; D40-R84 IonicContact OD2-NH2 2.73Å; D40-R84 PolarHBondContact OD2-NH2 3.43Å; C52-R84 PolarHBondContact SG-NH1 3.41Å; C52-R84 VanDerWaalsContact SG-NH1 3.44Å; I79-R84 HydrophobicContact CG2-CB 3.91Å; D80-R84 WeakPolarHBondContact O-CB 3.44Å; D80-R84 VanDerWaalsContact O-CG 3.3Å; D80-R84 WeakPolarHBondContact O-CG 3.47Å; D80-R84 PolarHBondContact O-N 3.26Å; R81-R84 PolarHBondContact O-NE 2.98Å; R84-R91 VanDerWaalsContact O-CD 3.31Å; R84-R91 WeakPolarHBondContact O-CD 3.42Å; R84-R91 PolarHBondContact O-NH1 3.46Å
85	N	94.5	Very high	94.7	Very high	120 Å²	120	67.1 Å²	67.1	64%	0.642	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-93	-12.9	176.2	-66.6	-11.1	0	0	0	113.2	S83 C87 R91	S83-N85 PolarHBondContact O-N 2.94Å; N85-C87 PolarHBondContact O-N 3.3Å; N85-R91 PolarHBondContact OD1-NH1 2.87Å
86	R	95	Very high	95	Very high	204 Å²	204	67.6 Å²	67.6	77%	0.77	33%	0.327	S	S	*	.	S	Bend	trans	-71.5	-26.6	-175	-62.3	177.6	-178.1	167.5	-2.5	114.2	S83	S83-R86 VanDerWaalsContact O-CB 3.26Å; S83-R86 WeakPolarHBondContact O-CB 3.18Å; S83-R86 WeakPolarHBondContact O-CG 3.13Å; S83-R86 PolarHBondContact O-N 3.22Å
87	C	96.1	Very high	95	Very high	12 Å²	12	66.9 Å²	66.9	8%	0.081	34%	0.335	C	S	.	.			trans	-146.6	108.2	175.4	-173.6	0	0	0	0	111.3	C77 N85 C90 R91	C77-C87 HydrophobicContact CB-CB 3.95Å; N85-C87 PolarHBondContact O-N 3.3Å; C87-C90 HydrophobicContact CB-CB 4.24Å; C87-R91 PolarHBondContact O-N 3.18Å
88	Q	96	Very high	95	Very high	102 Å²	102	69.8 Å²	69.8	48%	0.477	35%	0.346	S	S	.	.	H	α-helix	trans	-68.5	-38.4	-179.5	-64.6	171.4	-23.6	0	0	111.7	F58 Y69 R91 L92	F58-Q88 HydrophobicContact CE2-CB 4.1Å; F58-Q88 HydrophobicContact CE2-CG 4.19Å; F58-Q88 HydrophobicContact CZ-CB 4.31Å; F58-Q88 WeakPolarHBondContact CZ-O 3.44Å; Y69-Q88 HydrophobicContact CD1-CB 3.66Å; Y69-Q88 HydrophobicContact CD1-CG 4.45Å; Y69-Q88 HydrophobicContact CD2-CB 3.69Å; Y69-Q88 HydrophobicContact CE1-CB 3.83Å; Y69-Q88 HydrophobicContact CE1-CG 4.3Å; Y69-Q88 HydrophobicContact CE2-CB 3.84Å; Y69-Q88 HydrophobicContact CG-CB 3.59Å; Q88-R91 PolarHBondContact O-N 3.06Å; Q88-L92 PolarHBondContact O-N 3.38Å
89	H	95.9	Very high	94.7	Very high	43 Å²	43	64.6 Å²	64.6	20%	0.199	33%	0.334	C	S	.	.	H	α-helix	trans	-56.7	-56.4	175.7	-177.3	98.1	0	0	0	112.1	Y69 S70 C71 R91 L92 Q93	Y69-H89 PolarHBondContact O-ND1 2.88Å; S70-H89 WeakPolarHBondContact O-CB 3.45Å; C71-H89 HydrophobicContact CB-CB 4.23Å; H89-R91 VanDerWaalsContact C-N 3.27Å; H89-R91 PolarHBondContact O-N 3.03Å; H89-L92 PolarHBondContact O-N 3.36Å; H89-L92 VanDerWaalsContact O-N 3.11Å; H89-Q93 WeakPolarHBondContact O-CG 3.44Å; H89-Q93 PolarHBondContact O-N 3.5Å
90	C	96	Very high	94.6	Very high	8 Å²	8	64.4 Å²	64.4	5%	0.054	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-33.8	-178.4	-62.1	0	0	0	0	112.1	C71 S75 C77 I79 C87 K94	C71-C90 VanDerWaalsContact SG-SG 3.68Å; S75-C90 PolarHBondContact O-SG 3.39Å; S75-C90 VanDerWaalsContact O-SG 3.36Å; C77-C90 HydrophobicContact CB-CB 3.8Å; C77-C90 VanDerWaalsContact CB-SG 3.59Å; C77-C90 PolarHBondContact N-SG 2.93Å; I79-C90 HydrophobicContact CD1-CB 4.13Å; I79-C90 HydrophobicContact CG1-CB 4.49Å; C87-C90 HydrophobicContact CB-CB 4.24Å; C90-K94 WeakPolarHBondContact O-CB 3.38Å; C90-K94 PolarHBondContact O-N 2.86Å
91	R	97.5	Very high	94.3	Very high	11 Å²	11	63.1 Å²	63.1	4%	0.042	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-43.6	173.4	-168.6	-171.4	-168.6	154.6	-10.2	112.1	I37 G54 C55 F58 I79 R84 N85 C87 Q88 H89 K94 C95	I37-R91 HydrophobicContact CG2-CG 4.36Å; G54-R91 PolarHBondContact O-NH2 2.94Å; G54-R91 VanDerWaalsContact O-NH2 3.07Å; C55-R91 PolarHBondContact SG-NH2 3.1Å; F58-R91 HydrophobicContact CD1-CG 3.93Å; F58-R91 HydrophobicContact CE1-CB 3.92Å; F58-R91 HydrophobicContact CE1-CG 3.68Å; F58-R91 HydrophobicContact CZ-CB 3.99Å; F58-R91 HydrophobicContact CZ-CG 4.13Å; I79-R91 HydrophobicContact CD1-CB 4.02Å; I79-R91 HydrophobicContact CG2-CG 4.23Å; R84-R91 VanDerWaalsContact O-CD 3.31Å; R84-R91 WeakPolarHBondContact O-CD 3.42Å; R84-R91 PolarHBondContact O-NH1 3.46Å; N85-R91 PolarHBondContact OD1-NH1 2.87Å; C87-R91 PolarHBondContact O-N 3.18Å; Q88-R91 PolarHBondContact O-N 3.06Å; H89-R91 VanDerWaalsContact C-N 3.27Å; H89-R91 PolarHBondContact O-N 3.03Å; R91-K94 PolarHBondContact O-N 2.68Å; R91-C95 PolarHBondContact O-N 2.84Å; R91-C95 PolarHBondContact O-SG 3.24Å; R91-C95 VanDerWaalsContact O-SG 3.39Å
92	L	96.2	Very high	93.8	Very high	24 Å²	24	62.5 Å²	62.5	13%	0.126	33%	0.327	C	S	.	.	H	α-helix	trans	-66.6	-43.6	177.9	-177.8	58.4	0	0	0	111.5	F58 F59 Y69 Q88 H89 K94 C95 L96	F58-L92 HydrophobicContact CE1-CB 4Å; F58-L92 HydrophobicContact CE1-CD1 4.44Å; F58-L92 HydrophobicContact CZ-CB 4.11Å; F59-L92 HydrophobicContact CD2-CD1 4.01Å; F59-L92 HydrophobicContact CE2-CD1 4.25Å; Y69-L92 HydrophobicContact CD2-CB 4.26Å; Y69-L92 HydrophobicContact CD2-CD2 3.97Å; Y69-L92 HydrophobicContact CE2-CB 4.44Å; Y69-L92 HydrophobicContact CE2-CD2 4.17Å; Q88-L92 PolarHBondContact O-N 3.38Å; H89-L92 PolarHBondContact O-N 3.36Å; H89-L92 VanDerWaalsContact O-N 3.11Å; L92-K94 VanDerWaalsContact C-N 3.31Å; L92-K94 PolarHBondContact O-N 2.71Å; L92-C95 WeakPolarHBondContact O-CB 3.4Å; L92-C95 PolarHBondContact O-N 3.19Å; L92-C95 VanDerWaalsContact O-N 3.14Å; L92-L96 HydrophobicContact CG-CD1 4.27Å; L92-L96 WeakPolarHBondContact O-CG 3.23Å; L92-L96 PolarHBondContact O-N 2.99Å
93	Q	94.9	Very high	93.1	Very high	95 Å²	95	62.8 Å²	62.8	44%	0.444	32%	0.318	S	S	.	.	H	α-helix	trans	-59.3	-42.8	173.9	-66.5	-60.2	-12.6	0	0	111.3	H89 C95 L96 A97	H89-Q93 WeakPolarHBondContact O-CG 3.44Å; H89-Q93 PolarHBondContact O-N 3.5Å; Q93-C95 PolarHBondContact O-N 3.08Å; Q93-L96 PolarHBondContact O-N 3.1Å; Q93-A97 VanDerWaalsContact O-CB 3.28Å; Q93-A97 WeakPolarHBondContact O-CB 3.44Å; Q93-A97 PolarHBondContact O-N 2.7Å
94	K	96.8	Very high	92.1	Very high	66 Å²	66	64.6 Å²	64.6	29%	0.287	33%	0.334	S	S	.	.	H	α-helix	trans	-65.2	-34.8	174.7	-165.9	174.7	-179.6	-174.2	0	113.1	I37 I79 C90 R91 L92 Q98	I37-K94 HydrophobicContact CG2-CB 4.49Å; I37-K94 HydrophobicContact CG2-CD 4.45Å; I37-K94 HydrophobicContact CG2-CG 4.41Å; I37-K94 VanDerWaalsContact O-CD 3.29Å; I37-K94 WeakPolarHBondContact O-CD 3.14Å; I37-K94 WeakPolarHBondContact O-CE 3.24Å; I37-K94 PolarHBondContact O-NZ 3.13Å; I79-K94 HydrophobicContact CB-CD 3.82Å; I79-K94 HydrophobicContact CG1-CD 4.17Å; I79-K94 HydrophobicContact CG2-CD 4.26Å; I79-K94 PolarHBondContact O-NZ 2.79Å; C90-K94 WeakPolarHBondContact O-CB 3.38Å; C90-K94 PolarHBondContact O-N 2.86Å; R91-K94 PolarHBondContact O-N 2.68Å; L92-K94 VanDerWaalsContact C-N 3.31Å; L92-K94 PolarHBondContact O-N 2.71Å; K94-Q98 HydrophobicContact CG-CG 4.44Å; K94-Q98 WeakPolarHBondContact O-CB 3.46Å; K94-Q98 WeakPolarHBondContact O-CG 3.49Å; K94-Q98 PolarHBondContact O-N 3.01Å; K94-Q98 VanDerWaalsContact O-N 3.13Å
95	C	95.9	Very high	90.7	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-59.9	-49.7	170.7	-74.6	0	0	0	0	111.9	F59 R91 L92 Q93 Q98 G99 M100	F59-C95 HydrophobicContact CD2-CB 3.62Å; F59-C95 HydrophobicContact CE2-CB 4.09Å; R91-C95 PolarHBondContact O-N 2.84Å; R91-C95 PolarHBondContact O-SG 3.24Å; R91-C95 VanDerWaalsContact O-SG 3.39Å; L92-C95 WeakPolarHBondContact O-CB 3.4Å; L92-C95 PolarHBondContact O-N 3.19Å; L92-C95 VanDerWaalsContact O-N 3.14Å; Q93-C95 PolarHBondContact O-N 3.08Å; C95-Q98 PolarHBondContact O-N 3.08Å; C95-G99 PolarHBondContact O-N 3.11Å; C95-M100 HydrophobicContact CB-CB 4.29Å; C95-M100 HydrophobicContact CB-CG 4.27Å; C95-M100 HydrophobicContact CB-SD 3.66Å; C95-M100 VanDerWaalsContact O-CB 3.29Å; C95-M100 WeakPolarHBondContact O-CB 3.44Å; C95-M100 WeakPolarHBondContact O-CG 3.41Å; C95-M100 PolarHBondContact O-N 2.83Å
96	L	94.1	Very high	88.9	Confident	74 Å²	74	68.7 Å²	68.7	39%	0.387	35%	0.354	S	S	.	.	H	α-helix	trans	-67.1	-45.8	-178.5	-66.3	168.5	0	0	0	111.7	F59 L92 Q93 Q98 G99	F59-L96 HydrophobicContact CE2-CD2 3.87Å; F59-L96 HydrophobicContact CE2-CG 4.41Å; F59-L96 HydrophobicContact CZ-CD2 4.28Å; L92-L96 HydrophobicContact CG-CD1 4.27Å; L92-L96 WeakPolarHBondContact O-CG 3.23Å; L92-L96 PolarHBondContact O-N 2.99Å; Q93-L96 PolarHBondContact O-N 3.1Å; L96-Q98 PolarHBondContact O-N 3.2Å; L96-G99 WeakPolarHBondContact O-CA 3.43Å; L96-G99 PolarHBondContact O-N 3.15Å
97	A	93.5	Very high	86.8	Confident	83 Å²	83	67.3 Å²	67.3	69%	0.686	35%	0.354	S	S	*	.	H	α-helix	trans	-64.6	-24	178.1	0	0	0	0	0	113.8	Q93 G99	Q93-A97 VanDerWaalsContact O-CB 3.28Å; Q93-A97 WeakPolarHBondContact O-CB 3.44Å; Q93-A97 PolarHBondContact O-N 2.7Å; A97-G99 VanDerWaalsContact C-N 3.31Å
98	Q	92.5	Very high	84.8	Confident	90 Å²	90	70.2 Å²	70.2	42%	0.421	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	3.3	171.5	-68.9	-68.7	-65.5	0	0	113.3	I37 V49 K94 C95 L96	I37-Q98 HydrophobicContact CD1-CB 3.66Å; I37-Q98 HydrophobicContact CD1-CG 3.83Å; V49-Q98 HydrophobicContact CG1-CB 4.45Å; V49-Q98 WeakPolarHBondContact CG2-O 3.46Å; K94-Q98 HydrophobicContact CG-CG 4.44Å; K94-Q98 WeakPolarHBondContact O-CB 3.46Å; K94-Q98 WeakPolarHBondContact O-CG 3.49Å; K94-Q98 PolarHBondContact O-N 3.01Å; K94-Q98 VanDerWaalsContact O-N 3.13Å; C95-Q98 PolarHBondContact O-N 3.08Å; L96-Q98 PolarHBondContact O-N 3.2Å
99	G	89.5	Confident	83	Confident	48 Å²	48	75.9 Å²	75.9	50%	0.495	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	17.8	173.8	0	0	0	0	0	115.9	C95 L96 A97 S101	C95-G99 PolarHBondContact O-N 3.11Å; L96-G99 WeakPolarHBondContact O-CA 3.43Å; L96-G99 PolarHBondContact O-N 3.15Å; A97-G99 VanDerWaalsContact C-N 3.31Å; G99-S101 PolarHBondContact O-N 3.35Å
100	M	92.9	Very high	81.5	Confident	4 Å²	4	76.8 Å²	76.8	2%	0.02	41%	0.408	C	S	.	.			trans	-68.6	123.8	174.8	-64.9	-172.1	75.3	0	0	110.9	I37 Y47 V49 T51 F59 C95	I37-M100 HydrophobicContact CD1-SD 4.1Å; I37-M100 HydrophobicContact CG1-SD 4.05Å; Y47-M100 HydrophobicContact CD2-CE 3.79Å; Y47-M100 HydrophobicContact CG-CE 4.26Å; Y47-M100 WeakPolarHBondContact O-CA 3.41Å; V49-M100 HydrophobicContact CB-CG 3.8Å; V49-M100 HydrophobicContact CG2-CB 4.32Å; V49-M100 HydrophobicContact CG2-CG 3.53Å; T51-M100 HydrophobicContact CG2-CE 4.21Å; T51-M100 HydrophobicContact CG2-SD 4Å; F59-M100 HydrophobicContact CB-CE 3.76Å; F59-M100 HydrophobicContact CB-SD 4.37Å; F59-M100 HydrophobicContact CD1-CB 4.3Å; F59-M100 HydrophobicContact CD1-CE 3.95Å; F59-M100 HydrophobicContact CD2-CB 4.04Å; F59-M100 HydrophobicContact CD2-CE 4.46Å; F59-M100 HydrophobicContact CD2-SD 4.36Å; F59-M100 HydrophobicContact CE1-CB 4.01Å; F59-M100 HydrophobicContact CE2-CB 3.74Å; F59-M100 HydrophobicContact CG-CB 4.31Å; F59-M100 HydrophobicContact CG-CE 3.8Å; F59-M100 HydrophobicContact CG-SD 4.27Å; F59-M100 HydrophobicContact CZ-CB 3.72Å; F59-M100 WeakPolarHBondContact CZ-O 3.45Å; C95-M100 HydrophobicContact CB-CB 4.29Å; C95-M100 HydrophobicContact CB-CG 4.27Å; C95-M100 HydrophobicContact CB-SD 3.66Å; C95-M100 VanDerWaalsContact O-CB 3.29Å; C95-M100 WeakPolarHBondContact O-CB 3.44Å; C95-M100 WeakPolarHBondContact O-CG 3.41Å; C95-M100 PolarHBondContact O-N 2.83Å
101	S	89.1	Confident	80.1	Confident	47 Å²	47	79 Å²	79	33%	0.329	42%	0.423	S	S	.	.			trans	-139.2	146.1	-178.7	173.2	0	0	0	0	112.7	Y47 G99 D103	Y47-S101 WeakPolarHBondContact CB-O 3.47Å; Y47-S101 PolarHBondContact O-N 3.4Å; G99-S101 PolarHBondContact O-N 3.35Å; S101-D103 PolarHBondContact OG-N 3.46Å
102	R	84.1	Confident	79	Confident	160 Å²	160	85.7 Å²	85.7	60%	0.604	45%	0.453	S	S	*	.	S	Bend	trans	-63	-40.7	172.7	-69	-177.7	67.6	-161	-1.6	111.9	Q63 A104 V105	Q63-R102 HydrophobicContact CB-CG 4.5Å; Q63-R102 HydrophobicContact CG-CG 4.43Å; R102-A104 VanDerWaalsContact C-N 3.3Å; R102-A104 PolarHBondContact O-N 2.91Å; R102-V105 WeakPolarHBondContact O-CB 3.33Å; R102-V105 WeakPolarHBondContact O-CG2 3.27Å; R102-V105 PolarHBondContact O-N 3.19Å
103	D	76.8	Confident	78	Confident	83 Å²	83	95 Å²	95	44%	0.444	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-73.4	-22.3	-174.3	-64.4	-79.5	0	0	0	113.2	S101 V105 K106	S101-D103 PolarHBondContact OG-N 3.46Å; D103-V105 PolarHBondContact O-N 2.97Å; D103-V105 VanDerWaalsContact O-N 3.08Å; D103-K106 HydrophobicContact CB-CD 4.46Å; D103-K106 WeakPolarHBondContact O-CB 3.38Å; D103-K106 PolarHBondContact O-N 2.92Å; D103-K106 VanDerWaalsContact OD1-CE 3.23Å; D103-K106 WeakPolarHBondContact OD1-CE 3.41Å; D103-K106 IonicContact OD1-NZ 3.84Å; D103-K106 PolarHBondContact OD1-NZ 3.38Å
104	A	73.5	Confident	76.6	Confident	43 Å²	43	96 Å²	96	36%	0.355	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-59.4	-19	170.8	0	0	0	0	0	113.3	R102	R102-A104 VanDerWaalsContact C-N 3.3Å; R102-A104 PolarHBondContact O-N 2.91Å
105	V	64.1	Low	75.4	Confident	85 Å²	85	96.3 Å²	96.3	52%	0.515	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-73.6	-30.7	174.8	-175.9	0	0	0	0	112	Y47 R102 D103 F107 G108	Y47-V105 HydrophobicContact CD1-CG2 3.52Å; Y47-V105 HydrophobicContact CE1-CG2 3.71Å; Y47-V105 HydrophobicContact CG-CG2 4.4Å; R102-V105 WeakPolarHBondContact O-CB 3.33Å; R102-V105 WeakPolarHBondContact O-CG2 3.27Å; R102-V105 PolarHBondContact O-N 3.19Å; D103-V105 PolarHBondContact O-N 2.97Å; D103-V105 VanDerWaalsContact O-N 3.08Å; V105-F107 PolarHBondContact O-N 3.48Å; V105-G108 PolarHBondContact O-N 2.93Å
106	K	56.7	Low	74.5	Confident	161 Å²	161	99.8 Å²	99.8	70%	0.7	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.8	-174.2	-67.7	174.6	171.7	167.7	0	113.6	D103	D103-K106 HydrophobicContact CB-CD 4.46Å; D103-K106 WeakPolarHBondContact O-CB 3.38Å; D103-K106 PolarHBondContact O-N 2.92Å; D103-K106 VanDerWaalsContact OD1-CE 3.23Å; D103-K106 WeakPolarHBondContact OD1-CE 3.41Å; D103-K106 IonicContact OD1-NZ 3.84Å; D103-K106 PolarHBondContact OD1-NZ 3.38Å
107	F	51.6	Low	73.7	Confident	175 Å²	175	99.7 Å²	99.7	77%	0.768	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-18.2	-173.3	-75.7	-83.2	0	0	0	114.7	V105 R109	V105-F107 PolarHBondContact O-N 3.48Å; F107-R109 PolarHBondContact O-N 3.47Å
108	G	53.2	Low	72.8	Confident	73 Å²	73	96.5 Å²	96.5	75%	0.753	49%	0.486	S	S	*	.			trans	62.4	-17.4	167.6	0	0	0	0	0	118.4	V105	V105-G108 PolarHBondContact O-N 2.93Å
109	R	58.4	Low	72	Confident	220 Å²	220	96.1 Å²	96.1	83%	0.83	49%	0.486	S	S	*	.	S	Bend	trans	-144.6	121.8	-179.7	-59.7	179.8	-174.9	175.5	3	107.5	F107 S111	F107-R109 PolarHBondContact O-N 3.47Å; R109-S111 PolarHBondContact O-N 3.39Å
110	M	65.3	Low	71.6	Confident	63 Å²	63	96.2 Å²	96.2	31%	0.31	48%	0.482	S	S	.	.			trans	-57	138.7	173.8	-65	-176	-71.9	0	0	110.3	V45 Q114 R115 L118	V45-M110 HydrophobicContact CB-SD 4.33Å; V45-M110 HydrophobicContact CG1-SD 4.49Å; V45-M110 HydrophobicContact CG2-SD 3.93Å; M110-Q114 HydrophobicContact CB-CB 4.35Å; M110-R115 PolarHBondContact O-NH2 3.09Å; M110-L118 HydrophobicContact CE-CD2 3.9Å; M110-L118 HydrophobicContact SD-CD2 4.18Å
111	S	66.6	Low	71	Confident	54 Å²	54	97.8 Å²	97.8	38%	0.378	49%	0.489	S	S	.	.			trans	-59.2	157.2	174.8	69	0	0	0	0	110.5	R109 R113 Q114 R115	R109-S111 PolarHBondContact O-N 3.39Å; S111-R113 VanDerWaalsContact C-N 3.33Å; S111-R113 PolarHBondContact O-N 3.08Å; S111-Q114 VanDerWaalsContact N-OE1 3.09Å; S111-Q114 PolarHBondContact O-N 3.36Å; S111-Q114 VanDerWaalsContact O-N 3.15Å; S111-Q114 WeakPolarHBondContact OG-CB 3.29Å; S111-Q114 VanDerWaalsContact OG-CD 3.27Å; S111-Q114 VanDerWaalsContact OG-CG 3.3Å; S111-Q114 WeakPolarHBondContact OG-CG 3.5Å; S111-Q114 PolarHBondContact OG-N 2.61Å; S111-Q114 PolarHBondContact OG-OE1 2.96Å; S111-R115 PolarHBondContact O-N 3.17Å
112	K	73.1	Confident	70.6	Confident	151 Å²	151	96.5 Å²	96.5	66%	0.657	48%	0.479	S	S	*	.	H	α-helix	trans	-54.4	-50.4	177.9	-178.1	173.1	177.5	-172.9	0	111.1	Q114 R115 D116	K112-Q114 VanDerWaalsContact C-N 3.32Å; K112-Q114 PolarHBondContact O-N 3.5Å; K112-R115 PolarHBondContact O-N 3.32Å; K112-R115 VanDerWaalsContact O-N 3.08Å; K112-D116 VanDerWaalsContact CE-OD2 3.24Å; K112-D116 WeakPolarHBondContact CE-OD2 3.44Å; K112-D116 WeakPolarHBondContact CG-OD2 3.46Å; K112-D116 WeakPolarHBondContact O-CB 3.38Å; K112-D116 PolarHBondContact O-N 2.79Å; K112-D116 VanDerWaalsContact O-OD1 3.1Å
113	R	74.8	Confident	70.4	Confident	220 Å²	220	92.7 Å²	92.7	83%	0.83	47%	0.468	S	S	*	.	H	α-helix	trans	-54.4	-40.9	176.3	-65.6	-178.1	180	174	-1.2	113.6	S111 S117	S111-R113 VanDerWaalsContact C-N 3.33Å; S111-R113 PolarHBondContact O-N 3.08Å; R113-S117 WeakPolarHBondContact O-CB 3.33Å; R113-S117 PolarHBondContact O-N 3.31Å
114	Q	67.3	Low	70.7	Confident	116 Å²	116	95.2 Å²	95.2	54%	0.542	47%	0.472	S	S	.	.	H	α-helix	trans	-70.6	-38.2	177.4	-75.3	163.2	-44.9	0	0	112.9	M110 S111 K112 L118	M110-Q114 HydrophobicContact CB-CB 4.35Å; S111-Q114 VanDerWaalsContact N-OE1 3.09Å; S111-Q114 PolarHBondContact O-N 3.36Å; S111-Q114 VanDerWaalsContact O-N 3.15Å; S111-Q114 WeakPolarHBondContact OG-CB 3.29Å; S111-Q114 VanDerWaalsContact OG-CD 3.27Å; S111-Q114 VanDerWaalsContact OG-CG 3.3Å; S111-Q114 WeakPolarHBondContact OG-CG 3.5Å; S111-Q114 PolarHBondContact OG-N 2.61Å; S111-Q114 PolarHBondContact OG-OE1 2.96Å; K112-Q114 VanDerWaalsContact C-N 3.32Å; K112-Q114 PolarHBondContact O-N 3.5Å; Q114-L118 VanDerWaalsContact O-CB 3.31Å; Q114-L118 WeakPolarHBondContact O-CB 3.49Å; Q114-L118 PolarHBondContact O-N 2.75Å
115	R	71.2	Confident	71	Confident	73 Å²	73	96 Å²	96	28%	0.275	47%	0.468	S	S	.	.	H	α-helix	trans	-66.5	-45.9	175.6	-174.3	-172.4	-59.5	86.8	13.6	111.2	M110 S111 K112 S117 L118 I119	M110-R115 PolarHBondContact O-NH2 3.09Å; S111-R115 PolarHBondContact O-N 3.17Å; K112-R115 PolarHBondContact O-N 3.32Å; K112-R115 VanDerWaalsContact O-N 3.08Å; R115-S117 VanDerWaalsContact C-N 3.34Å; R115-S117 PolarHBondContact O-N 3.19Å; R115-L118 WeakPolarHBondContact O-CB 3.48Å; R115-L118 PolarHBondContact O-N 2.83Å; R115-I119 HydrophobicContact CG-CD1 4.01Å; R115-I119 WeakPolarHBondContact O-CG1 3.4Å; R115-I119 PolarHBondContact O-N 2.96Å
116	D	76.3	Confident	71.8	Confident	72 Å²	72	98.7 Å²	98.7	39%	0.385	47%	0.469	S	S	.	.	H	α-helix	trans	-66.4	-39.5	-177.6	-56.5	-4.6	0	0	0	110.2	K112 I119 A120	K112-D116 VanDerWaalsContact CE-OD2 3.24Å; K112-D116 WeakPolarHBondContact CE-OD2 3.44Å; K112-D116 WeakPolarHBondContact CG-OD2 3.46Å; K112-D116 WeakPolarHBondContact O-CB 3.38Å; K112-D116 PolarHBondContact O-N 2.79Å; K112-D116 VanDerWaalsContact O-OD1 3.1Å; D116-I119 PolarHBondContact O-N 3.22Å; D116-A120 PolarHBondContact O-N 3.04Å
117	S	78.3	Confident	72.9	Confident	73 Å²	73	95.5 Å²	95.5	51%	0.51	46%	0.456	S	S	.	.	H	α-helix	trans	-64.3	-41.5	171.6	-176.4	0	0	0	0	113.1	R113 R115 I119 A120 E121	R113-S117 WeakPolarHBondContact O-CB 3.33Å; R113-S117 PolarHBondContact O-N 3.31Å; R115-S117 VanDerWaalsContact C-N 3.34Å; R115-S117 PolarHBondContact O-N 3.19Å; S117-I119 PolarHBondContact O-N 3.24Å; S117-A120 PolarHBondContact O-N 3.23Å; S117-E121 PolarHBondContact O-N 2.97Å
118	L	73.1	Confident	74.3	Confident	16 Å²	16	92 Å²	92	8%	0.084	44%	0.442	C	S	.	.	H	α-helix	trans	-61.8	-42.4	174.7	177.3	65.6	0	0	0	111.8	I30 I33 V45 I50 M110 Q114 R115 E121 V122	I30-L118 HydrophobicContact CD1-CD2 4.3Å; I30-L118 HydrophobicContact CG1-CD2 4.35Å; I33-L118 HydrophobicContact CD1-CD1 3.9Å; V45-L118 HydrophobicContact CG2-CD2 4.35Å; I50-L118 HydrophobicContact CD1-CD1 3.46Å; I50-L118 VanDerWaalsContact CD1-CD1 3.46Å; I50-L118 HydrophobicContact CG1-CD1 4.09Å; M110-L118 HydrophobicContact CE-CD2 3.9Å; M110-L118 HydrophobicContact SD-CD2 4.18Å; Q114-L118 VanDerWaalsContact O-CB 3.31Å; Q114-L118 WeakPolarHBondContact O-CB 3.49Å; Q114-L118 PolarHBondContact O-N 2.75Å; R115-L118 WeakPolarHBondContact O-CB 3.48Å; R115-L118 PolarHBondContact O-N 2.83Å; L118-E121 PolarHBondContact O-N 3.08Å; L118-V122 WeakPolarHBondContact O-CG2 3.27Å; L118-V122 PolarHBondContact O-N 3.43Å
119	I	76.3	Confident	75.4	Confident	81 Å²	81	92.9 Å²	92.9	42%	0.415	43%	0.427	S	S	.	.	H	α-helix	trans	-62.5	-45.3	177	-69.7	163.3	0	0	0	110.5	R115 D116 S117 E121 V122 E123	R115-I119 HydrophobicContact CG-CD1 4.01Å; R115-I119 WeakPolarHBondContact O-CG1 3.4Å; R115-I119 PolarHBondContact O-N 2.96Å; D116-I119 PolarHBondContact O-N 3.22Å; S117-I119 PolarHBondContact O-N 3.24Å; I119-E121 VanDerWaalsContact C-N 3.28Å; I119-E121 PolarHBondContact O-N 3.04Å; I119-V122 PolarHBondContact O-N 3.05Å; I119-E123 WeakPolarHBondContact O-CB 3.42Å; I119-E123 PolarHBondContact O-N 3.13Å
120	A	81.1	Confident	76.2	Confident	50 Å²	50	87.3 Å²	87.3	41%	0.413	41%	0.41	S	S	.	.	H	α-helix	trans	-61.4	-34.6	175	0	0	0	0	0	112.8	D116 S117 R124	D116-A120 PolarHBondContact O-N 3.04Å; S117-A120 PolarHBondContact O-N 3.23Å; A120-R124 WeakPolarHBondContact O-CG 3.47Å; A120-R124 PolarHBondContact O-N 3.04Å; A120-R124 VanDerWaalsContact O-N 3.11Å
121	E	80.7	Confident	76.5	Confident	38 Å²	38	90.5 Å²	90.5	18%	0.178	42%	0.424	C	S	.	.	H	α-helix	trans	-74.2	-36.3	177.2	-165.2	150.6	104.7	0	0	113.4	I33 K36 S117 L118 I119 R124 H125	I33-E121 HydrophobicContact CD1-CB 4.2Å; I33-E121 HydrophobicContact CD1-CG 4.11Å; K36-E121 WeakPolarHBondContact CE-OE1 3.23Å; K36-E121 IonicContact NZ-OE1 2.84Å; K36-E121 PolarHBondContact NZ-OE1 3.42Å; S117-E121 PolarHBondContact O-N 2.97Å; L118-E121 PolarHBondContact O-N 3.08Å; I119-E121 VanDerWaalsContact C-N 3.28Å; I119-E121 PolarHBondContact O-N 3.04Å; E121-R124 IonicContact OE2-NH2 2.68Å; E121-R124 PolarHBondContact OE2-NH2 2.99Å; E121-H125 PolarHBondContact O-CD2 3.39Å; E121-H125 PolarHBondContact O-N 3.38Å
122	V	79.5	Confident	76.6	Confident	19 Å²	19	94 Å²	94	12%	0.115	44%	0.435	C	S	.	.	H	α-helix	trans	-61.4	-47.1	170.9	171.7	0	0	0	0	110.3	Q29 I33 L118 I119 H125 R126	Q29-V122 WeakPolarHBondContact O-CG2 3.32Å; I33-V122 HydrophobicContact CD1-CB 4.42Å; I33-V122 HydrophobicContact CD1-CG2 3.54Å; I33-V122 HydrophobicContact CG1-CG2 4.05Å; L118-V122 WeakPolarHBondContact O-CG2 3.27Å; L118-V122 PolarHBondContact O-N 3.43Å; I119-V122 PolarHBondContact O-N 3.05Å; V122-H125 PolarHBondContact O-N 2.87Å; V122-R126 PolarHBondContact O-N 3.45Å
123	E	80.1	Confident	76.1	Confident	81 Å²	81	93 Å²	93	38%	0.379	43%	0.433	S	S	.	.	H	α-helix	trans	-66.4	-42.4	-175.1	-171.6	53.5	-146.3	0	0	111.9	I119 H125 R126 Q127	I119-E123 WeakPolarHBondContact O-CB 3.42Å; I119-E123 PolarHBondContact O-N 3.13Å; E123-H125 PolarHBondContact O-N 3.11Å; E123-R126 PolarHBondContact O-N 3.43Å; E123-Q127 WeakPolarHBondContact O-CG 3.47Å; E123-Q127 PolarHBondContact O-N 3.19Å; E123-Q127 PolarHBondContact OE1-NE2 3.06Å
124	R	83.7	Confident	75.4	Confident	135 Å²	135	87.9 Å²	87.9	51%	0.509	42%	0.421	S	S	.	.	H	α-helix	trans	-57.8	-45.4	171.7	-73	-176.4	-53	-151.7	4.2	112.7	A120 E121 R126 Q127 Q128	A120-R124 WeakPolarHBondContact O-CG 3.47Å; A120-R124 PolarHBondContact O-N 3.04Å; A120-R124 VanDerWaalsContact O-N 3.11Å; E121-R124 IonicContact OE2-NH2 2.68Å; E121-R124 PolarHBondContact OE2-NH2 2.99Å; R124-R126 VanDerWaalsContact C-N 3.31Å; R124-R126 PolarHBondContact O-N 2.68Å; R124-Q127 PolarHBondContact O-N 3.49Å; R124-Q128 WeakPolarHBondContact O-CG 3.35Å; R124-Q128 PolarHBondContact O-N 3.29Å
125	H	79.8	Confident	74.8	Confident	59 Å²	59	88.9 Å²	88.9	27%	0.273	43%	0.426	S	S	.	.	H	α-helix	trans	-65.9	-34.8	178.9	-88.6	-56.5	0	0	0	112.5	V32 E121 V122 E123 Q128 Q129	V32-H125 HydrophobicContact CG1-CB 4.35Å; E121-H125 PolarHBondContact O-CD2 3.39Å; E121-H125 PolarHBondContact O-N 3.38Å; V122-H125 PolarHBondContact O-N 2.87Å; E123-H125 PolarHBondContact O-N 3.11Å; H125-Q128 PolarHBondContact ND1-OE1 2.97Å; H125-Q128 PolarHBondContact O-N 2.93Å; H125-Q129 WeakPolarHBondContact O-CG 3.31Å; H125-Q129 PolarHBondContact O-N 3.29Å
126	R	80.3	Confident	73.8	Confident	142 Å²	142	90.8 Å²	90.8	54%	0.536	44%	0.441	S	S	.	.	H	α-helix	trans	-66.8	-42.8	176	-167	179.4	-172	-170.8	0	112.2	V122 E123 R124 Q129 Q130	V122-R126 PolarHBondContact O-N 3.45Å; E123-R126 PolarHBondContact O-N 3.43Å; R124-R126 VanDerWaalsContact C-N 3.31Å; R124-R126 PolarHBondContact O-N 2.68Å; R126-Q129 PolarHBondContact O-N 3.47Å; R126-Q130 PolarHBondContact O-N 2.7Å
127	Q	80.8	Confident	72.5	Confident	94 Å²	94	92.9 Å²	92.9	44%	0.439	45%	0.452	S	S	.	.	H	α-helix	trans	-64.8	-39.3	175.6	-68.8	170.8	10.3	0	0	111.7	E123 R124 Q130 Q131	E123-Q127 WeakPolarHBondContact O-CG 3.47Å; E123-Q127 PolarHBondContact O-N 3.19Å; E123-Q127 PolarHBondContact OE1-NE2 3.06Å; R124-Q127 PolarHBondContact O-N 3.49Å; Q127-Q130 PolarHBondContact O-N 2.88Å; Q127-Q131 WeakPolarHBondContact O-CG 3.31Å; Q127-Q131 PolarHBondContact O-N 3.17Å
128	Q	80.7	Confident	71.2	Confident	101 Å²	101	93.3 Å²	93.3	47%	0.472	45%	0.452	S	S	.	.	H	α-helix	trans	-62.8	-41.7	173	-74.7	175.8	-15.9	0	0	112.7	R124 H125 Q131 Q132	R124-Q128 WeakPolarHBondContact O-CG 3.35Å; R124-Q128 PolarHBondContact O-N 3.29Å; H125-Q128 PolarHBondContact ND1-OE1 2.97Å; H125-Q128 PolarHBondContact O-N 2.93Å; Q128-Q131 PolarHBondContact O-N 3.44Å; Q128-Q132 WeakPolarHBondContact O-CG 3.4Å; Q128-Q132 PolarHBondContact O-N 3.19Å
129	Q	76.4	Confident	69.8	Low	92 Å²	92	99.9 Å²	99.9	43%	0.43	48%	0.482	S	S	.	.	H	α-helix	trans	-64	-39.6	175.9	-75.5	175.2	-1.3	0	0	112.1	H125 R126 Q132 Q133	H125-Q129 WeakPolarHBondContact O-CG 3.31Å; H125-Q129 PolarHBondContact O-N 3.29Å; R126-Q129 PolarHBondContact O-N 3.47Å; Q129-Q132 PolarHBondContact O-N 3.36Å; Q129-Q133 WeakPolarHBondContact O-CG 3.48Å; Q129-Q133 PolarHBondContact O-N 3.48Å
130	Q	75.5	Confident	68.5	Low	104 Å²	104	100.9 Å²	100.9	49%	0.486	49%	0.492	S	S	.	.	H	α-helix	trans	-66.6	-39.4	175	-72.2	-179.6	-44.4	0	0	112.5	R126 Q127 Q132 Q133 L134	R126-Q130 PolarHBondContact O-N 2.7Å; Q127-Q130 PolarHBondContact O-N 2.88Å; Q130-Q132 VanDerWaalsContact C-N 3.35Å; Q130-Q133 PolarHBondContact O-N 3.11Å; Q130-L134 WeakPolarHBondContact O-CG 3.47Å; Q130-L134 PolarHBondContact O-N 3.12Å
131	Q	71.6	Confident	66.7	Low	130 Å²	130	106.9 Å²	106.9	61%	0.607	51%	0.511	S	S	*	.	H	α-helix	trans	-65.7	-35.9	174.9	-74.5	178.2	-14.2	0	0	112.6	Q127 Q128 Q135	Q127-Q131 WeakPolarHBondContact O-CG 3.31Å; Q127-Q131 PolarHBondContact O-N 3.17Å; Q128-Q131 PolarHBondContact O-N 3.44Å; Q131-Q135 WeakPolarHBondContact O-CG 3.45Å; Q131-Q135 PolarHBondContact O-N 3Å; Q131-Q135 VanDerWaalsContact O-N 3.12Å
132	Q	67.8	Low	65.2	Low	128 Å²	128	112.4 Å²	112.4	60%	0.598	54%	0.542	S	S	*	.	H	α-helix	trans	-69.1	-41.4	174.7	-74.1	179.8	-31.7	0	0	112.1	Q128 Q129 Q130 L134 Q135 D136	Q128-Q132 WeakPolarHBondContact O-CG 3.4Å; Q128-Q132 PolarHBondContact O-N 3.19Å; Q129-Q132 PolarHBondContact O-N 3.36Å; Q130-Q132 VanDerWaalsContact C-N 3.35Å; Q132-L134 PolarHBondContact O-N 3.32Å; Q132-Q135 PolarHBondContact O-N 3.34Å; Q132-Q135 VanDerWaalsContact O-N 3.16Å; Q132-D136 PolarHBondContact O-N 3.44Å
133	Q	63.4	Low	63.3	Low	130 Å²	130	114.7 Å²	114.7	61%	0.607	56%	0.558	S	S	*	*	H	α-helix	trans	-62.5	-41.5	174.9	-73.7	177.8	-35.2	0	0	112.3	Q129 Q130 Q135 D136 D137	Q129-Q133 WeakPolarHBondContact O-CG 3.48Å; Q129-Q133 PolarHBondContact O-N 3.48Å; Q130-Q133 PolarHBondContact O-N 3.11Å; Q133-Q135 VanDerWaalsContact C-N 3.29Å; Q133-Q135 PolarHBondContact O-N 3.11Å; Q133-D136 PolarHBondContact O-N 3.04Å; Q133-D137 PolarHBondContact O-N 3.36Å; Q133-D137 VanDerWaalsContact O-N 3.11Å
134	L	58.6	Low	61	Low	112 Å²	112	121.1 Å²	121.1	59%	0.586	58%	0.58	S	S	*	*	H	α-helix	trans	-63.9	-31.6	174.2	-73.1	165	0	0	0	112.8	Q130 Q132 T138	Q130-L134 WeakPolarHBondContact O-CG 3.47Å; Q130-L134 PolarHBondContact O-N 3.12Å; Q132-L134 PolarHBondContact O-N 3.32Å; L134-T138 WeakPolarHBondContact O-CB 3.38Å; L134-T138 PolarHBondContact O-N 3.25Å; L134-T138 VanDerWaalsContact O-N 3.15Å; L134-T138 PolarHBondContact O-OG1 2.78Å
135	Q	55.3	Low	58.9	Low	137 Å²	137	119.6 Å²	119.6	64%	0.64	59%	0.588	S	S	*	*	H	α-helix	trans	-73.8	-37	175.2	-78.2	-173.3	-31	0	0	113.2	Q131 Q132 Q133 Q139	Q131-Q135 WeakPolarHBondContact O-CG 3.45Å; Q131-Q135 PolarHBondContact O-N 3Å; Q131-Q135 VanDerWaalsContact O-N 3.12Å; Q132-Q135 PolarHBondContact O-N 3.34Å; Q132-Q135 VanDerWaalsContact O-N 3.16Å; Q133-Q135 VanDerWaalsContact C-N 3.29Å; Q133-Q135 PolarHBondContact O-N 3.11Å; Q135-Q139 WeakPolarHBondContact O-CG 3.49Å; Q135-Q139 PolarHBondContact O-N 3.35Å
136	D	51.2	Low	56.9	Low	113 Å²	113	123.1 Å²	123.1	60%	0.604	62%	0.616	S	S	*	*	H	α-helix	trans	-62.8	-50.3	172.6	-89.5	-23.1	0	0	0	110.9	Q132 Q133 T138 Q139 V140	Q132-D136 PolarHBondContact O-N 3.44Å; Q133-D136 PolarHBondContact O-N 3.04Å; D136-T138 VanDerWaalsContact C-N 3.33Å; D136-T138 PolarHBondContact O-N 2.67Å; D136-Q139 PolarHBondContact O-N 3.01Å; D136-Q139 VanDerWaalsContact O-N 3.12Å; D136-V140 PolarHBondContact O-N 3.17Å
137	D	49.3	Very low	54.7	Low	115 Å²	115	126 Å²	126	62%	0.615	63%	0.632	S	S	*	*	H	α-helix	trans	-58.9	-42.7	178.4	-81.8	-29.8	0	0	0	111.9	Q133 Q139 V140 E141	Q133-D137 PolarHBondContact O-N 3.36Å; Q133-D137 VanDerWaalsContact O-N 3.11Å; D137-Q139 VanDerWaalsContact C-N 3.27Å; D137-Q139 PolarHBondContact O-N 2.86Å; D137-V140 PolarHBondContact O-N 2.94Å; D137-V140 VanDerWaalsContact O-N 3.14Å; D137-E141 PolarHBondContact O-N 2.72Å
138	T	49.3	Very low	52.4	Low	82 Å²	82	129.5 Å²	129.5	50%	0.503	65%	0.654	S	S	.	*	H	α-helix	trans	-66.6	-25.8	179.4	-51.9	0	0	0	0	112.7	L134 D136	L134-T138 WeakPolarHBondContact O-CB 3.38Å; L134-T138 PolarHBondContact O-N 3.25Å; L134-T138 VanDerWaalsContact O-N 3.15Å; L134-T138 PolarHBondContact O-OG1 2.78Å; D136-T138 VanDerWaalsContact C-N 3.33Å; D136-T138 PolarHBondContact O-N 2.67Å
139	Q	45.4	Very low	50.1	Low	154 Å²	154	135.6 Å²	135.6	72%	0.72	67%	0.673	S	S	*	*	H	α-helix	trans	-79.1	-25	173.9	-75.1	-166.5	1.1	0	0	113.3	Q135 D136 D137	Q135-Q139 WeakPolarHBondContact O-CG 3.49Å; Q135-Q139 PolarHBondContact O-N 3.35Å; D136-Q139 PolarHBondContact O-N 3.01Å; D136-Q139 VanDerWaalsContact O-N 3.12Å; D137-Q139 VanDerWaalsContact C-N 3.27Å; D137-Q139 PolarHBondContact O-N 2.86Å
140	V	47.8	Very low	48	Very low	102 Å²	102	140.5 Å²	140.5	62%	0.618	70%	0.696	S	S	*	*	H	α-helix	trans	-72.9	-43.5	174.9	177.1	0	0	0	0	111	D136 D137 L142 S143	D136-V140 PolarHBondContact O-N 3.17Å; D137-V140 PolarHBondContact O-N 2.94Å; D137-V140 VanDerWaalsContact O-N 3.14Å; V140-L142 VanDerWaalsContact C-N 3.32Å; V140-L142 PolarHBondContact O-N 2.87Å; V140-S143 PolarHBondContact O-OG 3.23Å
141	E	44.6	Very low	45.8	Very low	176 Å²	176	141.7 Å²	141.7	82%	0.822	71%	0.705	S	S	*	*	H	α-helix	trans	-69.9	-22.4	-169.7	-159.4	169.4	-142.1	0	0	114.5	D137 S143	D137-E141 PolarHBondContact O-N 2.72Å; E141-S143 PolarHBondContact O-N 2.89Å
142	L	47.5	Very low	43.9	Very low	155 Å²	155	144.4 Å²	144.4	81%	0.812	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	15.7	-177.5	-79.8	166.8	0	0	0	115.3	V140	V140-L142 VanDerWaalsContact C-N 3.32Å; V140-L142 PolarHBondContact O-N 2.87Å
143	S	40.6	Very low	42	Very low	66 Å²	66	143.7 Å²	143.7	46%	0.462	73%	0.727	S	S	.	*	S	Bend	trans	-113.3	4.4	-162.9	68	0	0	0	0	118.2	V140 E141	V140-S143 PolarHBondContact O-OG 3.23Å; E141-S143 PolarHBondContact O-N 2.89Å
144	Y	32.2	Very low	41.6	Very low	216 Å²	216	143 Å²	143	85%	0.847	73%	0.734	S	S	*	*			trans	-135.7	123	-179.5	-76.3	-84	0	0	0	115.8
145	P	38.1	Very low	40.2	Very low	104 Å²	104	147 Å²	147	68%	0.675	75%	0.749	S	S	*	*			trans	-82.5	148.4	161.2	34.2	-32.5	0	0	0	111
146	P	39.6	Very low	39.2	Very low	132 Å²	132	147.9 Å²	147.9	86%	0.857	76%	0.758	S	S	*	*			trans	-71.6	134	-177.7	29	-34.6	0	0	0	112.1
147	K	33.1	Very low	38.2	Very low	202 Å²	202	150.7 Å²	150.7	88%	0.878	77%	0.772	S	S	*	*			trans	-125.8	151	164.3	-82.3	-171.4	173.4	-178.7	0	110.7
148	N	32.3	Very low	37.4	Very low	168 Å²	168	153.4 Å²	153.4	90%	0.898	78%	0.781	S	S	*	*			trans	-66	154.7	-167.9	-83.7	-30.3	0	0	0	114.4
149	R	32.9	Very low	37.4	Very low	230 Å²	230	154.3 Å²	154.3	87%	0.868	79%	0.788	S	S	*	*			trans	-47.9	143.3	155.4	-79	171.1	148.6	154.5	-8.5	111.4
150	Q	31.7	Very low	36.9	Very low	195 Å²	195	154.5 Å²	154.5	91%	0.911	79%	0.792	S	S	*	*			trans	-150.1	140.7	134.3	-114.3	166.5	-2.4	0	0	109.1
151	D	30.3	Very low	35.8	Very low	128 Å²	128	154.2 Å²	154.2	68%	0.684	80%	0.801	S	S	*	*			trans	-77.4	158	-179.7	-62	-85.4	0	0	0	111.9
152	H	30.7	Very low	35.5	Very low	188 Å²	188	152.1 Å²	152.1	87%	0.87	80%	0.8	S	S	*	*				-178.8	153.6	111.7	-88.6	-58.3	0	0	0	111.2
153	S	27.5	Very low	35.4	Very low	113 Å²	113	150.8 Å²	150.8	79%	0.79	80%	0.801	S	S	*	*			trans	-113.7	-157.5	-172.4	-52.8	0	0	0	0	111.3
154	P	55.6	Low	35.1	Very low	115 Å²	115	158.1 Å²	158.1	75%	0.747	82%	0.82	S	S	*	*				-121.7	176.7	-112.8	38.6	-21	0	0	0	114.6
155	Q	29.7	Very low	35.8	Very low	196 Å²	196	154.1 Å²	154.1	92%	0.916	82%	0.821	S	S	*	*			trans	-156.4	161.8	157.7	-116.4	159	42.6	0	0	114.2
156	L	34.4	Very low	35.4	Very low	156 Å²	156	157.1 Å²	157.1	82%	0.817	82%	0.82	S	S	*	*			trans	-98	160.5	-174.1	-69.1	77.9	0	0	0	112
157	L	30.3	Very low	35.1	Very low	172 Å²	172	157.8 Å²	157.8	90%	0.901	82%	0.821	S	S	*	*				-176	159.6	115.2	-96.4	162.1	0	0	0	113.4
158	Q	33	Very low	34.8	Very low	171 Å²	171	150.6 Å²	150.6	80%	0.799	80%	0.804	S	S	*	*			trans	-125.9	-167.1	168.3	-59.4	-171.1	-43.9	0	0	107.2
159	P	47.8	Very low	34.7	Very low	102 Å²	102	148.1 Å²	148.1	66%	0.662	79%	0.79	S	S	*	*			cis	-141.4	166	-3.5	41	-21.2	0	0	0	118.7
160	I	34.6	Very low	34.4	Very low	157 Å²	157	143.4 Å²	143.4	81%	0.805	79%	0.788	S	S	*	*			trans	36	130.6	135.8	-54.6	166.6	0	0	0	121.7
161	A	25.8	Very low	34.3	Very low	96 Å²	96	143.3 Å²	143.3	79%	0.793	78%	0.78	S	S	*	*			trans	-157.1	141	142.8	0	0	0	0	0	113.5
162	T	37.2	Very low	34.1	Very low	133 Å²	133	143.1 Å²	143.1	82%	0.816	79%	0.789	S	S	*	*			trans	-152.8	149.3	166.5	50.4	0	0	0	0	109.3
163	P	45.6	Very low	34	Very low	126 Å²	126	138.6 Å²	138.6	82%	0.818	78%	0.784	S	S	*	*				-155.3	-178.2	100.1	39.8	-19.9	0	0	0	116.6
164	Y	35.1	Very low	33.9	Very low	221 Å²	221	142.4 Å²	142.4	87%	0.867	79%	0.789	S	S	*	*			trans	-90.7	174	171.1	-76	-92.5	0	0	0	112.9
165	P	47.7	Very low	32.7	Very low	132 Å²	132	142.7 Å²	142.7	86%	0.857	79%	0.788	S	S	*	*				-142.7	-168.6	100.5	37.9	-21.3	0	0	0	115.9
166	Y	29.3	Very low	32.7	Very low	167 Å²	167	141.7 Å²	141.7	66%	0.655	78%	0.783	S	S	*	*			trans	-138.7	150.2	-159.5	157.5	-82.1	0	0	0	113.1	D169	Y166-D169 PolarHBondContact OH-OD2 3.4Å
167	V	31.8	Very low	33.2	Very low	146 Å²	146	139 Å²	139	89%	0.885	78%	0.775	S	S	*	*			trans	-168.8	142.4	144.6	175.6	0	0	0	0	106.6
168	G	26.6	Very low	33.2	Very low	50 Å²	50	140.4 Å²	140.4	52%	0.515	77%	0.77	S	S	.	*			cis	-177.6	176.9	-1.6	0	0	0	0	0	111.8
169	D	31	Very low	33.1	Very low	116 Å²	116	138.8 Å²	138.8	62%	0.62	77%	0.766	S	S	*	*			trans	-85	162.4	-164.9	-50.2	-85	0	0	0	117.7	Y166 Y171	Y166-D169 PolarHBondContact OH-OD2 3.4Å; D169-Y171 HydrophobicContact CB-CE1 4.42Å
170	T	26.2	Very low	32.2	Very low	132 Å²	132	139.4 Å²	139.4	81%	0.81	77%	0.768	S	S	*	*			trans	-166.8	171.4	131.6	11.9	0	0	0	0	111.3
171	Y	29.7	Very low	31.7	Very low	192 Å²	192	141 Å²	141	75%	0.753	77%	0.765	S	S	*	*			trans	-120.5	147.2	-152.3	-22.3	-87.9	0	0	0	114.5	D169	D169-Y171 HydrophobicContact CB-CE1 4.42Å
172	S	26.3	Very low	32.4	Very low	125 Å²	125	142.4 Å²	142.4	87%	0.874	77%	0.766	S	S	*	*				163	163.4	127	-74	0	0	0	0	112.6
173	A	29.7	Very low	32.8	Very low	92 Å²	92	141.3 Å²	141.3	76%	0.76	76%	0.761	S	S	*	*			trans	-103.5	164.1	172.4	0	0	0	0	0	111.3
174	E	24.6	Very low	31.9	Very low	194 Å²	194	140.7 Å²	140.7	91%	0.907	76%	0.76	S	S	*	*				-178	-178.2	128.9	-85.2	-118.6	123	0	0	109.8
175	V	29.5	Very low	31.7	Very low	120 Å²	120	137.2 Å²	137.2	73%	0.727	76%	0.756	S	S	*	*			trans	-130.7	173.4	-165.3	173.3	0	0	0	0	110.7
176	H	29.5	Very low	30.8	Very low	175 Å²	175	135.9 Å²	135.9	81%	0.81	75%	0.75	S	S	*	*			trans	78.8	176.9	175.4	-69.5	-64.2	0	0	0	115.3
177	P	46.7	Very low	30.9	Very low	100 Å²	100	136.3 Å²	136.3	65%	0.649	76%	0.758	S	S	*	*			cis	-134.5	-160.8	-1.9	15.5	13	0	0	0	116
178	Y	28.9	Very low	30.6	Very low	201 Å²	201	132.7 Å²	132.7	79%	0.788	75%	0.751	S	S	*	*			trans	84.1	148.1	163.3	-71.7	-101.3	0	0	0	119.5
179	L	32.5	Very low	30.7	Very low	137 Å²	137	140.8 Å²	140.8	72%	0.717	77%	0.767	S	S	*	*			cis	-179.9	165.9	-29.2	-106.9	-149.8	0	0	0	108.2
180	V	28.1	Very low	30.6	Very low	115 Å²	115	146.8 Å²	146.8	70%	0.697	78%	0.781	S	S	*	*			cis	-161.8	-167.6	-7.5	72.1	0	0	0	0	112.2
181	Y	23.9	Very low	30.7	Very low	192 Å²	192	143.7 Å²	143.7	75%	0.753	78%	0.775	S	S	*	*			trans	-57.9	176.6	174.5	-90.9	-88.8	0	0	0	117.6	P183	Y181-P183 HydrophobicContact CD1-CG 4.29Å
182	P	40.1	Very low	30.7	Very low	124 Å²	124	140.8 Å²	140.8	81%	0.805	78%	0.783	S	S	*	*			cis	-145.5	175.5	45.9	40.6	-17.6	0	0	0	121.7
183	P	46.6	Very low	30.9	Very low	111 Å²	111	138.2 Å²	138.2	72%	0.721	78%	0.776	S	S	*	*			trans	-123.7	-165.8	-172.1	44.9	-29.5	0	0	0	114.4	Y181	Y181-P183 HydrophobicContact CD1-CG 4.29Å
184	S	26.4	Very low	30.9	Very low	112 Å²	112	140.9 Å²	140.9	78%	0.783	78%	0.783	S	S	*	*			trans	-149.3	133.9	163.1	60	0	0	0	0	114
185	D	30.3	Very low	31.1	Very low	148 Å²	148	136.7 Å²	136.7	79%	0.791	78%	0.775	S	S	*	*			trans	-25.3	169.5	171.1	-66.4	-66.7	0	0	0	121.6
186	S	29.2	Very low	32.4	Very low	104 Å²	104	136.1 Å²	136.1	73%	0.727	77%	0.774	S	S	*	*			cis	-152.7	143.9	20.3	40.9	0	0	0	0	116.4
187	Q	30.9	Very low	32.5	Very low	176 Å²	176	133.7 Å²	133.7	82%	0.822	77%	0.771	S	S	*	*			trans	18.6	148.3	138.8	-51.5	178.5	15.8	0	0	122.6
188	G	26.3	Very low	31.6	Very low	71 Å²	71	134.2 Å²	134.2	73%	0.732	78%	0.777	S	S	*	*			cis	162.3	177.8	-7	0	0	0	0	0	117.9
189	Y	29	Very low	31.7	Very low	220 Å²	220	134.1 Å²	134.1	86%	0.863	78%	0.776	S	S	*	*			trans	53.8	108	151.2	-78.9	-78.4	0	0	0	125.6
190	R	27.6	Very low	31.4	Very low	242 Å²	242	135.1 Å²	135.1	91%	0.913	77%	0.774	S	S	*	*				157.6	148.2	116.7	-84.6	-179.7	-171.2	-135.2	1.7	109.2
191	G	28.1	Very low	31.5	Very low	67 Å²	67	138.2 Å²	138.2	69%	0.691	78%	0.781	S	S	*	*			cis	104.8	120.9	12.1	0	0	0	0	0	110.8
192	S	31.6	Very low	31.8	Very low	130 Å²	130	132.9 Å²	132.9	91%	0.909	79%	0.785	S	S	*	*			cis	-153.8	-156.5	8.9	-66	0	0	0	0	111.3
193	G	28.5	Very low	31.4	Very low	71 Å²	71	139.4 Å²	139.4	73%	0.732	79%	0.793	S	S	*	*			trans	-66.4	-162.4	-176.9	0	0	0	0	0	116.8
194	V	30.3	Very low	30.5	Very low	148 Å²	148	137.6 Å²	137.6	90%	0.897	80%	0.795	S	S	*	*			cis	-155.5	165.1	24.3	-158.2	0	0	0	0	110.4
195	S	29.5	Very low	30.7	Very low	106 Å²	106	139.5 Å²	139.5	74%	0.741	80%	0.796	S	S	*	*			trans	-105	-178.3	170.6	-33.1	0	0	0	0	111.4
196	P	57.3	Low	30.8	Very low	109 Å²	109	137.8 Å²	137.8	71%	0.708	80%	0.796	S	S	*	*			cis	-130.1	-172.6	-23.2	36	-17.4	0	0	0	112.7
197	T	30.3	Very low	30.8	Very low	123 Å²	123	137 Å²	137	76%	0.755	80%	0.803	S	S	*	*				156.5	125.9	122.5	43.1	0	0	0	0	116.2
198	S	29.1	Very low	30.8	Very low	111 Å²	111	132.6 Å²	132.6	78%	0.776	81%	0.806	S	S	*	*			trans	65.1	167.9	144.1	88.5	0	0	0	0	118.9
199	R	30.1	Very low	31.3	Very low	200 Å²	200	137.6 Å²	137.6	76%	0.755	81%	0.809	S	S	*	*			cis	-162.7	169.2	-9.8	-136.7	177.6	-167.6	179.9	4.6	109.8
200	F	27.2	Very low	31.5	Very low	158 Å²	158	136.3 Å²	136.3	69%	0.693	81%	0.811	S	S	*	*			trans	65.8	138.4	171.4	-56.4	-69	0	0	0	116.4
201	Q	30.3	Very low	31.7	Very low	180 Å²	180	130.8 Å²	130.8	84%	0.841	80%	0.8	S	S	*	*			cis	99.6	111	16.1	-168.3	177.8	22.5	0	0	114.3
202	G	28.9	Very low	32	Very low	80 Å²	80	134.1 Å²	134.1	83%	0.825	80%	0.8	S	S	*	*			trans	-166	141.7	172.8	0	0	0	0	0	111.7
203	R	31.5	Very low	31.9	Very low	261 Å²	261	139.6 Å²	139.6	99%	0.985	80%	0.801	S	S	*	*			trans	-123.5	160.4	177.5	-92.4	-176.2	166	-162.5	-2.4	109.4
204	G	28.8	Very low	31.8	Very low	73 Å²	73	139.6 Å²	139.6	75%	0.753	80%	0.801	S	S	*	*			trans	126.8	102.9	176	0	0	0	0	0	110.3
205	D	30.2	Very low	31.6	Very low	152 Å²	152	142.5 Å²	142.5	81%	0.813	80%	0.802	S	S	*	*			cis	97.9	128.7	22.4	-159.3	5.5	0	0	0	114.6
206	S	33.3	Very low	31.8	Very low	112 Å²	112	144.6 Å²	144.6	78%	0.783	80%	0.804	S	S	*	*			trans	62.3	119.8	161.1	-69.1	0	0	0	0	122.1
207	G	29.2	Very low	30.4	Very low	86 Å²	86	144.9 Å²	144.9	89%	0.887	81%	0.809	S	S	*	*			trans	125.4	126.7	135.7	0	0	0	0	0	117.9
208	G	29.3	Very low	30.7	Very low	84 Å²	84	151 Å²	151	87%	0.866	82%	0.818	S	S	*	*			trans	147.9	89.9	164	0	0	0	0	0	116.1
209	H	37.4	Very low	30.5	Very low	176 Å²	176	154.3 Å²	154.3	82%	0.815	82%	0.822	S	S	*	*			trans	-86.8	143.4	165.7	-119.6	-82	0	0	0	110
210	H	33.1	Very low	30.5	Very low	193 Å²	193	153.5 Å²	153.5	89%	0.894	83%	0.827	S	S	*	*			trans	-162.2	170	146.7	-104	-58.2	0	0	0	110.9
211	D	32.6	Very low	30.5	Very low	126 Å²	126	153.3 Å²	153.3	67%	0.674	83%	0.828	S	S	*	*			trans	-133.8	160.3	-148.1	-124.5	-41.5	0	0	0	114.9
212	I	32.8	Very low	30.6	Very low	138 Å²	138	152.5 Å²	152.5	71%	0.708	82%	0.824	S	S	*	*			trans	53.6	102.3	156.2	-64.3	153.5	0	0	0	118.3
213	R	29.9	Very low	30.4	Very low	245 Å²	245	155.2 Å²	155.2	93%	0.925	82%	0.819	S	S	*	*				-175.8	143.6	113.2	-99.8	169	-158.2	-147.3	2.2	111.1
214	G	27.7	Very low	30.5	Very low	70 Å²	70	150 Å²	150	72%	0.722	81%	0.81	S	S	*	*			trans	-110.5	157.2	172.2	0	0	0	0	0	112.1
215	F	26.1	Very low	30.9	Very low	209 Å²	209	155.7 Å²	155.7	92%	0.917	82%	0.82	S	S	*	*			trans	-155.9	152.5	151.9	-133	-87.3	0	0	0	109.8
216	D	32.7	Very low	30.8	Very low	150 Å²	150	152.3 Å²	152.3	80%	0.802	81%	0.813	S	S	*	*			trans	-63.3	141	176.1	-102.3	-59.2	0	0	0	112.3
217	S	28.5	Very low	30.9	Very low	116 Å²	116	155.3 Å²	155.3	81%	0.811	82%	0.819	S	S	*	*			trans	-156.1	131.8	154.4	-85.8	0	0	0	0	111.7
218	R	35.7	Very low	31.2	Very low	250 Å²	250	159.5 Å²	159.5	94%	0.943	82%	0.815	S	S	*	*			trans	-59.1	135.4	172.3	-67.5	165.2	162.9	169.2	-6.7	110.2
219	Q	26.6	Very low	31.3	Very low	181 Å²	181	161 Å²	161	85%	0.846	81%	0.813	S	S	*	*			trans	-127.1	126.2	150.8	-106.7	175.6	-14.4	0	0	109.5
220	Q	29.7	Very low	31.3	Very low	184 Å²	184	162 Å²	162	86%	0.86	81%	0.81	S	S	*	*			trans	-67.9	129.9	158.6	-66.3	165.2	-77.9	0	0	106.5
221	H	26.3	Very low	31.5	Very low	154 Å²	154	158.2 Å²	158.2	71%	0.713	80%	0.797	S	S	*	*			trans	-115	124.4	159.7	-132.3	-93.8	0	0	0	108.9	D223	H221-D223 IonicContact CE1-OD1 3.16Å; H221-D223 IonicContact CG-OD1 2.79Å; H221-D223 IonicContact ND1-OD1 2.68Å; H221-D223 PolarHBondContact ND1-OD1 3.48Å
222	Q	31.6	Very low	31.8	Very low	163 Å²	163	157 Å²	157	76%	0.762	80%	0.795	S	S	*	*			trans	-111.1	79.7	-170.9	-178.6	173.3	-13.9	0	0	106.7	L224	Q222-L224 WeakPolarHBondContact O-CD1 3.35Å; Q222-L224 PolarHBondContact O-N 2.97Å
223	D	26	Very low	32	Very low	136 Å²	136	157.3 Å²	157.3	73%	0.727	80%	0.798	S	S	*	*			trans	-72.6	103.1	-170.6	-72	-7.1	0	0	0	110.6	H221	H221-D223 IonicContact CE1-OD1 3.16Å; H221-D223 IonicContact CG-OD1 2.79Å; H221-D223 IonicContact ND1-OD1 2.68Å; H221-D223 PolarHBondContact ND1-OD1 3.48Å
224	L	32.6	Very low	32.6	Very low	152 Å²	152	149.6 Å²	149.6	80%	0.796	78%	0.775	S	S	*	*			trans	-57.4	159.6	167.2	-81.8	83.9	0	0	0	110.5	Q222 A226	Q222-L224 WeakPolarHBondContact O-CD1 3.35Å; Q222-L224 PolarHBondContact O-N 2.97Å; L224-A226 PolarHBondContact O-N 3.21Å
225	M	37.2	Very low	33.3	Very low	193 Å²	193	149.1 Å²	149.1	95%	0.951	76%	0.756	S	S	*	*			trans	-54.7	100.7	176	-69.6	-169.6	175.3	0	0	112.3	L227	M225-L227 PolarHBondContact O-N 2.88Å
226	A	29.3	Very low	34.2	Very low	81 Å²	81	144.6 Å²	144.6	67%	0.669	74%	0.741	S	S	*	*			trans	-69.8	110.6	167.4	0	0	0	0	0	109.1	L224 H228	L224-A226 PolarHBondContact O-N 3.21Å; A226-H228 VanDerWaalsContact C-N 3.35Å; A226-H228 PolarHBondContact O-N 2.9Å
227	L	35.8	Very low	34.8	Very low	174 Å²	174	145.1 Å²	145.1	91%	0.911	73%	0.733	S	S	*	*			trans	-65	93.8	168.4	-77.6	165.7	0	0	0	109.1	M225 S229	M225-L227 PolarHBondContact O-N 2.88Å; L227-S229 PolarHBondContact O-N 3.48Å
228	H	35	Very low	35.5	Very low	175 Å²	175	141.7 Å²	141.7	81%	0.81	71%	0.705	S	S	*	*			trans	-59.2	125.1	170.4	-81.8	-32.2	0	0	0	110.2	A226 Y230	A226-H228 VanDerWaalsContact C-N 3.35Å; A226-H228 PolarHBondContact O-N 2.9Å; H228-Y230 PolarHBondContact O-N 2.89Å; H228-Y230 VanDerWaalsContact O-N 3.14Å
229	S	31.3	Very low	36.4	Very low	116 Å²	116	137 Å²	137	81%	0.811	69%	0.694	S	S	*	*			trans	-54.5	118.4	176.5	-66.1	0	0	0	0	111.2	L227 N231	L227-S229 PolarHBondContact O-N 3.48Å; S229-N231 PolarHBondContact O-N 3.2Å; S229-N231 VanDerWaalsContact O-N 3.09Å
230	Y	37.8	Very low	37.5	Very low	196 Å²	196	131.3 Å²	131.3	77%	0.769	67%	0.665	S	S	*	*			trans	-63	109.7	-178.1	-150.5	-85.5	0	0	0	110	H228 P232	H228-Y230 PolarHBondContact O-N 2.89Å; H228-Y230 VanDerWaalsContact O-N 3.14Å; Y230-P232 WeakPolarHBondContact O-CD 3.42Å
231	N	36.4	Very low	38.5	Very low	113 Å²	113	125.9 Å²	125.9	60%	0.604	65%	0.646	S	S	*	*			trans	-104.4	101.3	-174.1	-168.5	-9.9	0	0	0	110.5	S229 L233	S229-N231 PolarHBondContact O-N 3.2Å; S229-N231 VanDerWaalsContact O-N 3.09Å; N231-L233 PolarHBondContact O-N 3.23Å
232	P	38.2	Very low	39.9	Very low	100 Å²	100	124.2 Å²	124.2	65%	0.649	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-3.2	-163.2	-21.3	35	0	0	0	116.2	Y230	Y230-P232 WeakPolarHBondContact O-CD 3.42Å
233	L	38.6	Very low	41.6	Very low	146 Å²	146	119.2 Å²	119.2	76%	0.764	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-21.8	-173.6	-70.8	169.2	0	0	0	114.3	N231	N231-L233 PolarHBondContact O-N 3.23Å
234	D	41.8	Very low	43.7	Very low	82 Å²	82	118.1 Å²	118.1	44%	0.439	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85	-29.6	-178	-159.2	20.8	0	0	0	112.4	L236 R418	D234-L236 VanDerWaalsContact C-N 3.33Å; D234-L236 PolarHBondContact O-N 3.35Å; D234-R418 PolarHBondContact O-NH2 3.38Å; D234-R418 IonicContact OD1-CZ 3.79Å; D234-R418 IonicContact OD1-NE 3.89Å; D234-R418 IonicContact OD1-NH2 3.13Å; D234-R418 PolarHBondContact OD1-NH2 3.42Å
235	D	42.8	Very low	45.7	Very low	60 Å²	60	118.9 Å²	118.9	32%	0.321	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-75.4	-16.5	-173.1	-158.9	39.9	0	0	0	114	Y237 N238	D235-Y237 PolarHBondContact O-N 3.36Å; D235-N238 PolarHBondContact O-N 2.92Å; D235-N238 WeakPolarHBondContact OD1-CB 3.41Å; D235-N238 PolarHBondContact OD1-ND2 2.96Å
236	L	44.5	Very low	48	Very low	115 Å²	115	110.7 Å²	110.7	60%	0.602	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-62.4	-8.6	-178.3	-163.5	66.3	0	0	0	114.1	P65 D234	P65-L236 HydrophobicContact CB-CD2 4.37Å; D234-L236 VanDerWaalsContact C-N 3.33Å; D234-L236 PolarHBondContact O-N 3.35Å
237	Y	45.3	Very low	50.9	Low	161 Å²	161	107.7 Å²	107.7	63%	0.631	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-120.1	1.7	176.7	-70.5	-85.3	0	0	0	114.2	D235 H239	D235-Y237 PolarHBondContact O-N 3.36Å; Y237-H239 PolarHBondContact O-N 3.41Å
238	N	43.2	Very low	53.6	Low	44 Å²	44	103.1 Å²	103.1	24%	0.235	52%	0.516	C	S	.	.			trans	-73.1	99.4	171.7	-81.5	-26	0	0	0	109.4	D235 Y240	D235-N238 PolarHBondContact O-N 2.92Å; D235-N238 WeakPolarHBondContact OD1-CB 3.41Å; D235-N238 PolarHBondContact OD1-ND2 2.96Å; N238-Y240 PolarHBondContact O-N 3.5Å; N238-Y240 VanDerWaalsContact O-N 3.12Å
239	H	53.9	Low	56.4	Low	152 Å²	152	98.7 Å²	98.7	70%	0.704	50%	0.496	S	S	*	.	S	Bend	trans	-65.3	-13.6	178.1	-121.2	61.7	0	0	0	113.7	Y237	Y237-H239 PolarHBondContact O-N 3.41Å
240	Y	49.7	Very low	59.4	Low	61 Å²	61	93.4 Å²	93.4	24%	0.239	46%	0.459	C	S	.	.	S	Bend	trans	-126.8	99.2	166.9	-71	-56.3	0	0	0	108.4	N238 N246 L250 P316	N238-Y240 PolarHBondContact O-N 3.5Å; N238-Y240 VanDerWaalsContact O-N 3.12Å; Y240-N246 HydrophobicContact CD1-CB 3.5Å; Y240-N246 HydrophobicContact CE1-CB 4.26Å; Y240-N246 HydrophobicContact CG-CB 4.03Å; Y240-L250 HydrophobicContact CD2-CB 4.34Å; Y240-L250 HydrophobicContact CD2-CD2 4.5Å; Y240-L250 HydrophobicContact CE2-CB 3.87Å; Y240-L250 HydrophobicContact CE2-CD1 4.22Å; Y240-L250 HydrophobicContact CE2-CG 4.47Å; Y240-P316 HydrophobicContact CE2-CB 3.94Å
241	P	51.5	Low	62.3	Low	70 Å²	70	84.1 Å²	84.1	46%	0.455	42%	0.422	S	S	.	.			trans	-57.6	147.6	160.3	24.4	-32.9	0	0	0	108.8	S243 N246	P241-S243 PolarHBondContact O-N 2.88Å; P241-N246 WeakPolarHBondContact CD-ND2 3.47Å; P241-N246 PolarHBondContact O-ND2 3.15Å
242	H	56.2	Low	65.1	Low	118 Å²	118	80.9 Å²	80.9	55%	0.546	41%	0.411	S	S	.	.	S	Bend	trans	-69.8	34	-165.7	-65.7	-70.5	0	0	0	116.4
243	S	67.3	Low	68	Low	59 Å²	59	77.4 Å²	77.4	41%	0.413	39%	0.389	S	S	.	.			trans	-72.6	144.2	167.6	70.6	0	0	0	0	110.9	P241 R245 N246 I247	P241-S243 PolarHBondContact O-N 2.88Å; S243-R245 VanDerWaalsContact C-N 3.3Å; S243-R245 PolarHBondContact O-N 3.36Å; S243-N246 WeakPolarHBondContact O-CB 3.25Å; S243-N246 PolarHBondContact O-N 3.41Å; S243-N246 VanDerWaalsContact O-N 3.11Å; S243-N246 VanDerWaalsContact OG-CG 3.3Å; S243-N246 PolarHBondContact OG-ND2 2.77Å; S243-I247 PolarHBondContact O-N 2.83Å
244	L	69.1	Low	70.8	Confident	113 Å²	113	70.4 Å²	70.4	59%	0.592	35%	0.353	S	S	*	.	H	α-helix	trans	-55.7	-43.3	-176.7	-65.1	170.3	0	0	0	112.5	N246 I247 D248	L244-N246 PolarHBondContact O-N 2.88Å; L244-N246 VanDerWaalsContact O-N 3.15Å; L244-I247 WeakPolarHBondContact O-CA 3.37Å; L244-I247 WeakPolarHBondContact O-CB 3.34Å; L244-I247 PolarHBondContact O-N 2.78Å; L244-D248 PolarHBondContact O-N 3.04Å
245	R	75.2	Confident	73.5	Confident	167 Å²	167	68.4 Å²	68.4	63%	0.63	34%	0.343	S	S	*	.	H	α-helix	trans	-56.7	-34.3	-180	-150.9	-163.6	85	-154.2	0.8	113.3	S243 E249	S243-R245 VanDerWaalsContact C-N 3.3Å; S243-R245 PolarHBondContact O-N 3.36Å; R245-E249 IonicContact CZ-OE1 3.11Å; R245-E249 IonicContact NE-OE1 2.7Å; R245-E249 PolarHBondContact NE-OE1 2.91Å; R245-E249 IonicContact NH2-OE1 3.49Å; R245-E249 PolarHBondContact NH2-OE1 3.04Å; R245-E249 IonicContact NH2-OE2 3.42Å; R245-E249 WeakPolarHBondContact O-CB 3.43Å; R245-E249 VanDerWaalsContact O-CG 3.31Å; R245-E249 WeakPolarHBondContact O-CG 3.38Å; R245-E249 PolarHBondContact O-N 2.88Å
246	N	85.3	Confident	76.1	Confident	21 Å²	21	71.7 Å²	71.7	11%	0.112	35%	0.351	C	S	.	.	H	α-helix	trans	-71.8	-35.3	177.4	-74.6	-8.3	0	0	0	111.9	Y240 P241 S243 L244 L250	Y240-N246 HydrophobicContact CD1-CB 3.5Å; Y240-N246 HydrophobicContact CE1-CB 4.26Å; Y240-N246 HydrophobicContact CG-CB 4.03Å; P241-N246 WeakPolarHBondContact CD-ND2 3.47Å; P241-N246 PolarHBondContact O-ND2 3.15Å; S243-N246 WeakPolarHBondContact O-CB 3.25Å; S243-N246 PolarHBondContact O-N 3.41Å; S243-N246 VanDerWaalsContact O-N 3.11Å; S243-N246 VanDerWaalsContact OG-CG 3.3Å; S243-N246 PolarHBondContact OG-ND2 2.77Å; L244-N246 PolarHBondContact O-N 2.88Å; L244-N246 VanDerWaalsContact O-N 3.15Å; N246-L250 WeakPolarHBondContact O-CB 3.39Å; N246-L250 PolarHBondContact O-N 2.92Å
247	I	90.5	Very high	78.7	Confident	19 Å²	19	66.3 Å²	66.3	10%	0.097	32%	0.323	C	S	.	.	H	α-helix	trans	-70.2	-42.1	175.9	-57.5	169.8	0	0	0	109.6	S243 L244 L250 C251 V425 H429	S243-I247 PolarHBondContact O-N 2.83Å; L244-I247 WeakPolarHBondContact O-CA 3.37Å; L244-I247 WeakPolarHBondContact O-CB 3.34Å; L244-I247 PolarHBondContact O-N 2.78Å; I247-L250 WeakPolarHBondContact O-CB 2.99Å; I247-L250 PolarHBondContact O-N 2.84Å; I247-C251 WeakPolarHBondContact O-CB 3.2Å; I247-C251 PolarHBondContact O-N 2.97Å; I247-C251 PolarHBondContact O-SG 3.08Å; I247-V425 HydrophobicContact CD1-CG1 3.81Å; I247-V425 HydrophobicContact CG1-CG1 4.29Å; I247-H429 HydrophobicContact CG2-CB 3.9Å
248	D	92.5	Very high	81.2	Confident	77 Å²	77	58.8 Å²	58.8	41%	0.412	29%	0.293	S	S	.	.	H	α-helix	trans	-58.9	-48.9	172	-75.9	-53.9	0	0	0	112.1	L244 L250 C251 A252	L244-D248 PolarHBondContact O-N 3.04Å; D248-L250 VanDerWaalsContact C-N 3.34Å; D248-L250 PolarHBondContact O-N 3.33Å; D248-C251 PolarHBondContact O-N 3.28Å; D248-A252 WeakPolarHBondContact O-CB 3.49Å; D248-A252 PolarHBondContact O-N 3.06Å
249	E	93.3	Very high	83.7	Confident	82 Å²	82	65.1 Å²	65.1	38%	0.383	31%	0.314	S	S	.	.	H	α-helix	trans	-58.8	-43.3	177.4	-78	174.4	-144.6	0	0	112.2	R245 S253	R245-E249 IonicContact CZ-OE1 3.11Å; R245-E249 IonicContact NE-OE1 2.7Å; R245-E249 PolarHBondContact NE-OE1 2.91Å; R245-E249 IonicContact NH2-OE1 3.49Å; R245-E249 PolarHBondContact NH2-OE1 3.04Å; R245-E249 IonicContact NH2-OE2 3.42Å; R245-E249 WeakPolarHBondContact O-CB 3.43Å; R245-E249 VanDerWaalsContact O-CG 3.31Å; R245-E249 WeakPolarHBondContact O-CG 3.38Å; R245-E249 PolarHBondContact O-N 2.88Å; E249-S253 PolarHBondContact O-N 3Å
250	L	95.1	Very high	85.7	Confident	6 Å²	6	63.6 Å²	63.6	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	-59.5	-53.1	174	168.1	60.7	0	0	0	111.6	Y240 N246 I247 D248 A252 S253 I254 P316 S422	Y240-L250 HydrophobicContact CD2-CB 4.34Å; Y240-L250 HydrophobicContact CD2-CD2 4.5Å; Y240-L250 HydrophobicContact CE2-CB 3.87Å; Y240-L250 HydrophobicContact CE2-CD1 4.22Å; Y240-L250 HydrophobicContact CE2-CG 4.47Å; N246-L250 WeakPolarHBondContact O-CB 3.39Å; N246-L250 PolarHBondContact O-N 2.92Å; I247-L250 WeakPolarHBondContact O-CB 2.99Å; I247-L250 PolarHBondContact O-N 2.84Å; D248-L250 VanDerWaalsContact C-N 3.34Å; D248-L250 PolarHBondContact O-N 3.33Å; L250-A252 PolarHBondContact O-N 3.43Å; L250-S253 PolarHBondContact O-N 3.43Å; L250-I254 HydrophobicContact CD1-CD1 3.71Å; L250-I254 HydrophobicContact CD1-CG1 4.42Å; L250-I254 HydrophobicContact CG-CD1 4.27Å; L250-I254 PolarHBondContact O-N 3.32Å; L250-I254 VanDerWaalsContact O-N 3.15Å; L250-P316 HydrophobicContact CD1-CB 3.87Å; L250-P316 HydrophobicContact CD1-CG 3.63Å; L250-S422 VanDerWaalsContact CD2-O 3.24Å; L250-S422 WeakPolarHBondContact CD2-O 3.33Å
251	C	97.4	Very high	88	Confident	1 Å²	1	61 Å²	61	1%	0.007	30%	0.298	C	S	.	.	H	α-helix	trans	-61	-44.6	179.5	-72.2	0	0	0	0	111.3	I247 D248 S253 I254 V255 L396 G426	I247-C251 WeakPolarHBondContact O-CB 3.2Å; I247-C251 PolarHBondContact O-N 2.97Å; I247-C251 PolarHBondContact O-SG 3.08Å; D248-C251 PolarHBondContact O-N 3.28Å; C251-S253 VanDerWaalsContact C-N 3.29Å; C251-S253 PolarHBondContact O-N 3.21Å; C251-I254 PolarHBondContact O-N 3.05Å; C251-V255 VanDerWaalsContact O-CG2 3.27Å; C251-V255 WeakPolarHBondContact O-CG2 3.43Å; C251-V255 PolarHBondContact O-N 3.02Å; C251-L396 HydrophobicContact CB-CD1 4.37Å; C251-G426 VanDerWaalsContact SG-CA 3.52Å
252	A	96.8	Very high	90	Very high	45 Å²	45	58.7 Å²	58.7	37%	0.372	28%	0.283	S	S	.	.	H	α-helix	trans	-62.8	-34.6	177.9	0	0	0	0	0	112.4	D248 L250 R256	D248-A252 WeakPolarHBondContact O-CB 3.49Å; D248-A252 PolarHBondContact O-N 3.06Å; L250-A252 PolarHBondContact O-N 3.43Å; A252-R256 WeakPolarHBondContact O-CB 3.36Å; A252-R256 PolarHBondContact O-N 3.22Å
253	S	97.6	Very high	91.5	Very high	26 Å²	26	57.1 Å²	57.1	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-64.5	-45.8	174	-164.6	0	0	0	0	112.2	E249 L250 C251 R256 S257 H314	E249-S253 PolarHBondContact O-N 3Å; L250-S253 PolarHBondContact O-N 3.43Å; C251-S253 VanDerWaalsContact C-N 3.29Å; C251-S253 PolarHBondContact O-N 3.21Å; S253-R256 PolarHBondContact O-N 3.33Å; S253-S257 WeakPolarHBondContact O-CB 3.36Å; S253-S257 PolarHBondContact O-N 2.85Å; S253-H314 PolarHBondContact OG-O 3.39Å; S253-H314 VanDerWaalsContact OG-O 3.05Å
254	I	98.6	Very high	92.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.7	-41.9	-179.2	-65.9	168.9	0	0	0	111.1	L250 C251 S257 H258 F311 I315 A395 L396 A399 V423	L250-I254 HydrophobicContact CD1-CD1 3.71Å; L250-I254 HydrophobicContact CD1-CG1 4.42Å; L250-I254 HydrophobicContact CG-CD1 4.27Å; L250-I254 PolarHBondContact O-N 3.32Å; L250-I254 VanDerWaalsContact O-N 3.15Å; C251-I254 PolarHBondContact O-N 3.05Å; I254-S257 PolarHBondContact O-N 3.01Å; I254-H258 WeakPolarHBondContact O-CB 3.47Å; I254-H258 PolarHBondContact O-N 3.25Å; I254-F311 HydrophobicContact CG2-CE2 4.15Å; I254-F311 HydrophobicContact CG2-CZ 4.12Å; I254-I315 HydrophobicContact CD1-CG2 4.25Å; I254-I315 HydrophobicContact CG1-CG2 4.33Å; I254-A395 HydrophobicContact CG2-CB 4.22Å; I254-A395 WeakPolarHBondContact CG2-O 3.19Å; I254-L396 HydrophobicContact CB-CD2 4.23Å; I254-L396 HydrophobicContact CD1-CD2 3.78Å; I254-L396 HydrophobicContact CG2-CD2 4.12Å; I254-L396 HydrophobicContact CG2-CG 4.41Å; I254-A399 HydrophobicContact CD1-CB 4.16Å; I254-A399 HydrophobicContact CG2-CB 3.85Å; I254-V423 HydrophobicContact CD1-CG1 4.42Å; I254-V423 HydrophobicContact CD1-CG2 4.02Å
255	V	98.3	Very high	93.7	Very high	39 Å²	39	59 Å²	59	24%	0.236	27%	0.267	C	S	.	.	H	α-helix	trans	-65.7	-44	176.3	175.8	0	0	0	0	111.8	C251 S257 H258 R259 Q392 A395	C251-V255 VanDerWaalsContact O-CG2 3.27Å; C251-V255 WeakPolarHBondContact O-CG2 3.43Å; C251-V255 PolarHBondContact O-N 3.02Å; V255-S257 PolarHBondContact O-N 3.45Å; V255-H258 PolarHBondContact O-N 2.9Å; V255-R259 WeakPolarHBondContact O-CB 3.2Å; V255-R259 PolarHBondContact O-N 3.45Å; V255-Q392 HydrophobicContact CG2-CB 3.94Å; V255-Q392 HydrophobicContact CG2-CG 3.6Å; V255-A395 HydrophobicContact CG2-CB 4.22Å
256	R	97.8	Very high	94.3	Very high	130 Å²	130	54.5 Å²	54.5	49%	0.491	26%	0.255	S	S	.	.	H	α-helix	trans	-57.7	-50.1	175.3	-174.9	-170.2	-54.3	104.9	4.5	110.6	A252 S253 H258 R259 E260	A252-R256 WeakPolarHBondContact O-CB 3.36Å; A252-R256 PolarHBondContact O-N 3.22Å; S253-R256 PolarHBondContact O-N 3.33Å; R256-H258 PolarHBondContact O-N 2.97Å; R256-R259 PolarHBondContact O-N 3.42Å; R256-E260 WeakPolarHBondContact CD-OE1 3.5Å; R256-E260 VanDerWaalsContact CG-CD 3.49Å; R256-E260 HydrophobicContact CG-CG 4.39Å; R256-E260 WeakPolarHBondContact CG-OE1 3.31Å; R256-E260 WeakPolarHBondContact O-CB 3.32Å; R256-E260 WeakPolarHBondContact O-CG 3.35Å; R256-E260 PolarHBondContact O-N 2.94Å
257	S	98.3	Very high	94.6	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-58.1	-44.6	176.6	179.2	0	0	0	0	112.6	S253 I254 V255 R259 E260 T261 F311 H314	S253-S257 WeakPolarHBondContact O-CB 3.36Å; S253-S257 PolarHBondContact O-N 2.85Å; I254-S257 PolarHBondContact O-N 3.01Å; V255-S257 PolarHBondContact O-N 3.45Å; S257-R259 VanDerWaalsContact C-N 3.34Å; S257-R259 PolarHBondContact O-N 2.95Å; S257-E260 PolarHBondContact O-N 3.24Å; S257-T261 WeakPolarHBondContact O-CB 3.44Å; S257-T261 WeakPolarHBondContact O-CG2 3.39Å; S257-T261 PolarHBondContact O-N 3.49Å; S257-T261 PolarHBondContact O-OG1 3.43Å; S257-F311 VanDerWaalsContact OG-CA 3.32Å; S257-F311 WeakPolarHBondContact OG-CA 3.46Å; S257-F311 WeakPolarHBondContact OG-CD2 3.47Å; S257-F311 PolarHBondContact OG-O 3.3Å; S257-H314 WeakPolarHBondContact OG-CB 3.47Å
258	H	97.8	Very high	94.7	Very high	3 Å²	3	62.4 Å²	62.4	1%	0.014	29%	0.291	C	S	.	.	H	α-helix	trans	-60.1	-43.1	176.5	178.1	85.2	0	0	0	112	I254 V255 R256 T261 S262 F311 R341 A395	I254-H258 WeakPolarHBondContact O-CB 3.47Å; I254-H258 PolarHBondContact O-N 3.25Å; V255-H258 PolarHBondContact O-N 2.9Å; R256-H258 PolarHBondContact O-N 2.97Å; H258-T261 CarbonylContact O-C 3.24Å; H258-T261 PolarHBondContact O-N 2.95Å; H258-T261 PolarHBondContact O-OG1 3.48Å; H258-S262 WeakPolarHBondContact O-CB 3.4Å; H258-S262 PolarHBondContact O-N 2.98Å; H258-S262 PolarHBondContact O-OG 3.33Å; H258-F311 HydrophobicContact CB-CD2 4.36Å; H258-F311 HydrophobicContact CB-CE2 3.94Å; H258-R341 PolarHBondContact CE1-NE 2.93Å; H258-R341 VanDerWaalsContact CE1-NE 3.29Å; H258-R341 PolarHBondContact CE1-NH2 3.17Å; H258-A395 HydrophobicContact CB-CB 3.4Å
259	R	96.1	Very high	94.8	Very high	178 Å²	178	59.1 Å²	59.1	67%	0.672	27%	0.273	S	S	*	.	H	α-helix	trans	-67.2	-42.3	177.2	-177.6	175.7	179	-101.5	5.9	112.6	V255 R256 S257 T261 S262	V255-R259 WeakPolarHBondContact O-CB 3.2Å; V255-R259 PolarHBondContact O-N 3.45Å; R256-R259 PolarHBondContact O-N 3.42Å; S257-R259 VanDerWaalsContact C-N 3.34Å; S257-R259 PolarHBondContact O-N 2.95Å; R259-T261 VanDerWaalsContact C-N 3.27Å; R259-T261 PolarHBondContact O-N 3.29Å; R259-S262 PolarHBondContact O-N 3.15Å
260	E	95.9	Very high	94.7	Very high	120 Å²	120	60.4 Å²	60.4	56%	0.561	28%	0.279	S	S	*	.	H	α-helix	trans	-70.7	-22.9	178.2	-72.7	166.1	176.6	0	0	112.8	R256 S257	R256-E260 WeakPolarHBondContact CD-OE1 3.5Å; R256-E260 VanDerWaalsContact CG-CD 3.49Å; R256-E260 HydrophobicContact CG-CG 4.39Å; R256-E260 WeakPolarHBondContact CG-OE1 3.31Å; R256-E260 WeakPolarHBondContact O-CB 3.32Å; R256-E260 WeakPolarHBondContact O-CG 3.35Å; R256-E260 PolarHBondContact O-N 2.94Å; S257-E260 PolarHBondContact O-N 3.24Å
261	T	96.8	Very high	94.7	Very high	6 Å²	6	64.2 Å²	64.2	4%	0.037	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	16.4	176.5	62.1	0	0	0	0	113.4	S257 H258 R259 Y307 E310 F311 R341	S257-T261 WeakPolarHBondContact O-CB 3.44Å; S257-T261 WeakPolarHBondContact O-CG2 3.39Å; S257-T261 PolarHBondContact O-N 3.49Å; S257-T261 PolarHBondContact O-OG1 3.43Å; H258-T261 CarbonylContact O-C 3.24Å; H258-T261 PolarHBondContact O-N 2.95Å; H258-T261 PolarHBondContact O-OG1 3.48Å; R259-T261 VanDerWaalsContact C-N 3.27Å; R259-T261 PolarHBondContact O-N 3.29Å; T261-Y307 WeakPolarHBondContact CB-O 3.34Å; T261-E310 HydrophobicContact CG2-CB 3.96Å; T261-E310 HydrophobicContact CG2-CG 4.29Å; T261-F311 HydrophobicContact CG2-CB 4.19Å; T261-R341 PolarHBondContact O-NH1 2.71Å; T261-R341 PolarHBondContact OG1-NH1 3.39Å; T261-R341 VanDerWaalsContact OG1-NH1 3.17Å; T261-R341 PolarHBondContact OG1-NH2 3Å
262	S	93.7	Very high	94.6	Very high	21 Å²	21	66.2 Å²	66.2	15%	0.147	32%	0.321	C	S	.	.			trans	-99.8	108.4	170.7	-73.1	0	0	0	0	108.9	H258 R259 Y264	H258-S262 WeakPolarHBondContact O-CB 3.4Å; H258-S262 PolarHBondContact O-N 2.98Å; H258-S262 PolarHBondContact O-OG 3.33Å; R259-S262 PolarHBondContact O-N 3.15Å; S262-Y264 PolarHBondContact O-N 2.65Å; S262-Y264 VanDerWaalsContact O-N 3.1Å
263	Q	88.6	Confident	94.4	Very high	86 Å²	86	66.5 Å²	66.5	40%	0.402	31%	0.313	S	S	.	.	S	Bend	trans	-55.2	-30.3	-176.7	-173.3	-178.4	28	0	0	113.3	Y307	Q263-Y307 HydrophobicContact CB-CE2 4.19Å; Q263-Y307 HydrophobicContact CG-CE2 4.41Å
264	Y	91.9	Very high	94.2	Very high	59 Å²	59	73.7 Å²	73.7	23%	0.231	34%	0.336	C	S	.	.	S	Bend	trans	-129.3	143.5	175.7	-61.8	-96.6	0	0	0	110.8	S262 L269 L272 R344 F345 F354	S262-Y264 PolarHBondContact O-N 2.65Å; S262-Y264 VanDerWaalsContact O-N 3.1Å; Y264-L269 HydrophobicContact CD1-CD2 4.47Å; Y264-L269 HydrophobicContact CD2-CD2 4.46Å; Y264-L269 HydrophobicContact CG-CD2 4.06Å; Y264-L269 HydrophobicContact CG-CG 4.37Å; Y264-L272 HydrophobicContact CE1-CD1 4.44Å; Y264-R344 PolarHBondContact O-NH1 3.45Å; Y264-R344 PolarHBondContact O-NH2 3.43Å; Y264-R344 VanDerWaalsContact O-NH2 3.08Å; Y264-F345 AromaticContact CD2-CE1 3.75Å; Y264-F345 HydrophobicContact CD2-CE1 3.75Å; Y264-F345 HydrophobicContact CD2-CZ 4.33Å; Y264-F345 HydrophobicContact CE2-CE1 4.44Å; Y264-F345 HydrophobicContact CG-CE1 4.47Å; Y264-F354 HydrophobicContact CD2-CE1 4.29Å; Y264-F354 HydrophobicContact CE1-CE1 4.26Å; Y264-F354 HydrophobicContact CE1-CZ 4.13Å; Y264-F354 AromaticContact CE2-CE1 3.64Å; Y264-F354 HydrophobicContact CE2-CE1 3.64Å; Y264-F354 HydrophobicContact CE2-CZ 4.32Å; Y264-F354 AromaticContact CZ-CE1 3.63Å; Y264-F354 AromaticContact CZ-CZ 3.85Å
265	R	90.3	Very high	94.1	Very high	152 Å²	152	78.4 Å²	78.4	57%	0.574	36%	0.357	S	S	*	.			trans	-75.8	163.4	167.6	-52.2	177.7	-178.3	168.9	5.9	110.5	E267 E268 L269	R265-E267 VanDerWaalsContact C-N 3.33Å; R265-E267 VanDerWaalsContact CB-OE2 3.23Å; R265-E267 WeakPolarHBondContact CB-OE2 3.34Å; R265-E267 PolarHBondContact O-N 3.01Å; R265-E268 HydrophobicContact CB-CG 4.18Å; R265-E268 WeakPolarHBondContact CB-OE2 3.39Å; R265-E268 WeakPolarHBondContact CG-OE2 3.47Å; R265-E268 PolarHBondContact N-OE2 2.92Å; R265-E268 IonicContact NE-OE1 3.24Å; R265-E268 PolarHBondContact O-N 2.82Å; R265-L269 PolarHBondContact O-N 2.89Å
266	L	88.4	Confident	94	Very high	73 Å²	73	79.7 Å²	79.7	38%	0.382	37%	0.365	S	S	.	.	H	α-helix	trans	-67.2	-37.4	-176.7	-174.9	61.5	0	0	0	111.7	E268 L269 Q270	L266-E268 VanDerWaalsContact C-N 3.34Å; L266-E268 PolarHBondContact O-N 3.48Å; L266-L269 PolarHBondContact O-N 3.23Å; L266-Q270 WeakPolarHBondContact O-CB 3.47Å; L266-Q270 VanDerWaalsContact O-CG 3.25Å; L266-Q270 WeakPolarHBondContact O-CG 3.32Å; L266-Q270 PolarHBondContact O-N 3.01Å
267	E	91.4	Very high	94	Very high	125 Å²	125	74.6 Å²	74.6	58%	0.584	35%	0.346	S	S	*	.	H	α-helix	trans	-67.1	-35.6	179.7	-52	80.4	-178.5	0	0	111.6	R265 Q270 A271	R265-E267 VanDerWaalsContact C-N 3.33Å; R265-E267 VanDerWaalsContact CB-OE2 3.23Å; R265-E267 WeakPolarHBondContact CB-OE2 3.34Å; R265-E267 PolarHBondContact O-N 3.01Å; E267-Q270 PolarHBondContact O-N 3.31Å; E267-A271 WeakPolarHBondContact O-CB 3.29Å; E267-A271 PolarHBondContact O-N 3.48Å
268	E	93.4	Very high	94	Very high	81 Å²	81	76.6 Å²	76.6	38%	0.379	36%	0.36	S	S	.	.	H	α-helix	trans	-68.7	-41.6	177	-65.5	164.1	169.4	0	0	110.9	R265 L266 A271 L272	R265-E268 HydrophobicContact CB-CG 4.18Å; R265-E268 WeakPolarHBondContact CB-OE2 3.39Å; R265-E268 WeakPolarHBondContact CG-OE2 3.47Å; R265-E268 PolarHBondContact N-OE2 2.92Å; R265-E268 IonicContact NE-OE1 3.24Å; R265-E268 PolarHBondContact O-N 2.82Å; L266-E268 VanDerWaalsContact C-N 3.34Å; L266-E268 PolarHBondContact O-N 3.48Å; E268-A271 PolarHBondContact O-N 3Å; E268-L272 WeakPolarHBondContact O-CD1 3.28Å; E268-L272 VanDerWaalsContact O-CG 3.31Å; E268-L272 WeakPolarHBondContact O-CG 3.36Å; E268-L272 PolarHBondContact O-N 2.92Å; E268-L272 VanDerWaalsContact O-N 3.17Å
269	L	93.2	Very high	93.9	Very high	7 Å²	7	85.7 Å²	85.7	4%	0.037	39%	0.394	C	S	.	.	H	α-helix	trans	-69.7	-34.8	174.8	-68.1	168.8	0	0	0	112.2	Y264 R265 L266 L272 R273 R344 F345 F354	Y264-L269 HydrophobicContact CD1-CD2 4.47Å; Y264-L269 HydrophobicContact CD2-CD2 4.46Å; Y264-L269 HydrophobicContact CG-CD2 4.06Å; Y264-L269 HydrophobicContact CG-CG 4.37Å; R265-L269 PolarHBondContact O-N 2.89Å; L266-L269 PolarHBondContact O-N 3.23Å; L269-L272 CarbonylContact O-C 3.59Å; L269-L272 PolarHBondContact O-N 2.98Å; L269-R273 PolarHBondContact O-N 3.35Å; L269-R344 WeakPolarHBondContact CD1-O 3.34Å; L269-F345 HydrophobicContact CD1-CD1 3.98Å; L269-F345 HydrophobicContact CD1-CE1 3.96Å; L269-F345 HydrophobicContact CD2-CD1 3.74Å; L269-F345 HydrophobicContact CD2-CE1 3.91Å; L269-F354 HydrophobicContact CD2-CD1 4.11Å; L269-F354 HydrophobicContact CD2-CD2 4.41Å; L269-F354 HydrophobicContact CD2-CE1 4.36Å; L269-F354 HydrophobicContact CD2-CG 4.11Å
270	Q	91.7	Very high	94	Very high	110 Å²	110	82.9 Å²	82.9	51%	0.514	39%	0.389	S	S	.	.	H	α-helix	trans	-64	-44	172.1	-75.8	170.7	-0.4	0	0	111.9	L266 E267 L272 R273	L266-Q270 WeakPolarHBondContact O-CB 3.47Å; L266-Q270 VanDerWaalsContact O-CG 3.25Å; L266-Q270 WeakPolarHBondContact O-CG 3.32Å; L266-Q270 PolarHBondContact O-N 3.01Å; E267-Q270 PolarHBondContact O-N 3.31Å; Q270-L272 PolarHBondContact O-N 3.25Å; Q270-R273 WeakPolarHBondContact O-CB 3.38Å; Q270-R273 PolarHBondContact O-N 3.35Å; Q270-R273 VanDerWaalsContact O-N 3.17Å
271	A	95	Very high	94	Very high	85 Å²	85	80.2 Å²	80.2	70%	0.702	38%	0.376	S	S	*	.	H	α-helix	trans	-62.3	-29.2	175.1	0	0	0	0	0	112.8	E267 E268	E267-A271 WeakPolarHBondContact O-CB 3.29Å; E267-A271 PolarHBondContact O-N 3.48Å; E268-A271 PolarHBondContact O-N 3Å
272	L	95	Very high	94.1	Very high	43 Å²	43	81.3 Å²	81.3	23%	0.225	38%	0.382	C	S	.	.	H	α-helix	trans	-88.9	-6.9	177.8	-66.8	167.7	0	0	0	114.1	Y264 E268 L269 Q270 W274 K275 F354 F359	Y264-L272 HydrophobicContact CE1-CD1 4.44Å; E268-L272 WeakPolarHBondContact O-CD1 3.28Å; E268-L272 VanDerWaalsContact O-CG 3.31Å; E268-L272 WeakPolarHBondContact O-CG 3.36Å; E268-L272 PolarHBondContact O-N 2.92Å; E268-L272 VanDerWaalsContact O-N 3.17Å; L269-L272 CarbonylContact O-C 3.59Å; L269-L272 PolarHBondContact O-N 2.98Å; Q270-L272 PolarHBondContact O-N 3.25Å; L272-W274 PolarHBondContact O-N 3.13Å; L272-K275 HydrophobicContact CD2-CD 3.73Å; L272-K275 VanDerWaalsContact O-CB 3.31Å; L272-K275 WeakPolarHBondContact O-CB 3.38Å; L272-K275 PolarHBondContact O-N 3.35Å; L272-F354 HydrophobicContact CB-CE2 4.17Å; L272-F354 HydrophobicContact CD1-CE2 3.78Å; L272-F354 HydrophobicContact CD1-CZ 3.94Å; L272-F359 HydrophobicContact CB-CE2 4.36Å; L272-F359 VanDerWaalsContact O-CD2 3.28Å; L272-F359 WeakPolarHBondContact O-CD2 3.46Å; L272-F359 WeakPolarHBondContact O-CE2 3.36Å
273	R	93.1	Very high	94.2	Very high	52 Å²	52	86 Å²	86	20%	0.196	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-35.4	-172.1	-172.6	177.7	-165.9	81.1	-18.4	115.1	L269 Q270 N347 E349	L269-R273 PolarHBondContact O-N 3.35Å; Q270-R273 WeakPolarHBondContact O-CB 3.38Å; Q270-R273 PolarHBondContact O-N 3.35Å; Q270-R273 VanDerWaalsContact O-N 3.17Å; R273-N347 VanDerWaalsContact CG-ND2 3.26Å; R273-N347 WeakPolarHBondContact CG-ND2 3.31Å; R273-N347 PolarHBondContact NE-OD1 3.37Å; R273-N347 PolarHBondContact NH1-OD1 2.79Å; R273-N347 PolarHBondContact NH2-OD1 2.89Å; R273-N347 VanDerWaalsContact NH2-OD1 3.15Å; R273-E349 IonicContact CZ-OE1 3.42Å; R273-E349 IonicContact CZ-OE2 3.54Å; R273-E349 IonicContact NE-OE1 2.73Å; R273-E349 PolarHBondContact NE-OE1 3.09Å; R273-E349 IonicContact NE-OE2 3.59Å; R273-E349 PolarHBondContact NE-OE2 3.48Å; R273-E349 IonicContact NH2-OE1 2.71Å; R273-E349 PolarHBondContact NH2-OE1 3.47Å; R273-E349 IonicContact NH2-OE2 3.9Å; R273-E349 PolarHBondContact NH2-OE2 2.95Å
274	W	93.9	Very high	94.7	Very high	177 Å²	177	86.1 Å²	86.1	67%	0.67	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-3.7	-177.9	-56.5	113	0	0	0	113.9	L272 V276 E349	L272-W274 PolarHBondContact O-N 3.13Å; W274-V276 VanDerWaalsContact C-N 3.25Å; W274-V276 PolarHBondContact O-N 3Å; W274-E349 VanDerWaalsContact CH2-OE2 3.24Å; W274-E349 WeakPolarHBondContact CH2-OE2 3.32Å; W274-E349 WeakPolarHBondContact CZ2-OE2 3.46Å
275	K	96.3	Very high	94.9	Very high	99 Å²	99	84.9 Å²	84.9	43%	0.43	40%	0.403	S	S	.	.			trans	-83	69.7	178.6	-167.3	-163.6	173.3	-159.9	0	109.9	L272 G357 K358 F359	L272-K275 HydrophobicContact CD2-CD 3.73Å; L272-K275 VanDerWaalsContact O-CB 3.31Å; L272-K275 WeakPolarHBondContact O-CB 3.38Å; L272-K275 PolarHBondContact O-N 3.35Å; K275-G357 WeakPolarHBondContact CD-O 3.4Å; K275-G357 WeakPolarHBondContact CE-O 3.28Å; K275-G357 PolarHBondContact NZ-O 3.47Å; K275-K358 HydrophobicContact CD-CG 4.17Å; K275-K358 HydrophobicContact CG-CG 4.15Å; K275-K358 CarbonylContact O-C 3.52Å; K275-K358 WeakPolarHBondContact O-CA 3.44Å; K275-K358 WeakPolarHBondContact O-CB 3.45Å; K275-F359 PolarHBondContact O-N 3.36Å
276	V	96.4	Very high	95.2	Very high	66 Å²	66	80.9 Å²	80.9	40%	0.4	39%	0.39	S	S	.	.	B	Isolated β-bridge	trans	-77.5	159.4	176.8	-65.6	0	0	0	0	112.4	W274 K358 F359	W274-V276 VanDerWaalsContact C-N 3.25Å; W274-V276 PolarHBondContact O-N 3Å; V276-K358 WeakPolarHBondContact O-CD 3.46Å; V276-F359 VanDerWaalsContact CA-O 3.26Å; V276-F359 WeakPolarHBondContact CA-O 3.43Å; V276-F359 HydrophobicContact CG1-CB 4.05Å
277	F	97.3	Very high	95.7	Very high	22 Å²	22	81.7 Å²	81.7	10%	0.096	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-66.5	147.9	170.5	-75.4	-85.1	0	0	0	112.1	E281 I282 Y285 F355 D356 K358 F359 A360 V364	F277-E281 WeakPolarHBondContact CA-OE2 3.48Å; F277-E281 HydrophobicContact CB-CB 4.46Å; F277-E281 HydrophobicContact CD1-CB 3.78Å; F277-I282 HydrophobicContact CB-CD1 4.31Å; F277-I282 HydrophobicContact CB-CG1 3.85Å; F277-Y285 HydrophobicContact CD1-CE2 4.38Å; F277-Y285 AromaticContact CE1-CE2 3.73Å; F277-Y285 HydrophobicContact CE1-CE2 3.73Å; F277-Y285 HydrophobicContact CZ-CE2 4.16Å; F277-F355 WeakPolarHBondContact CE2-O 3.44Å; F277-F355 VanDerWaalsContact CZ-O 3.3Å; F277-F355 WeakPolarHBondContact CZ-O 3.46Å; F277-D356 HydrophobicContact CZ-CB 4.43Å; F277-K358 HydrophobicContact CD1-CB 4.25Å; F277-K358 HydrophobicContact CD1-CD 3.94Å; F277-K358 HydrophobicContact CD2-CB 3.68Å; F277-K358 HydrophobicContact CE1-CB 4.15Å; F277-K358 HydrophobicContact CE1-CD 4.26Å; F277-K358 HydrophobicContact CE1-CG 4.47Å; F277-K358 HydrophobicContact CE2-CB 3.57Å; F277-K358 HydrophobicContact CG-CB 4.04Å; F277-K358 HydrophobicContact CG-CD 4.15Å; F277-K358 HydrophobicContact CZ-CB 3.82Å; F277-F359 WeakPolarHBondContact CD2-O 3.5Å; F277-F359 PolarHBondContact N-O 2.91Å; F277-F359 VanDerWaalsContact N-O 3.11Å; F277-A360 HydrophobicContact CD2-CB 3.64Å; F277-A360 HydrophobicContact CE2-CB 3.76Å; F277-V364 HydrophobicContact CD2-CG2 4.42Å
278	S	97.3	Very high	96	Very high	44 Å²	44	78.6 Å²	78.6	31%	0.308	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-80.7	165.1	168.1	93.2	0	0	0	0	111.2	E280 E281 I282	S278-E280 VanDerWaalsContact CB-OE2 3.23Å; S278-E280 WeakPolarHBondContact CB-OE2 3.47Å; S278-E280 PolarHBondContact O-N 2.88Å; S278-E280 PolarHBondContact OG-N 3.09Å; S278-E280 PolarHBondContact OG-OE2 3.23Å; S278-E281 PolarHBondContact N-OE2 3.45Å; S278-E281 PolarHBondContact O-N 3.26Å; S278-E281 PolarHBondContact OG-N 3.41Å; S278-I282 VanDerWaalsContact O-CG1 3.29Å; S278-I282 WeakPolarHBondContact O-CG1 3.41Å; S278-I282 PolarHBondContact O-N 2.99Å
279	R	96.6	Very high	96.2	Very high	194 Å²	194	78 Å²	78	73%	0.732	39%	0.388	S	S	*	.	H	α-helix	trans	-59	-37.7	177.2	176.5	-178.8	174.3	178.3	-1.9	112.1	Q283	R279-Q283 WeakPolarHBondContact O-CB 3.45Å; R279-Q283 PolarHBondContact O-N 3.09Å
280	E	97.3	Very high	96.4	Very high	119 Å²	119	79.1 Å²	79.1	56%	0.556	40%	0.396	S	S	*	.	H	α-helix	trans	-69.1	-42.3	-179.2	-56.3	65.4	-137.7	0	0	110.2	S278 Q283 V284	S278-E280 VanDerWaalsContact CB-OE2 3.23Å; S278-E280 WeakPolarHBondContact CB-OE2 3.47Å; S278-E280 PolarHBondContact O-N 2.88Å; S278-E280 PolarHBondContact OG-N 3.09Å; S278-E280 PolarHBondContact OG-OE2 3.23Å; E280-Q283 WeakPolarHBondContact O-CB 3.43Å; E280-Q283 PolarHBondContact O-N 3.07Å; E280-V284 PolarHBondContact O-N 3.36Å; E280-V284 VanDerWaalsContact O-N 3.14Å
281	E	97.5	Very high	96.7	Very high	64 Å²	64	75.7 Å²	75.7	30%	0.299	38%	0.381	S	S	.	.	H	α-helix	trans	-68	-41.3	175.4	-61.5	171.9	142.7	0	0	111.9	F277 S278 Q283 V284 Y285 K358	F277-E281 WeakPolarHBondContact CA-OE2 3.48Å; F277-E281 HydrophobicContact CB-CB 4.46Å; F277-E281 HydrophobicContact CD1-CB 3.78Å; S278-E281 PolarHBondContact N-OE2 3.45Å; S278-E281 PolarHBondContact O-N 3.26Å; S278-E281 PolarHBondContact OG-N 3.41Å; E281-Q283 PolarHBondContact O-N 3.38Å; E281-V284 WeakPolarHBondContact O-CB 3.45Å; E281-V284 PolarHBondContact O-N 3.32Å; E281-V284 VanDerWaalsContact O-N 3.13Å; E281-Y285 WeakPolarHBondContact O-CD2 3.38Å; E281-Y285 PolarHBondContact O-N 3.09Å; E281-K358 WeakPolarHBondContact OE1-CE 3.37Å; E281-K358 IonicContact OE1-NZ 2.65Å; E281-K358 PolarHBondContact OE1-NZ 2.85Å; E281-K358 IonicContact OE2-NZ 2.66Å; E281-K358 PolarHBondContact OE2-NZ 3.19Å
282	I	97.5	Very high	96.8	Very high	29 Å²	29	75.9 Å²	75.9	15%	0.149	37%	0.367	C	S	.	.	H	α-helix	trans	-56.4	-42.7	171.3	-69.4	163.4	0	0	0	109.9	F277 S278 V284 Y285 Q286 E363 V364	F277-I282 HydrophobicContact CB-CD1 4.31Å; F277-I282 HydrophobicContact CB-CG1 3.85Å; S278-I282 VanDerWaalsContact O-CG1 3.29Å; S278-I282 WeakPolarHBondContact O-CG1 3.41Å; S278-I282 PolarHBondContact O-N 2.99Å; I282-V284 VanDerWaalsContact C-N 3.29Å; I282-V284 PolarHBondContact O-N 3.49Å; I282-Y285 PolarHBondContact O-N 3.5Å; I282-Q286 HydrophobicContact CG2-CG 4.24Å; I282-Q286 WeakPolarHBondContact O-CG 3.49Å; I282-Q286 PolarHBondContact O-N 3.48Å; I282-E363 HydrophobicContact CD1-CG 4.05Å; I282-E363 HydrophobicContact CG1-CG 4.42Å; I282-E363 HydrophobicContact CG2-CB 4.45Å; I282-E363 HydrophobicContact CG2-CG 3.75Å; I282-V364 HydrophobicContact CB-CG2 4.46Å; I282-V364 HydrophobicContact CG1-CG2 3.84Å; I282-V364 HydrophobicContact CG2-CG2 4.45Å
283	Q	97.1	Very high	96.9	Very high	120 Å²	120	73.9 Å²	73.9	56%	0.561	36%	0.357	S	S	*	.	H	α-helix	trans	-63.1	-33	178.7	-172.4	169.8	-13.9	0	0	112.6	R279 E280 E281 Y285 Q286 S287	R279-Q283 WeakPolarHBondContact O-CB 3.45Å; R279-Q283 PolarHBondContact O-N 3.09Å; E280-Q283 WeakPolarHBondContact O-CB 3.43Å; E280-Q283 PolarHBondContact O-N 3.07Å; E281-Q283 PolarHBondContact O-N 3.38Å; Q283-Y285 VanDerWaalsContact C-N 3.34Å; Q283-Y285 PolarHBondContact O-N 3.14Å; Q283-Q286 CarbonylContact O-C 3.42Å; Q283-Q286 PolarHBondContact O-N 3.32Å; Q283-S287 WeakPolarHBondContact O-CB 3.15Å; Q283-S287 PolarHBondContact O-N 3.5Å; Q283-S287 PolarHBondContact O-OG 2.85Å; Q283-S287 VanDerWaalsContact O-OG 3.1Å
284	V	97.4	Very high	97.1	Very high	87 Å²	87	71.8 Å²	71.8	53%	0.527	35%	0.349	S	S	.	.	H	α-helix	trans	-62	-39.2	174.3	173.8	0	0	0	0	112	E280 E281 I282 S287	E280-V284 PolarHBondContact O-N 3.36Å; E280-V284 VanDerWaalsContact O-N 3.14Å; E281-V284 WeakPolarHBondContact O-CB 3.45Å; E281-V284 PolarHBondContact O-N 3.32Å; E281-V284 VanDerWaalsContact O-N 3.13Å; I282-V284 VanDerWaalsContact C-N 3.29Å; I282-V284 PolarHBondContact O-N 3.49Å; V284-S287 WeakPolarHBondContact CA-OG 3.46Å; V284-S287 PolarHBondContact O-OG 3.34Å
285	Y	97.4	Very high	97.3	Very high	34 Å²	34	66.3 Å²	66.3	13%	0.133	33%	0.331	C	S	.	.	H	α-helix	trans	-72.4	-40.6	173	-68.3	-84.8	0	0	0	111.8	F277 E281 I282 Q283 S287 K288 M293 F355 D356 V364 S367	F277-Y285 HydrophobicContact CD1-CE2 4.38Å; F277-Y285 AromaticContact CE1-CE2 3.73Å; F277-Y285 HydrophobicContact CE1-CE2 3.73Å; F277-Y285 HydrophobicContact CZ-CE2 4.16Å; E281-Y285 WeakPolarHBondContact O-CD2 3.38Å; E281-Y285 PolarHBondContact O-N 3.09Å; I282-Y285 PolarHBondContact O-N 3.5Å; Q283-Y285 VanDerWaalsContact C-N 3.34Å; Q283-Y285 PolarHBondContact O-N 3.14Å; Y285-S287 PolarHBondContact O-N 3.47Å; Y285-K288 HydrophobicContact CD1-CD 4.43Å; Y285-K288 WeakPolarHBondContact O-CB 3.35Å; Y285-K288 PolarHBondContact O-N 3.29Å; Y285-K288 VanDerWaalsContact O-N 3.12Å; Y285-M293 HydrophobicContact CD1-CE 3.96Å; Y285-M293 HydrophobicContact CD1-SD 3.95Å; Y285-F355 AromaticContact CE1-CE1 3.99Å; Y285-F355 HydrophobicContact CE1-CE1 3.99Å; Y285-D356 PolarHBondContact OH-OD2 2.83Å; Y285-V364 HydrophobicContact CD1-CG1 4.17Å; Y285-V364 HydrophobicContact CD2-CG1 3.98Å; Y285-V364 HydrophobicContact CG-CG1 3.78Å; Y285-S367 PolarHBondContact O-OG 2.92Å
286	Q	96.8	Very high	97.4	Very high	68 Å²	68	64 Å²	64	32%	0.318	32%	0.322	S	S	.	.	H	α-helix	trans	-67	-22.5	177.3	-68	-174.3	5.9	0	0	113.8	I282 Q283 E363 K366 S367	I282-Q286 HydrophobicContact CG2-CG 4.24Å; I282-Q286 WeakPolarHBondContact O-CG 3.49Å; I282-Q286 PolarHBondContact O-N 3.48Å; Q283-Q286 CarbonylContact O-C 3.42Å; Q283-Q286 PolarHBondContact O-N 3.32Å; Q286-E363 WeakPolarHBondContact CG-O 3.38Å; Q286-E363 PolarHBondContact NE2-O 3.17Å; Q286-K366 HydrophobicContact CG-CB 4.35Å; Q286-K366 HydrophobicContact CG-CD 4.49Å; Q286-S367 WeakPolarHBondContact CA-OG 3.37Å; Q286-S367 PolarHBondContact O-OG 2.88Å; Q286-S367 VanDerWaalsContact O-OG 3.06Å
287	S	97.4	Very high	97.4	Very high	90 Å²	90	61.7 Å²	61.7	63%	0.629	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.9	173.2	56.5	0	0	0	0	114.5	Q283 V284 Y285	Q283-S287 WeakPolarHBondContact O-CB 3.15Å; Q283-S287 PolarHBondContact O-N 3.5Å; Q283-S287 PolarHBondContact O-OG 2.85Å; Q283-S287 VanDerWaalsContact O-OG 3.1Å; V284-S287 WeakPolarHBondContact CA-OG 3.46Å; V284-S287 PolarHBondContact O-OG 3.34Å; Y285-S287 PolarHBondContact O-N 3.47Å
288	K	97.7	Very high	97.4	Very high	60 Å²	60	60.7 Å²	60.7	26%	0.261	30%	0.303	S	S	.	.	S	Bend	trans	-65.8	148.8	176.3	-68.9	-172.4	169.4	-64	0	111.6	Y285 E292 M293 S367	Y285-K288 HydrophobicContact CD1-CD 4.43Å; Y285-K288 WeakPolarHBondContact O-CB 3.35Å; Y285-K288 PolarHBondContact O-N 3.29Å; Y285-K288 VanDerWaalsContact O-N 3.12Å; K288-E292 VanDerWaalsContact CA-OE2 3.27Å; K288-E292 WeakPolarHBondContact CA-OE2 3.45Å; K288-E292 HydrophobicContact CB-CB 4.16Å; K288-M293 HydrophobicContact CB-CB 4.25Å; K288-M293 HydrophobicContact CD-SD 3.95Å; K288-S367 WeakPolarHBondContact O-CB 3.24Å; K288-S367 PolarHBondContact O-OG 2.93Å
289	T	98	Very high	97.4	Very high	67 Å²	67	61.1 Å²	61.1	41%	0.411	30%	0.304	S	S	.	.			trans	-65.5	162.8	166	75.4	0	0	0	0	110.5	D291 E292 M293	T289-D291 VanDerWaalsContact C-N 3.25Å; T289-D291 VanDerWaalsContact CB-OD1 3.31Å; T289-D291 WeakPolarHBondContact CB-OD1 3.38Å; T289-D291 PolarHBondContact O-N 2.83Å; T289-D291 PolarHBondContact OG1-OD1 2.94Å; T289-E292 PolarHBondContact N-OE2 3.15Å; T289-E292 PolarHBondContact O-N 2.92Å; T289-E292 WeakPolarHBondContact OG1-CB 3.16Å; T289-E292 WeakPolarHBondContact OG1-CG 3.32Å; T289-E292 PolarHBondContact OG1-N 3.19Å; T289-E292 VanDerWaalsContact OG1-N 3.08Å; T289-M293 PolarHBondContact O-N 3.35Å; T289-M293 VanDerWaalsContact O-N 3.09Å
290	V	97.7	Very high	97.4	Very high	31 Å²	31	55.2 Å²	55.2	19%	0.188	28%	0.282	C	S	.	.	H	α-helix	trans	-56.3	-45	176.1	-178.3	0	0	0	0	110.3	M293 W294 S367 W463 F464 Y468	V290-M293 PolarHBondContact O-N 3.14Å; V290-W294 WeakPolarHBondContact O-CB 3.38Å; V290-W294 VanDerWaalsContact O-CD1 3.24Å; V290-W294 PolarHBondContact O-N 2.8Å; V290-S367 WeakPolarHBondContact CA-O 3.45Å; V290-W463 HydrophobicContact CG1-CH2 4.36Å; V290-W463 HydrophobicContact CG1-CZ3 4.28Å; V290-F464 HydrophobicContact CG1-CD2 4.32Å; V290-F464 HydrophobicContact CG1-CE2 4.33Å; V290-Y468 HydrophobicContact CB-CE2 4.11Å; V290-Y468 HydrophobicContact CG1-CE2 3.97Å
291	D	97.4	Very high	97.3	Very high	39 Å²	39	51.5 Å²	51.5	21%	0.209	27%	0.266	C	S	.	.	H	α-helix	trans	-77.5	-32.7	-175.1	64.4	-56.6	0	0	0	114.5	T289 Q295 F464 Y468 T471	T289-D291 VanDerWaalsContact C-N 3.25Å; T289-D291 VanDerWaalsContact CB-OD1 3.31Å; T289-D291 WeakPolarHBondContact CB-OD1 3.38Å; T289-D291 PolarHBondContact O-N 2.83Å; T289-D291 PolarHBondContact OG1-OD1 2.94Å; D291-Q295 VanDerWaalsContact O-CB 3.28Å; D291-Q295 WeakPolarHBondContact O-CB 3.36Å; D291-Q295 PolarHBondContact O-N 2.82Å; D291-F464 HydrophobicContact CB-CE2 3.74Å; D291-F464 HydrophobicContact CB-CZ 3.67Å; D291-Y468 HydrophobicContact CB-CD1 3.56Å; D291-Y468 HydrophobicContact CB-CE1 4.02Å; D291-Y468 HydrophobicContact CB-CG 3.84Å; D291-T471 HydrophobicContact CB-CG2 4.05Å; D291-T471 PolarHBondContact OD2-OG1 3.42Å
292	E	97.7	Very high	97.3	Very high	89 Å²	89	48.9 Å²	48.9	42%	0.416	25%	0.254	S	S	.	.	H	α-helix	trans	-59	-46.7	165.9	-77	-177.1	137.9	0	0	111.6	K288 T289 Q295 H296	K288-E292 VanDerWaalsContact CA-OE2 3.27Å; K288-E292 WeakPolarHBondContact CA-OE2 3.45Å; K288-E292 HydrophobicContact CB-CB 4.16Å; T289-E292 PolarHBondContact N-OE2 3.15Å; T289-E292 PolarHBondContact O-N 2.92Å; T289-E292 WeakPolarHBondContact OG1-CB 3.16Å; T289-E292 WeakPolarHBondContact OG1-CG 3.32Å; T289-E292 PolarHBondContact OG1-N 3.19Å; T289-E292 VanDerWaalsContact OG1-N 3.08Å; E292-Q295 PolarHBondContact O-N 3.41Å; E292-H296 WeakPolarHBondContact O-CB 3.47Å; E292-H296 PolarHBondContact O-N 3.06Å
293	M	97.6	Very high	97.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-71.1	-37.1	-176.9	-167.9	59.6	-178.5	0	0	111.8	Y285 K288 T289 V290 H296 C297 V364 F365 L368	Y285-M293 HydrophobicContact CD1-CE 3.96Å; Y285-M293 HydrophobicContact CD1-SD 3.95Å; K288-M293 HydrophobicContact CB-CB 4.25Å; K288-M293 HydrophobicContact CD-SD 3.95Å; T289-M293 PolarHBondContact O-N 3.35Å; T289-M293 VanDerWaalsContact O-N 3.09Å; V290-M293 PolarHBondContact O-N 3.14Å; M293-H296 PolarHBondContact O-N 3.23Å; M293-C297 WeakPolarHBondContact O-CB 3.37Å; M293-C297 PolarHBondContact O-N 3.47Å; M293-C297 PolarHBondContact O-SG 3.42Å; M293-V364 HydrophobicContact CE-CG1 4.35Å; M293-V364 WeakPolarHBondContact CE-O 3.37Å; M293-F365 HydrophobicContact CE-CD1 4.04Å; M293-L368 HydrophobicContact CB-CD2 4.02Å; M293-L368 HydrophobicContact CB-CG 4.5Å; M293-L368 HydrophobicContact CG-CD2 3.66Å; M293-L368 HydrophobicContact CG-CG 3.76Å
294	W	97.6	Very high	97.2	Very high	9 Å²	9	46.2 Å²	46.2	3%	0.034	25%	0.247	C	C	.	.	H	α-helix	trans	-65.7	-44.2	172.6	-93.2	90.9	0	0	0	112.2	V290 H296 C297 A298 L368 C370 K460 L461 F464 F476	V290-W294 WeakPolarHBondContact O-CB 3.38Å; V290-W294 VanDerWaalsContact O-CD1 3.24Å; V290-W294 PolarHBondContact O-N 2.8Å; W294-H296 VanDerWaalsContact C-N 3.34Å; W294-H296 PolarHBondContact O-N 3.1Å; W294-C297 PolarHBondContact O-N 2.71Å; W294-A298 WeakPolarHBondContact O-CB 3.48Å; W294-A298 PolarHBondContact O-N 3.4Å; W294-L368 HydrophobicContact CB-CD2 4.23Å; W294-L368 HydrophobicContact CD2-CD2 4.13Å; W294-L368 HydrophobicContact CG-CD2 3.72Å; W294-L368 PolarHBondContact NE1-O 3.22Å; W294-C370 HydrophobicContact CZ2-CB 4.46Å; W294-K460 HydrophobicContact CH2-CB 3.88Å; W294-K460 HydrophobicContact CZ2-CB 3.9Å; W294-L461 HydrophobicContact CH2-CB 4.47Å; W294-L461 HydrophobicContact CZ3-CB 4.32Å; W294-L461 HydrophobicContact CZ3-CD1 4.18Å; W294-F464 HydrophobicContact CB-CD1 4.45Å; W294-F464 HydrophobicContact CB-CD2 3.93Å; W294-F464 HydrophobicContact CB-CE1 4.11Å; W294-F464 HydrophobicContact CB-CE2 3.54Å; W294-F464 HydrophobicContact CB-CG 4.37Å; W294-F464 HydrophobicContact CB-CZ 3.63Å; W294-F464 AromaticContact CD1-CD2 3.51Å; W294-F464 AromaticContact CD1-CE2 3.77Å; W294-F464 HydrophobicContact CD2-CB 4.21Å; W294-F464 HydrophobicContact CD2-CD1 4.37Å; W294-F464 AromaticContact CD2-CD2 3.89Å; W294-F464 HydrophobicContact CD2-CD2 3.89Å; W294-F464 HydrophobicContact CD2-CE2 4.44Å; W294-F464 AromaticContact CD2-CG 3.86Å; W294-F464 HydrophobicContact CD2-CG 3.86Å; W294-F464 HydrophobicContact CE3-CB 4.47Å; W294-F464 HydrophobicContact CE3-CD1 4.43Å; W294-F464 HydrophobicContact CE3-CG 4.25Å; W294-F464 HydrophobicContact CG-CD1 4.41Å; W294-F464 AromaticContact CG-CD2 3.49Å; W294-F464 HydrophobicContact CG-CD2 3.49Å; W294-F464 VanDerWaalsContact CG-CD2 3.49Å; W294-F464 AromaticContact CG-CE2 3.63Å; W294-F464 HydrophobicContact CG-CE2 3.63Å; W294-F464 AromaticContact CG-CG 3.92Å; W294-F464 HydrophobicContact CG-CG 3.92Å; W294-F464 HydrophobicContact CG-CZ 4.15Å; W294-F464 HydrophobicContact CZ2-CB 4.36Å; W294-F464 AromaticContact NE1-CD2 3.88Å; W294-F476 HydrophobicContact CB-CE1 4.4Å; W294-F476 HydrophobicContact CB-CZ 4.18Å; W294-F476 HydrophobicContact CE3-CZ 4.28Å
295	Q	97.4	Very high	97.1	Very high	62 Å²	62	42.1 Å²	42.1	29%	0.29	22%	0.222	S	C	.	.	H	α-helix	trans	-59.9	-45.8	174.5	-177.6	-172.7	-9.6	0	0	111	D291 E292 A298 V299 T471 L475 F476	D291-Q295 VanDerWaalsContact O-CB 3.28Å; D291-Q295 WeakPolarHBondContact O-CB 3.36Å; D291-Q295 PolarHBondContact O-N 2.82Å; E292-Q295 PolarHBondContact O-N 3.41Å; Q295-A298 PolarHBondContact O-N 3.48Å; Q295-V299 WeakPolarHBondContact O-CG2 3.27Å; Q295-V299 PolarHBondContact O-N 2.93Å; Q295-T471 HydrophobicContact CB-CG2 4.1Å; Q295-L475 HydrophobicContact CG-CB 4.3Å; Q295-F476 HydrophobicContact CB-CD1 4.41Å; Q295-F476 HydrophobicContact CB-CE1 4.26Å
296	H	97.5	Very high	97.1	Very high	51 Å²	51	45.7 Å²	45.7	24%	0.236	24%	0.24	C	C	.	.	H	α-helix	trans	-57.7	-51.6	177.3	-172.7	66.2	0	0	0	111.1	E292 M293 W294 A298 V299 R300 F355 D356	E292-H296 WeakPolarHBondContact O-CB 3.47Å; E292-H296 PolarHBondContact O-N 3.06Å; M293-H296 PolarHBondContact O-N 3.23Å; W294-H296 VanDerWaalsContact C-N 3.34Å; W294-H296 PolarHBondContact O-N 3.1Å; H296-A298 VanDerWaalsContact C-N 3.32Å; H296-A298 PolarHBondContact O-N 3.18Å; H296-V299 WeakPolarHBondContact O-CB 3.41Å; H296-V299 PolarHBondContact O-N 2.73Å; H296-V299 VanDerWaalsContact O-N 3.11Å; H296-R300 WeakPolarHBondContact O-CG 3.42Å; H296-R300 PolarHBondContact O-N 3.33Å; H296-R300 VanDerWaalsContact O-N 3.12Å; H296-F355 AromaticContact CD2-CZ 3.78Å; H296-F355 AromaticContact NE2-CE1 3.86Å; H296-F355 AromaticContact NE2-CZ 3.83Å; H296-D356 IonicContact CD2-OD2 3.35Å; H296-D356 IonicContact CE1-OD2 2.62Å; H296-D356 PolarHBondContact CE1-OD2 3.5Å; H296-D356 IonicContact NE2-OD2 3.86Å; H296-D356 PolarHBondContact NE2-OD2 2.89Å
297	C	97.1	Very high	97.2	Very high	16 Å²	16	46.6 Å²	46.6	11%	0.108	24%	0.241	C	C	.	.	H	α-helix	trans	-62.4	-36.4	177.8	-65.1	0	0	0	0	112.8	M293 W294 V299 R300 L301 L368	M293-C297 WeakPolarHBondContact O-CB 3.37Å; M293-C297 PolarHBondContact O-N 3.47Å; M293-C297 PolarHBondContact O-SG 3.42Å; W294-C297 PolarHBondContact O-N 2.71Å; C297-V299 VanDerWaalsContact C-N 3.32Å; C297-V299 PolarHBondContact O-N 2.97Å; C297-R300 PolarHBondContact O-N 3.43Å; C297-L301 WeakPolarHBondContact O-CB 3.44Å; C297-L301 VanDerWaalsContact O-CG 3.29Å; C297-L301 WeakPolarHBondContact O-CG 3.47Å; C297-L301 PolarHBondContact O-N 3.03Å; C297-L368 HydrophobicContact CB-CD2 4.41Å
298	A	97.2	Very high	97.2	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-63.3	-35.1	174.6	0	0	0	0	0	112.6	W294 Q295 H296 T302 F476 Y480	W294-A298 WeakPolarHBondContact O-CB 3.48Å; W294-A298 PolarHBondContact O-N 3.4Å; Q295-A298 PolarHBondContact O-N 3.48Å; H296-A298 VanDerWaalsContact C-N 3.32Å; H296-A298 PolarHBondContact O-N 3.18Å; A298-T302 WeakPolarHBondContact O-CB 3.39Å; A298-T302 PolarHBondContact O-N 3.39Å; A298-T302 PolarHBondContact O-OG1 3.24Å; A298-F476 HydrophobicContact CB-CD1 4.11Å; A298-F476 HydrophobicContact CB-CD2 4.26Å; A298-F476 HydrophobicContact CB-CE1 4.18Å; A298-F476 HydrophobicContact CB-CE2 4.32Å; A298-F476 HydrophobicContact CB-CG 4.14Å; A298-F476 HydrophobicContact CB-CZ 4.27Å; A298-Y480 HydrophobicContact CB-CD1 4.33Å; A298-Y480 HydrophobicContact CB-CD2 3.79Å; A298-Y480 HydrophobicContact CB-CE1 4.34Å; A298-Y480 HydrophobicContact CB-CE2 3.78Å; A298-Y480 HydrophobicContact CB-CG 4.08Å; A298-Y480 WeakPolarHBondContact O-CD2 3.27Å
299	V	97.3	Very high	97.2	Very high	54 Å²	54	41 Å²	41	33%	0.327	21%	0.208	S	C	.	.	H	α-helix	trans	-64.5	-52.6	171.5	173.9	0	0	0	0	110.8	Q295 H296 C297 L301 T302 E303 P477	Q295-V299 WeakPolarHBondContact O-CG2 3.27Å; Q295-V299 PolarHBondContact O-N 2.93Å; H296-V299 WeakPolarHBondContact O-CB 3.41Å; H296-V299 PolarHBondContact O-N 2.73Å; H296-V299 VanDerWaalsContact O-N 3.11Å; C297-V299 VanDerWaalsContact C-N 3.32Å; C297-V299 PolarHBondContact O-N 2.97Å; V299-L301 VanDerWaalsContact C-N 3.32Å; V299-L301 PolarHBondContact O-N 2.81Å; V299-T302 WeakPolarHBondContact O-CA 3.21Å; V299-T302 WeakPolarHBondContact O-CB 3.32Å; V299-T302 PolarHBondContact O-N 3.24Å; V299-E303 PolarHBondContact O-N 3.15Å; V299-E303 VanDerWaalsContact O-N 3.11Å; V299-P477 HydrophobicContact CG2-CG 3.92Å
300	R	96.3	Very high	97.2	Very high	70 Å²	70	41.4 Å²	41.4	26%	0.264	21%	0.206	S	C	.	.	H	α-helix	trans	-61.4	-39.2	-178.8	-48.3	-50.9	-79.8	125.9	8.2	112.3	H296 C297 E303 A304 F355 D356	H296-R300 WeakPolarHBondContact O-CG 3.42Å; H296-R300 PolarHBondContact O-N 3.33Å; H296-R300 VanDerWaalsContact O-N 3.12Å; C297-R300 PolarHBondContact O-N 3.43Å; R300-E303 IonicContact CZ-OE1 2.7Å; R300-E303 IonicContact CZ-OE2 3.15Å; R300-E303 IonicContact NH1-OE1 3.44Å; R300-E303 PolarHBondContact NH1-OE1 3.36Å; R300-E303 IonicContact NH1-OE2 2.71Å; R300-E303 PolarHBondContact NH1-OE2 2.87Å; R300-E303 PolarHBondContact O-N 2.83Å; R300-A304 PolarHBondContact O-N 3.37Å; R300-F355 HydrophobicContact CB-CE2 4.42Å; R300-F355 HydrophobicContact CG-CE2 4.09Å; R300-F355 HydrophobicContact CG-CZ 4.17Å; R300-D356 IonicContact CZ-OD1 3.52Å; R300-D356 VanDerWaalsContact CZ-OD1 3.3Å; R300-D356 IonicContact NE-OD1 3.29Å; R300-D356 PolarHBondContact NE-OD1 3.45Å; R300-D356 IonicContact NH2-OD1 2.71Å; R300-D356 PolarHBondContact NH2-OD1 3.17Å; R300-D356 VanDerWaalsContact NH2-OD1 3.11Å
301	L	96.3	Very high	97.3	Very high	40 Å²	40	40 Å²	40	21%	0.209	20%	0.197	C	C	.	.	H	α-helix	trans	-65.5	-36.5	173.2	-74	169.4	0	0	0	112.3	C297 V299 A304 V305 M335 V338 Y480	C297-L301 WeakPolarHBondContact O-CB 3.44Å; C297-L301 VanDerWaalsContact O-CG 3.29Å; C297-L301 WeakPolarHBondContact O-CG 3.47Å; C297-L301 PolarHBondContact O-N 3.03Å; V299-L301 VanDerWaalsContact C-N 3.32Å; V299-L301 PolarHBondContact O-N 2.81Å; L301-A304 PolarHBondContact O-N 3.02Å; L301-V305 WeakPolarHBondContact O-CB 3.38Å; L301-V305 VanDerWaalsContact O-CG2 3.27Å; L301-V305 WeakPolarHBondContact O-CG2 3.2Å; L301-V305 PolarHBondContact O-N 3.16Å; L301-M335 HydrophobicContact CD1-CE 4.17Å; L301-M335 HydrophobicContact CD2-CE 4.36Å; L301-M335 HydrophobicContact CD2-SD 4.32Å; L301-V338 HydrophobicContact CD2-CG1 4.04Å; L301-Y480 HydrophobicContact CB-CD2 4.39Å; L301-Y480 HydrophobicContact CB-CE2 4.05Å; L301-Y480 HydrophobicContact CD1-CE2 3.96Å
302	T	96.6	Very high	97.3	Very high	10 Å²	10	38.1 Å²	38.1	6%	0.061	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-42.5	177	-60.6	0	0	0	0	111.9	A298 V299 V305 Q306 P477 L479	A298-T302 WeakPolarHBondContact O-CB 3.39Å; A298-T302 PolarHBondContact O-N 3.39Å; A298-T302 PolarHBondContact O-OG1 3.24Å; V299-T302 WeakPolarHBondContact O-CA 3.21Å; V299-T302 WeakPolarHBondContact O-CB 3.32Å; V299-T302 PolarHBondContact O-N 3.24Å; T302-V305 PolarHBondContact O-N 3.29Å; T302-Q306 WeakPolarHBondContact O-CG 3.46Å; T302-Q306 PolarHBondContact O-N 3.4Å; T302-P477 HydrophobicContact CG2-CB 3.9Å; T302-P477 HydrophobicContact CG2-CG 4.45Å; T302-P477 WeakPolarHBondContact OG1-CB 3.03Å; T302-P477 WeakPolarHBondContact OG1-CG 3.43Å; T302-L479 HydrophobicContact CG2-CB 4.08Å; T302-L479 HydrophobicContact CG2-CD2 4.19Å; T302-L479 HydrophobicContact CG2-CG 4.48Å
303	E	95.6	Very high	97.3	Very high	58 Å²	58	37.4 Å²	37.4	27%	0.271	18%	0.182	S	C	.	.	H	α-helix	trans	-60.8	-48.1	174.2	-68.8	170.3	-122.4	0	0	111.3	V299 R300 V305 Q306 Y307	V299-E303 PolarHBondContact O-N 3.15Å; V299-E303 VanDerWaalsContact O-N 3.11Å; R300-E303 IonicContact CZ-OE1 2.7Å; R300-E303 IonicContact CZ-OE2 3.15Å; R300-E303 IonicContact NH1-OE1 3.44Å; R300-E303 PolarHBondContact NH1-OE1 3.36Å; R300-E303 IonicContact NH1-OE2 2.71Å; R300-E303 PolarHBondContact NH1-OE2 2.87Å; R300-E303 PolarHBondContact O-N 2.83Å; E303-V305 VanDerWaalsContact C-N 3.3Å; E303-V305 PolarHBondContact O-N 3.05Å; E303-Q306 WeakPolarHBondContact O-CB 3.45Å; E303-Q306 PolarHBondContact O-N 3.31Å; E303-Q306 VanDerWaalsContact O-N 3.13Å; E303-Y307 WeakPolarHBondContact O-CD2 3.42Å; E303-Y307 PolarHBondContact O-N 3.08Å
304	A	96.6	Very high	97.2	Very high	34 Å²	34	40.7 Å²	40.7	28%	0.281	20%	0.197	S	C	.	.	H	α-helix	trans	-58.7	-41.1	177.1	0	0	0	0	0	112.3	R300 L301 Y307 V308 V338	R300-A304 PolarHBondContact O-N 3.37Å; L301-A304 PolarHBondContact O-N 3.02Å; A304-Y307 PolarHBondContact O-N 3Å; A304-V308 PolarHBondContact O-N 3.36Å; A304-V338 HydrophobicContact CB-CG1 4.03Å; A304-V338 HydrophobicContact CB-CG2 3.89Å
305	V	97.1	Very high	97.2	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.012	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-38.6	175.2	161.3	0	0	0	0	112.4	L301 T302 E303 Y307 V308 V309 V338 L479 L483	L301-V305 WeakPolarHBondContact O-CB 3.38Å; L301-V305 VanDerWaalsContact O-CG2 3.27Å; L301-V305 WeakPolarHBondContact O-CG2 3.2Å; L301-V305 PolarHBondContact O-N 3.16Å; T302-V305 PolarHBondContact O-N 3.29Å; E303-V305 VanDerWaalsContact C-N 3.3Å; E303-V305 PolarHBondContact O-N 3.05Å; V305-Y307 VanDerWaalsContact C-N 3.27Å; V305-Y307 PolarHBondContact O-N 3.05Å; V305-V308 CarbonylContact O-C 3.52Å; V305-V308 WeakPolarHBondContact O-CA 3.43Å; V305-V308 WeakPolarHBondContact O-CB 3.45Å; V305-V308 PolarHBondContact O-N 3.06Å; V305-V309 HydrophobicContact CG1-CG2 4.4Å; V305-V309 WeakPolarHBondContact O-CG2 3.44Å; V305-V309 PolarHBondContact O-N 3.44Å; V305-V338 HydrophobicContact CG2-CG2 4.1Å; V305-L479 HydrophobicContact CG1-CD2 4.01Å; V305-L479 HydrophobicContact CG1-CG 4.3Å; V305-L483 HydrophobicContact CG1-CD1 3.38Å
306	Q	97.1	Very high	97.1	Very high	108 Å²	108	38.8 Å²	38.8	51%	0.505	19%	0.191	S	C	.	.	H	α-helix	trans	-60	-39.2	177.1	-73.1	170.7	3.8	0	0	111.7	T302 E303 V308 V309 E310 L479	T302-Q306 WeakPolarHBondContact O-CG 3.46Å; T302-Q306 PolarHBondContact O-N 3.4Å; E303-Q306 WeakPolarHBondContact O-CB 3.45Å; E303-Q306 PolarHBondContact O-N 3.31Å; E303-Q306 VanDerWaalsContact O-N 3.13Å; Q306-V308 VanDerWaalsContact C-N 3.33Å; Q306-V308 PolarHBondContact O-N 3.33Å; Q306-V309 PolarHBondContact O-N 3.29Å; Q306-E310 PolarHBondContact O-N 2.82Å; Q306-L479 HydrophobicContact CG-CD2 3.73Å
307	Y	97.8	Very high	97	Very high	87 Å²	87	37.4 Å²	37.4	34%	0.341	19%	0.191	S	C	.	.	H	α-helix	trans	-65.9	-31.9	172	-67.2	-68.6	0	0	0	113.1	T261 Q263 E303 A304 V305 F311	T261-Y307 WeakPolarHBondContact CB-O 3.34Å; Q263-Y307 HydrophobicContact CB-CE2 4.19Å; Q263-Y307 HydrophobicContact CG-CE2 4.41Å; E303-Y307 WeakPolarHBondContact O-CD2 3.42Å; E303-Y307 PolarHBondContact O-N 3.08Å; A304-Y307 PolarHBondContact O-N 3Å; V305-Y307 VanDerWaalsContact C-N 3.27Å; V305-Y307 PolarHBondContact O-N 3.05Å; Y307-F311 VanDerWaalsContact O-CB 3.27Å; Y307-F311 WeakPolarHBondContact O-CB 3.27Å; Y307-F311 PolarHBondContact O-N 3.23Å
308	V	98.4	Very high	97	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-69.6	-39.2	172.6	178	0	0	0	0	111.8	A304 V305 Q306 E310 F311 A312 V337 V338	A304-V308 PolarHBondContact O-N 3.36Å; V305-V308 CarbonylContact O-C 3.52Å; V305-V308 WeakPolarHBondContact O-CA 3.43Å; V305-V308 WeakPolarHBondContact O-CB 3.45Å; V305-V308 PolarHBondContact O-N 3.06Å; Q306-V308 VanDerWaalsContact C-N 3.33Å; Q306-V308 PolarHBondContact O-N 3.33Å; V308-E310 VanDerWaalsContact C-N 3.35Å; V308-F311 WeakPolarHBondContact O-CB 3.49Å; V308-F311 PolarHBondContact O-N 3.06Å; V308-A312 WeakPolarHBondContact O-CB 3.31Å; V308-A312 PolarHBondContact O-N 3.24Å; V308-V337 HydrophobicContact CB-CG1 4.44Å; V308-V337 HydrophobicContact CG1-CB 3.87Å; V308-V337 HydrophobicContact CG1-CG1 3.89Å; V308-V337 HydrophobicContact CG1-CG2 4.23Å; V308-V337 HydrophobicContact CG2-CB 4.02Å; V308-V337 HydrophobicContact CG2-CG1 3.69Å; V308-V338 HydrophobicContact CG2-CG2 3.92Å
309	V	97.8	Very high	96.9	Very high	32 Å²	32	43.7 Å²	43.7	19%	0.194	21%	0.212	C	C	.	.	H	α-helix	trans	-63	-41.4	174.2	174.7	0	0	0	0	110.9	V305 Q306 F311 K313 L330	V305-V309 HydrophobicContact CG1-CG2 4.4Å; V305-V309 WeakPolarHBondContact O-CG2 3.44Å; V305-V309 PolarHBondContact O-N 3.44Å; Q306-V309 PolarHBondContact O-N 3.29Å; V309-F311 VanDerWaalsContact C-N 3.35Å; V309-K313 WeakPolarHBondContact O-CG 3.33Å; V309-K313 PolarHBondContact O-N 2.62Å; V309-L330 HydrophobicContact CG1-CD1 4.36Å; V309-L330 HydrophobicContact CG2-CD1 4.3Å; V309-L330 HydrophobicContact CG2-CD2 4.04Å
310	E	97.9	Very high	96.7	Very high	76 Å²	76	46 Å²	46	36%	0.355	22%	0.22	S	C	.	.	H	α-helix	trans	-72	-29.8	176	-157.1	58.3	-129.7	0	0	112.9	T261 Q306 V308 K313 H314	T261-E310 HydrophobicContact CG2-CB 3.96Å; T261-E310 HydrophobicContact CG2-CG 4.29Å; Q306-E310 PolarHBondContact O-N 2.82Å; V308-E310 VanDerWaalsContact C-N 3.35Å; E310-K313 WeakPolarHBondContact OE1-CD 3.48Å; E310-K313 IonicContact OE1-NZ 2.66Å; E310-K313 IonicContact OE2-NZ 3.33Å; E310-K313 PolarHBondContact OE2-NZ 2.99Å; E310-H314 PolarHBondContact O-ND1 3.45Å; E310-H314 IonicContact OE1-CE1 2.68Å; E310-H314 PolarHBondContact OE1-CE1 3.04Å; E310-H314 VanDerWaalsContact OE1-CE1 3.24Å; E310-H314 IonicContact OE1-ND1 3.96Å
311	F	98.7	Very high	96.7	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65	-49.8	174.1	169.5	-114.2	0	0	0	111	I254 S257 H258 T261 Y307 V308 V309 K313 H314 I315 A399	I254-F311 HydrophobicContact CG2-CE2 4.15Å; I254-F311 HydrophobicContact CG2-CZ 4.12Å; S257-F311 VanDerWaalsContact OG-CA 3.32Å; S257-F311 WeakPolarHBondContact OG-CA 3.46Å; S257-F311 WeakPolarHBondContact OG-CD2 3.47Å; S257-F311 PolarHBondContact OG-O 3.3Å; H258-F311 HydrophobicContact CB-CD2 4.36Å; H258-F311 HydrophobicContact CB-CE2 3.94Å; T261-F311 HydrophobicContact CG2-CB 4.19Å; Y307-F311 VanDerWaalsContact O-CB 3.27Å; Y307-F311 WeakPolarHBondContact O-CB 3.27Å; Y307-F311 PolarHBondContact O-N 3.23Å; V308-F311 WeakPolarHBondContact O-CB 3.49Å; V308-F311 PolarHBondContact O-N 3.06Å; V309-F311 VanDerWaalsContact C-N 3.35Å; F311-K313 VanDerWaalsContact C-N 3.29Å; F311-K313 PolarHBondContact O-N 2.91Å; F311-H314 PolarHBondContact O-N 2.92Å; F311-I315 HydrophobicContact CD1-CD1 4.27Å; F311-I315 HydrophobicContact CE1-CD1 3.89Å; F311-I315 HydrophobicContact CE1-CG1 4.43Å; F311-I315 HydrophobicContact CZ-CD1 4.28Å; F311-I315 HydrophobicContact CZ-CG1 4.42Å; F311-I315 PolarHBondContact O-N 3.3Å; F311-A399 HydrophobicContact CE1-CB 4.36Å; F311-A399 HydrophobicContact CZ-CB 4.02Å
312	A	98.5	Very high	96.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-53.5	-45.2	-179.9	0	0	0	0	0	112.2	V308 H314 I315 F318 L330 L402	V308-A312 WeakPolarHBondContact O-CB 3.31Å; V308-A312 PolarHBondContact O-N 3.24Å; A312-H314 PolarHBondContact O-N 2.93Å; A312-I315 PolarHBondContact O-N 2.89Å; A312-I315 VanDerWaalsContact O-N 3.09Å; A312-F318 VanDerWaalsContact C-CD1 3.45Å; A312-F318 HydrophobicContact CB-CD1 4.02Å; A312-F318 HydrophobicContact CB-CE1 3.69Å; A312-F318 HydrophobicContact CB-CE2 4.35Å; A312-F318 HydrophobicContact CB-CG 4.48Å; A312-F318 HydrophobicContact CB-CZ 3.86Å; A312-F318 WeakPolarHBondContact O-CB 3.41Å; A312-F318 WeakPolarHBondContact O-CD1 3.34Å; A312-F318 WeakPolarHBondContact O-CG 3.3Å; A312-L330 HydrophobicContact CB-CD2 3.86Å; A312-L402 HydrophobicContact CB-CD2 3.46Å; A312-L402 VanDerWaalsContact CB-CD2 3.46Å
313	K	96.7	Very high	96.7	Very high	75 Å²	75	49.5 Å²	49.5	33%	0.326	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-19	177.7	-72.7	170.5	-165.6	165.9	0	114.1	V309 E310 F311 R319	V309-K313 WeakPolarHBondContact O-CG 3.33Å; V309-K313 PolarHBondContact O-N 2.62Å; E310-K313 WeakPolarHBondContact OE1-CD 3.48Å; E310-K313 IonicContact OE1-NZ 2.66Å; E310-K313 IonicContact OE2-NZ 3.33Å; E310-K313 PolarHBondContact OE2-NZ 2.99Å; F311-K313 VanDerWaalsContact C-N 3.29Å; F311-K313 PolarHBondContact O-N 2.91Å; K313-R319 PolarHBondContact O-NE 3.09Å; K313-R319 PolarHBondContact O-NH2 3.27Å
314	H	95.8	Very high	96.7	Very high	68 Å²	68	51 Å²	51	32%	0.315	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	6.7	-177.5	-60.5	100.2	0	0	0	113.6	S253 S257 E310 F311 A312 P316 R319	S253-H314 PolarHBondContact OG-O 3.39Å; S253-H314 VanDerWaalsContact OG-O 3.05Å; S257-H314 WeakPolarHBondContact OG-CB 3.47Å; E310-H314 PolarHBondContact O-ND1 3.45Å; E310-H314 IonicContact OE1-CE1 2.68Å; E310-H314 PolarHBondContact OE1-CE1 3.04Å; E310-H314 VanDerWaalsContact OE1-CE1 3.24Å; E310-H314 IonicContact OE1-ND1 3.96Å; F311-H314 PolarHBondContact O-N 2.92Å; A312-H314 PolarHBondContact O-N 2.93Å; H314-P316 WeakPolarHBondContact O-CD 3.23Å; H314-R319 PolarHBondContact NE2-NH2 3.15Å
315	I	97.7	Very high	96.8	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.015	24%	0.239	C	C	.	.	S	Bend	trans	-73.6	120.2	162.8	-56.8	173.5	0	0	0	107.6	I254 F311 A312 G317 F318 A399 L402 I403 V423	I254-I315 HydrophobicContact CD1-CG2 4.25Å; I254-I315 HydrophobicContact CG1-CG2 4.33Å; F311-I315 HydrophobicContact CD1-CD1 4.27Å; F311-I315 HydrophobicContact CE1-CD1 3.89Å; F311-I315 HydrophobicContact CE1-CG1 4.43Å; F311-I315 HydrophobicContact CZ-CD1 4.28Å; F311-I315 HydrophobicContact CZ-CG1 4.42Å; F311-I315 PolarHBondContact O-N 3.3Å; A312-I315 PolarHBondContact O-N 2.89Å; A312-I315 VanDerWaalsContact O-N 3.09Å; I315-G317 PolarHBondContact O-N 3.38Å; I315-F318 HydrophobicContact CB-CB 4.24Å; I315-F318 WeakPolarHBondContact O-CB 3.43Å; I315-F318 PolarHBondContact O-N 3.29Å; I315-F318 VanDerWaalsContact O-N 3.13Å; I315-A399 HydrophobicContact CD1-CB 3.78Å; I315-A399 HydrophobicContact CG1-CB 4.23Å; I315-L402 HydrophobicContact CD1-CD2 4.13Å; I315-I403 HydrophobicContact CD1-CD1 4.15Å; I315-I403 HydrophobicContact CD1-CG1 4.05Å; I315-I403 HydrophobicContact CG2-CG1 4.26Å; I315-V423 HydrophobicContact CG2-CG2 4.13Å
316	P	95.8	Very high	96.8	Very high	28 Å²	28	51.1 Å²	51.1	18%	0.182	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	136	177.4	-27.2	37.3	0	0	0	111.9	Y240 L250 H314 F318 V419	Y240-P316 HydrophobicContact CE2-CB 3.94Å; L250-P316 HydrophobicContact CD1-CB 3.87Å; L250-P316 HydrophobicContact CD1-CG 3.63Å; H314-P316 WeakPolarHBondContact O-CD 3.23Å; P316-F318 PolarHBondContact O-N 3.43Å; P316-V419 WeakPolarHBondContact O-CG1 3.44Å
317	G	94.3	Very high	96.7	Very high	22 Å²	22	50.3 Å²	50.3	23%	0.227	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	-26.9	-174.7	0	0	0	0	0	115.5	I315 R319 M320	I315-G317 PolarHBondContact O-N 3.38Å; G317-R319 PolarHBondContact O-N 3.48Å; G317-M320 WeakPolarHBondContact O-CB 3.31Å; G317-M320 PolarHBondContact O-N 3.01Å
318	F	97.4	Very high	96.6	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.009	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-59.4	-47.4	-176	179.1	-103.9	0	0	0	113.1	A312 I315 P316 M320 L321 Q326 L329 L330 I403	A312-F318 VanDerWaalsContact C-CD1 3.45Å; A312-F318 HydrophobicContact CB-CD1 4.02Å; A312-F318 HydrophobicContact CB-CE1 3.69Å; A312-F318 HydrophobicContact CB-CE2 4.35Å; A312-F318 HydrophobicContact CB-CG 4.48Å; A312-F318 HydrophobicContact CB-CZ 3.86Å; A312-F318 WeakPolarHBondContact O-CB 3.41Å; A312-F318 WeakPolarHBondContact O-CD1 3.34Å; A312-F318 WeakPolarHBondContact O-CG 3.3Å; I315-F318 HydrophobicContact CB-CB 4.24Å; I315-F318 WeakPolarHBondContact O-CB 3.43Å; I315-F318 PolarHBondContact O-N 3.29Å; I315-F318 VanDerWaalsContact O-N 3.13Å; P316-F318 PolarHBondContact O-N 3.43Å; F318-M320 PolarHBondContact O-N 2.99Å; F318-L321 HydrophobicContact CD2-CD1 4.02Å; F318-L321 WeakPolarHBondContact O-CB 3.49Å; F318-L321 WeakPolarHBondContact O-CG 3.24Å; F318-L321 PolarHBondContact O-N 3.15Å; F318-L321 VanDerWaalsContact O-N 3.17Å; F318-Q326 HydrophobicContact CD1-CG 4.32Å; F318-Q326 HydrophobicContact CD2-CG 4.3Å; F318-Q326 HydrophobicContact CE1-CB 4.17Å; F318-Q326 HydrophobicContact CE1-CG 3.89Å; F318-Q326 HydrophobicContact CE2-CB 4.1Å; F318-Q326 HydrophobicContact CE2-CG 3.89Å; F318-Q326 HydrophobicContact CZ-CB 3.65Å; F318-Q326 HydrophobicContact CZ-CG 3.67Å; F318-Q326 WeakPolarHBondContact O-CG 3.5Å; F318-L329 HydrophobicContact CD2-CD1 4.34Å; F318-L329 HydrophobicContact CE2-CB 4.38Å; F318-L329 HydrophobicContact CE2-CD1 4.1Å; F318-L330 HydrophobicContact CZ-CD1 3.95Å; F318-L330 HydrophobicContact CZ-CG 4.05Å; F318-I403 HydrophobicContact CB-CD1 4.42Å; F318-I403 HydrophobicContact CD2-CD1 3.48Å; F318-I403 VanDerWaalsContact CD2-CD1 3.48Å; F318-I403 HydrophobicContact CE2-CD1 4.14Å; F318-I403 HydrophobicContact CG-CD1 4.31Å
319	R	95	Very high	96.6	Very high	148 Å²	148	46.8 Å²	46.8	56%	0.558	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-65.6	-4.1	176.6	-60.3	-167.1	-164.4	-169.8	6.4	114.3	K313 H314 G317	K313-R319 PolarHBondContact O-NE 3.09Å; K313-R319 PolarHBondContact O-NH2 3.27Å; H314-R319 PolarHBondContact NE2-NH2 3.15Å; G317-R319 PolarHBondContact O-N 3.48Å
320	M	94.4	Very high	96.6	Very high	101 Å²	101	46.3 Å²	46.3	50%	0.498	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-103.6	-4.3	179.2	-56.5	170.3	69.2	0	0	113.3	G317 F318 R415	G317-M320 WeakPolarHBondContact O-CB 3.31Å; G317-M320 PolarHBondContact O-N 3.01Å; F318-M320 PolarHBondContact O-N 2.99Å; M320-R415 PolarHBondContact O-NH1 3.49Å
321	L	95.5	Very high	96.4	Very high	9 Å²	9	45.4 Å²	45.4	5%	0.047	23%	0.225	C	C	.	.	S	Bend	trans	-73.6	166.1	167.2	-55.2	177.4	0	0	0	110.1	F318 D325 Q326 L329 R415 V416 V419	F318-L321 HydrophobicContact CD2-CD1 4.02Å; F318-L321 WeakPolarHBondContact O-CB 3.49Å; F318-L321 WeakPolarHBondContact O-CG 3.24Å; F318-L321 PolarHBondContact O-N 3.15Å; F318-L321 VanDerWaalsContact O-N 3.17Å; L321-D325 HydrophobicContact CB-CB 3.97Å; L321-Q326 HydrophobicContact CB-CG 4.05Å; L321-Q326 PolarHBondContact O-NE2 2.63Å; L321-L329 HydrophobicContact CD1-CD1 3.45Å; L321-L329 VanDerWaalsContact CD1-CD1 3.45Å; L321-R415 HydrophobicContact CD2-CB 4.19Å; L321-R415 HydrophobicContact CD2-CG 3.78Å; L321-V416 HydrophobicContact CD1-CG2 4.18Å; L321-V416 HydrophobicContact CD2-CG2 4.01Å; L321-V419 HydrophobicContact CD2-CG2 4.23Å
322	S	96.7	Very high	96.2	Very high	32 Å²	32	47.4 Å²	47.4	22%	0.224	24%	0.237	C	C	.	.			trans	-64.3	162.1	173.4	97.4	0	0	0	0	110.8	N324 D325 Q326 E411	S322-N324 PolarHBondContact O-N 3.31Å; S322-N324 PolarHBondContact OG-N 2.94Å; S322-N324 VanDerWaalsContact OG-N 3.16Å; S322-D325 PolarHBondContact O-N 3.38Å; S322-D325 PolarHBondContact OG-N 2.9Å; S322-Q326 VanDerWaalsContact O-CG 3.3Å; S322-Q326 WeakPolarHBondContact O-CG 3.46Å; S322-Q326 PolarHBondContact O-N 3.02Å; S322-Q326 PolarHBondContact O-NE2 3.01Å; S322-E411 WeakPolarHBondContact CB-OE2 3.3Å; S322-E411 PolarHBondContact OG-OE2 3.26Å
323	Q	96.1	Very high	96.1	Very high	153 Å²	153	47.4 Å²	47.4	72%	0.715	24%	0.237	S	C	*	.	H	α-helix	trans	-65	-34.1	174	-74	-174.7	-15.6	0	0	111.1	Q326 I327	Q323-Q326 PolarHBondContact O-N 3.44Å; Q323-I327 WeakPolarHBondContact O-CB 3.44Å; Q323-I327 WeakPolarHBondContact O-CD1 3.27Å; Q323-I327 WeakPolarHBondContact O-CG1 3.34Å; Q323-I327 PolarHBondContact O-N 3.33Å
324	N	95.8	Very high	96.1	Very high	90 Å²	90	43.9 Å²	43.9	48%	0.481	22%	0.222	S	C	.	.	H	α-helix	trans	-68.2	-42.6	177	-60.2	-15.2	0	0	0	110.9	S322 I327 A328 E411	S322-N324 PolarHBondContact O-N 3.31Å; S322-N324 PolarHBondContact OG-N 2.94Å; S322-N324 VanDerWaalsContact OG-N 3.16Å; N324-I327 PolarHBondContact O-N 3.28Å; N324-A328 VanDerWaalsContact O-CB 3.32Å; N324-A328 WeakPolarHBondContact O-CB 3.49Å; N324-A328 PolarHBondContact O-N 3.2Å; N324-E411 HydrophobicContact CB-CG 4.32Å; N324-E411 PolarHBondContact ND2-OE1 3.28Å
325	D	97.6	Very high	96.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.9	-45.2	172.3	-72.3	-34.4	0	0	0	111.6	L321 S322 I327 A328 L329 L410 E411 D412	L321-D325 HydrophobicContact CB-CB 3.97Å; S322-D325 PolarHBondContact O-N 3.38Å; S322-D325 PolarHBondContact OG-N 2.9Å; D325-I327 VanDerWaalsContact C-N 3.33Å; D325-I327 PolarHBondContact O-N 3.21Å; D325-A328 PolarHBondContact O-N 3.44Å; D325-L329 WeakPolarHBondContact O-CB 3.47Å; D325-L329 VanDerWaalsContact O-CG 3.26Å; D325-L329 WeakPolarHBondContact O-CG 3.47Å; D325-L329 PolarHBondContact O-N 2.75Å; D325-L410 HydrophobicContact CB-CD2 4.35Å; D325-L410 WeakPolarHBondContact OD1-CA 3.31Å; D325-E411 PolarHBondContact OD1-N 3.17Å; D325-D412 PolarHBondContact OD1-N 3.07Å; D325-D412 PolarHBondContact OD2-N 3.22Å
326	Q	97.8	Very high	96.2	Very high	39 Å²	39	41.3 Å²	41.3	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-41.7	177.5	-72.7	174.5	64.1	0	0	111.6	F318 L321 S322 Q323 L330	F318-Q326 HydrophobicContact CD1-CG 4.32Å; F318-Q326 HydrophobicContact CD2-CG 4.3Å; F318-Q326 HydrophobicContact CE1-CB 4.17Å; F318-Q326 HydrophobicContact CE1-CG 3.89Å; F318-Q326 HydrophobicContact CE2-CB 4.1Å; F318-Q326 HydrophobicContact CE2-CG 3.89Å; F318-Q326 HydrophobicContact CZ-CB 3.65Å; F318-Q326 HydrophobicContact CZ-CG 3.67Å; F318-Q326 WeakPolarHBondContact O-CG 3.5Å; L321-Q326 HydrophobicContact CB-CG 4.05Å; L321-Q326 PolarHBondContact O-NE2 2.63Å; S322-Q326 VanDerWaalsContact O-CG 3.3Å; S322-Q326 WeakPolarHBondContact O-CG 3.46Å; S322-Q326 PolarHBondContact O-N 3.02Å; S322-Q326 PolarHBondContact O-NE2 3.01Å; Q323-Q326 PolarHBondContact O-N 3.44Å; Q326-L330 WeakPolarHBondContact O-CB 3.45Å; Q326-L330 VanDerWaalsContact O-CG 3.32Å; Q326-L330 WeakPolarHBondContact O-CG 3.47Å; Q326-L330 PolarHBondContact O-N 3.49Å; Q326-L330 VanDerWaalsContact O-N 3.1Å
327	I	95.3	Very high	96.3	Very high	91 Å²	91	40 Å²	40	47%	0.467	20%	0.201	S	C	.	.	H	α-helix	trans	-67.3	-45.5	175.8	-69.8	163.5	0	0	0	110.9	Q323 N324 D325 L329 L330 K331	Q323-I327 WeakPolarHBondContact O-CB 3.44Å; Q323-I327 WeakPolarHBondContact O-CD1 3.27Å; Q323-I327 WeakPolarHBondContact O-CG1 3.34Å; Q323-I327 PolarHBondContact O-N 3.33Å; N324-I327 PolarHBondContact O-N 3.28Å; D325-I327 VanDerWaalsContact C-N 3.33Å; D325-I327 PolarHBondContact O-N 3.21Å; I327-L329 PolarHBondContact O-N 3.43Å; I327-L330 PolarHBondContact O-N 2.87Å; I327-K331 VanDerWaalsContact O-CB 3.24Å; I327-K331 WeakPolarHBondContact O-CB 3.33Å; I327-K331 PolarHBondContact O-N 2.9Å
328	A	96.1	Very high	96.5	Very high	13 Å²	13	40 Å²	40	11%	0.107	20%	0.197	C	C	.	.	H	α-helix	trans	-62.9	-43.5	-179.9	0	0	0	0	0	112.3	N324 D325 T332 L410	N324-A328 VanDerWaalsContact O-CB 3.32Å; N324-A328 WeakPolarHBondContact O-CB 3.49Å; N324-A328 PolarHBondContact O-N 3.2Å; D325-A328 PolarHBondContact O-N 3.44Å; A328-T332 WeakPolarHBondContact O-CB 3.4Å; A328-T332 PolarHBondContact O-N 3.49Å; A328-T332 VanDerWaalsContact O-N 3.1Å; A328-T332 PolarHBondContact O-OG1 2.93Å; A328-L410 HydrophobicContact CB-CD2 3.94Å
329	L	97.9	Very high	96.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62	-44.3	173.9	-69.1	174.8	0	0	0	111.7	F318 L321 D325 I327 G333 L402 I403 N404 R407 L410 V416	F318-L329 HydrophobicContact CD2-CD1 4.34Å; F318-L329 HydrophobicContact CE2-CB 4.38Å; F318-L329 HydrophobicContact CE2-CD1 4.1Å; L321-L329 HydrophobicContact CD1-CD1 3.45Å; L321-L329 VanDerWaalsContact CD1-CD1 3.45Å; D325-L329 WeakPolarHBondContact O-CB 3.47Å; D325-L329 VanDerWaalsContact O-CG 3.26Å; D325-L329 WeakPolarHBondContact O-CG 3.47Å; D325-L329 PolarHBondContact O-N 2.75Å; I327-L329 PolarHBondContact O-N 3.43Å; L329-G333 WeakPolarHBondContact O-CA 3.5Å; L329-G333 PolarHBondContact O-N 2.76Å; L329-L402 WeakPolarHBondContact O-CD1 3.5Å; L329-I403 HydrophobicContact CD1-CD1 4.18Å; L329-N404 WeakPolarHBondContact CD2-O 3.4Å; L329-R407 HydrophobicContact CD2-CB 4.49Å; L329-R407 HydrophobicContact CD2-CG 3.89Å; L329-L410 HydrophobicContact CD2-CD1 4.46Å; L329-L410 HydrophobicContact CD2-CD2 4.06Å; L329-L410 HydrophobicContact CG-CD2 4.04Å; L329-V416 HydrophobicContact CD1-CG1 4.34Å; L329-V416 HydrophobicContact CD1-CG2 4.39Å; L329-V416 HydrophobicContact CD2-CG1 4.07Å
330	L	97.3	Very high	96.7	Very high	23 Å²	23	33.5 Å²	33.5	12%	0.12	17%	0.173	C	C	.	.	H	α-helix	trans	-67.9	-45.7	177.5	-75.4	168.4	0	0	0	112.3	V309 A312 F318 Q326 I327 T332 S334 L402	V309-L330 HydrophobicContact CG1-CD1 4.36Å; V309-L330 HydrophobicContact CG2-CD1 4.3Å; V309-L330 HydrophobicContact CG2-CD2 4.04Å; A312-L330 HydrophobicContact CB-CD2 3.86Å; F318-L330 HydrophobicContact CZ-CD1 3.95Å; F318-L330 HydrophobicContact CZ-CG 4.05Å; Q326-L330 WeakPolarHBondContact O-CB 3.45Å; Q326-L330 VanDerWaalsContact O-CG 3.32Å; Q326-L330 WeakPolarHBondContact O-CG 3.47Å; Q326-L330 PolarHBondContact O-N 3.49Å; Q326-L330 VanDerWaalsContact O-N 3.1Å; I327-L330 PolarHBondContact O-N 2.87Å; L330-T332 VanDerWaalsContact C-N 3.27Å; L330-T332 PolarHBondContact O-N 3.5Å; L330-S334 WeakPolarHBondContact O-CB 3.14Å; L330-S334 PolarHBondContact O-N 2.9Å; L330-S334 PolarHBondContact O-OG 3.49Å; L330-L402 HydrophobicContact CD2-CD1 4.29Å; L330-L402 HydrophobicContact CD2-CD2 4.36Å
331	K	94.4	Very high	96.8	Very high	56 Å²	56	29.6 Å²	29.6	24%	0.243	15%	0.153	C	C	.	.	H	α-helix	trans	-59.9	-36.6	180	-178.7	154.3	179.3	153.5	0	112.6	I327 E482 L483 A485	I327-K331 VanDerWaalsContact O-CB 3.24Å; I327-K331 WeakPolarHBondContact O-CB 3.33Å; I327-K331 PolarHBondContact O-N 2.9Å; K331-E482 WeakPolarHBondContact CE-O 3.41Å; K331-E482 PolarHBondContact NZ-O 3.41Å; K331-L483 HydrophobicContact CB-CD2 4.12Å; K331-L483 VanDerWaalsContact CE-O 3.24Å; K331-L483 WeakPolarHBondContact CE-O 3.5Å; K331-L483 WeakPolarHBondContact CG-O 3.32Å; K331-A485 PolarHBondContact NZ-O 2.98Å
332	T	93.4	Very high	96.8	Very high	42 Å²	42	30.6 Å²	30.6	26%	0.258	16%	0.158	S	C	.	.	H	α-helix	trans	-98.8	-23.7	-176.7	58.9	0	0	0	0	114.4	A328 L330 R407 P408	A328-T332 WeakPolarHBondContact O-CB 3.4Å; A328-T332 PolarHBondContact O-N 3.49Å; A328-T332 VanDerWaalsContact O-N 3.1Å; A328-T332 PolarHBondContact O-OG1 2.93Å; L330-T332 VanDerWaalsContact C-N 3.27Å; L330-T332 PolarHBondContact O-N 3.5Å; T332-R407 PolarHBondContact O-NH1 3.27Å; T332-R407 WeakPolarHBondContact OG1-CD 3.35Å; T332-R407 VanDerWaalsContact OG1-CG 3.24Å; T332-R407 WeakPolarHBondContact OG1-CG 3.42Å; T332-P408 HydrophobicContact CG2-CG 3.88Å
333	G	96.8	Very high	96.7	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-102.2	-19.3	-177.5	0	0	0	0	0	115.9	L329 M335 E336 V337	L329-G333 WeakPolarHBondContact O-CA 3.5Å; L329-G333 PolarHBondContact O-N 2.76Å; G333-M335 PolarHBondContact O-N 3.08Å; G333-E336 PolarHBondContact O-N 3.05Å; G333-E336 VanDerWaalsContact O-N 3.15Å; G333-V337 WeakPolarHBondContact O-CG2 3.24Å; G333-V337 PolarHBondContact O-N 2.79Å
334	S	97.3	Very high	96.7	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.007	12%	0.123	C	C	.	.	H	α-helix	trans	-63.8	-40.1	-170	-63.4	0	0	0	0	113.8	L330 V337 V338	L330-S334 WeakPolarHBondContact O-CB 3.14Å; L330-S334 PolarHBondContact O-N 2.9Å; L330-S334 PolarHBondContact O-OG 3.49Å; S334-V337 PolarHBondContact O-N 2.82Å; S334-V338 WeakPolarHBondContact O-CG2 3.44Å; S334-V338 PolarHBondContact O-N 3.1Å
335	M	96.8	Very high	96.7	Very high	12 Å²	12	21.4 Å²	21.4	6%	0.059	11%	0.109	C	C	.	.	H	α-helix	trans	-63.7	-41.1	175.5	-178.6	63.9	76.5	0	0	111.5	L301 G333 V337 V338 L339 C454 F484	L301-M335 HydrophobicContact CD1-CE 4.17Å; L301-M335 HydrophobicContact CD2-CE 4.36Å; L301-M335 HydrophobicContact CD2-SD 4.32Å; G333-M335 PolarHBondContact O-N 3.08Å; M335-V337 VanDerWaalsContact C-N 3.31Å; M335-V337 PolarHBondContact O-N 2.85Å; M335-V338 PolarHBondContact O-N 2.58Å; M335-L339 HydrophobicContact CG-CD1 4.19Å; M335-L339 HydrophobicContact CG-CG 4.49Å; M335-L339 WeakPolarHBondContact O-CG 3.49Å; M335-L339 PolarHBondContact O-N 3.35Å; M335-L339 HydrophobicContact SD-CG 4.43Å; M335-C454 VanDerWaalsContact CG-SG 3.54Å; M335-F484 HydrophobicContact CB-CE1 3.89Å; M335-F484 HydrophobicContact CB-CZ 4Å; M335-F484 HydrophobicContact CE-CE1 4.05Å; M335-F484 HydrophobicContact CE-CE2 4.07Å; M335-F484 HydrophobicContact CE-CZ 3.64Å
336	E	98.2	Very high	96.6	Very high	6 Å²	6	21.9 Å²	21.9	3%	0.028	11%	0.111	C	C	.	.	H	α-helix	trans	-61.6	-40.7	177	-61.4	-177.2	-167	0	0	111.3	G333 L339 V340 V401 R407 L450 C454	G333-E336 PolarHBondContact O-N 3.05Å; G333-E336 VanDerWaalsContact O-N 3.15Å; E336-L339 PolarHBondContact O-N 2.93Å; E336-V340 VanDerWaalsContact O-CG2 3.32Å; E336-V340 WeakPolarHBondContact O-CG2 3.2Å; E336-V340 PolarHBondContact O-N 3.29Å; E336-V401 HydrophobicContact CB-CG1 3.5Å; E336-V401 VanDerWaalsContact CB-CG1 3.5Å; E336-R407 VanDerWaalsContact CD-NH1 3.33Å; E336-R407 VanDerWaalsContact CD-NH2 3.31Å; E336-R407 IonicContact OE1-CZ 2.67Å; E336-R407 IonicContact OE1-NH1 3.7Å; E336-R407 PolarHBondContact OE1-NH1 3.49Å; E336-R407 IonicContact OE1-NH2 2.86Å; E336-R407 IonicContact OE2-CZ 2.79Å; E336-R407 IonicContact OE2-NH1 3.59Å; E336-R407 PolarHBondContact OE2-NH1 3.3Å; E336-R407 IonicContact OE2-NH2 2.67Å; E336-R407 PolarHBondContact OE2-NH2 2.97Å; E336-L450 HydrophobicContact CB-CB 4.26Å; E336-L450 HydrophobicContact CB-CD1 4.33Å; E336-L450 HydrophobicContact CB-CD2 4.38Å; E336-L450 HydrophobicContact CG-CB 4.03Å; E336-C454 WeakPolarHBondContact CG-SG 3.46Å
337	V	98.6	Very high	96.5	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-68.5	-36.2	175.5	-178.2	0	0	0	0	112.4	V308 G333 S334 M335 V340 R341 V401 L402	V308-V337 HydrophobicContact CB-CG1 4.44Å; V308-V337 HydrophobicContact CG1-CB 3.87Å; V308-V337 HydrophobicContact CG1-CG1 3.89Å; V308-V337 HydrophobicContact CG1-CG2 4.23Å; V308-V337 HydrophobicContact CG2-CB 4.02Å; V308-V337 HydrophobicContact CG2-CG1 3.69Å; G333-V337 WeakPolarHBondContact O-CG2 3.24Å; G333-V337 PolarHBondContact O-N 2.79Å; S334-V337 PolarHBondContact O-N 2.82Å; M335-V337 VanDerWaalsContact C-N 3.31Å; M335-V337 PolarHBondContact O-N 2.85Å; V337-V340 PolarHBondContact O-N 3.31Å; V337-R341 HydrophobicContact CG1-CG 4.36Å; V337-R341 WeakPolarHBondContact O-CB 3.41Å; V337-R341 WeakPolarHBondContact O-CG 3.24Å; V337-R341 PolarHBondContact O-N 3.43Å; V337-V401 HydrophobicContact CG2-CG1 4Å; V337-L402 HydrophobicContact CG2-CB 3.87Å; V337-L402 HydrophobicContact CG2-CD1 4.3Å
338	V	98.1	Very high	96.5	Very high	21 Å²	21	18.7 Å²	18.7	13%	0.127	10%	0.099	C	C	.	.	H	α-helix	trans	-63	-45.7	173.4	169.8	0	0	0	0	110.5	L301 A304 V305 V308 S334 M335 V340 R341 M342	L301-V338 HydrophobicContact CD2-CG1 4.04Å; A304-V338 HydrophobicContact CB-CG1 4.03Å; A304-V338 HydrophobicContact CB-CG2 3.89Å; V305-V338 HydrophobicContact CG2-CG2 4.1Å; V308-V338 HydrophobicContact CG2-CG2 3.92Å; S334-V338 WeakPolarHBondContact O-CG2 3.44Å; S334-V338 PolarHBondContact O-N 3.1Å; M335-V338 PolarHBondContact O-N 2.58Å; V338-V340 PolarHBondContact O-N 3.42Å; V338-R341 PolarHBondContact O-N 2.61Å; V338-M342 PolarHBondContact O-N 2.8Å
339	L	98.3	Very high	96.4	Very high	14 Å²	14	23.8 Å²	23.8	7%	0.073	12%	0.12	C	C	.	.	H	α-helix	trans	-63.6	-37.9	175.8	-69.3	172.1	0	0	0	112.5	M335 E336 M342 V377 F380 L450 L453	M335-L339 HydrophobicContact CG-CD1 4.19Å; M335-L339 HydrophobicContact CG-CG 4.49Å; M335-L339 WeakPolarHBondContact O-CG 3.49Å; M335-L339 PolarHBondContact O-N 3.35Å; M335-L339 HydrophobicContact SD-CG 4.43Å; E336-L339 PolarHBondContact O-N 2.93Å; L339-M342 WeakPolarHBondContact O-CB 3.02Å; L339-M342 PolarHBondContact O-N 2.71Å; L339-V377 HydrophobicContact CD2-CG1 3.87Å; L339-V377 HydrophobicContact CD2-CG2 3.88Å; L339-F380 HydrophobicContact CB-CE1 4.36Å; L339-L450 HydrophobicContact CB-CD2 3.63Å; L339-L450 HydrophobicContact CD1-CD2 4.15Å; L339-L453 HydrophobicContact CD1-CB 3.93Å; L339-L453 HydrophobicContact CD1-CD1 4.18Å
340	V	98.5	Very high	96.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.8	-47.1	171.5	166.9	0	0	0	0	111.3	E336 V337 V338 M342 C343 L384 L394 F397 V401 L450	E336-V340 VanDerWaalsContact O-CG2 3.32Å; E336-V340 WeakPolarHBondContact O-CG2 3.2Å; E336-V340 PolarHBondContact O-N 3.29Å; V337-V340 PolarHBondContact O-N 3.31Å; V338-V340 PolarHBondContact O-N 3.42Å; V340-M342 VanDerWaalsContact C-N 3.26Å; V340-M342 PolarHBondContact O-N 2.74Å; V340-C343 PolarHBondContact O-N 2.72Å; V340-C343 PolarHBondContact O-SG 2.84Å; V340-L384 HydrophobicContact CB-CD2 4.41Å; V340-L384 HydrophobicContact CG1-CD2 4.32Å; V340-L384 HydrophobicContact CG2-CD2 4.47Å; V340-L384 WeakPolarHBondContact O-CD2 3.3Å; V340-L394 HydrophobicContact CG1-CD1 3.56Å; V340-F397 HydrophobicContact CG1-CD1 3.79Å; V340-F397 HydrophobicContact CG1-CE1 4.1Å; V340-F397 HydrophobicContact CG2-CD1 4.2Å; V340-F397 HydrophobicContact CG2-CE1 3.71Å; V340-F397 HydrophobicContact CG2-CZ 4.44Å; V340-V401 HydrophobicContact CG2-CG2 4.3Å; V340-L450 HydrophobicContact CG2-CD1 3.49Å; V340-L450 VanDerWaalsContact CG2-CD1 3.49Å; V340-L450 HydrophobicContact CG2-CD2 4.21Å; V340-L450 HydrophobicContact CG2-CG 4.47Å
341	R	97.1	Very high	96.1	Very high	19 Å²	19	29.1 Å²	29.1	7%	0.072	15%	0.149	C	C	.	.	H	α-helix	trans	-69.3	-21.9	-179.5	-73.2	177.6	171.7	-141.6	-2.1	113.2	H258 T261 V337 V338 C343 R344 F345	H258-R341 PolarHBondContact CE1-NE 2.93Å; H258-R341 VanDerWaalsContact CE1-NE 3.29Å; H258-R341 PolarHBondContact CE1-NH2 3.17Å; T261-R341 PolarHBondContact O-NH1 2.71Å; T261-R341 PolarHBondContact OG1-NH1 3.39Å; T261-R341 VanDerWaalsContact OG1-NH1 3.17Å; T261-R341 PolarHBondContact OG1-NH2 3Å; V337-R341 HydrophobicContact CG1-CG 4.36Å; V337-R341 WeakPolarHBondContact O-CB 3.41Å; V337-R341 WeakPolarHBondContact O-CG 3.24Å; V337-R341 PolarHBondContact O-N 3.43Å; V338-R341 PolarHBondContact O-N 2.61Å; R341-C343 PolarHBondContact O-N 3.24Å; R341-C343 VanDerWaalsContact O-N 3.15Å; R341-R344 WeakPolarHBondContact O-CB 3.45Å; R341-R344 PolarHBondContact O-N 3.11Å; R341-R344 VanDerWaalsContact O-N 3.11Å; R341-F345 WeakPolarHBondContact O-CD2 3.33Å
342	M	94.2	Very high	96.3	Very high	30 Å²	30	27 Å²	27	15%	0.148	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-55.6	-27.6	174.8	-177.7	175.3	158.3	0	0	112.9	V338 L339 V340 R344 F345 F346 V353 V377 F378 A381	V338-M342 PolarHBondContact O-N 2.8Å; L339-M342 WeakPolarHBondContact O-CB 3.02Å; L339-M342 PolarHBondContact O-N 2.71Å; V340-M342 VanDerWaalsContact C-N 3.26Å; V340-M342 PolarHBondContact O-N 2.74Å; M342-R344 PolarHBondContact O-N 3.41Å; M342-F345 CarbonylContact O-C 3.53Å; M342-F345 WeakPolarHBondContact O-CA 3.33Å; M342-F345 WeakPolarHBondContact O-CB 3.46Å; M342-F345 PolarHBondContact O-N 3.46Å; M342-F346 HydrophobicContact CE-CD2 4.21Å; M342-F346 PolarHBondContact O-N 2.74Å; M342-V353 HydrophobicContact CE-CB 4.04Å; M342-V353 HydrophobicContact CE-CG2 3.73Å; M342-V353 HydrophobicContact CG-CG2 4.06Å; M342-V353 HydrophobicContact SD-CG2 4.49Å; M342-V377 HydrophobicContact CE-CG1 3.67Å; M342-V377 HydrophobicContact SD-CG1 3.45Å; M342-V377 WeakPolarHBondContact SD-CG1 3.49Å; M342-F378 HydrophobicContact CE-CD2 4.17Å; M342-F378 HydrophobicContact CE-CE2 4.32Å; M342-A381 HydrophobicContact CE-CB 3.93Å; M342-A381 HydrophobicContact CG-CB 4.38Å; M342-A381 HydrophobicContact SD-CB 4.44Å
343	C	95.2	Very high	96.4	Very high	19 Å²	19	25.6 Å²	25.6	13%	0.128	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-61.7	-26.9	177.9	75.8	0	0	0	0	113.4	V340 R341 F345 F346 L384 C385	V340-C343 PolarHBondContact O-N 2.72Å; V340-C343 PolarHBondContact O-SG 2.84Å; R341-C343 PolarHBondContact O-N 3.24Å; R341-C343 VanDerWaalsContact O-N 3.15Å; C343-F345 PolarHBondContact O-N 3.13Å; C343-F346 PolarHBondContact O-N 3.17Å; C343-L384 HydrophobicContact CB-CB 4.26Å; C343-L384 HydrophobicContact CB-CD2 3.93Å; C343-L384 HydrophobicContact CB-CG 3.98Å; C343-C385 PolarHBondContact O-SG 3.22Å
344	R	95.5	Very high	96.4	Very high	23 Å²	23	26.5 Å²	26.5	9%	0.087	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-66.4	-29.9	173.4	-57.5	177.8	76.3	-105	9	111.9	Y264 L269 R341 M342 E391 L394	Y264-R344 PolarHBondContact O-NH1 3.45Å; Y264-R344 PolarHBondContact O-NH2 3.43Å; Y264-R344 VanDerWaalsContact O-NH2 3.08Å; L269-R344 WeakPolarHBondContact CD1-O 3.34Å; R341-R344 WeakPolarHBondContact O-CB 3.45Å; R341-R344 PolarHBondContact O-N 3.11Å; R341-R344 VanDerWaalsContact O-N 3.11Å; M342-R344 PolarHBondContact O-N 3.41Å; R344-E391 WeakPolarHBondContact CD-OE1 3.21Å; R344-E391 IonicContact CZ-OE1 3.77Å; R344-E391 IonicContact CZ-OE2 3.39Å; R344-E391 IonicContact NE-OE1 2.71Å; R344-E391 PolarHBondContact NE-OE1 2.91Å; R344-E391 IonicContact NE-OE2 2.8Å; R344-E391 PolarHBondContact NE-OE2 2.7Å; R344-E391 VanDerWaalsContact NE-OE2 3.13Å; R344-E391 IonicContact NH2-OE1 3.16Å; R344-E391 IonicContact NH2-OE2 3.77Å; R344-E391 PolarHBondContact NH2-OE2 2.97Å; R344-L394 HydrophobicContact CG-CD2 3.5Å
345	F	95.8	Very high	96.4	Very high	41 Å²	41	27.7 Å²	27.7	18%	0.18	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-94.4	5.5	-177.2	-63.9	-76.7	0	0	0	112.6	Y264 L269 R341 M342 C343 V353 F354 F359	Y264-F345 AromaticContact CD2-CE1 3.75Å; Y264-F345 HydrophobicContact CD2-CE1 3.75Å; Y264-F345 HydrophobicContact CD2-CZ 4.33Å; Y264-F345 HydrophobicContact CE2-CE1 4.44Å; Y264-F345 HydrophobicContact CG-CE1 4.47Å; L269-F345 HydrophobicContact CD1-CD1 3.98Å; L269-F345 HydrophobicContact CD1-CE1 3.96Å; L269-F345 HydrophobicContact CD2-CD1 3.74Å; L269-F345 HydrophobicContact CD2-CE1 3.91Å; R341-F345 WeakPolarHBondContact O-CD2 3.33Å; M342-F345 CarbonylContact O-C 3.53Å; M342-F345 WeakPolarHBondContact O-CA 3.33Å; M342-F345 WeakPolarHBondContact O-CB 3.46Å; M342-F345 PolarHBondContact O-N 3.46Å; C343-F345 PolarHBondContact O-N 3.13Å; F345-V353 HydrophobicContact CB-CG2 4.26Å; F345-V353 CarbonylContact O-C 3.48Å; F345-V353 WeakPolarHBondContact O-CA 3.32Å; F345-F354 HydrophobicContact CB-CB 4.09Å; F345-F354 HydrophobicContact CD1-CB 4.08Å; F345-F354 AromaticContact CD1-CD1 3.83Å; F345-F354 HydrophobicContact CD1-CD1 3.83Å; F345-F354 HydrophobicContact CD1-CG 4.33Å; F345-F354 HydrophobicContact CE1-CD1 4.26Å; F345-F354 PolarHBondContact O-N 3.46Å; F345-F359 WeakPolarHBondContact O-CE1 3.41Å
346	F	97	Very high	96.2	Very high	10 Å²	10	29.2 Å²	29.2	4%	0.044	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	134.1	-172.6	-164.9	-97.2	0	0	0	112	M342 C343 T348 N351 V353 F378 A381 H382	M342-F346 HydrophobicContact CE-CD2 4.21Å; M342-F346 PolarHBondContact O-N 2.74Å; C343-F346 PolarHBondContact O-N 3.17Å; F346-T348 HydrophobicContact CD1-CG2 3.94Å; F346-T348 HydrophobicContact CE1-CG2 4.13Å; F346-N351 WeakPolarHBondContact CZ-OD1 3.37Å; F346-V353 HydrophobicContact CD2-CB 4.29Å; F346-F378 HydrophobicContact CE2-CB 4.28Å; F346-F378 AromaticContact CE2-CD1 3.69Å; F346-F378 HydrophobicContact CE2-CD1 3.69Å; F346-F378 HydrophobicContact CE2-CE1 4.24Å; F346-F378 HydrophobicContact CE2-CG 4.01Å; F346-F378 HydrophobicContact CZ-CD1 4.22Å; F346-A381 HydrophobicContact CB-CB 4.28Å; F346-A381 HydrophobicContact CD1-CB 4.38Å; F346-A381 HydrophobicContact CD2-CB 3.59Å; F346-A381 HydrophobicContact CE2-CB 3.91Å; F346-A381 HydrophobicContact CG-CB 3.83Å; F346-A381 HydrophobicContact CZ-CB 4.42Å; F346-H382 HydrophobicContact CE1-CB 3.68Å; F346-H382 HydrophobicContact CZ-CB 4Å
347	N	95.8	Very high	96.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	107.2	175	-175.7	-1.1	0	0	0	110.4	R273 E349 N350 N351 T352 F359	R273-N347 VanDerWaalsContact CG-ND2 3.26Å; R273-N347 WeakPolarHBondContact CG-ND2 3.31Å; R273-N347 PolarHBondContact NE-OD1 3.37Å; R273-N347 PolarHBondContact NH1-OD1 2.79Å; R273-N347 PolarHBondContact NH2-OD1 2.89Å; R273-N347 VanDerWaalsContact NH2-OD1 3.15Å; N347-E349 VanDerWaalsContact C-N 3.3Å; N347-E349 PolarHBondContact O-N 3.26Å; N347-E349 WeakPolarHBondContact OD1-CB 3.41Å; N347-E349 PolarHBondContact OD1-N 3.32Å; N347-N350 WeakPolarHBondContact CB-OD1 3.38Å; N347-N350 PolarHBondContact ND2-OD1 3.5Å; N347-N350 VanDerWaalsContact ND2-OD1 3.13Å; N347-N350 PolarHBondContact O-OD1 3.14Å; N347-N351 WeakPolarHBondContact O-CA 3.27Å; N347-N351 PolarHBondContact O-N 3.28Å; N347-T352 PolarHBondContact N-O 2.77Å; N347-T352 PolarHBondContact O-N 3.1Å; N347-F359 HydrophobicContact CB-CD1 3.89Å; N347-F359 HydrophobicContact CB-CE1 3.78Å
348	T	94.7	Very high	96	Very high	63 Å²	63	32 Å²	32	39%	0.387	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-13.9	178.8	54.2	0	0	0	0	114.7	F346 C385	F346-T348 HydrophobicContact CD1-CG2 3.94Å; F346-T348 HydrophobicContact CE1-CG2 4.13Å; T348-C385 HydrophobicContact CG2-CB 3.55Å
349	E	93.7	Very high	95.9	Very high	119 Å²	119	31.2 Å²	31.2	56%	0.556	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-30	-179.3	-73.9	150.8	-154.9	0	0	112.9	R273 W274 N347	R273-E349 IonicContact CZ-OE1 3.42Å; R273-E349 IonicContact CZ-OE2 3.54Å; R273-E349 IonicContact NE-OE1 2.73Å; R273-E349 PolarHBondContact NE-OE1 3.09Å; R273-E349 IonicContact NE-OE2 3.59Å; R273-E349 PolarHBondContact NE-OE2 3.48Å; R273-E349 IonicContact NH2-OE1 2.71Å; R273-E349 PolarHBondContact NH2-OE1 3.47Å; R273-E349 IonicContact NH2-OE2 3.9Å; R273-E349 PolarHBondContact NH2-OE2 2.95Å; W274-E349 VanDerWaalsContact CH2-OE2 3.24Å; W274-E349 WeakPolarHBondContact CH2-OE2 3.32Å; W274-E349 WeakPolarHBondContact CZ2-OE2 3.46Å; N347-E349 VanDerWaalsContact C-N 3.3Å; N347-E349 PolarHBondContact O-N 3.26Å; N347-E349 WeakPolarHBondContact OD1-CB 3.41Å; N347-E349 PolarHBondContact OD1-N 3.32Å
350	N	94.1	Very high	95.8	Very high	61 Å²	61	30.6 Å²	30.6	33%	0.326	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	8.9	-177	67.4	-4.7	0	0	0	113.4	N347 T352	N347-N350 WeakPolarHBondContact CB-OD1 3.38Å; N347-N350 PolarHBondContact ND2-OD1 3.5Å; N347-N350 VanDerWaalsContact ND2-OD1 3.13Å; N347-N350 PolarHBondContact O-OD1 3.14Å; N350-T352 HydrophobicContact CB-CG2 4.49Å; N350-T352 PolarHBondContact ND2-OG1 2.85Å; N350-T352 PolarHBondContact OD1-N 3.37Å; N350-T352 PolarHBondContact OD1-OG1 3.24Å
351	N	95.8	Very high	95.8	Very high	75 Å²	75	30.9 Å²	30.9	40%	0.401	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	47.8	179.7	-163.7	51	0	0	0	113.8	F346 N347 F378	F346-N351 WeakPolarHBondContact CZ-OD1 3.37Å; N347-N351 WeakPolarHBondContact O-CA 3.27Å; N347-N351 PolarHBondContact O-N 3.28Å; N351-F378 WeakPolarHBondContact O-CE1 3.24Å
352	T	97.1	Very high	95.8	Very high	12 Å²	12	33 Å²	33	7%	0.074	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	154.3	-179.1	61.6	0	0	0	0	113.1	N347 N350 F359 A360	N347-T352 PolarHBondContact N-O 2.77Å; N347-T352 PolarHBondContact O-N 3.1Å; N350-T352 HydrophobicContact CB-CG2 4.49Å; N350-T352 PolarHBondContact ND2-OG1 2.85Å; N350-T352 PolarHBondContact OD1-N 3.37Å; N350-T352 PolarHBondContact OD1-OG1 3.24Å; T352-F359 WeakPolarHBondContact OG1-CD1 3.42Å; T352-A360 CarbonylContact C-O 3.56Å; T352-A360 WeakPolarHBondContact CA-O 3.16Å; T352-A360 WeakPolarHBondContact CB-O 3.44Å
353	V	96.9	Very high	95.9	Very high	11 Å²	11	34.9 Å²	34.9	7%	0.067	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	144.1	171.2	69	0	0	0	0	110.6	M342 F345 F346 F355 F359 A360 F365 F378	M342-V353 HydrophobicContact CE-CB 4.04Å; M342-V353 HydrophobicContact CE-CG2 3.73Å; M342-V353 HydrophobicContact CG-CG2 4.06Å; M342-V353 HydrophobicContact SD-CG2 4.49Å; F345-V353 HydrophobicContact CB-CG2 4.26Å; F345-V353 CarbonylContact O-C 3.48Å; F345-V353 WeakPolarHBondContact O-CA 3.32Å; F346-V353 HydrophobicContact CD2-CB 4.29Å; V353-F355 PolarHBondContact O-N 3.07Å; V353-F359 WeakPolarHBondContact O-CA 3.42Å; V353-A360 PolarHBondContact N-O 2.68Å; V353-A360 PolarHBondContact O-N 2.86Å; V353-F365 HydrophobicContact CG1-CE2 3.89Å; V353-F365 HydrophobicContact CG1-CZ 4.09Å; V353-F378 HydrophobicContact CB-CZ 4.21Å; V353-F378 HydrophobicContact CG1-CE2 4.02Å; V353-F378 HydrophobicContact CG1-CZ 3.65Å
354	F	96.8	Very high	96	Very high	20 Å²	20	34 Å²	34	9%	0.088	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	116.3	171.5	-175.1	-100.3	0	0	0	110.6	Y264 L269 L272 F345 G357 K358 F359	Y264-F354 HydrophobicContact CD2-CE1 4.29Å; Y264-F354 HydrophobicContact CE1-CE1 4.26Å; Y264-F354 HydrophobicContact CE1-CZ 4.13Å; Y264-F354 AromaticContact CE2-CE1 3.64Å; Y264-F354 HydrophobicContact CE2-CE1 3.64Å; Y264-F354 HydrophobicContact CE2-CZ 4.32Å; Y264-F354 AromaticContact CZ-CE1 3.63Å; Y264-F354 AromaticContact CZ-CZ 3.85Å; L269-F354 HydrophobicContact CD2-CD1 4.11Å; L269-F354 HydrophobicContact CD2-CD2 4.41Å; L269-F354 HydrophobicContact CD2-CE1 4.36Å; L269-F354 HydrophobicContact CD2-CG 4.11Å; L272-F354 HydrophobicContact CB-CE2 4.17Å; L272-F354 HydrophobicContact CD1-CE2 3.78Å; L272-F354 HydrophobicContact CD1-CZ 3.94Å; F345-F354 HydrophobicContact CB-CB 4.09Å; F345-F354 HydrophobicContact CD1-CB 4.08Å; F345-F354 AromaticContact CD1-CD1 3.83Å; F345-F354 HydrophobicContact CD1-CD1 3.83Å; F345-F354 HydrophobicContact CD1-CG 4.33Å; F345-F354 HydrophobicContact CE1-CD1 4.26Å; F345-F354 PolarHBondContact O-N 3.46Å; F354-G357 VanDerWaalsContact CE2-C 3.47Å; F354-G357 VanDerWaalsContact CZ-CA 3.49Å; F354-K358 CarbonylContact C-O 3.52Å; F354-K358 VanDerWaalsContact CA-O 3.31Å; F354-K358 WeakPolarHBondContact CA-O 3.48Å; F354-F359 HydrophobicContact CB-CD1 4.24Å; F354-F359 HydrophobicContact CB-CD2 4.44Å; F354-F359 HydrophobicContact CB-CE1 3.9Å; F354-F359 HydrophobicContact CB-CE2 4.1Å; F354-F359 HydrophobicContact CB-CZ 3.82Å; F354-F359 AromaticContact CD2-CD2 3.88Å; F354-F359 HydrophobicContact CD2-CD2 3.88Å; F354-F359 AromaticContact CD2-CE2 3.67Å; F354-F359 HydrophobicContact CD2-CE2 3.67Å; F354-F359 HydrophobicContact CD2-CZ 4.24Å; F354-F359 HydrophobicContact CG-CE2 4.33Å; F354-F359 HydrophobicContact CG-CZ 4.47Å
355	F	95.8	Very high	96.1	Very high	26 Å²	26	33.8 Å²	33.8	11%	0.114	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	132.8	-179.9	-167.3	-104.8	0	0	0	108.5	F277 Y285 H296 R300 V353 G357 K358 V364 F365	F277-F355 WeakPolarHBondContact CE2-O 3.44Å; F277-F355 VanDerWaalsContact CZ-O 3.3Å; F277-F355 WeakPolarHBondContact CZ-O 3.46Å; Y285-F355 AromaticContact CE1-CE1 3.99Å; Y285-F355 HydrophobicContact CE1-CE1 3.99Å; H296-F355 AromaticContact CD2-CZ 3.78Å; H296-F355 AromaticContact NE2-CE1 3.86Å; H296-F355 AromaticContact NE2-CZ 3.83Å; R300-F355 HydrophobicContact CB-CE2 4.42Å; R300-F355 HydrophobicContact CG-CE2 4.09Å; R300-F355 HydrophobicContact CG-CZ 4.17Å; V353-F355 PolarHBondContact O-N 3.07Å; F355-G357 PolarHBondContact O-N 3.45Å; F355-K358 PolarHBondContact N-O 2.91Å; F355-K358 PolarHBondContact O-N 3.47Å; F355-V364 HydrophobicContact CD1-CG1 4.29Å; F355-F365 HydrophobicContact CB-CZ 4.21Å; F355-F365 HydrophobicContact CD1-CE1 4.37Å; F355-F365 HydrophobicContact CD1-CZ 4.25Å; F355-F365 AromaticContact CD2-CE1 3.88Å; F355-F365 HydrophobicContact CD2-CE1 3.88Å; F355-F365 AromaticContact CD2-CZ 3.76Å; F355-F365 HydrophobicContact CD2-CZ 3.76Å; F355-F365 HydrophobicContact CE1-CE1 4.26Å; F355-F365 AromaticContact CE2-CE1 3.76Å; F355-F365 HydrophobicContact CE2-CE1 3.76Å; F355-F365 HydrophobicContact CE2-CZ 4.15Å; F355-F365 HydrophobicContact CG-CE1 4.19Å; F355-F365 AromaticContact CG-CZ 3.82Å; F355-F365 HydrophobicContact CG-CZ 3.82Å; F355-F365 AromaticContact CZ-CE1 3.96Å; F355-F365 HydrophobicContact CZ-CE1 3.96Å
356	D	94.1	Very high	96.1	Very high	44 Å²	44	38.9 Å²	38.9	24%	0.235	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.2	40.3	176	-60.7	-9.4	0	0	0	116	F277 Y285 H296 R300	F277-D356 HydrophobicContact CZ-CB 4.43Å; Y285-D356 PolarHBondContact OH-OD2 2.83Å; H296-D356 IonicContact CD2-OD2 3.35Å; H296-D356 IonicContact CE1-OD2 2.62Å; H296-D356 PolarHBondContact CE1-OD2 3.5Å; H296-D356 IonicContact NE2-OD2 3.86Å; H296-D356 PolarHBondContact NE2-OD2 2.89Å; R300-D356 IonicContact CZ-OD1 3.52Å; R300-D356 VanDerWaalsContact CZ-OD1 3.3Å; R300-D356 IonicContact NE-OD1 3.29Å; R300-D356 PolarHBondContact NE-OD1 3.45Å; R300-D356 IonicContact NH2-OD1 2.71Å; R300-D356 PolarHBondContact NH2-OD1 3.17Å; R300-D356 VanDerWaalsContact NH2-OD1 3.11Å
357	G	94.1	Very high	96.1	Very high	20 Å²	20	39.3 Å²	39.3	21%	0.206	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	8	174.1	0	0	0	0	0	115.2	K275 F354 F355	K275-G357 WeakPolarHBondContact CD-O 3.4Å; K275-G357 WeakPolarHBondContact CE-O 3.28Å; K275-G357 PolarHBondContact NZ-O 3.47Å; F354-G357 VanDerWaalsContact CE2-C 3.47Å; F354-G357 VanDerWaalsContact CZ-CA 3.49Å; F355-G357 PolarHBondContact O-N 3.45Å
358	K	96.6	Very high	96.2	Very high	43 Å²	43	39.8 Å²	39.8	19%	0.187	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	169.9	176.7	-67	-161	-175.4	-169.8	0	111.4	K275 V276 F277 E281 F354 F355	K275-K358 HydrophobicContact CD-CG 4.17Å; K275-K358 HydrophobicContact CG-CG 4.15Å; K275-K358 CarbonylContact O-C 3.52Å; K275-K358 WeakPolarHBondContact O-CA 3.44Å; K275-K358 WeakPolarHBondContact O-CB 3.45Å; V276-K358 WeakPolarHBondContact O-CD 3.46Å; F277-K358 HydrophobicContact CD1-CB 4.25Å; F277-K358 HydrophobicContact CD1-CD 3.94Å; F277-K358 HydrophobicContact CD2-CB 3.68Å; F277-K358 HydrophobicContact CE1-CB 4.15Å; F277-K358 HydrophobicContact CE1-CD 4.26Å; F277-K358 HydrophobicContact CE1-CG 4.47Å; F277-K358 HydrophobicContact CE2-CB 3.57Å; F277-K358 HydrophobicContact CG-CB 4.04Å; F277-K358 HydrophobicContact CG-CD 4.15Å; F277-K358 HydrophobicContact CZ-CB 3.82Å; E281-K358 WeakPolarHBondContact OE1-CE 3.37Å; E281-K358 IonicContact OE1-NZ 2.65Å; E281-K358 PolarHBondContact OE1-NZ 2.85Å; E281-K358 IonicContact OE2-NZ 2.66Å; E281-K358 PolarHBondContact OE2-NZ 3.19Å; F354-K358 CarbonylContact C-O 3.52Å; F354-K358 VanDerWaalsContact CA-O 3.31Å; F354-K358 WeakPolarHBondContact CA-O 3.48Å; F355-K358 PolarHBondContact N-O 2.91Å; F355-K358 PolarHBondContact O-N 3.47Å
359	F	97.3	Very high	96.2	Very high	5 Å²	5	39.8 Å²	39.8	2%	0.022	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	130.2	172.8	-82.6	-93.7	0	0	0	111.8	L272 K275 V276 F277 F345 N347 T352 V353 F354	L272-F359 HydrophobicContact CB-CE2 4.36Å; L272-F359 VanDerWaalsContact O-CD2 3.28Å; L272-F359 WeakPolarHBondContact O-CD2 3.46Å; L272-F359 WeakPolarHBondContact O-CE2 3.36Å; K275-F359 PolarHBondContact O-N 3.36Å; V276-F359 VanDerWaalsContact CA-O 3.26Å; V276-F359 WeakPolarHBondContact CA-O 3.43Å; V276-F359 HydrophobicContact CG1-CB 4.05Å; F277-F359 WeakPolarHBondContact CD2-O 3.5Å; F277-F359 PolarHBondContact N-O 2.91Å; F277-F359 VanDerWaalsContact N-O 3.11Å; F345-F359 WeakPolarHBondContact O-CE1 3.41Å; N347-F359 HydrophobicContact CB-CD1 3.89Å; N347-F359 HydrophobicContact CB-CE1 3.78Å; T352-F359 WeakPolarHBondContact OG1-CD1 3.42Å; V353-F359 WeakPolarHBondContact O-CA 3.42Å; F354-F359 HydrophobicContact CB-CD1 4.24Å; F354-F359 HydrophobicContact CB-CD2 4.44Å; F354-F359 HydrophobicContact CB-CE1 3.9Å; F354-F359 HydrophobicContact CB-CE2 4.1Å; F354-F359 HydrophobicContact CB-CZ 3.82Å; F354-F359 AromaticContact CD2-CD2 3.88Å; F354-F359 HydrophobicContact CD2-CD2 3.88Å; F354-F359 AromaticContact CD2-CE2 3.67Å; F354-F359 HydrophobicContact CD2-CE2 3.67Å; F354-F359 HydrophobicContact CD2-CZ 4.24Å; F354-F359 HydrophobicContact CG-CE2 4.33Å; F354-F359 HydrophobicContact CG-CZ 4.47Å
360	A	96.5	Very high	96.3	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.008	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	143.2	-176.7	0	0	0	0	0	111.9	F277 T352 V353 V364	F277-A360 HydrophobicContact CD2-CB 3.64Å; F277-A360 HydrophobicContact CE2-CB 3.76Å; T352-A360 CarbonylContact C-O 3.56Å; T352-A360 WeakPolarHBondContact CA-O 3.16Å; T352-A360 WeakPolarHBondContact CB-O 3.44Å; V353-A360 PolarHBondContact N-O 2.68Å; V353-A360 PolarHBondContact O-N 2.86Å; A360-V364 HydrophobicContact CB-CB 3.96Å; A360-V364 HydrophobicContact CB-CG1 4.44Å; A360-V364 HydrophobicContact CB-CG2 3.61Å
361	G	97.1	Very high	96.4	Very high	7 Å²	7	34 Å²	34	7%	0.072	20%	0.2	C	C	.	.			trans	-81.4	-165.6	164.2	0	0	0	0	0	111.6	E363	G361-E363 VanDerWaalsContact CA-OE1 3.24Å; G361-E363 WeakPolarHBondContact CA-OE1 3.38Å; G361-E363 WeakPolarHBondContact CA-OE2 3.48Å; G361-E363 PolarHBondContact N-OE1 3.01Å; G361-E363 PolarHBondContact O-N 2.97Å
362	T	97.5	Very high	96.6	Very high	62 Å²	62	34.2 Å²	34.2	38%	0.38	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-70.2	-19.1	179.5	58.1	0	0	0	0	112.7	V364 F365 I374 F378	T362-V364 VanDerWaalsContact C-N 3.31Å; T362-V364 PolarHBondContact O-N 3.42Å; T362-F365 PolarHBondContact O-N 3.39Å; T362-F365 VanDerWaalsContact O-N 3.09Å; T362-I374 HydrophobicContact CG2-CG2 3.91Å; T362-F378 HydrophobicContact CG2-CB 4.46Å; T362-F378 HydrophobicContact CG2-CD1 3.61Å; T362-F378 HydrophobicContact CG2-CD2 3.95Å; T362-F378 HydrophobicContact CG2-CE1 3.67Å; T362-F378 HydrophobicContact CG2-CE2 4Å; T362-F378 HydrophobicContact CG2-CG 3.75Å; T362-F378 HydrophobicContact CG2-CZ 3.86Å
363	E	96.5	Very high	96.6	Very high	71 Å²	71	34.2 Å²	34.2	33%	0.332	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-64.6	-26.9	-177.1	70	-66.5	148.7	0	0	114.4	I282 Q286 G361 F365 K366	I282-E363 HydrophobicContact CD1-CG 4.05Å; I282-E363 HydrophobicContact CG1-CG 4.42Å; I282-E363 HydrophobicContact CG2-CB 4.45Å; I282-E363 HydrophobicContact CG2-CG 3.75Å; Q286-E363 WeakPolarHBondContact CG-O 3.38Å; Q286-E363 PolarHBondContact NE2-O 3.17Å; G361-E363 VanDerWaalsContact CA-OE1 3.24Å; G361-E363 WeakPolarHBondContact CA-OE1 3.38Å; G361-E363 WeakPolarHBondContact CA-OE2 3.48Å; G361-E363 PolarHBondContact N-OE1 3.01Å; G361-E363 PolarHBondContact O-N 2.97Å; E363-F365 VanDerWaalsContact C-N 3.28Å; E363-F365 PolarHBondContact O-N 2.94Å; E363-K366 WeakPolarHBondContact O-CB 3.32Å
364	V	97.4	Very high	96.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-65.9	-33.4	173.3	167.3	0	0	0	0	111.4	F277 I282 Y285 M293 F355 A360 T362 K366	F277-V364 HydrophobicContact CD2-CG2 4.42Å; I282-V364 HydrophobicContact CB-CG2 4.46Å; I282-V364 HydrophobicContact CG1-CG2 3.84Å; I282-V364 HydrophobicContact CG2-CG2 4.45Å; Y285-V364 HydrophobicContact CD1-CG1 4.17Å; Y285-V364 HydrophobicContact CD2-CG1 3.98Å; Y285-V364 HydrophobicContact CG-CG1 3.78Å; M293-V364 HydrophobicContact CE-CG1 4.35Å; M293-V364 WeakPolarHBondContact CE-O 3.37Å; F355-V364 HydrophobicContact CD1-CG1 4.29Å; A360-V364 HydrophobicContact CB-CB 3.96Å; A360-V364 HydrophobicContact CB-CG1 4.44Å; A360-V364 HydrophobicContact CB-CG2 3.61Å; T362-V364 VanDerWaalsContact C-N 3.31Å; T362-V364 PolarHBondContact O-N 3.42Å; V364-K366 VanDerWaalsContact C-N 3.33Å; V364-K366 PolarHBondContact O-N 3.12Å
365	F	97.5	Very high	96.7	Very high	19 Å²	19	35.8 Å²	35.8	8%	0.083	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-86.9	-0.2	-174.8	-59.6	-76.6	0	0	0	114	M293 V353 F355 T362 E363 S367 L368 I374 F378	M293-F365 HydrophobicContact CE-CD1 4.04Å; V353-F365 HydrophobicContact CG1-CE2 3.89Å; V353-F365 HydrophobicContact CG1-CZ 4.09Å; F355-F365 HydrophobicContact CB-CZ 4.21Å; F355-F365 HydrophobicContact CD1-CE1 4.37Å; F355-F365 HydrophobicContact CD1-CZ 4.25Å; F355-F365 AromaticContact CD2-CE1 3.88Å; F355-F365 HydrophobicContact CD2-CE1 3.88Å; F355-F365 AromaticContact CD2-CZ 3.76Å; F355-F365 HydrophobicContact CD2-CZ 3.76Å; F355-F365 HydrophobicContact CE1-CE1 4.26Å; F355-F365 AromaticContact CE2-CE1 3.76Å; F355-F365 HydrophobicContact CE2-CE1 3.76Å; F355-F365 HydrophobicContact CE2-CZ 4.15Å; F355-F365 HydrophobicContact CG-CE1 4.19Å; F355-F365 AromaticContact CG-CZ 3.82Å; F355-F365 HydrophobicContact CG-CZ 3.82Å; F355-F365 AromaticContact CZ-CE1 3.96Å; F355-F365 HydrophobicContact CZ-CE1 3.96Å; T362-F365 PolarHBondContact O-N 3.39Å; T362-F365 VanDerWaalsContact O-N 3.09Å; E363-F365 VanDerWaalsContact C-N 3.28Å; E363-F365 PolarHBondContact O-N 2.94Å; F365-S367 VanDerWaalsContact C-N 3.26Å; F365-S367 PolarHBondContact O-N 2.96Å; F365-S367 VanDerWaalsContact O-N 3.12Å; F365-L368 HydrophobicContact CB-CD1 4.17Å; F365-L368 HydrophobicContact CD1-CD1 4.16Å; F365-L368 WeakPolarHBondContact O-CB 3.41Å; F365-L368 PolarHBondContact O-N 3.33Å; F365-I374 HydrophobicContact CB-CD1 3.93Å; F365-I374 HydrophobicContact CB-CG1 3.93Å; F365-I374 HydrophobicContact CB-CG2 4.02Å; F365-I374 HydrophobicContact CD1-CD1 4.4Å; F365-I374 HydrophobicContact CD2-CG2 4.3Å; F365-I374 HydrophobicContact CG-CD1 4.16Å; F365-I374 HydrophobicContact CG-CG2 4.37Å; F365-F378 HydrophobicContact CD2-CE2 4.33Å; F365-F378 HydrophobicContact CD2-CZ 4.4Å; F365-F378 HydrophobicContact CE2-CE2 4.22Å; F365-F378 HydrophobicContact CE2-CZ 4.16Å
366	K	96.4	Very high	96.8	Very high	148 Å²	148	36 Å²	36	64%	0.643	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-51.8	-38.4	-173.2	-174.2	179.5	177.4	-175.5	0	113.9	Q286 E363 V364 L368 A369	Q286-K366 HydrophobicContact CG-CB 4.35Å; Q286-K366 HydrophobicContact CG-CD 4.49Å; E363-K366 WeakPolarHBondContact O-CB 3.32Å; V364-K366 VanDerWaalsContact C-N 3.33Å; V364-K366 PolarHBondContact O-N 3.12Å; K366-L368 PolarHBondContact O-N 3.44Å; K366-A369 PolarHBondContact O-N 3.07Å
367	S	97.1	Very high	97	Very high	19 Å²	19	34.8 Å²	34.8	13%	0.133	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-70.1	-12.2	-178.3	-59.8	0	0	0	0	114.6	Y285 Q286 K288 V290 F365 A369	Y285-S367 PolarHBondContact O-OG 2.92Å; Q286-S367 WeakPolarHBondContact CA-OG 3.37Å; Q286-S367 PolarHBondContact O-OG 2.88Å; Q286-S367 VanDerWaalsContact O-OG 3.06Å; K288-S367 WeakPolarHBondContact O-CB 3.24Å; K288-S367 PolarHBondContact O-OG 2.93Å; V290-S367 WeakPolarHBondContact CA-O 3.45Å; F365-S367 VanDerWaalsContact C-N 3.26Å; F365-S367 PolarHBondContact O-N 2.96Å; F365-S367 VanDerWaalsContact O-N 3.12Å; S367-A369 PolarHBondContact O-N 3.39Å
368	L	96.6	Very high	97.2	Very high	9 Å²	9	34.1 Å²	34.1	5%	0.047	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-67.5	-14.7	174.1	-67.6	173.1	0	0	0	113.9	M293 W294 C297 F365 K366 C370 I374	M293-L368 HydrophobicContact CB-CD2 4.02Å; M293-L368 HydrophobicContact CB-CG 4.5Å; M293-L368 HydrophobicContact CG-CD2 3.66Å; M293-L368 HydrophobicContact CG-CG 3.76Å; W294-L368 HydrophobicContact CB-CD2 4.23Å; W294-L368 HydrophobicContact CD2-CD2 4.13Å; W294-L368 HydrophobicContact CG-CD2 3.72Å; W294-L368 PolarHBondContact NE1-O 3.22Å; C297-L368 HydrophobicContact CB-CD2 4.41Å; F365-L368 HydrophobicContact CB-CD1 4.17Å; F365-L368 HydrophobicContact CD1-CD1 4.16Å; F365-L368 WeakPolarHBondContact O-CB 3.41Å; F365-L368 PolarHBondContact O-N 3.33Å; K366-L368 PolarHBondContact O-N 3.44Å; L368-C370 WeakPolarHBondContact CB-SG 3.38Å; L368-C370 PolarHBondContact O-N 3.45Å; L368-C370 VanDerWaalsContact O-N 3.11Å; L368-I374 HydrophobicContact CD1-CD1 3.9Å; L368-I374 HydrophobicContact CD1-CG1 4.43Å
369	A	95.9	Very high	97.3	Very high	64 Å²	64	37.5 Å²	37.5	53%	0.529	23%	0.228	S	C	.	.	S	Bend	trans	58.9	14.3	-174.9	0	0	0	0	0	115.6	K366 S367 W463	K366-A369 PolarHBondContact O-N 3.07Å; S367-A369 PolarHBondContact O-N 3.39Å; A369-W463 HydrophobicContact CB-CH2 4.05Å; A369-W463 HydrophobicContact CB-CZ3 4.43Å
370	C	95.9	Very high	97.4	Very high	4 Å²	4	37.7 Å²	37.7	3%	0.027	23%	0.229	C	C	.	.			trans	-117.5	49.4	177.1	60.8	0	0	0	0	112.6	W294 L368 D372 L373 I374 K460	W294-C370 HydrophobicContact CZ2-CB 4.46Å; L368-C370 WeakPolarHBondContact CB-SG 3.38Å; L368-C370 PolarHBondContact O-N 3.45Å; L368-C370 VanDerWaalsContact O-N 3.11Å; C370-D372 PolarHBondContact O-N 3.42Å; C370-D372 VanDerWaalsContact O-N 3.13Å; C370-L373 HydrophobicContact CB-CB 4.17Å; C370-L373 WeakPolarHBondContact O-CB 3.14Å; C370-L373 PolarHBondContact O-N 2.82Å; C370-I374 PolarHBondContact O-N 2.95Å; C370-I374 VanDerWaalsContact O-N 3.08Å; C370-K460 HydrophobicContact CB-CB 4.11Å; C370-K460 HydrophobicContact CB-CD 4.37Å; C370-K460 HydrophobicContact CB-CG 3.82Å
371	G	96.6	Very high	97.4	Very high	54 Å²	54	37.7 Å²	37.7	56%	0.557	23%	0.228	S	C	*	.	H	α-helix	trans	-59.1	-25.3	-175.6	0	0	0	0	0	114.7	A375	G371-A375 WeakPolarHBondContact O-CB 3.24Å; G371-A375 PolarHBondContact O-N 3.11Å
372	D	98	Very high	97.4	Very high	80 Å²	80	41.6 Å²	41.6	43%	0.428	25%	0.245	S	C	.	.	H	α-helix	trans	-67.6	-44.5	172.8	59.6	-25.4	0	0	0	112.6	C370 A376 K460	C370-D372 PolarHBondContact O-N 3.42Å; C370-D372 VanDerWaalsContact O-N 3.13Å; D372-A376 WeakPolarHBondContact O-CB 3.49Å; D372-A376 PolarHBondContact O-N 3.27Å; D372-K460 VanDerWaalsContact CG-CE 3.47Å; D372-K460 WeakPolarHBondContact OD1-CE 3.37Å; D372-K460 IonicContact OD1-NZ 2.74Å; D372-K460 WeakPolarHBondContact OD2-CE 3.38Å; D372-K460 IonicContact OD2-NZ 3.98Å; D372-K460 PolarHBondContact OD2-NZ 3.33Å
373	L	98	Very high	97.4	Very high	11 Å²	11	39.1 Å²	39.1	6%	0.058	23%	0.232	C	C	.	.	H	α-helix	trans	-63.7	-43.9	172.7	176.2	63.4	0	0	0	111.2	C370 A376 V377 L456 H457 K460	C370-L373 HydrophobicContact CB-CB 4.17Å; C370-L373 WeakPolarHBondContact O-CB 3.14Å; C370-L373 PolarHBondContact O-N 2.82Å; L373-A376 PolarHBondContact O-N 2.93Å; L373-V377 HydrophobicContact CD1-CG2 4.12Å; L373-V377 WeakPolarHBondContact O-CB 3.41Å; L373-V377 VanDerWaalsContact O-CG2 3.25Å; L373-V377 WeakPolarHBondContact O-CG2 3.47Å; L373-V377 PolarHBondContact O-N 3.46Å; L373-L456 HydrophobicContact CB-CD2 4.09Å; L373-L456 HydrophobicContact CB-CG 4.26Å; L373-L456 HydrophobicContact CD1-CB 4.17Å; L373-L456 HydrophobicContact CD1-CD2 3.96Å; L373-L456 HydrophobicContact CD1-CG 3.97Å; L373-H457 HydrophobicContact CD1-CB 4.27Å; L373-H457 HydrophobicContact CD2-CB 4.21Å; L373-K460 HydrophobicContact CB-CG 4.31Å; L373-K460 HydrophobicContact CD2-CB 4.38Å; L373-K460 HydrophobicContact CD2-CG 4.15Å
374	I	98.1	Very high	97.5	Very high	22 Å²	22	35.8 Å²	35.8	11%	0.113	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-44.3	179.8	-62	-61.4	0	0	0	111.3	T362 F365 L368 C370 V377 F378	T362-I374 HydrophobicContact CG2-CG2 3.91Å; F365-I374 HydrophobicContact CB-CD1 3.93Å; F365-I374 HydrophobicContact CB-CG1 3.93Å; F365-I374 HydrophobicContact CB-CG2 4.02Å; F365-I374 HydrophobicContact CD1-CD1 4.4Å; F365-I374 HydrophobicContact CD2-CG2 4.3Å; F365-I374 HydrophobicContact CG-CD1 4.16Å; F365-I374 HydrophobicContact CG-CG2 4.37Å; L368-I374 HydrophobicContact CD1-CD1 3.9Å; L368-I374 HydrophobicContact CD1-CG1 4.43Å; C370-I374 PolarHBondContact O-N 2.95Å; C370-I374 VanDerWaalsContact O-N 3.08Å; I374-V377 PolarHBondContact O-N 2.76Å; I374-F378 HydrophobicContact CG2-CD2 4.11Å; I374-F378 HydrophobicContact CG2-CE2 4Å; I374-F378 VanDerWaalsContact O-CD2 3.29Å; I374-F378 WeakPolarHBondContact O-CD2 3.14Å; I374-F378 PolarHBondContact O-N 3.49Å
375	A	98.3	Very high	97.5	Very high	42 Å²	42	37.3 Å²	37.3	35%	0.347	23%	0.226	S	C	.	.	H	α-helix	trans	-59.2	-51.7	174.7	0	0	0	0	0	111.5	G371 V377 F378 D379	G371-A375 WeakPolarHBondContact O-CB 3.24Å; G371-A375 PolarHBondContact O-N 3.11Å; A375-V377 VanDerWaalsContact C-N 3.26Å; A375-V377 PolarHBondContact O-N 3.03Å; A375-F378 PolarHBondContact O-N 2.83Å; A375-D379 PolarHBondContact O-N 3.41Å
376	A	98.4	Very high	97.4	Very high	31 Å²	31	39.5 Å²	39.5	26%	0.256	25%	0.248	S	C	.	.	H	α-helix	trans	-61.8	-31.9	-179.3	0	0	0	0	0	113.3	D372 L373 F380 L453	D372-A376 WeakPolarHBondContact O-CB 3.49Å; D372-A376 PolarHBondContact O-N 3.27Å; L373-A376 PolarHBondContact O-N 2.93Å; A376-F380 WeakPolarHBondContact O-CB 3.43Å; A376-F380 PolarHBondContact O-N 2.76Å; A376-L453 HydrophobicContact CB-CD2 3.56Å
377	V	98.3	Very high	97.4	Very high	19 Å²	19	33.7 Å²	33.7	12%	0.115	22%	0.223	C	C	.	.	H	α-helix	trans	-70.7	-40.3	173.6	165.8	0	0	0	0	111.9	L339 M342 L373 I374 A375 A381 L453	L339-V377 HydrophobicContact CD2-CG1 3.87Å; L339-V377 HydrophobicContact CD2-CG2 3.88Å; M342-V377 HydrophobicContact CE-CG1 3.67Å; M342-V377 HydrophobicContact SD-CG1 3.45Å; M342-V377 WeakPolarHBondContact SD-CG1 3.49Å; L373-V377 HydrophobicContact CD1-CG2 4.12Å; L373-V377 WeakPolarHBondContact O-CB 3.41Å; L373-V377 VanDerWaalsContact O-CG2 3.25Å; L373-V377 WeakPolarHBondContact O-CG2 3.47Å; L373-V377 PolarHBondContact O-N 3.46Å; I374-V377 PolarHBondContact O-N 2.76Å; A375-V377 VanDerWaalsContact C-N 3.26Å; A375-V377 PolarHBondContact O-N 3.03Å; V377-A381 WeakPolarHBondContact O-CB 3.36Å; V377-A381 PolarHBondContact O-N 3.1Å; V377-L453 HydrophobicContact CG2-CD2 4.15Å
378	F	98.4	Very high	97.4	Very high	6 Å²	6	41.4 Å²	41.4	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-44.6	173.7	-87.1	-124.3	0	0	0	111.5	M342 F346 N351 V353 T362 F365 I374 A375 F380 A381 H382	M342-F378 HydrophobicContact CE-CD2 4.17Å; M342-F378 HydrophobicContact CE-CE2 4.32Å; F346-F378 HydrophobicContact CE2-CB 4.28Å; F346-F378 AromaticContact CE2-CD1 3.69Å; F346-F378 HydrophobicContact CE2-CD1 3.69Å; F346-F378 HydrophobicContact CE2-CE1 4.24Å; F346-F378 HydrophobicContact CE2-CG 4.01Å; F346-F378 HydrophobicContact CZ-CD1 4.22Å; N351-F378 WeakPolarHBondContact O-CE1 3.24Å; V353-F378 HydrophobicContact CB-CZ 4.21Å; V353-F378 HydrophobicContact CG1-CE2 4.02Å; V353-F378 HydrophobicContact CG1-CZ 3.65Å; T362-F378 HydrophobicContact CG2-CB 4.46Å; T362-F378 HydrophobicContact CG2-CD1 3.61Å; T362-F378 HydrophobicContact CG2-CD2 3.95Å; T362-F378 HydrophobicContact CG2-CE1 3.67Å; T362-F378 HydrophobicContact CG2-CE2 4Å; T362-F378 HydrophobicContact CG2-CG 3.75Å; T362-F378 HydrophobicContact CG2-CZ 3.86Å; F365-F378 HydrophobicContact CD2-CE2 4.33Å; F365-F378 HydrophobicContact CD2-CZ 4.4Å; F365-F378 HydrophobicContact CE2-CE2 4.22Å; F365-F378 HydrophobicContact CE2-CZ 4.16Å; I374-F378 HydrophobicContact CG2-CD2 4.11Å; I374-F378 HydrophobicContact CG2-CE2 4Å; I374-F378 VanDerWaalsContact O-CD2 3.29Å; I374-F378 WeakPolarHBondContact O-CD2 3.14Å; I374-F378 PolarHBondContact O-N 3.49Å; A375-F378 PolarHBondContact O-N 2.83Å; F378-F380 VanDerWaalsContact C-N 3.31Å; F378-F380 PolarHBondContact O-N 3.02Å; F378-A381 PolarHBondContact O-N 3.48Å; F378-H382 WeakPolarHBondContact O-CB 3.47Å; F378-H382 PolarHBondContact O-N 2.79Å
379	D	97.9	Very high	97.4	Very high	114 Å²	114	42.5 Å²	42.5	61%	0.61	26%	0.26	S	S	*	.	H	α-helix	trans	-59.4	-41.2	176.4	-71.4	-30.4	0	0	0	111.7	A375 G383	A375-D379 PolarHBondContact O-N 3.41Å; D379-G383 PolarHBondContact O-N 3.29Å
380	F	98.4	Very high	97.4	Very high	9 Å²	9	42.3 Å²	42.3	4%	0.039	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-45.8	173.8	174.6	-91.4	0	0	0	112.4	L339 A376 F378 H382 G383 L384 R446 V449 L450 L453	L339-F380 HydrophobicContact CB-CE1 4.36Å; A376-F380 WeakPolarHBondContact O-CB 3.43Å; A376-F380 PolarHBondContact O-N 2.76Å; F378-F380 VanDerWaalsContact C-N 3.31Å; F378-F380 PolarHBondContact O-N 3.02Å; F380-H382 PolarHBondContact O-N 2.78Å; F380-G383 CarbonylContact O-C 3.59Å; F380-G383 PolarHBondContact O-N 3.22Å; F380-L384 HydrophobicContact CE1-CB 4.45Å; F380-L384 HydrophobicContact CE1-CD2 3.84Å; F380-L384 HydrophobicContact CZ-CD2 3.99Å; F380-L384 WeakPolarHBondContact O-CB 3.44Å; F380-L384 PolarHBondContact O-N 2.91Å; F380-R446 HydrophobicContact CE2-CB 4.06Å; F380-V449 HydrophobicContact CD2-CB 4.08Å; F380-V449 HydrophobicContact CD2-CG1 3.73Å; F380-V449 HydrophobicContact CE2-CB 4.35Å; F380-V449 HydrophobicContact CE2-CG1 4.46Å; F380-L450 HydrophobicContact CD1-CD2 4.45Å; F380-L450 HydrophobicContact CE1-CD2 3.67Å; F380-L450 HydrophobicContact CE1-CG 4.4Å; F380-L450 HydrophobicContact CE2-CD2 3.88Å; F380-L450 HydrophobicContact CE2-CG 3.77Å; F380-L450 HydrophobicContact CZ-CD1 4.07Å; F380-L450 HydrophobicContact CZ-CD2 3.34Å; F380-L450 HydrophobicContact CZ-CG 3.57Å; F380-L453 HydrophobicContact CB-CD1 3.61Å; F380-L453 HydrophobicContact CD1-CD1 4.13Å; F380-L453 HydrophobicContact CD2-CD1 4Å; F380-L453 HydrophobicContact CG-CD1 3.62Å
381	A	97.8	Very high	97.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-47	178.7	0	0	0	0	0	111.1	M342 F346 V377 F378 L384 C385	M342-A381 HydrophobicContact CE-CB 3.93Å; M342-A381 HydrophobicContact CG-CB 4.38Å; M342-A381 HydrophobicContact SD-CB 4.44Å; F346-A381 HydrophobicContact CB-CB 4.28Å; F346-A381 HydrophobicContact CD1-CB 4.38Å; F346-A381 HydrophobicContact CD2-CB 3.59Å; F346-A381 HydrophobicContact CE2-CB 3.91Å; F346-A381 HydrophobicContact CG-CB 3.83Å; F346-A381 HydrophobicContact CZ-CB 4.42Å; V377-A381 WeakPolarHBondContact O-CB 3.36Å; V377-A381 PolarHBondContact O-N 3.1Å; F378-A381 PolarHBondContact O-N 3.48Å; A381-L384 PolarHBondContact O-N 2.83Å; A381-C385 PolarHBondContact O-N 3.38Å; A381-C385 PolarHBondContact O-SG 3.45Å
382	H	97	Very high	97.4	Very high	90 Å²	90	44.7 Å²	44.7	42%	0.417	25%	0.249	S	C	.	.	H	α-helix	trans	-58.7	-47.5	172.7	-177.7	-96.4	0	0	0	111.6	F346 F378 F380 L384 C385 A386	F346-H382 HydrophobicContact CE1-CB 3.68Å; F346-H382 HydrophobicContact CZ-CB 4Å; F378-H382 WeakPolarHBondContact O-CB 3.47Å; F378-H382 PolarHBondContact O-N 2.79Å; F380-H382 PolarHBondContact O-N 2.78Å; H382-L384 VanDerWaalsContact C-N 3.26Å; H382-L384 PolarHBondContact O-N 3.05Å; H382-C385 PolarHBondContact O-N 3.45Å; H382-A386 WeakPolarHBondContact O-CB 3.44Å; H382-A386 PolarHBondContact O-N 3.27Å
383	G	96.9	Very high	97.4	Very high	10 Å²	10	41 Å²	41	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-64.9	-23.1	177.9	0	0	0	0	0	115	D379 F380 R446	D379-G383 PolarHBondContact O-N 3.29Å; F380-G383 CarbonylContact O-C 3.59Å; F380-G383 PolarHBondContact O-N 3.22Å; G383-R446 PolarHBondContact O-NE 3.2Å; G383-R446 PolarHBondContact O-NH2 3.49Å
384	L	97.9	Very high	97.4	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-85.3	-41.9	173.1	-175.8	56.2	0	0	0	111.2	V340 C343 F380 A381 H382 A386 L387 L389 F397	V340-L384 HydrophobicContact CB-CD2 4.41Å; V340-L384 HydrophobicContact CG1-CD2 4.32Å; V340-L384 HydrophobicContact CG2-CD2 4.47Å; V340-L384 WeakPolarHBondContact O-CD2 3.3Å; C343-L384 HydrophobicContact CB-CB 4.26Å; C343-L384 HydrophobicContact CB-CD2 3.93Å; C343-L384 HydrophobicContact CB-CG 3.98Å; F380-L384 HydrophobicContact CE1-CB 4.45Å; F380-L384 HydrophobicContact CE1-CD2 3.84Å; F380-L384 HydrophobicContact CZ-CD2 3.99Å; F380-L384 WeakPolarHBondContact O-CB 3.44Å; F380-L384 PolarHBondContact O-N 2.91Å; A381-L384 PolarHBondContact O-N 2.83Å; H382-L384 VanDerWaalsContact C-N 3.26Å; H382-L384 PolarHBondContact O-N 3.05Å; L384-A386 PolarHBondContact O-N 3.31Å; L384-L387 HydrophobicContact CD1-CD1 4.17Å; L384-L387 WeakPolarHBondContact O-CB 3.47Å; L384-L387 PolarHBondContact O-N 3.44Å; L384-L389 HydrophobicContact CD1-CD1 3.79Å; L384-F397 HydrophobicContact CD1-CE1 4.26Å
385	C	97.2	Very high	97.4	Very high	31 Å²	31	39.6 Å²	39.6	21%	0.209	22%	0.222	C	C	.	.	H	α-helix	trans	-56.8	-37.8	171.6	-65.9	0	0	0	0	112	C343 T348 A381 H382 L387 K388	C343-C385 PolarHBondContact O-SG 3.22Å; T348-C385 HydrophobicContact CG2-CB 3.55Å; A381-C385 PolarHBondContact O-N 3.38Å; A381-C385 PolarHBondContact O-SG 3.45Å; H382-C385 PolarHBondContact O-N 3.45Å; C385-L387 PolarHBondContact O-N 3.36Å; C385-L387 VanDerWaalsContact O-N 3.14Å; C385-K388 PolarHBondContact O-N 2.85Å
386	A	96.6	Very high	97.4	Very high	65 Å²	65	37.6 Å²	37.6	54%	0.537	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.7	176.6	0	0	0	0	0	114.2	H382 L384 K388	H382-A386 WeakPolarHBondContact O-CB 3.44Å; H382-A386 PolarHBondContact O-N 3.27Å; L384-A386 PolarHBondContact O-N 3.31Å; A386-K388 VanDerWaalsContact C-N 3.3Å
387	L	96.7	Very high	97.4	Very high	26 Å²	26	36.1 Å²	36.1	14%	0.136	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-10.5	172.9	-58.3	-174.8	0	0	0	113.3	L384 C385 L389 K442 L443 R446	L384-L387 HydrophobicContact CD1-CD1 4.17Å; L384-L387 WeakPolarHBondContact O-CB 3.47Å; L384-L387 PolarHBondContact O-N 3.44Å; C385-L387 PolarHBondContact O-N 3.36Å; C385-L387 VanDerWaalsContact O-N 3.14Å; L387-L389 VanDerWaalsContact C-N 3.25Å; L387-L389 HydrophobicContact CB-CD2 3.91Å; L387-L389 HydrophobicContact CB-CG 4.06Å; L387-L389 PolarHBondContact O-N 3.43Å; L387-K442 HydrophobicContact CD1-CB 4.33Å; L387-K442 HydrophobicContact CD2-CB 4.18Å; L387-K442 HydrophobicContact CD2-CD 4Å; L387-L443 HydrophobicContact CD1-CD2 4.06Å; L387-R446 HydrophobicContact CD1-CG 4.16Å
388	K	95.7	Very high	97.4	Very high	182 Å²	182	35.2 Å²	35.2	79%	0.791	19%	0.188	S	C	*	.			trans	51	39.4	177.6	-59.9	-176.1	175.5	-179.3	0	114.2	C385 A386	C385-K388 PolarHBondContact O-N 2.85Å; A386-K388 VanDerWaalsContact C-N 3.3Å
389	L	96.8	Very high	97.5	Very high	31 Å²	31	34.9 Å²	34.9	16%	0.162	19%	0.186	C	C	.	.			trans	-59.2	137.8	-179.6	-54.3	-179.4	0	0	0	111.3	L384 L387 Q393 L394 F397 L439 L443	L384-L389 HydrophobicContact CD1-CD1 3.79Å; L387-L389 VanDerWaalsContact C-N 3.25Å; L387-L389 HydrophobicContact CB-CD2 3.91Å; L387-L389 HydrophobicContact CB-CG 4.06Å; L387-L389 PolarHBondContact O-N 3.43Å; L389-Q393 HydrophobicContact CB-CB 4.32Å; L389-L394 HydrophobicContact CB-CB 4.43Å; L389-L394 HydrophobicContact CD1-CD1 4.18Å; L389-F397 HydrophobicContact CD1-CD1 4.48Å; L389-L439 HydrophobicContact CD2-CD1 3.91Å; L389-L443 HydrophobicContact CD1-CD2 3.77Å; L389-L443 HydrophobicContact CD2-CD2 4.05Å
390	T	96.3	Very high	97.5	Very high	60 Å²	60	29.5 Å²	29.5	37%	0.368	16%	0.158	S	C	.	.			trans	-71.1	156.5	167.8	70.5	0	0	0	0	110.3	Q392 Q393 L394	T390-Q392 PolarHBondContact O-N 3.13Å; T390-Q392 VanDerWaalsContact O-N 3.08Å; T390-Q393 VanDerWaalsContact N-OE1 3.1Å; T390-Q393 PolarHBondContact O-N 3.27Å; T390-Q393 VanDerWaalsContact OG1-CG 3.27Å; T390-Q393 WeakPolarHBondContact OG1-CG 3.42Å; T390-Q393 PolarHBondContact OG1-N 3.37Å; T390-L394 WeakPolarHBondContact O-CB 3.26Å; T390-L394 PolarHBondContact O-N 2.78Å
391	E	95.1	Very high	97.5	Very high	64 Å²	64	29.1 Å²	29.1	30%	0.299	16%	0.156	S	C	.	.	H	α-helix	trans	-54.1	-30.5	173.8	-69.6	-84.2	85.1	0	0	112	R344 A395	R344-E391 WeakPolarHBondContact CD-OE1 3.21Å; R344-E391 IonicContact CZ-OE1 3.77Å; R344-E391 IonicContact CZ-OE2 3.39Å; R344-E391 IonicContact NE-OE1 2.71Å; R344-E391 PolarHBondContact NE-OE1 2.91Å; R344-E391 IonicContact NE-OE2 2.8Å; R344-E391 PolarHBondContact NE-OE2 2.7Å; R344-E391 VanDerWaalsContact NE-OE2 3.13Å; R344-E391 IonicContact NH2-OE1 3.16Å; R344-E391 IonicContact NH2-OE2 3.77Å; R344-E391 PolarHBondContact NH2-OE2 2.97Å; E391-A395 WeakPolarHBondContact O-CB 3.42Å; E391-A395 PolarHBondContact O-N 3Å
392	Q	96.9	Very high	97.5	Very high	44 Å²	44	29.1 Å²	29.1	21%	0.206	16%	0.156	C	C	.	.	H	α-helix	trans	-70.5	-44.3	175.3	174.5	161.1	45.7	0	0	112.5	V255 T390 L396 I430 R433	V255-Q392 HydrophobicContact CG2-CB 3.94Å; V255-Q392 HydrophobicContact CG2-CG 3.6Å; T390-Q392 PolarHBondContact O-N 3.13Å; T390-Q392 VanDerWaalsContact O-N 3.08Å; Q392-L396 HydrophobicContact CG-CD1 4.23Å; Q392-L396 PolarHBondContact O-N 2.79Å; Q392-I430 HydrophobicContact CG-CD1 4.33Å; Q392-I430 HydrophobicContact CG-CG1 4.12Å; Q392-I430 HydrophobicContact CG-CG2 3.88Å; Q392-R433 VanDerWaalsContact OE1-NH1 3.11Å
393	Q	98.1	Very high	97.6	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.009	14%	0.136	C	C	.	.	H	α-helix	trans	-66.6	-41.1	175.6	-66	162	6.7	0	0	111.1	L389 T390 L396 F397 I430 L431 D434	L389-Q393 HydrophobicContact CB-CB 4.32Å; T390-Q393 VanDerWaalsContact N-OE1 3.1Å; T390-Q393 PolarHBondContact O-N 3.27Å; T390-Q393 VanDerWaalsContact OG1-CG 3.27Å; T390-Q393 WeakPolarHBondContact OG1-CG 3.42Å; T390-Q393 PolarHBondContact OG1-N 3.37Å; Q393-L396 PolarHBondContact O-N 2.55Å; Q393-F397 WeakPolarHBondContact O-CB 3.44Å; Q393-F397 PolarHBondContact O-N 3.16Å; Q393-I430 HydrophobicContact CG-CG2 3.82Å; Q393-L431 HydrophobicContact CG-CD2 3.97Å; Q393-D434 PolarHBondContact NE2-OD2 3.01Å
394	L	98.1	Very high	97.6	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-65.6	-38.8	177.2	-175.7	64.4	0	0	0	112.3	V340 R344 L389 T390 S398	V340-L394 HydrophobicContact CG1-CD1 3.56Å; R344-L394 HydrophobicContact CG-CD2 3.5Å; L389-L394 HydrophobicContact CB-CB 4.43Å; L389-L394 HydrophobicContact CD1-CD1 4.18Å; T390-L394 WeakPolarHBondContact O-CB 3.26Å; T390-L394 PolarHBondContact O-N 2.78Å; L394-S398 VanDerWaalsContact O-CB 3.31Å; L394-S398 WeakPolarHBondContact O-CB 3.32Å; L394-S398 PolarHBondContact O-N 2.76Å; L394-S398 PolarHBondContact O-OG 3.44Å
395	A	98.5	Very high	97.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.1	-46.9	173.1	0	0	0	0	0	111.9	I254 V255 H258 E391 S398 A399	I254-A395 HydrophobicContact CG2-CB 4.22Å; I254-A395 WeakPolarHBondContact CG2-O 3.19Å; V255-A395 HydrophobicContact CG2-CB 4.22Å; H258-A395 HydrophobicContact CB-CB 3.4Å; E391-A395 WeakPolarHBondContact O-CB 3.42Å; E391-A395 PolarHBondContact O-N 3Å; A395-S398 WeakPolarHBondContact O-CB 3.44Å; A395-S398 PolarHBondContact O-N 2.9Å; A395-A399 PolarHBondContact O-N 3.14Å; A395-A399 VanDerWaalsContact O-N 3.07Å
396	L	98.7	Very high	97.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.7	-39.2	179.7	-74.9	161.3	0	0	0	112.2	C251 I254 Q392 Q393 A399 L400 L427 I430	C251-L396 HydrophobicContact CB-CD1 4.37Å; I254-L396 HydrophobicContact CB-CD2 4.23Å; I254-L396 HydrophobicContact CD1-CD2 3.78Å; I254-L396 HydrophobicContact CG2-CD2 4.12Å; I254-L396 HydrophobicContact CG2-CG 4.41Å; Q392-L396 HydrophobicContact CG-CD1 4.23Å; Q392-L396 PolarHBondContact O-N 2.79Å; Q393-L396 PolarHBondContact O-N 2.55Å; L396-A399 PolarHBondContact O-N 3.42Å; L396-L400 PolarHBondContact O-N 3.48Å; L396-L427 HydrophobicContact CB-CB 4.11Å; L396-L427 HydrophobicContact CB-CD1 3.8Å; L396-I430 HydrophobicContact CD1-CB 4.04Å; L396-I430 HydrophobicContact CD1-CG1 3.48Å; L396-I430 VanDerWaalsContact CD1-CG1 3.48Å; L396-I430 HydrophobicContact CD1-CG2 4.47Å
397	F	98.8	Very high	97.2	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.6	-40.8	172	-178.4	-127.6	0	0	0	112.1	V340 L384 L389 Q393 A399 L400 V401 L443 R446 M447	V340-F397 HydrophobicContact CG1-CD1 3.79Å; V340-F397 HydrophobicContact CG1-CE1 4.1Å; V340-F397 HydrophobicContact CG2-CD1 4.2Å; V340-F397 HydrophobicContact CG2-CE1 3.71Å; V340-F397 HydrophobicContact CG2-CZ 4.44Å; L384-F397 HydrophobicContact CD1-CE1 4.26Å; L389-F397 HydrophobicContact CD1-CD1 4.48Å; Q393-F397 WeakPolarHBondContact O-CB 3.44Å; Q393-F397 PolarHBondContact O-N 3.16Å; F397-A399 VanDerWaalsContact C-N 3.28Å; F397-A399 PolarHBondContact O-N 3.09Å; F397-L400 PolarHBondContact O-N 2.67Å; F397-V401 HydrophobicContact CD2-CG2 4.07Å; F397-V401 HydrophobicContact CE1-CG2 4.28Å; F397-V401 HydrophobicContact CE2-CG2 3.7Å; F397-V401 HydrophobicContact CZ-CG2 3.81Å; F397-V401 WeakPolarHBondContact O-CB 3.24Å; F397-V401 WeakPolarHBondContact O-CG2 3.19Å; F397-V401 PolarHBondContact O-N 3.02Å; F397-L443 HydrophobicContact CB-CD1 4.42Å; F397-L443 HydrophobicContact CD1-CD2 3.88Å; F397-L443 HydrophobicContact CD2-CB 3.87Å; F397-L443 HydrophobicContact CD2-CD1 4.16Å; F397-L443 HydrophobicContact CD2-CD2 3.95Å; F397-L443 HydrophobicContact CD2-CG 4.21Å; F397-L443 HydrophobicContact CE1-CD2 4Å; F397-L443 HydrophobicContact CE2-CB 3.7Å; F397-L443 HydrophobicContact CE2-CD2 4.08Å; F397-L443 HydrophobicContact CE2-CG 4.38Å; F397-L443 HydrophobicContact CG-CD1 4.35Å; F397-L443 HydrophobicContact CG-CD2 3.86Å; F397-L443 HydrophobicContact CG-CG 4.5Å; F397-L443 HydrophobicContact CZ-CB 4.31Å; F397-L443 HydrophobicContact CZ-CD2 4.11Å; F397-R446 HydrophobicContact CZ-CB 4.19Å; F397-M447 HydrophobicContact CE2-CG 3.71Å; F397-M447 HydrophobicContact CE2-SD 4.07Å; F397-M447 HydrophobicContact CZ-CG 4.02Å
398	S	98.8	Very high	97	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-59	-38.6	173.2	-61.3	0	0	0	0	112.2	L394 A395 L402	L394-S398 VanDerWaalsContact O-CB 3.31Å; L394-S398 WeakPolarHBondContact O-CB 3.32Å; L394-S398 PolarHBondContact O-N 2.76Å; L394-S398 PolarHBondContact O-OG 3.44Å; A395-S398 WeakPolarHBondContact O-CB 3.44Å; A395-S398 PolarHBondContact O-N 2.9Å; S398-L402 PolarHBondContact O-N 3.06Å
399	A	98.8	Very high	96.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-70.3	-40.4	175.6	0	0	0	0	0	112.1	I254 F311 I315 A395 L396 F397 L402 I403 V423	I254-A399 HydrophobicContact CD1-CB 4.16Å; I254-A399 HydrophobicContact CG2-CB 3.85Å; F311-A399 HydrophobicContact CE1-CB 4.36Å; F311-A399 HydrophobicContact CZ-CB 4.02Å; I315-A399 HydrophobicContact CD1-CB 3.78Å; I315-A399 HydrophobicContact CG1-CB 4.23Å; A395-A399 PolarHBondContact O-N 3.14Å; A395-A399 VanDerWaalsContact O-N 3.07Å; L396-A399 PolarHBondContact O-N 3.42Å; F397-A399 VanDerWaalsContact C-N 3.28Å; F397-A399 PolarHBondContact O-N 3.09Å; A399-L402 PolarHBondContact O-N 3.14Å; A399-I403 WeakPolarHBondContact O-CG1 3.45Å; A399-I403 PolarHBondContact O-N 3.11Å; A399-V423 HydrophobicContact CB-CG1 3.67Å; A399-V423 HydrophobicContact CB-CG2 4.43Å
400	L	98.5	Very high	96.7	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-65	-41.7	178.6	-169.7	69.4	0	0	0	112.3	L396 F397 L402 H420 V423 E424 L427 Y444 M447	L396-L400 PolarHBondContact O-N 3.48Å; F397-L400 PolarHBondContact O-N 2.67Å; L400-L402 VanDerWaalsContact C-N 3.33Å; L400-L402 PolarHBondContact O-N 3.47Å; L400-H420 WeakPolarHBondContact CD1-NE2 3.48Å; L400-V423 HydrophobicContact CB-CG1 4.12Å; L400-V423 HydrophobicContact CD1-CG1 4.38Å; L400-E424 HydrophobicContact CD1-CB 3.83Å; L400-L427 HydrophobicContact CD2-CD2 3.75Å; L400-Y444 HydrophobicContact CD2-CE1 4.43Å; L400-M447 HydrophobicContact CD2-SD 4.45Å
401	V	98.6	Very high	96.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.2	-42.5	173.9	166.4	0	0	0	0	111.3	E336 V337 V340 F397 R407 M447 L450	E336-V401 HydrophobicContact CB-CG1 3.5Å; E336-V401 VanDerWaalsContact CB-CG1 3.5Å; V337-V401 HydrophobicContact CG2-CG1 4Å; V340-V401 HydrophobicContact CG2-CG2 4.3Å; F397-V401 HydrophobicContact CD2-CG2 4.07Å; F397-V401 HydrophobicContact CE1-CG2 4.28Å; F397-V401 HydrophobicContact CE2-CG2 3.7Å; F397-V401 HydrophobicContact CZ-CG2 3.81Å; F397-V401 WeakPolarHBondContact O-CB 3.24Å; F397-V401 WeakPolarHBondContact O-CG2 3.19Å; F397-V401 PolarHBondContact O-N 3.02Å; V401-R407 PolarHBondContact O-NH2 3.4Å; V401-M447 HydrophobicContact CG2-CE 4.45Å; V401-M447 HydrophobicContact CG2-CG 4.01Å; V401-M447 HydrophobicContact CG2-SD 4.44Å; V401-L450 HydrophobicContact CG1-CD1 4.28Å; V401-L450 HydrophobicContact CG2-CD1 4.1Å
402	L	98.6	Very high	96.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-71.6	-51.7	-179.7	-172.4	59.7	0	0	0	112.7	A312 I315 L329 L330 V337 S398 A399 L400 N404	A312-L402 HydrophobicContact CB-CD2 3.46Å; A312-L402 VanDerWaalsContact CB-CD2 3.46Å; I315-L402 HydrophobicContact CD1-CD2 4.13Å; L329-L402 WeakPolarHBondContact O-CD1 3.5Å; L330-L402 HydrophobicContact CD2-CD1 4.29Å; L330-L402 HydrophobicContact CD2-CD2 4.36Å; V337-L402 HydrophobicContact CG2-CB 3.87Å; V337-L402 HydrophobicContact CG2-CD1 4.3Å; S398-L402 PolarHBondContact O-N 3.06Å; A399-L402 PolarHBondContact O-N 3.14Å; L400-L402 VanDerWaalsContact C-N 3.33Å; L400-L402 PolarHBondContact O-N 3.47Å; L402-N404 PolarHBondContact O-N 3.46Å
403	I	98.2	Very high	96.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-85.4	60.3	-172.8	-47.8	-60.2	0	0	0	110.6	I315 F318 L329 A399 V416 V419 H420	I315-I403 HydrophobicContact CD1-CD1 4.15Å; I315-I403 HydrophobicContact CD1-CG1 4.05Å; I315-I403 HydrophobicContact CG2-CG1 4.26Å; F318-I403 HydrophobicContact CB-CD1 4.42Å; F318-I403 HydrophobicContact CD2-CD1 3.48Å; F318-I403 VanDerWaalsContact CD2-CD1 3.48Å; F318-I403 HydrophobicContact CE2-CD1 4.14Å; F318-I403 HydrophobicContact CG-CD1 4.31Å; L329-I403 HydrophobicContact CD1-CD1 4.18Å; A399-I403 WeakPolarHBondContact O-CG1 3.45Å; A399-I403 PolarHBondContact O-N 3.11Å; I403-V416 HydrophobicContact CG2-CG1 4.3Å; I403-V419 HydrophobicContact CG2-CB 3.86Å; I403-V419 HydrophobicContact CG2-CG1 3.78Å; I403-H420 WeakPolarHBondContact O-CB 3.43Å; I403-H420 PolarHBondContact O-CD2 2.53Å; I403-H420 VanDerWaalsContact O-CD2 3.24Å
404	N	96.5	Very high	96.5	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.027	18%	0.176	C	C	.	.			trans	-95.9	129.5	-174.9	-169.1	-74.4	0	0	0	112.1	L329 L402 D406 R407 R451	L329-N404 WeakPolarHBondContact CD2-O 3.4Å; L402-N404 PolarHBondContact O-N 3.46Å; N404-D406 VanDerWaalsContact C-N 3.32Å; N404-D406 PolarHBondContact O-N 3.01Å; N404-D406 WeakPolarHBondContact OD1-CA 3.17Å; N404-D406 WeakPolarHBondContact OD1-CB 3.28Å; N404-D406 PolarHBondContact OD1-N 2.67Å; N404-D406 PolarHBondContact OD1-OD2 3.36Å; N404-R407 HydrophobicContact CB-CG 4.24Å; N404-R407 WeakPolarHBondContact O-CG 3.38Å; N404-R451 PolarHBondContact ND2-NH2 2.93Å; N404-R451 PolarHBondContact OD1-NH2 3.12Å
405	P	96.8	Very high	96.3	Very high	13 Å²	13	37.4 Å²	37.4	8%	0.084	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-13.1	-179.2	32	-36.8	0	0	0	114.3	R407 R413 V416 Q417 H420	P405-R407 VanDerWaalsContact C-N 3.32Å; P405-R407 PolarHBondContact O-N 2.86Å; P405-R413 PolarHBondContact O-NH1 3.07Å; P405-V416 HydrophobicContact CB-CG1 4.35Å; P405-Q417 HydrophobicContact CB-CB 4.17Å; P405-H420 VanDerWaalsContact CD-CD2 3.4Å; P405-H420 WeakPolarHBondContact CD-CD2 3.37Å
406	D	94.8	Very high	96.3	Very high	101 Å²	101	37.4 Å²	37.4	54%	0.54	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-12.1	-179.8	-52.9	-21.9	0	0	0	112.9	N404 R451	N404-D406 VanDerWaalsContact C-N 3.32Å; N404-D406 PolarHBondContact O-N 3.01Å; N404-D406 WeakPolarHBondContact OD1-CA 3.17Å; N404-D406 WeakPolarHBondContact OD1-CB 3.28Å; N404-D406 PolarHBondContact OD1-N 2.67Å; N404-D406 PolarHBondContact OD1-OD2 3.36Å; D406-R451 IonicContact OD2-CZ 3.88Å; D406-R451 IonicContact OD2-NH1 3.3Å; D406-R451 PolarHBondContact OD2-NH1 2.83Å; D406-R451 IonicContact OD2-NH2 2.68Å; D406-R451 PolarHBondContact OD2-NH2 2.85Å
407	R	93.3	Very high	96.2	Very high	14 Å²	14	40.8 Å²	40.8	5%	0.053	21%	0.211	C	C	.	.			trans	-57.1	145.4	-171.9	-60.2	-50.4	-171.2	179.1	-12.4	111.7	L329 T332 E336 V401 N404 P405 L410 R413	L329-R407 HydrophobicContact CD2-CB 4.49Å; L329-R407 HydrophobicContact CD2-CG 3.89Å; T332-R407 PolarHBondContact O-NH1 3.27Å; T332-R407 WeakPolarHBondContact OG1-CD 3.35Å; T332-R407 VanDerWaalsContact OG1-CG 3.24Å; T332-R407 WeakPolarHBondContact OG1-CG 3.42Å; E336-R407 VanDerWaalsContact CD-NH1 3.33Å; E336-R407 VanDerWaalsContact CD-NH2 3.31Å; E336-R407 IonicContact OE1-CZ 2.67Å; E336-R407 IonicContact OE1-NH1 3.7Å; E336-R407 PolarHBondContact OE1-NH1 3.49Å; E336-R407 IonicContact OE1-NH2 2.86Å; E336-R407 IonicContact OE2-CZ 2.79Å; E336-R407 IonicContact OE2-NH1 3.59Å; E336-R407 PolarHBondContact OE2-NH1 3.3Å; E336-R407 IonicContact OE2-NH2 2.67Å; E336-R407 PolarHBondContact OE2-NH2 2.97Å; V401-R407 PolarHBondContact O-NH2 3.4Å; N404-R407 HydrophobicContact CB-CG 4.24Å; N404-R407 WeakPolarHBondContact O-CG 3.38Å; P405-R407 VanDerWaalsContact C-N 3.32Å; P405-R407 PolarHBondContact O-N 2.86Å; R407-L410 HydrophobicContact CB-CD1 4.06Å; R407-L410 HydrophobicContact CB-CG 4.14Å; R407-R413 VanDerWaalsContact O-CZ 3.25Å; R407-R413 PolarHBondContact O-NH1 3.41Å; R407-R413 PolarHBondContact O-NH2 2.85Å
408	P	91.1	Very high	96.1	Very high	78 Å²	78	43.6 Å²	43.6	51%	0.506	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	160.1	172.3	28.1	-35.9	0	0	0	111.2	T332 L410	T332-P408 HydrophobicContact CG2-CG 3.88Å; P408-L410 PolarHBondContact O-N 2.98Å
409	S	91.1	Very high	95.9	Very high	95 Å²	95	44.3 Å²	44.3	66%	0.664	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	18.6	170.2	-48.8	0	0	0	0	117.6
410	L	95.4	Very high	95.9	Very high	15 Å²	15	44.9 Å²	44.9	8%	0.079	23%	0.228	C	C	.	.			trans	-72.4	136.3	169.7	-65.1	178.5	0	0	0	112.1	D325 A328 L329 R407 P408 R413 V416	D325-L410 HydrophobicContact CB-CD2 4.35Å; D325-L410 WeakPolarHBondContact OD1-CA 3.31Å; A328-L410 HydrophobicContact CB-CD2 3.94Å; L329-L410 HydrophobicContact CD2-CD1 4.46Å; L329-L410 HydrophobicContact CD2-CD2 4.06Å; L329-L410 HydrophobicContact CG-CD2 4.04Å; R407-L410 HydrophobicContact CB-CD1 4.06Å; R407-L410 HydrophobicContact CB-CG 4.14Å; P408-L410 PolarHBondContact O-N 2.98Å; L410-R413 HydrophobicContact CB-CG 3.77Å; L410-R413 HydrophobicContact CD1-CG 4.3Å; L410-V416 HydrophobicContact CD1-CB 4.36Å; L410-V416 HydrophobicContact CD1-CG1 4.12Å; L410-V416 HydrophobicContact CD1-CG2 4.21Å; L410-V416 HydrophobicContact CD2-CG2 4.29Å
411	E	95.4	Very high	95.8	Very high	117 Å²	117	50.9 Å²	50.9	55%	0.547	25%	0.251	S	S	.	.	S	Bend	trans	-85.4	-55.4	177.5	-61.6	179.7	145.9	0	0	111.3	S322 N324 D325	S322-E411 WeakPolarHBondContact CB-OE2 3.3Å; S322-E411 PolarHBondContact OG-OE2 3.26Å; N324-E411 HydrophobicContact CB-CG 4.32Å; N324-E411 PolarHBondContact ND2-OE1 3.28Å; D325-E411 PolarHBondContact OD1-N 3.17Å
412	D	95.1	Very high	95.7	Very high	46 Å²	46	52.4 Å²	52.4	25%	0.246	26%	0.261	C	S	.	.			trans	-110.1	69.1	-178.4	-167.7	-15.4	0	0	0	111.2	D325 V414 R415 V416	D325-D412 PolarHBondContact OD1-N 3.07Å; D325-D412 PolarHBondContact OD2-N 3.22Å; D412-V414 PolarHBondContact O-N 3.35Å; D412-V414 VanDerWaalsContact O-N 3.14Å; D412-V414 PolarHBondContact OD1-N 3.49Å; D412-R415 HydrophobicContact CB-CB 4.1Å; D412-R415 PolarHBondContact O-N 2.97Å; D412-R415 WeakPolarHBondContact OD1-CB 3.36Å; D412-R415 PolarHBondContact OD1-N 3.03Å; D412-R415 WeakPolarHBondContact OD2-CB 3.38Å; D412-R415 IonicContact OD2-CZ 2.68Å; D412-R415 IonicContact OD2-NE 2.71Å; D412-R415 PolarHBondContact OD2-NE 3.49Å; D412-R415 IonicContact OD2-NH2 3.33Å; D412-R415 PolarHBondContact OD2-NH2 3.11Å; D412-V416 PolarHBondContact O-N 2.96Å
413	R	97	Very high	95.6	Very high	102 Å²	102	52.4 Å²	52.4	39%	0.385	26%	0.261	S	S	.	.	H	α-helix	trans	-52.6	-33	175.9	-69.4	-174.5	-176.4	-79.4	-10.1	113.1	P405 R407 L410 V416 Q417	P405-R413 PolarHBondContact O-NH1 3.07Å; R407-R413 VanDerWaalsContact O-CZ 3.25Å; R407-R413 PolarHBondContact O-NH1 3.41Å; R407-R413 PolarHBondContact O-NH2 2.85Å; L410-R413 HydrophobicContact CB-CG 3.77Å; L410-R413 HydrophobicContact CD1-CG 4.3Å; R413-V416 PolarHBondContact O-N 3.3Å; R413-Q417 WeakPolarHBondContact O-CB 3.49Å; R413-Q417 PolarHBondContact O-N 2.95Å
414	V	95.3	Very high	95.6	Very high	89 Å²	89	54.8 Å²	54.8	54%	0.539	27%	0.272	S	S	.	.	H	α-helix	trans	-67.8	-41.4	179.4	180	0	0	0	0	110.7	D412 Q417 R418	D412-V414 PolarHBondContact O-N 3.35Å; D412-V414 VanDerWaalsContact O-N 3.14Å; D412-V414 PolarHBondContact OD1-N 3.49Å; V414-Q417 PolarHBondContact O-N 3.23Å; V414-R418 WeakPolarHBondContact O-CG 3.47Å; V414-R418 PolarHBondContact O-N 2.95Å
415	R	94	Very high	95.5	Very high	110 Å²	110	56.7 Å²	56.7	42%	0.415	28%	0.284	S	S	.	.	H	α-helix	trans	-69.7	-40.9	175.1	-163.6	-173.3	-48.7	-169.8	7.8	112.1	M320 L321 D412 Q417 R418 V419	M320-R415 PolarHBondContact O-NH1 3.49Å; L321-R415 HydrophobicContact CD2-CB 4.19Å; L321-R415 HydrophobicContact CD2-CG 3.78Å; D412-R415 HydrophobicContact CB-CB 4.1Å; D412-R415 PolarHBondContact O-N 2.97Å; D412-R415 WeakPolarHBondContact OD1-CB 3.36Å; D412-R415 PolarHBondContact OD1-N 3.03Å; D412-R415 WeakPolarHBondContact OD2-CB 3.38Å; D412-R415 IonicContact OD2-CZ 2.68Å; D412-R415 IonicContact OD2-NE 2.71Å; D412-R415 PolarHBondContact OD2-NE 3.49Å; D412-R415 IonicContact OD2-NH2 3.33Å; D412-R415 PolarHBondContact OD2-NH2 3.11Å; R415-Q417 VanDerWaalsContact C-N 3.34Å; R415-Q417 PolarHBondContact O-N 2.93Å; R415-R418 PolarHBondContact O-N 3.14Å; R415-V419 PolarHBondContact O-N 3.39Å; R415-V419 VanDerWaalsContact O-N 3.11Å
416	V	97.7	Very high	95.5	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.5	-45.6	172.4	178	0	0	0	0	110.6	L321 L329 I403 P405 L410 D412 R413 R418 V419 H420	L321-V416 HydrophobicContact CD1-CG2 4.18Å; L321-V416 HydrophobicContact CD2-CG2 4.01Å; L329-V416 HydrophobicContact CD1-CG1 4.34Å; L329-V416 HydrophobicContact CD1-CG2 4.39Å; L329-V416 HydrophobicContact CD2-CG1 4.07Å; I403-V416 HydrophobicContact CG2-CG1 4.3Å; P405-V416 HydrophobicContact CB-CG1 4.35Å; L410-V416 HydrophobicContact CD1-CB 4.36Å; L410-V416 HydrophobicContact CD1-CG1 4.12Å; L410-V416 HydrophobicContact CD1-CG2 4.21Å; L410-V416 HydrophobicContact CD2-CG2 4.29Å; D412-V416 PolarHBondContact O-N 2.96Å; R413-V416 PolarHBondContact O-N 3.3Å; V416-R418 VanDerWaalsContact C-N 3.32Å; V416-R418 PolarHBondContact O-N 3.36Å; V416-V419 PolarHBondContact O-N 3.23Å; V416-V419 VanDerWaalsContact O-N 3.14Å; V416-H420 PolarHBondContact O-N 3.44Å
417	Q	97.6	Very high	95.7	Very high	71 Å²	71	51.2 Å²	51.2	33%	0.332	25%	0.254	S	S	.	.	H	α-helix	trans	-60.4	-36.9	177	-179.1	64.3	85.8	0	0	113	P405 R413 V414 R415 R421	P405-Q417 HydrophobicContact CB-CB 4.17Å; R413-Q417 WeakPolarHBondContact O-CB 3.49Å; R413-Q417 PolarHBondContact O-N 2.95Å; V414-Q417 PolarHBondContact O-N 3.23Å; R415-Q417 VanDerWaalsContact C-N 3.34Å; R415-Q417 PolarHBondContact O-N 2.93Å; Q417-R421 WeakPolarHBondContact O-CB 3.33Å; Q417-R421 PolarHBondContact O-N 2.9Å
418	R	95.1	Very high	95.9	Very high	58 Å²	58	53.1 Å²	53.1	22%	0.219	27%	0.268	C	S	.	.	H	α-helix	trans	-65.9	-41.9	173.5	-76.2	174.6	176.6	157.8	-5.1	111.8	D234 V414 R415 V416 R421 S422	D234-R418 PolarHBondContact O-NH2 3.38Å; D234-R418 IonicContact OD1-CZ 3.79Å; D234-R418 IonicContact OD1-NE 3.89Å; D234-R418 IonicContact OD1-NH2 3.13Å; D234-R418 PolarHBondContact OD1-NH2 3.42Å; V414-R418 WeakPolarHBondContact O-CG 3.47Å; V414-R418 PolarHBondContact O-N 2.95Å; R415-R418 PolarHBondContact O-N 3.14Å; V416-R418 VanDerWaalsContact C-N 3.32Å; V416-R418 PolarHBondContact O-N 3.36Å; R418-R421 PolarHBondContact O-N 3.02Å; R418-S422 PolarHBondContact O-N 3.26Å; R418-S422 VanDerWaalsContact O-N 3.09Å; R418-S422 PolarHBondContact O-OG 2.91Å
419	V	96.1	Very high	96.1	Very high	16 Å²	16	51.7 Å²	51.7	10%	0.097	25%	0.254	C	S	.	.	H	α-helix	trans	-68.5	-41.5	175.5	-172.9	0	0	0	0	111.3	P316 L321 I403 R415 V416 R421 S422 V423	P316-V419 WeakPolarHBondContact O-CG1 3.44Å; L321-V419 HydrophobicContact CD2-CG2 4.23Å; I403-V419 HydrophobicContact CG2-CB 3.86Å; I403-V419 HydrophobicContact CG2-CG1 3.78Å; R415-V419 PolarHBondContact O-N 3.39Å; R415-V419 VanDerWaalsContact O-N 3.11Å; V416-V419 PolarHBondContact O-N 3.23Å; V416-V419 VanDerWaalsContact O-N 3.14Å; V419-R421 PolarHBondContact O-N 2.71Å; V419-S422 WeakPolarHBondContact O-CB 3.16Å; V419-S422 PolarHBondContact O-N 3.15Å; V419-V423 WeakPolarHBondContact O-CG2 3.31Å; V419-V423 PolarHBondContact O-N 3.25Å
420	H	97.8	Very high	96.3	Very high	11 Å²	11	47.1 Å²	47.1	5%	0.051	22%	0.222	C	C	.	.	H	α-helix	trans	-53.4	-53.2	171.7	179.3	-77.4	0	0	0	111.2	L400 I403 P405 V416 S422 V423 E424 Y444	L400-H420 WeakPolarHBondContact CD1-NE2 3.48Å; I403-H420 WeakPolarHBondContact O-CB 3.43Å; I403-H420 PolarHBondContact O-CD2 2.53Å; I403-H420 VanDerWaalsContact O-CD2 3.24Å; P405-H420 VanDerWaalsContact CD-CD2 3.4Å; P405-H420 WeakPolarHBondContact CD-CD2 3.37Å; V416-H420 PolarHBondContact O-N 3.44Å; H420-S422 VanDerWaalsContact C-N 3.29Å; H420-S422 PolarHBondContact O-N 3.39Å; H420-V423 PolarHBondContact O-N 2.66Å; H420-V423 VanDerWaalsContact O-N 3.08Å; H420-E424 IonicContact CE1-OE2 3.66Å; H420-E424 PolarHBondContact CE1-OE2 3.25Å; H420-E424 IonicContact ND1-OE2 2.77Å; H420-E424 PolarHBondContact ND1-OE2 3.29Å; H420-E424 WeakPolarHBondContact O-CB 3.12Å; H420-E424 PolarHBondContact O-N 2.97Å; H420-Y444 PolarHBondContact CE1-OH 2.82Å
421	R	96.7	Very high	96.4	Very high	127 Å²	127	46.5 Å²	46.5	48%	0.479	22%	0.219	S	C	.	.	H	α-helix	trans	-59.4	-38.6	-179.2	-173.9	-178.4	-70.9	166.5	-2.3	111.9	Q417 R418 V419 E424 V425	Q417-R421 WeakPolarHBondContact O-CB 3.33Å; Q417-R421 PolarHBondContact O-N 2.9Å; R418-R421 PolarHBondContact O-N 3.02Å; V419-R421 PolarHBondContact O-N 2.71Å; R421-E424 PolarHBondContact O-N 3.41Å; R421-V425 HydrophobicContact CG-CG2 4.5Å; R421-V425 WeakPolarHBondContact O-CB 3.29Å; R421-V425 VanDerWaalsContact O-CG2 3.27Å; R421-V425 WeakPolarHBondContact O-CG2 3.21Å; R421-V425 PolarHBondContact O-N 3.14Å
422	S	95.8	Very high	96.4	Very high	32 Å²	32	46.5 Å²	46.5	22%	0.224	22%	0.219	C	C	.	.	H	α-helix	trans	-61.1	-48.4	173.3	-64.3	0	0	0	0	112	L250 R418 V419 H420 V425 G426	L250-S422 VanDerWaalsContact CD2-O 3.24Å; L250-S422 WeakPolarHBondContact CD2-O 3.33Å; R418-S422 PolarHBondContact O-N 3.26Å; R418-S422 VanDerWaalsContact O-N 3.09Å; R418-S422 PolarHBondContact O-OG 2.91Å; V419-S422 WeakPolarHBondContact O-CB 3.16Å; V419-S422 PolarHBondContact O-N 3.15Å; H420-S422 VanDerWaalsContact C-N 3.29Å; H420-S422 PolarHBondContact O-N 3.39Å; S422-V425 PolarHBondContact O-N 3Å; S422-G426 PolarHBondContact O-N 3.36Å
423	V	97.6	Very high	96.3	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.4	-39.8	178.7	175.8	0	0	0	0	111.7	I254 I315 A399 L400 V419 H420 G426 L427	I254-V423 HydrophobicContact CD1-CG1 4.42Å; I254-V423 HydrophobicContact CD1-CG2 4.02Å; I315-V423 HydrophobicContact CG2-CG2 4.13Å; A399-V423 HydrophobicContact CB-CG1 3.67Å; A399-V423 HydrophobicContact CB-CG2 4.43Å; L400-V423 HydrophobicContact CB-CG1 4.12Å; L400-V423 HydrophobicContact CD1-CG1 4.38Å; V419-V423 WeakPolarHBondContact O-CG2 3.31Å; V419-V423 PolarHBondContact O-N 3.25Å; H420-V423 PolarHBondContact O-N 2.66Å; H420-V423 VanDerWaalsContact O-N 3.08Å; V423-G426 PolarHBondContact O-N 3.26Å; V423-L427 PolarHBondContact O-N 3.18Å
424	E	97.1	Very high	96.2	Very high	50 Å²	50	46.9 Å²	46.9	23%	0.234	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-43.1	177.1	-178.9	172.7	-152.1	0	0	112.6	L400 H420 R421 G426 L427 T428 Y444	L400-E424 HydrophobicContact CD1-CB 3.83Å; H420-E424 IonicContact CE1-OE2 3.66Å; H420-E424 PolarHBondContact CE1-OE2 3.25Å; H420-E424 IonicContact ND1-OE2 2.77Å; H420-E424 PolarHBondContact ND1-OE2 3.29Å; H420-E424 WeakPolarHBondContact O-CB 3.12Å; H420-E424 PolarHBondContact O-N 2.97Å; R421-E424 PolarHBondContact O-N 3.41Å; E424-G426 VanDerWaalsContact C-N 3.31Å; E424-G426 PolarHBondContact O-N 3.12Å; E424-L427 PolarHBondContact O-N 2.68Å; E424-T428 WeakPolarHBondContact O-CB 3.2Å; E424-T428 PolarHBondContact O-N 3.15Å; E424-T428 PolarHBondContact O-OG1 2.73Å; E424-Y444 VanDerWaalsContact CD-OH 3.23Å; E424-Y444 PolarHBondContact OE1-OH 2.91Å
425	V	96.1	Very high	96.1	Very high	45 Å²	45	49.3 Å²	49.3	27%	0.273	23%	0.229	S	C	.	.	H	α-helix	trans	-62.8	-39.7	172.4	167	0	0	0	0	110.6	I247 R421 S422 T428 H429	I247-V425 HydrophobicContact CD1-CG1 3.81Å; I247-V425 HydrophobicContact CG1-CG1 4.29Å; R421-V425 HydrophobicContact CG-CG2 4.5Å; R421-V425 WeakPolarHBondContact O-CB 3.29Å; R421-V425 VanDerWaalsContact O-CG2 3.27Å; R421-V425 WeakPolarHBondContact O-CG2 3.21Å; R421-V425 PolarHBondContact O-N 3.14Å; S422-V425 PolarHBondContact O-N 3Å; V425-T428 PolarHBondContact O-N 3.11Å; V425-H429 VanDerWaalsContact O-CB 3.3Å; V425-H429 WeakPolarHBondContact O-CB 3.24Å; V425-H429 PolarHBondContact O-N 3.33Å
426	G	96.8	Very high	96.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.1	-47.3	172.8	0	0	0	0	0	113.3	C251 S422 V423 E424 H429 I430	C251-G426 VanDerWaalsContact SG-CA 3.52Å; S422-G426 PolarHBondContact O-N 3.36Å; V423-G426 PolarHBondContact O-N 3.26Å; E424-G426 VanDerWaalsContact C-N 3.31Å; E424-G426 PolarHBondContact O-N 3.12Å; G426-H429 PolarHBondContact O-N 3.35Å; G426-I430 WeakPolarHBondContact O-CG1 3.19Å; G426-I430 PolarHBondContact O-N 3.31Å; G426-I430 VanDerWaalsContact O-N 3.09Å
427	L	97.8	Very high	95.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-46.4	175.3	178.7	61.8	0	0	0	111.4	L396 L400 V423 E424 H429 I430 L431 L440 L443	L396-L427 HydrophobicContact CB-CB 4.11Å; L396-L427 HydrophobicContact CB-CD1 3.8Å; L400-L427 HydrophobicContact CD2-CD2 3.75Å; V423-L427 PolarHBondContact O-N 3.18Å; E424-L427 PolarHBondContact O-N 2.68Å; L427-H429 PolarHBondContact O-N 3.04Å; L427-I430 PolarHBondContact O-N 3.39Å; L427-L431 HydrophobicContact CD1-CD1 4.1Å; L427-L431 HydrophobicContact CD1-CG 4.14Å; L427-L431 HydrophobicContact CG-CD1 3.97Å; L427-L431 HydrophobicContact CG-CG 4.39Å; L427-L431 WeakPolarHBondContact O-CB 3.48Å; L427-L431 WeakPolarHBondContact O-CG 3.43Å; L427-L431 PolarHBondContact O-N 3.12Å; L427-L440 HydrophobicContact CD2-CD1 3.87Å; L427-L440 HydrophobicContact CG-CD1 4.34Å; L427-L443 HydrophobicContact CD1-CD1 4.27Å; L427-L443 HydrophobicContact CD2-CD1 3.96Å
428	T	96.9	Very high	95.5	Very high	54 Å²	54	52.3 Å²	52.3	33%	0.331	26%	0.259	S	S	.	.	H	α-helix	trans	-63.1	-42.5	179.6	-54.7	0	0	0	0	111.2	E424 V425 I430 L431 H432	E424-T428 WeakPolarHBondContact O-CB 3.2Å; E424-T428 PolarHBondContact O-N 3.15Å; E424-T428 PolarHBondContact O-OG1 2.73Å; V425-T428 PolarHBondContact O-N 3.11Å; T428-I430 PolarHBondContact O-N 3.16Å; T428-L431 PolarHBondContact O-N 3.48Å; T428-H432 VanDerWaalsContact O-CB 3.31Å; T428-H432 WeakPolarHBondContact O-CB 3.39Å; T428-H432 PolarHBondContact O-N 3.01Å
429	H	95.4	Very high	95.5	Very high	47 Å²	47	50.1 Å²	50.1	22%	0.218	25%	0.252	C	S	.	.	H	α-helix	trans	-59.8	-45.5	175.6	174.9	68.7	0	0	0	112.4	I247 V425 G426 L427 H432 R433	I247-H429 HydrophobicContact CG2-CB 3.9Å; V425-H429 VanDerWaalsContact O-CB 3.3Å; V425-H429 WeakPolarHBondContact O-CB 3.24Å; V425-H429 PolarHBondContact O-N 3.33Å; G426-H429 PolarHBondContact O-N 3.35Å; L427-H429 PolarHBondContact O-N 3.04Å; H429-H432 PolarHBondContact O-N 3.41Å; H429-R433 VanDerWaalsContact O-CB 3.32Å; H429-R433 WeakPolarHBondContact O-CB 3.34Å; H429-R433 PolarHBondContact O-N 3.34Å
430	I	96.8	Very high	95.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.1	-46.3	175.8	-67	-50.8	0	0	0	111.7	Q392 Q393 L396 G426 L427 T428 H432 R433 D434	Q392-I430 HydrophobicContact CG-CD1 4.33Å; Q392-I430 HydrophobicContact CG-CG1 4.12Å; Q392-I430 HydrophobicContact CG-CG2 3.88Å; Q393-I430 HydrophobicContact CG-CG2 3.82Å; L396-I430 HydrophobicContact CD1-CB 4.04Å; L396-I430 HydrophobicContact CD1-CG1 3.48Å; L396-I430 VanDerWaalsContact CD1-CG1 3.48Å; L396-I430 HydrophobicContact CD1-CG2 4.47Å; G426-I430 WeakPolarHBondContact O-CG1 3.19Å; G426-I430 PolarHBondContact O-N 3.31Å; G426-I430 VanDerWaalsContact O-N 3.09Å; L427-I430 PolarHBondContact O-N 3.39Å; T428-I430 PolarHBondContact O-N 3.16Å; I430-H432 VanDerWaalsContact C-N 3.3Å; I430-H432 PolarHBondContact O-N 3.39Å; I430-R433 PolarHBondContact O-N 2.97Å; I430-D434 VanDerWaalsContact O-CB 3.31Å; I430-D434 WeakPolarHBondContact O-CB 3.33Å; I430-D434 PolarHBondContact O-N 3.35Å
431	L	96.7	Very high	95.4	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-41.8	178.5	-72.8	176.6	0	0	0	111.3	Q393 L427 T428 D434 N435 H436 L439 L440 L443	Q393-L431 HydrophobicContact CG-CD2 3.97Å; L427-L431 HydrophobicContact CD1-CD1 4.1Å; L427-L431 HydrophobicContact CD1-CG 4.14Å; L427-L431 HydrophobicContact CG-CD1 3.97Å; L427-L431 HydrophobicContact CG-CG 4.39Å; L427-L431 WeakPolarHBondContact O-CB 3.48Å; L427-L431 WeakPolarHBondContact O-CG 3.43Å; L427-L431 PolarHBondContact O-N 3.12Å; T428-L431 PolarHBondContact O-N 3.48Å; L431-D434 CarbonylContact O-C 3.56Å; L431-D434 PolarHBondContact O-N 3.06Å; L431-N435 PolarHBondContact O-N 2.97Å; L431-N435 VanDerWaalsContact O-N 3.17Å; L431-H436 HydrophobicContact CD2-CB 4.07Å; L431-H436 WeakPolarHBondContact O-CA 3.39Å; L431-H436 PolarHBondContact O-N 3.01Å; L431-L439 HydrophobicContact CD1-CB 4.4Å; L431-L439 HydrophobicContact CD2-CB 3.99Å; L431-L439 HydrophobicContact CD2-CD1 4.04Å; L431-L439 HydrophobicContact CD2-CG 4.5Å; L431-L440 HydrophobicContact CD1-CB 3.92Å; L431-L440 HydrophobicContact CD1-CD1 4.24Å; L431-L443 HydrophobicContact CD1-CD1 4.26Å
432	H	95.3	Very high	95.4	Very high	117 Å²	117	54.7 Å²	54.7	54%	0.542	28%	0.277	S	S	.	.	H	α-helix	trans	-64.7	-48.9	176.5	-170.7	66.2	0	0	0	112.1	T428 H429 I430 D434 N435 D437	T428-H432 VanDerWaalsContact O-CB 3.31Å; T428-H432 WeakPolarHBondContact O-CB 3.39Å; T428-H432 PolarHBondContact O-N 3.01Å; H429-H432 PolarHBondContact O-N 3.41Å; I430-H432 VanDerWaalsContact C-N 3.3Å; I430-H432 PolarHBondContact O-N 3.39Å; H432-D434 PolarHBondContact O-N 3.31Å; H432-N435 PolarHBondContact O-N 3.23Å; H432-D437 IonicContact CE1-OD1 3.35Å; H432-D437 IonicContact CG-OD1 3.43Å; H432-D437 IonicContact ND1-OD1 3.5Å; H432-D437 PolarHBondContact ND1-OD1 2.98Å; H432-D437 IonicContact ND1-OD2 2.81Å
433	R	94	Very high	95.5	Very high	121 Å²	121	53.2 Å²	53.2	46%	0.457	27%	0.267	S	S	.	.	H	α-helix	trans	-55.5	-37.4	175.2	-174.4	-157.3	69.7	-171.9	-3.6	112	Q392 H429 I430 N435	Q392-R433 VanDerWaalsContact OE1-NH1 3.11Å; H429-R433 VanDerWaalsContact O-CB 3.32Å; H429-R433 WeakPolarHBondContact O-CB 3.34Å; H429-R433 PolarHBondContact O-N 3.34Å; I430-R433 PolarHBondContact O-N 2.97Å; R433-N435 VanDerWaalsContact C-N 3.3Å
434	D	94.3	Very high	95.4	Very high	36 Å²	36	56.8 Å²	56.8	19%	0.193	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	2.4	-179.8	-61.6	-8	0	0	0	112.9	Q393 I430 L431 H432 H436	Q393-D434 PolarHBondContact NE2-OD2 3.01Å; I430-D434 VanDerWaalsContact O-CB 3.31Å; I430-D434 WeakPolarHBondContact O-CB 3.33Å; I430-D434 PolarHBondContact O-N 3.35Å; L431-D434 CarbonylContact O-C 3.56Å; L431-D434 PolarHBondContact O-N 3.06Å; H432-D434 PolarHBondContact O-N 3.31Å; D434-H436 PolarHBondContact O-CE1 3.46Å; D434-H436 VanDerWaalsContact O-CE1 3.32Å; D434-H436 PolarHBondContact O-ND1 3.02Å
435	N	93.7	Very high	95.4	Very high	140 Å²	140	59.2 Å²	59.2	75%	0.749	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	37.2	-175.5	-59.7	-94	0	0	0	114.5	L431 H432 R433	L431-N435 PolarHBondContact O-N 2.97Å; L431-N435 VanDerWaalsContact O-N 3.17Å; H432-N435 PolarHBondContact O-N 3.23Å; R433-N435 VanDerWaalsContact C-N 3.3Å
436	H	94.1	Very high	95.4	Very high	86 Å²	86	60.3 Å²	60.3	40%	0.398	29%	0.291	S	S	.	.			trans	-125.7	25.8	-170.8	-75.1	117.2	0	0	0	113.9	L431 D434 S438 L439	L431-H436 HydrophobicContact CD2-CB 4.07Å; L431-H436 WeakPolarHBondContact O-CA 3.39Å; L431-H436 PolarHBondContact O-N 3.01Å; D434-H436 PolarHBondContact O-CE1 3.46Å; D434-H436 VanDerWaalsContact O-CE1 3.32Å; D434-H436 PolarHBondContact O-ND1 3.02Å; H436-S438 PolarHBondContact O-N 2.91Å; H436-L439 HydrophobicContact CB-CD1 3.83Å; H436-L439 HydrophobicContact CB-CG 4.07Å; H436-L439 VanDerWaalsContact O-CB 3.31Å; H436-L439 WeakPolarHBondContact O-CB 3.38Å; H436-L439 WeakPolarHBondContact O-CG 3.16Å; H436-L439 PolarHBondContact O-N 3.43Å
437	D	90.5	Very high	95.4	Very high	78 Å²	78	60.7 Å²	60.7	42%	0.417	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-38.2	-177.7	-52.2	-107.4	0	0	0	113.5	H432 L439 L440	H432-D437 IonicContact CE1-OD1 3.35Å; H432-D437 IonicContact CG-OD1 3.43Å; H432-D437 IonicContact ND1-OD1 3.5Å; H432-D437 PolarHBondContact ND1-OD1 2.98Å; H432-D437 IonicContact ND1-OD2 2.81Å; D437-L439 PolarHBondContact O-N 3.39Å; D437-L440 PolarHBondContact O-N 2.95Å; D437-L440 VanDerWaalsContact O-N 3.08Å
438	S	91.9	Very high	95.2	Very high	80 Å²	80	63.5 Å²	63.5	56%	0.559	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-12	177.8	75.7	0	0	0	0	115	H436 K442	H436-S438 PolarHBondContact O-N 2.91Å; S438-K442 WeakPolarHBondContact O-CE 3.37Å
439	L	95.3	Very high	95.3	Very high	11 Å²	11	63.5 Å²	63.5	6%	0.058	32%	0.316	C	S	.	.	H	α-helix	trans	-74.8	-28.8	173.8	-62.6	-173.4	0	0	0	112.5	L389 L431 H436 D437 H441 K442 L443	L389-L439 HydrophobicContact CD2-CD1 3.91Å; L431-L439 HydrophobicContact CD1-CB 4.4Å; L431-L439 HydrophobicContact CD2-CB 3.99Å; L431-L439 HydrophobicContact CD2-CD1 4.04Å; L431-L439 HydrophobicContact CD2-CG 4.5Å; H436-L439 HydrophobicContact CB-CD1 3.83Å; H436-L439 HydrophobicContact CB-CG 4.07Å; H436-L439 VanDerWaalsContact O-CB 3.31Å; H436-L439 WeakPolarHBondContact O-CB 3.38Å; H436-L439 WeakPolarHBondContact O-CG 3.16Å; H436-L439 PolarHBondContact O-N 3.43Å; D437-L439 PolarHBondContact O-N 3.39Å; L439-H441 VanDerWaalsContact C-N 3.33Å; L439-H441 PolarHBondContact O-N 3.27Å; L439-K442 HydrophobicContact CD2-CD 4.08Å; L439-K442 CarbonylContact O-C 3.58Å; L439-K442 WeakPolarHBondContact O-CA 3.29Å; L439-K442 WeakPolarHBondContact O-CB 3.48Å; L439-K442 PolarHBondContact O-N 3.22Å; L439-L443 WeakPolarHBondContact O-CG 3.22Å; L439-L443 PolarHBondContact O-N 3.47Å
440	L	95.1	Very high	95.4	Very high	39 Å²	39	61.3 Å²	61.3	20%	0.204	31%	0.306	C	S	.	.	H	α-helix	trans	-57.5	-45	-174.3	-174.9	66.3	0	0	0	111.9	L427 L431 D437 K442 L443 Y444	L427-L440 HydrophobicContact CD2-CD1 3.87Å; L427-L440 HydrophobicContact CG-CD1 4.34Å; L431-L440 HydrophobicContact CD1-CB 3.92Å; L431-L440 HydrophobicContact CD1-CD1 4.24Å; D437-L440 PolarHBondContact O-N 2.95Å; D437-L440 VanDerWaalsContact O-N 3.08Å; L440-K442 PolarHBondContact O-N 3.32Å; L440-L443 PolarHBondContact O-N 2.8Å; L440-Y444 HydrophobicContact CD1-CD2 4.44Å; L440-Y444 HydrophobicContact CD1-CE2 4.11Å; L440-Y444 HydrophobicContact CG-CD2 4.29Å; L440-Y444 HydrophobicContact CG-CE2 4.19Å; L440-Y444 WeakPolarHBondContact O-CD2 3.3Å; L440-Y444 PolarHBondContact O-N 3.01Å; L440-Y444 VanDerWaalsContact O-N 3.1Å
441	H	95.2	Very high	95.3	Very high	130 Å²	130	65.9 Å²	65.9	60%	0.602	32%	0.323	S	S	*	.	H	α-helix	trans	-63.9	-39.1	175.2	-176.2	71.8	0	0	0	112.5	L439 Y444 Q445	L439-H441 VanDerWaalsContact C-N 3.33Å; L439-H441 PolarHBondContact O-N 3.27Å; H441-Y444 PolarHBondContact O-N 3.36Å; H441-Q445 PolarHBondContact CD2-NE2 2.94Å; H441-Q445 PolarHBondContact NE2-NE2 2.82Å; H441-Q445 WeakPolarHBondContact O-CG 3.44Å; H441-Q445 PolarHBondContact O-N 2.84Å
442	K	97	Very high	95.3	Very high	82 Å²	82	69.7 Å²	69.7	36%	0.357	35%	0.349	S	S	.	.	H	α-helix	trans	-67.3	-35.9	177.6	-58.1	174.8	-166.2	167.8	0	111.6	L387 S438 L439 L440 Q445 R446	L387-K442 HydrophobicContact CD1-CB 4.33Å; L387-K442 HydrophobicContact CD2-CB 4.18Å; L387-K442 HydrophobicContact CD2-CD 4Å; S438-K442 WeakPolarHBondContact O-CE 3.37Å; L439-K442 HydrophobicContact CD2-CD 4.08Å; L439-K442 CarbonylContact O-C 3.58Å; L439-K442 WeakPolarHBondContact O-CA 3.29Å; L439-K442 WeakPolarHBondContact O-CB 3.48Å; L439-K442 PolarHBondContact O-N 3.22Å; L440-K442 PolarHBondContact O-N 3.32Å; K442-Q445 WeakPolarHBondContact O-CB 3.37Å; K442-Q445 PolarHBondContact O-N 2.99Å; K442-R446 WeakPolarHBondContact O-CG 3.38Å; K442-R446 PolarHBondContact O-N 2.87Å
443	L	97.4	Very high	95.4	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-63.9	-45	173.6	-68.7	177.6	0	0	0	111	L387 L389 F397 L427 L431 L439 L440 Q445 R446 M447	L387-L443 HydrophobicContact CD1-CD2 4.06Å; L389-L443 HydrophobicContact CD1-CD2 3.77Å; L389-L443 HydrophobicContact CD2-CD2 4.05Å; F397-L443 HydrophobicContact CB-CD1 4.42Å; F397-L443 HydrophobicContact CD1-CD2 3.88Å; F397-L443 HydrophobicContact CD2-CB 3.87Å; F397-L443 HydrophobicContact CD2-CD1 4.16Å; F397-L443 HydrophobicContact CD2-CD2 3.95Å; F397-L443 HydrophobicContact CD2-CG 4.21Å; F397-L443 HydrophobicContact CE1-CD2 4Å; F397-L443 HydrophobicContact CE2-CB 3.7Å; F397-L443 HydrophobicContact CE2-CD2 4.08Å; F397-L443 HydrophobicContact CE2-CG 4.38Å; F397-L443 HydrophobicContact CG-CD1 4.35Å; F397-L443 HydrophobicContact CG-CD2 3.86Å; F397-L443 HydrophobicContact CG-CG 4.5Å; F397-L443 HydrophobicContact CZ-CB 4.31Å; F397-L443 HydrophobicContact CZ-CD2 4.11Å; L427-L443 HydrophobicContact CD1-CD1 4.27Å; L427-L443 HydrophobicContact CD2-CD1 3.96Å; L431-L443 HydrophobicContact CD1-CD1 4.26Å; L439-L443 WeakPolarHBondContact O-CG 3.22Å; L439-L443 PolarHBondContact O-N 3.47Å; L440-L443 PolarHBondContact O-N 2.8Å; L443-Q445 VanDerWaalsContact C-N 3.34Å; L443-Q445 PolarHBondContact O-N 3.24Å; L443-R446 WeakPolarHBondContact O-CA 3.46Å; L443-R446 WeakPolarHBondContact O-CB 3.23Å; L443-R446 PolarHBondContact O-N 2.93Å; L443-M447 PolarHBondContact O-N 2.97Å
444	Y	96.3	Very high	95.6	Very high	75 Å²	75	59.7 Å²	59.7	29%	0.294	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-38.3	172.6	-83.9	-61	0	0	0	113.1	L400 H420 E424 L440 H441 R446 M447 A448	L400-Y444 HydrophobicContact CD2-CE1 4.43Å; H420-Y444 PolarHBondContact CE1-OH 2.82Å; E424-Y444 VanDerWaalsContact CD-OH 3.23Å; E424-Y444 PolarHBondContact OE1-OH 2.91Å; L440-Y444 HydrophobicContact CD1-CD2 4.44Å; L440-Y444 HydrophobicContact CD1-CE2 4.11Å; L440-Y444 HydrophobicContact CG-CD2 4.29Å; L440-Y444 HydrophobicContact CG-CE2 4.19Å; L440-Y444 WeakPolarHBondContact O-CD2 3.3Å; L440-Y444 PolarHBondContact O-N 3.01Å; L440-Y444 VanDerWaalsContact O-N 3.1Å; H441-Y444 PolarHBondContact O-N 3.36Å; Y444-R446 VanDerWaalsContact C-N 3.32Å; Y444-R446 PolarHBondContact O-N 2.83Å; Y444-M447 HydrophobicContact CD1-SD 3.56Å; Y444-M447 VanDerWaalsContact CD1-SD 3.56Å; Y444-M447 HydrophobicContact CE1-CE 4.42Å; Y444-M447 HydrophobicContact CE1-SD 3.78Å; Y444-M447 HydrophobicContact CG-SD 4.49Å; Y444-M447 WeakPolarHBondContact O-CB 3.33Å; Y444-M447 PolarHBondContact O-N 3.46Å; Y444-A448 PolarHBondContact O-N 2.99Å
445	Q	96.2	Very high	95.6	Very high	100 Å²	100	61.7 Å²	61.7	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-39.1	170.7	-68.7	174.8	-5.3	0	0	112.2	H441 K442 L443 M447 A448 V449	H441-Q445 PolarHBondContact CD2-NE2 2.94Å; H441-Q445 PolarHBondContact NE2-NE2 2.82Å; H441-Q445 WeakPolarHBondContact O-CG 3.44Å; H441-Q445 PolarHBondContact O-N 2.84Å; K442-Q445 WeakPolarHBondContact O-CB 3.37Å; K442-Q445 PolarHBondContact O-N 2.99Å; L443-Q445 VanDerWaalsContact C-N 3.34Å; L443-Q445 PolarHBondContact O-N 3.24Å; Q445-M447 VanDerWaalsContact C-N 3.33Å; Q445-M447 PolarHBondContact O-N 3.01Å; Q445-A448 PolarHBondContact O-N 2.87Å; Q445-V449 PolarHBondContact O-N 3.15Å
446	R	97.3	Very high	95.8	Very high	69 Å²	69	56.9 Å²	56.9	26%	0.26	30%	0.301	S	S	.	.	H	α-helix	trans	-66.5	-30.9	175	-66.2	-58	-177.9	-137.9	0.7	112.8	F380 G383 L387 F397 K442 L443 Y444 A448 V449 L450	F380-R446 HydrophobicContact CE2-CB 4.06Å; G383-R446 PolarHBondContact O-NE 3.2Å; G383-R446 PolarHBondContact O-NH2 3.49Å; L387-R446 HydrophobicContact CD1-CG 4.16Å; F397-R446 HydrophobicContact CZ-CB 4.19Å; K442-R446 WeakPolarHBondContact O-CG 3.38Å; K442-R446 PolarHBondContact O-N 2.87Å; L443-R446 WeakPolarHBondContact O-CA 3.46Å; L443-R446 WeakPolarHBondContact O-CB 3.23Å; L443-R446 PolarHBondContact O-N 2.93Å; Y444-R446 VanDerWaalsContact C-N 3.32Å; Y444-R446 PolarHBondContact O-N 2.83Å; R446-A448 VanDerWaalsContact C-N 3.31Å; R446-A448 PolarHBondContact O-N 3.46Å; R446-V449 PolarHBondContact O-N 3.32Å; R446-L450 WeakPolarHBondContact O-CG 3.44Å; R446-L450 PolarHBondContact O-N 3.35Å
447	M	96.5	Very high	95.9	Very high	8 Å²	8	53.5 Å²	53.5	4%	0.039	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-34.2	173.7	-64.7	175.2	69.2	0	0	113	F397 L400 V401 L443 Y444 Q445 R451	F397-M447 HydrophobicContact CE2-CG 3.71Å; F397-M447 HydrophobicContact CE2-SD 4.07Å; F397-M447 HydrophobicContact CZ-CG 4.02Å; L400-M447 HydrophobicContact CD2-SD 4.45Å; V401-M447 HydrophobicContact CG2-CE 4.45Å; V401-M447 HydrophobicContact CG2-CG 4.01Å; V401-M447 HydrophobicContact CG2-SD 4.44Å; L443-M447 PolarHBondContact O-N 2.97Å; Y444-M447 HydrophobicContact CD1-SD 3.56Å; Y444-M447 VanDerWaalsContact CD1-SD 3.56Å; Y444-M447 HydrophobicContact CE1-CE 4.42Å; Y444-M447 HydrophobicContact CE1-SD 3.78Å; Y444-M447 HydrophobicContact CG-SD 4.49Å; Y444-M447 WeakPolarHBondContact O-CB 3.33Å; Y444-M447 PolarHBondContact O-N 3.46Å; Q445-M447 VanDerWaalsContact C-N 3.33Å; Q445-M447 PolarHBondContact O-N 3.01Å; M447-R451 WeakPolarHBondContact O-CG 3.43Å; M447-R451 PolarHBondContact O-N 3.1Å
448	A	94.1	Very high	96.2	Very high	58 Å²	58	52.7 Å²	52.7	48%	0.479	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-42.8	173	0	0	0	0	0	111.8	Y444 Q445 R446 R451 S452	Y444-A448 PolarHBondContact O-N 2.99Å; Q445-A448 PolarHBondContact O-N 2.87Å; R446-A448 VanDerWaalsContact C-N 3.31Å; R446-A448 PolarHBondContact O-N 3.46Å; A448-R451 PolarHBondContact O-N 2.99Å; A448-S452 PolarHBondContact O-N 3.08Å
449	V	97.6	Very high	96.4	Very high	55 Å²	55	53.3 Å²	53.3	33%	0.333	27%	0.274	S	S	.	.	H	α-helix	trans	-65.7	-38.8	177.9	-174.4	0	0	0	0	111.7	F380 Q445 R446 R451 S452 L453	F380-V449 HydrophobicContact CD2-CB 4.08Å; F380-V449 HydrophobicContact CD2-CG1 3.73Å; F380-V449 HydrophobicContact CE2-CB 4.35Å; F380-V449 HydrophobicContact CE2-CG1 4.46Å; Q445-V449 PolarHBondContact O-N 3.15Å; R446-V449 PolarHBondContact O-N 3.32Å; V449-R451 VanDerWaalsContact C-N 3.34Å; V449-R451 PolarHBondContact O-N 2.9Å; V449-S452 WeakPolarHBondContact O-CB 3.36Å; V449-S452 PolarHBondContact O-N 3.24Å; V449-S452 VanDerWaalsContact O-N 3.17Å; V449-L453 HydrophobicContact CG1-CD1 4.33Å; V449-L453 HydrophobicContact CG1-CG 4.4Å; V449-L453 WeakPolarHBondContact O-CG 3.43Å; V449-L453 PolarHBondContact O-N 3.29Å
450	L	97.6	Very high	96.5	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.2	-44.4	174.8	-75.1	168.7	0	0	0	112.2	E336 L339 V340 F380 V401 R446 S452 L453 C454	E336-L450 HydrophobicContact CB-CB 4.26Å; E336-L450 HydrophobicContact CB-CD1 4.33Å; E336-L450 HydrophobicContact CB-CD2 4.38Å; E336-L450 HydrophobicContact CG-CB 4.03Å; L339-L450 HydrophobicContact CB-CD2 3.63Å; L339-L450 HydrophobicContact CD1-CD2 4.15Å; V340-L450 HydrophobicContact CG2-CD1 3.49Å; V340-L450 VanDerWaalsContact CG2-CD1 3.49Å; V340-L450 HydrophobicContact CG2-CD2 4.21Å; V340-L450 HydrophobicContact CG2-CG 4.47Å; F380-L450 HydrophobicContact CD1-CD2 4.45Å; F380-L450 HydrophobicContact CE1-CD2 3.67Å; F380-L450 HydrophobicContact CE1-CG 4.4Å; F380-L450 HydrophobicContact CE2-CD2 3.88Å; F380-L450 HydrophobicContact CE2-CG 3.77Å; F380-L450 HydrophobicContact CZ-CD1 4.07Å; F380-L450 HydrophobicContact CZ-CD2 3.34Å; F380-L450 HydrophobicContact CZ-CG 3.57Å; V401-L450 HydrophobicContact CG1-CD1 4.28Å; V401-L450 HydrophobicContact CG2-CD1 4.1Å; R446-L450 WeakPolarHBondContact O-CG 3.44Å; R446-L450 PolarHBondContact O-N 3.35Å; L450-S452 VanDerWaalsContact C-N 3.31Å; L450-S452 PolarHBondContact O-N 3.19Å; L450-L453 PolarHBondContact O-N 2.9Å; L450-C454 PolarHBondContact O-N 3.01Å; L450-C454 PolarHBondContact O-SG 3.23Å; L450-C454 VanDerWaalsContact O-SG 3.4Å
451	R	95.1	Very high	96.5	Very high	97 Å²	97	52.9 Å²	52.9	37%	0.366	27%	0.271	S	S	.	.	H	α-helix	trans	-60.7	-38.4	176.4	-68.8	172.8	178.4	-173.6	-2.9	112.2	N404 D406 M447 A448 V449 S455	N404-R451 PolarHBondContact ND2-NH2 2.93Å; N404-R451 PolarHBondContact OD1-NH2 3.12Å; D406-R451 IonicContact OD2-CZ 3.88Å; D406-R451 IonicContact OD2-NH1 3.3Å; D406-R451 PolarHBondContact OD2-NH1 2.83Å; D406-R451 IonicContact OD2-NH2 2.68Å; D406-R451 PolarHBondContact OD2-NH2 2.85Å; M447-R451 WeakPolarHBondContact O-CG 3.43Å; M447-R451 PolarHBondContact O-N 3.1Å; A448-R451 PolarHBondContact O-N 2.99Å; V449-R451 VanDerWaalsContact C-N 3.34Å; V449-R451 PolarHBondContact O-N 2.9Å; R451-S455 WeakPolarHBondContact O-CB 3.4Å; R451-S455 PolarHBondContact O-N 3.09Å; R451-S455 VanDerWaalsContact O-N 3.08Å; R451-S455 PolarHBondContact O-OG 3.46Å
452	S	97.3	Very high	96.5	Very high	80 Å²	80	53 Å²	53	56%	0.559	27%	0.266	S	S	*	.	H	α-helix	trans	-68	-43.8	174.3	-60.9	0	0	0	0	112.5	A448 V449 L450 S455 L456	A448-S452 PolarHBondContact O-N 3.08Å; V449-S452 WeakPolarHBondContact O-CB 3.36Å; V449-S452 PolarHBondContact O-N 3.24Å; V449-S452 VanDerWaalsContact O-N 3.17Å; L450-S452 VanDerWaalsContact C-N 3.31Å; L450-S452 PolarHBondContact O-N 3.19Å; S452-S455 WeakPolarHBondContact O-CB 3.45Å; S452-S455 PolarHBondContact O-N 2.99Å; S452-L456 PolarHBondContact O-N 3.25Å
453	L	98.1	Very high	96.4	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.042	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-41.9	177.1	-71.3	174.1	0	0	0	112.4	L339 A376 V377 F380 V449 L450 L456 H457	L339-L453 HydrophobicContact CD1-CB 3.93Å; L339-L453 HydrophobicContact CD1-CD1 4.18Å; A376-L453 HydrophobicContact CB-CD2 3.56Å; V377-L453 HydrophobicContact CG2-CD2 4.15Å; F380-L453 HydrophobicContact CB-CD1 3.61Å; F380-L453 HydrophobicContact CD1-CD1 4.13Å; F380-L453 HydrophobicContact CD2-CD1 4Å; F380-L453 HydrophobicContact CG-CD1 3.62Å; V449-L453 HydrophobicContact CG1-CD1 4.33Å; V449-L453 HydrophobicContact CG1-CG 4.4Å; V449-L453 WeakPolarHBondContact O-CG 3.43Å; V449-L453 PolarHBondContact O-N 3.29Å; L450-L453 PolarHBondContact O-N 2.9Å; L453-L456 PolarHBondContact O-N 3.19Å; L453-H457 WeakPolarHBondContact O-CB 3.47Å; L453-H457 PolarHBondContact O-N 3.19Å
454	C	96.5	Very high	96.4	Very high	20 Å²	20	54.6 Å²	54.6	14%	0.135	27%	0.27	C	S	.	.	H	α-helix	trans	-67	-37.9	176.1	-66.7	0	0	0	0	111.8	M335 E336 L450 H457 M458	M335-C454 VanDerWaalsContact CG-SG 3.54Å; E336-C454 WeakPolarHBondContact CG-SG 3.46Å; L450-C454 PolarHBondContact O-N 3.01Å; L450-C454 PolarHBondContact O-SG 3.23Å; L450-C454 VanDerWaalsContact O-SG 3.4Å; C454-H457 PolarHBondContact O-N 3.4Å; C454-M458 WeakPolarHBondContact O-CB 3.3Å; C454-M458 VanDerWaalsContact O-CG 3.24Å; C454-M458 WeakPolarHBondContact O-CG 3.13Å; C454-M458 PolarHBondContact O-N 3.45Å
455	S	95.8	Very high	96.3	Very high	79 Å²	79	51.7 Å²	51.7	55%	0.552	26%	0.261	S	S	*	.	H	α-helix	trans	-59.4	-45.1	171.5	-60.3	0	0	0	0	112.2	R451 S452 M458 E459	R451-S455 WeakPolarHBondContact O-CB 3.4Å; R451-S455 PolarHBondContact O-N 3.09Å; R451-S455 VanDerWaalsContact O-N 3.08Å; R451-S455 PolarHBondContact O-OG 3.46Å; S452-S455 WeakPolarHBondContact O-CB 3.45Å; S452-S455 PolarHBondContact O-N 2.99Å; S455-M458 PolarHBondContact O-N 3.43Å; S455-E459 PolarHBondContact O-N 3.04Å
456	L	97.6	Very high	96.2	Very high	38 Å²	38	54.5 Å²	54.5	20%	0.199	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-41.9	177.4	-174.2	63.1	0	0	0	111.8	L373 S452 L453 M458 E459 K460	L373-L456 HydrophobicContact CB-CD2 4.09Å; L373-L456 HydrophobicContact CB-CG 4.26Å; L373-L456 HydrophobicContact CD1-CB 4.17Å; L373-L456 HydrophobicContact CD1-CD2 3.96Å; L373-L456 HydrophobicContact CD1-CG 3.97Å; S452-L456 PolarHBondContact O-N 3.25Å; L453-L456 PolarHBondContact O-N 3.19Å; L456-M458 VanDerWaalsContact C-N 3.33Å; L456-M458 PolarHBondContact O-N 3.03Å; L456-E459 WeakPolarHBondContact O-CB 3.42Å; L456-E459 PolarHBondContact O-N 3.04Å; L456-E459 VanDerWaalsContact O-N 3.15Å; L456-K460 WeakPolarHBondContact O-CG 3.36Å; L456-K460 PolarHBondContact O-N 2.77Å
457	H	96.8	Very high	96.1	Very high	16 Å²	16	58.7 Å²	58.7	7%	0.074	29%	0.289	C	S	.	.	H	α-helix	trans	-56.6	-47.3	172.5	175.7	82.5	0	0	0	111.6	L373 L453 C454 E459 K460 L461 Y480	L373-H457 HydrophobicContact CD1-CB 4.27Å; L373-H457 HydrophobicContact CD2-CB 4.21Å; L453-H457 WeakPolarHBondContact O-CB 3.47Å; L453-H457 PolarHBondContact O-N 3.19Å; C454-H457 PolarHBondContact O-N 3.4Å; H457-E459 VanDerWaalsContact C-N 3.27Å; H457-E459 PolarHBondContact O-N 3.2Å; H457-K460 PolarHBondContact O-N 2.68Å; H457-L461 VanDerWaalsContact O-CB 3.3Å; H457-L461 WeakPolarHBondContact O-CB 3.42Å; H457-L461 PolarHBondContact O-N 2.99Å; H457-Y480 PolarHBondContact CE1-OH 3.08Å; H457-Y480 PolarHBondContact NE2-OH 2.62Å; H457-Y480 VanDerWaalsContact NE2-OH 3.14Å
458	M	95.8	Very high	96.1	Very high	61 Å²	61	61.1 Å²	61.1	30%	0.3	30%	0.298	S	S	.	.	H	α-helix	trans	-66.9	-25.3	178.2	-67.1	-63.8	-65.6	0	0	113	C454 S455 L456 L461 R462 F484	C454-M458 WeakPolarHBondContact O-CB 3.3Å; C454-M458 VanDerWaalsContact O-CG 3.24Å; C454-M458 WeakPolarHBondContact O-CG 3.13Å; C454-M458 PolarHBondContact O-N 3.45Å; S455-M458 PolarHBondContact O-N 3.43Å; L456-M458 VanDerWaalsContact C-N 3.33Å; L456-M458 PolarHBondContact O-N 3.03Å; M458-L461 HydrophobicContact SD-CD2 4.24Å; M458-R462 VanDerWaalsContact O-CG 3.31Å; M458-R462 WeakPolarHBondContact O-CG 3.32Å; M458-R462 PolarHBondContact O-N 3.05Å; M458-R462 PolarHBondContact O-NE 3.05Å; M458-F484 WeakPolarHBondContact CE-O 3.41Å; M458-F484 HydrophobicContact SD-CB 4.18Å; M458-F484 HydrophobicContact SD-CD1 4.07Å
459	E	96.2	Very high	96	Very high	92 Å²	92	61.3 Å²	61.3	43%	0.43	30%	0.295	S	S	.	.	H	α-helix	trans	-67.7	-53.5	168	-174.2	-160.6	107	0	0	111.8	S455 L456 H457 L461 R462 W463	S455-E459 PolarHBondContact O-N 3.04Å; L456-E459 WeakPolarHBondContact O-CB 3.42Å; L456-E459 PolarHBondContact O-N 3.04Å; L456-E459 VanDerWaalsContact O-N 3.15Å; H457-E459 VanDerWaalsContact C-N 3.27Å; H457-E459 PolarHBondContact O-N 3.2Å; E459-L461 VanDerWaalsContact C-N 3.29Å; E459-L461 PolarHBondContact O-N 2.77Å; E459-R462 VanDerWaalsContact CA-NH2 3.31Å; E459-R462 PolarHBondContact O-N 2.98Å; E459-R462 VanDerWaalsContact O-N 3.15Å; E459-W463 PolarHBondContact O-N 3.49Å
460	K	96.8	Very high	95.8	Very high	32 Å²	32	65.3 Å²	65.3	14%	0.139	31%	0.314	C	S	.	.	H	α-helix	trans	-65.7	-34.3	-178.3	-53	-45.6	-175.1	-166.1	0	112.1	W294 C370 D372 L373 L456 H457 W463 F464	W294-K460 HydrophobicContact CH2-CB 3.88Å; W294-K460 HydrophobicContact CZ2-CB 3.9Å; C370-K460 HydrophobicContact CB-CB 4.11Å; C370-K460 HydrophobicContact CB-CD 4.37Å; C370-K460 HydrophobicContact CB-CG 3.82Å; D372-K460 VanDerWaalsContact CG-CE 3.47Å; D372-K460 WeakPolarHBondContact OD1-CE 3.37Å; D372-K460 IonicContact OD1-NZ 2.74Å; D372-K460 WeakPolarHBondContact OD2-CE 3.38Å; D372-K460 IonicContact OD2-NZ 3.98Å; D372-K460 PolarHBondContact OD2-NZ 3.33Å; L373-K460 HydrophobicContact CB-CG 4.31Å; L373-K460 HydrophobicContact CD2-CB 4.38Å; L373-K460 HydrophobicContact CD2-CG 4.15Å; L456-K460 WeakPolarHBondContact O-CG 3.36Å; L456-K460 PolarHBondContact O-N 2.77Å; H457-K460 PolarHBondContact O-N 2.68Å; K460-W463 PolarHBondContact O-N 2.79Å; K460-F464 WeakPolarHBondContact O-CB 3.26Å; K460-F464 PolarHBondContact O-N 3.27Å
461	L	95.9	Very high	95.6	Very high	9 Å²	9	65.8 Å²	65.8	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-63.4	-43.5	172.5	178.2	58.4	0	0	0	112	W294 H457 M458 E459 F464 S465 F476 Y480 F484	W294-L461 HydrophobicContact CH2-CB 4.47Å; W294-L461 HydrophobicContact CZ3-CB 4.32Å; W294-L461 HydrophobicContact CZ3-CD1 4.18Å; H457-L461 VanDerWaalsContact O-CB 3.3Å; H457-L461 WeakPolarHBondContact O-CB 3.42Å; H457-L461 PolarHBondContact O-N 2.99Å; M458-L461 HydrophobicContact SD-CD2 4.24Å; E459-L461 VanDerWaalsContact C-N 3.29Å; E459-L461 PolarHBondContact O-N 2.77Å; L461-F464 WeakPolarHBondContact O-CB 3.31Å; L461-F464 PolarHBondContact O-N 3.16Å; L461-S465 PolarHBondContact O-N 3.02Å; L461-S465 PolarHBondContact O-OG 3.09Å; L461-F476 HydrophobicContact CD1-CE2 3.77Å; L461-Y480 HydrophobicContact CD1-CE1 4.12Å; L461-Y480 HydrophobicContact CD2-CE1 4.1Å; L461-F484 HydrophobicContact CD2-CB 3.53Å
462	R	95.4	Very high	95.4	Very high	134 Å²	134	61.4 Å²	61.4	51%	0.506	30%	0.301	S	S	.	.	H	α-helix	trans	-63.1	-43.5	175.4	-79.2	174.5	-69.3	149.2	-1	112.1	M458 E459 F464 S465 Q466	M458-R462 VanDerWaalsContact O-CG 3.31Å; M458-R462 WeakPolarHBondContact O-CG 3.32Å; M458-R462 PolarHBondContact O-N 3.05Å; M458-R462 PolarHBondContact O-NE 3.05Å; E459-R462 VanDerWaalsContact CA-NH2 3.31Å; E459-R462 PolarHBondContact O-N 2.98Å; E459-R462 VanDerWaalsContact O-N 3.15Å; R462-F464 VanDerWaalsContact C-N 3.3Å; R462-F464 PolarHBondContact O-N 2.78Å; R462-S465 PolarHBondContact O-N 3.44Å; R462-Q466 WeakPolarHBondContact O-CB 3.47Å; R462-Q466 VanDerWaalsContact O-CG 3.27Å; R462-Q466 WeakPolarHBondContact O-CG 3.47Å; R462-Q466 PolarHBondContact O-N 3.24Å
463	W	95.4	Very high	95	Very high	115 Å²	115	62 Å²	62	44%	0.436	30%	0.295	S	S	.	.	H	α-helix	trans	-58	-43.8	172.6	171.7	87.7	0	0	0	111.6	V290 A369 E459 K460 R467	V290-W463 HydrophobicContact CG1-CH2 4.36Å; V290-W463 HydrophobicContact CG1-CZ3 4.28Å; A369-W463 HydrophobicContact CB-CH2 4.05Å; A369-W463 HydrophobicContact CB-CZ3 4.43Å; E459-W463 PolarHBondContact O-N 3.49Å; K460-W463 PolarHBondContact O-N 2.79Å; W463-R467 WeakPolarHBondContact O-CB 3.31Å; W463-R467 PolarHBondContact O-N 2.95Å; W463-R467 VanDerWaalsContact O-N 3.16Å
464	F	96.1	Very high	94.7	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-51	177.3	179.8	-95.3	0	0	0	112.2	V290 D291 W294 K460 L461 R462 Q466 R467 Y468 T471 A472 F476	V290-F464 HydrophobicContact CG1-CD2 4.32Å; V290-F464 HydrophobicContact CG1-CE2 4.33Å; D291-F464 HydrophobicContact CB-CE2 3.74Å; D291-F464 HydrophobicContact CB-CZ 3.67Å; W294-F464 HydrophobicContact CB-CD1 4.45Å; W294-F464 HydrophobicContact CB-CD2 3.93Å; W294-F464 HydrophobicContact CB-CE1 4.11Å; W294-F464 HydrophobicContact CB-CE2 3.54Å; W294-F464 HydrophobicContact CB-CG 4.37Å; W294-F464 HydrophobicContact CB-CZ 3.63Å; W294-F464 AromaticContact CD1-CD2 3.51Å; W294-F464 AromaticContact CD1-CE2 3.77Å; W294-F464 HydrophobicContact CD2-CB 4.21Å; W294-F464 HydrophobicContact CD2-CD1 4.37Å; W294-F464 AromaticContact CD2-CD2 3.89Å; W294-F464 HydrophobicContact CD2-CD2 3.89Å; W294-F464 HydrophobicContact CD2-CE2 4.44Å; W294-F464 AromaticContact CD2-CG 3.86Å; W294-F464 HydrophobicContact CD2-CG 3.86Å; W294-F464 HydrophobicContact CE3-CB 4.47Å; W294-F464 HydrophobicContact CE3-CD1 4.43Å; W294-F464 HydrophobicContact CE3-CG 4.25Å; W294-F464 HydrophobicContact CG-CD1 4.41Å; W294-F464 AromaticContact CG-CD2 3.49Å; W294-F464 HydrophobicContact CG-CD2 3.49Å; W294-F464 VanDerWaalsContact CG-CD2 3.49Å; W294-F464 AromaticContact CG-CE2 3.63Å; W294-F464 HydrophobicContact CG-CE2 3.63Å; W294-F464 AromaticContact CG-CG 3.92Å; W294-F464 HydrophobicContact CG-CG 3.92Å; W294-F464 HydrophobicContact CG-CZ 4.15Å; W294-F464 HydrophobicContact CZ2-CB 4.36Å; W294-F464 AromaticContact NE1-CD2 3.88Å; K460-F464 WeakPolarHBondContact O-CB 3.26Å; K460-F464 PolarHBondContact O-N 3.27Å; L461-F464 WeakPolarHBondContact O-CB 3.31Å; L461-F464 PolarHBondContact O-N 3.16Å; R462-F464 VanDerWaalsContact C-N 3.3Å; R462-F464 PolarHBondContact O-N 2.78Å; F464-Q466 VanDerWaalsContact C-N 3.27Å; F464-Q466 PolarHBondContact O-N 3.01Å; F464-R467 PolarHBondContact O-N 3.4Å; F464-Y468 AromaticContact CD2-CD2 3.59Å; F464-Y468 HydrophobicContact CD2-CD2 3.59Å; F464-Y468 HydrophobicContact CD2-CE2 4.28Å; F464-Y468 HydrophobicContact CD2-CG 4.29Å; F464-Y468 AromaticContact CE2-CD2 3.4Å; F464-Y468 HydrophobicContact CE2-CD2 3.4Å; F464-Y468 VanDerWaalsContact CE2-CD2 3.4Å; F464-Y468 HydrophobicContact CE2-CE2 4.16Å; F464-Y468 AromaticContact CE2-CG 3.71Å; F464-Y468 HydrophobicContact CE2-CG 3.71Å; F464-Y468 HydrophobicContact CG-CD2 4.46Å; F464-Y468 HydrophobicContact CZ-CD2 4.19Å; F464-Y468 HydrophobicContact CZ-CG 4.07Å; F464-Y468 PolarHBondContact O-N 3.45Å; F464-T471 HydrophobicContact CE1-CG2 4.46Å; F464-T471 HydrophobicContact CZ-CG2 4.08Å; F464-A472 HydrophobicContact CD1-CB 4.27Å; F464-A472 HydrophobicContact CE1-CB 4.09Å; F464-F476 HydrophobicContact CD1-CE1 4.46Å; F464-F476 HydrophobicContact CD1-CE2 4.19Å; F464-F476 AromaticContact CD1-CZ 3.64Å; F464-F476 HydrophobicContact CD1-CZ 3.64Å; F464-F476 AromaticContact CE1-CE1 3.65Å; F464-F476 HydrophobicContact CE1-CE1 3.65Å; F464-F476 HydrophobicContact CE1-CE2 4.11Å; F464-F476 AromaticContact CE1-CZ 3.26Å; F464-F476 HydrophobicContact CE1-CZ 3.26Å; F464-F476 HydrophobicContact CZ-CE1 4.22Å; F464-F476 HydrophobicContact CZ-CZ 4.12Å
465	S	94.6	Very high	94.5	Very high	15 Å²	15	69 Å²	69	11%	0.105	34%	0.337	C	S	.	.	H	α-helix	trans	-57.8	-37.5	178.7	-67.6	0	0	0	0	112.7	L461 R462 P469	L461-S465 PolarHBondContact O-N 3.02Å; L461-S465 PolarHBondContact O-OG 3.09Å; R462-S465 PolarHBondContact O-N 3.44Å; S465-P469 VanDerWaalsContact O-CA 3.23Å; S465-P469 WeakPolarHBondContact O-CA 3.34Å; S465-P469 WeakPolarHBondContact O-CB 3.31Å
466	Q	94.4	Very high	94.6	Very high	158 Å²	158	65.5 Å²	65.5	74%	0.738	31%	0.312	S	S	*	.	H	α-helix	trans	-67.6	-36	175.1	-72.9	171.9	0.5	0	0	112.6	R462 F464	R462-Q466 WeakPolarHBondContact O-CB 3.47Å; R462-Q466 VanDerWaalsContact O-CG 3.27Å; R462-Q466 WeakPolarHBondContact O-CG 3.47Å; R462-Q466 PolarHBondContact O-N 3.24Å; F464-Q466 VanDerWaalsContact C-N 3.27Å; F464-Q466 PolarHBondContact O-N 3.01Å
467	R	95.1	Very high	94.5	Very high	158 Å²	158	64.7 Å²	64.7	60%	0.596	31%	0.31	S	S	*	.	H	α-helix	trans	-88.6	-28	-175.5	-169.6	64	-172.7	85.4	-7.6	114	W463 F464 P469	W463-R467 WeakPolarHBondContact O-CB 3.31Å; W463-R467 PolarHBondContact O-N 2.95Å; W463-R467 VanDerWaalsContact O-N 3.16Å; F464-R467 PolarHBondContact O-N 3.4Å; R467-P469 VanDerWaalsContact C-CD 3.5Å
468	Y	95.3	Very high	94.3	Very high	58 Å²	58	69 Å²	69	23%	0.227	34%	0.338	C	S	.	.			trans	-133.9	55.1	-175.8	-59	-85.6	0	0	0	112	V290 D291 F464 L470 T471 A472	V290-Y468 HydrophobicContact CB-CE2 4.11Å; V290-Y468 HydrophobicContact CG1-CE2 3.97Å; D291-Y468 HydrophobicContact CB-CD1 3.56Å; D291-Y468 HydrophobicContact CB-CE1 4.02Å; D291-Y468 HydrophobicContact CB-CG 3.84Å; F464-Y468 AromaticContact CD2-CD2 3.59Å; F464-Y468 HydrophobicContact CD2-CD2 3.59Å; F464-Y468 HydrophobicContact CD2-CE2 4.28Å; F464-Y468 HydrophobicContact CD2-CG 4.29Å; F464-Y468 AromaticContact CE2-CD2 3.4Å; F464-Y468 HydrophobicContact CE2-CD2 3.4Å; F464-Y468 VanDerWaalsContact CE2-CD2 3.4Å; F464-Y468 HydrophobicContact CE2-CE2 4.16Å; F464-Y468 AromaticContact CE2-CG 3.71Å; F464-Y468 HydrophobicContact CE2-CG 3.71Å; F464-Y468 HydrophobicContact CG-CD2 4.46Å; F464-Y468 HydrophobicContact CZ-CD2 4.19Å; F464-Y468 HydrophobicContact CZ-CG 4.07Å; F464-Y468 PolarHBondContact O-N 3.45Å; Y468-L470 VanDerWaalsContact C-N 3.29Å; Y468-L470 PolarHBondContact O-N 2.93Å; Y468-T471 PolarHBondContact O-N 3.29Å; Y468-T471 VanDerWaalsContact O-N 3.14Å; Y468-A472 PolarHBondContact O-N 3.42Å; Y468-A472 VanDerWaalsContact O-N 3.09Å
469	P	93.2	Very high	94.2	Very high	63 Å²	63	68 Å²	68	41%	0.409	34%	0.335	S	S	.	.	H	α-helix	trans	-60.8	-34.8	-171.1	23	-34.1	0	0	0	113.3	S465 R467 T471 A472 H473	S465-P469 VanDerWaalsContact O-CA 3.23Å; S465-P469 WeakPolarHBondContact O-CA 3.34Å; S465-P469 WeakPolarHBondContact O-CB 3.31Å; R467-P469 VanDerWaalsContact C-CD 3.5Å; P469-T471 PolarHBondContact O-N 2.82Å; P469-A472 PolarHBondContact O-N 3.42Å; P469-H473 WeakPolarHBondContact O-CB 3.3Å; P469-H473 PolarHBondContact O-N 3.49Å; P469-H473 PolarHBondContact O-ND1 3.47Å
470	L	92.4	Very high	94.2	Very high	138 Å²	138	63.9 Å²	63.9	72%	0.723	32%	0.315	S	S	*	.	H	α-helix	trans	-62.2	-43.5	177.5	-64.8	176.6	0	0	0	112	Y468 S474	Y468-L470 VanDerWaalsContact C-N 3.29Å; Y468-L470 PolarHBondContact O-N 2.93Å; L470-S474 WeakPolarHBondContact O-CA 3.35Å; L470-S474 WeakPolarHBondContact O-CB 3.14Å; L470-S474 PolarHBondContact O-N 3.07Å; L470-S474 PolarHBondContact O-OG 3.43Å
471	T	93.3	Very high	94	Very high	10 Å²	10	65 Å²	65	6%	0.061	32%	0.32	C	S	.	.	I	π-helix	trans	-68.5	-45.7	178.1	-52	0	0	0	0	110.8	D291 Q295 F464 Y468 P469 H473 L475 F476	D291-T471 HydrophobicContact CB-CG2 4.05Å; D291-T471 PolarHBondContact OD2-OG1 3.42Å; Q295-T471 HydrophobicContact CB-CG2 4.1Å; F464-T471 HydrophobicContact CE1-CG2 4.46Å; F464-T471 HydrophobicContact CZ-CG2 4.08Å; Y468-T471 PolarHBondContact O-N 3.29Å; Y468-T471 VanDerWaalsContact O-N 3.14Å; P469-T471 PolarHBondContact O-N 2.82Å; T471-H473 PolarHBondContact O-N 2.88Å; T471-L475 HydrophobicContact CG2-CB 4.11Å; T471-L475 HydrophobicContact CG2-CD1 4.14Å; T471-L475 WeakPolarHBondContact O-CA 3.39Å; T471-L475 WeakPolarHBondContact O-CB 3.39Å; T471-L475 PolarHBondContact O-N 3.18Å; T471-F476 HydrophobicContact CG2-CD1 4.34Å; T471-F476 HydrophobicContact CG2-CE1 4.09Å; T471-F476 WeakPolarHBondContact O-CD1 3.4Å; T471-F476 PolarHBondContact O-N 3.01Å; T471-F476 VanDerWaalsContact O-N 3.09Å
472	A	91.5	Very high	93.8	Very high	6 Å²	6	70 Å²	70	5%	0.05	34%	0.343	C	S	.	.	I	π-helix	trans	-63.5	-40.4	179.6	0	0	0	0	0	113.5	F464 Y468 P469 F476 K481	F464-A472 HydrophobicContact CD1-CB 4.27Å; F464-A472 HydrophobicContact CE1-CB 4.09Å; Y468-A472 PolarHBondContact O-N 3.42Å; Y468-A472 VanDerWaalsContact O-N 3.09Å; P469-A472 PolarHBondContact O-N 3.42Å; A472-F476 WeakPolarHBondContact O-CB 3.36Å; A472-K481 WeakPolarHBondContact O-CD 3.45Å
473	H	89.3	Confident	93.5	Very high	91 Å²	91	64.4 Å²	64.4	42%	0.421	32%	0.323	S	S	.	.	I	π-helix	trans	-85.7	-40.9	-178.5	-66.7	80.9	0	0	0	112.8	P469 T471 K481	P469-H473 WeakPolarHBondContact O-CB 3.3Å; P469-H473 PolarHBondContact O-N 3.49Å; P469-H473 PolarHBondContact O-ND1 3.47Å; T471-H473 PolarHBondContact O-N 2.88Å; H473-K481 WeakPolarHBondContact O-CD 3.46Å; H473-K481 PolarHBondContact O-NZ 2.67Å
474	S	90.5	Very high	93.2	Very high	86 Å²	86	59.6 Å²	59.6	60%	0.601	31%	0.305	S	S	*	.	I	π-helix	trans	-95.7	-39.3	-171.5	-53	0	0	0	0	113.8	L470	L470-S474 WeakPolarHBondContact O-CA 3.35Å; L470-S474 WeakPolarHBondContact O-CB 3.14Å; L470-S474 PolarHBondContact O-N 3.07Å; L470-S474 PolarHBondContact O-OG 3.43Å
475	L	94.3	Very high	92.3	Very high	90 Å²	90	60.6 Å²	60.6	47%	0.471	31%	0.313	S	S	.	.	I	π-helix	trans	-101.4	-20.9	-167.8	-56.9	-177.4	0	0	0	114.2	Q295 T471	Q295-L475 HydrophobicContact CG-CB 4.3Å; T471-L475 HydrophobicContact CG2-CB 4.11Å; T471-L475 HydrophobicContact CG2-CD1 4.14Å; T471-L475 WeakPolarHBondContact O-CA 3.39Å; T471-L475 WeakPolarHBondContact O-CB 3.39Å; T471-L475 PolarHBondContact O-N 3.18Å
476	F	95.9	Very high	90.7	Very high	5 Å²	5	62.1 Å²	62.1	2%	0.022	32%	0.324	C	S	.	.	S	Bend	trans	-68.5	142.4	172.9	-78.4	14.4	0	0	0	111.6	W294 Q295 A298 L461 F464 T471 A472 Y480 K481	W294-F476 HydrophobicContact CB-CE1 4.4Å; W294-F476 HydrophobicContact CB-CZ 4.18Å; W294-F476 HydrophobicContact CE3-CZ 4.28Å; Q295-F476 HydrophobicContact CB-CD1 4.41Å; Q295-F476 HydrophobicContact CB-CE1 4.26Å; A298-F476 HydrophobicContact CB-CD1 4.11Å; A298-F476 HydrophobicContact CB-CD2 4.26Å; A298-F476 HydrophobicContact CB-CE1 4.18Å; A298-F476 HydrophobicContact CB-CE2 4.32Å; A298-F476 HydrophobicContact CB-CG 4.14Å; A298-F476 HydrophobicContact CB-CZ 4.27Å; L461-F476 HydrophobicContact CD1-CE2 3.77Å; F464-F476 HydrophobicContact CD1-CE1 4.46Å; F464-F476 HydrophobicContact CD1-CE2 4.19Å; F464-F476 AromaticContact CD1-CZ 3.64Å; F464-F476 HydrophobicContact CD1-CZ 3.64Å; F464-F476 AromaticContact CE1-CE1 3.65Å; F464-F476 HydrophobicContact CE1-CE1 3.65Å; F464-F476 HydrophobicContact CE1-CE2 4.11Å; F464-F476 AromaticContact CE1-CZ 3.26Å; F464-F476 HydrophobicContact CE1-CZ 3.26Å; F464-F476 HydrophobicContact CZ-CE1 4.22Å; F464-F476 HydrophobicContact CZ-CZ 4.12Å; T471-F476 HydrophobicContact CG2-CD1 4.34Å; T471-F476 HydrophobicContact CG2-CE1 4.09Å; T471-F476 WeakPolarHBondContact O-CD1 3.4Å; T471-F476 PolarHBondContact O-N 3.01Å; T471-F476 VanDerWaalsContact O-N 3.09Å; A472-F476 WeakPolarHBondContact O-CB 3.36Å; F476-Y480 AromaticContact CD2-CD1 3.68Å; F476-Y480 HydrophobicContact CD2-CD1 3.68Å; F476-Y480 AromaticContact CD2-CE1 3.76Å; F476-Y480 HydrophobicContact CD2-CE1 3.76Å; F476-Y480 HydrophobicContact CE2-CD1 4.24Å; F476-Y480 AromaticContact CE2-CE1 3.83Å; F476-Y480 HydrophobicContact CE2-CE1 3.83Å; F476-Y480 HydrophobicContact CG-CD1 4.47Å; F476-K481 HydrophobicContact CB-CD 4.09Å; F476-K481 HydrophobicContact CB-CG 3.95Å; F476-K481 WeakPolarHBondContact O-CE 3.37Å; F476-K481 PolarHBondContact O-NZ 2.91Å
477	P	96.5	Very high	88.7	Confident	22 Å²	22	61.8 Å²	61.8	14%	0.143	32%	0.323	C	S	.	.			trans	-56.3	144.6	179.8	-27.2	36	0	0	0	113.2	V299 T302 L479 Y480 K481	V299-P477 HydrophobicContact CG2-CG 3.92Å; T302-P477 HydrophobicContact CG2-CB 3.9Å; T302-P477 HydrophobicContact CG2-CG 4.45Å; T302-P477 WeakPolarHBondContact OG1-CB 3.03Å; T302-P477 WeakPolarHBondContact OG1-CG 3.43Å; P477-L479 VanDerWaalsContact C-N 3.33Å; P477-L479 PolarHBondContact O-N 3.22Å; P477-Y480 WeakPolarHBondContact O-CB 3.06Å; P477-Y480 PolarHBondContact O-N 2.96Å; P477-K481 PolarHBondContact O-N 3.4Å; P477-K481 VanDerWaalsContact O-N 3.17Å
478	P	93.5	Very high	86.3	Confident	105 Å²	105	58.2 Å²	58.2	68%	0.682	33%	0.326	S	S	*	.	H	α-helix	trans	-54.2	-44.9	-178.8	-28.6	35.9	0	0	0	113.9	Y480 K481 E482	P478-Y480 VanDerWaalsContact C-N 3.34Å; P478-Y480 PolarHBondContact O-N 2.71Å; P478-K481 PolarHBondContact O-N 3.45Å; P478-E482 PolarHBondContact O-N 2.64Å
479	L	93.1	Very high	84.1	Confident	42 Å²	42	58.5 Å²	58.5	22%	0.22	33%	0.33	C	S	.	.	H	α-helix	trans	-65.5	-34	178.6	-179.8	61.3	0	0	0	112.7	T302 V305 Q306 P477 K481 E482 L483	T302-L479 HydrophobicContact CG2-CB 4.08Å; T302-L479 HydrophobicContact CG2-CD2 4.19Å; T302-L479 HydrophobicContact CG2-CG 4.48Å; V305-L479 HydrophobicContact CG1-CD2 4.01Å; V305-L479 HydrophobicContact CG1-CG 4.3Å; Q306-L479 HydrophobicContact CG-CD2 3.73Å; P477-L479 VanDerWaalsContact C-N 3.33Å; P477-L479 PolarHBondContact O-N 3.22Å; L479-K481 VanDerWaalsContact C-N 3.35Å; L479-E482 PolarHBondContact O-N 2.73Å; L479-L483 HydrophobicContact CD1-CD1 3.85Å; L479-L483 HydrophobicContact CD1-CG 4.14Å; L479-L483 HydrophobicContact CG-CD1 3.96Å; L479-L483 WeakPolarHBondContact O-CD1 3.48Å; L479-L483 VanDerWaalsContact O-CG 3.24Å; L479-L483 WeakPolarHBondContact O-CG 3.09Å; L479-L483 PolarHBondContact O-N 3.04Å
480	Y	94.9	Very high	81.6	Confident	5 Å²	5	60.1 Å²	60.1	2%	0.02	33%	0.334	C	S	.	.	H	α-helix	trans	-62	-45.9	173.7	-166.6	-82.5	0	0	0	110.7	A298 L301 H457 L461 F476 P477 P478 L483 F484	A298-Y480 HydrophobicContact CB-CD1 4.33Å; A298-Y480 HydrophobicContact CB-CD2 3.79Å; A298-Y480 HydrophobicContact CB-CE1 4.34Å; A298-Y480 HydrophobicContact CB-CE2 3.78Å; A298-Y480 HydrophobicContact CB-CG 4.08Å; A298-Y480 WeakPolarHBondContact O-CD2 3.27Å; L301-Y480 HydrophobicContact CB-CD2 4.39Å; L301-Y480 HydrophobicContact CB-CE2 4.05Å; L301-Y480 HydrophobicContact CD1-CE2 3.96Å; H457-Y480 PolarHBondContact CE1-OH 3.08Å; H457-Y480 PolarHBondContact NE2-OH 2.62Å; H457-Y480 VanDerWaalsContact NE2-OH 3.14Å; L461-Y480 HydrophobicContact CD1-CE1 4.12Å; L461-Y480 HydrophobicContact CD2-CE1 4.1Å; F476-Y480 AromaticContact CD2-CD1 3.68Å; F476-Y480 HydrophobicContact CD2-CD1 3.68Å; F476-Y480 AromaticContact CD2-CE1 3.76Å; F476-Y480 HydrophobicContact CD2-CE1 3.76Å; F476-Y480 HydrophobicContact CE2-CD1 4.24Å; F476-Y480 AromaticContact CE2-CE1 3.83Å; F476-Y480 HydrophobicContact CE2-CE1 3.83Å; F476-Y480 HydrophobicContact CG-CD1 4.47Å; P477-Y480 WeakPolarHBondContact O-CB 3.06Å; P477-Y480 PolarHBondContact O-N 2.96Å; P478-Y480 VanDerWaalsContact C-N 3.34Å; P478-Y480 PolarHBondContact O-N 2.71Å; Y480-L483 PolarHBondContact O-N 3.21Å; Y480-F484 HydrophobicContact CD1-CB 4.42Å; Y480-F484 AromaticContact CD1-CD2 3.9Å; Y480-F484 HydrophobicContact CD1-CD2 3.9Å; Y480-F484 AromaticContact CD2-CD2 3.83Å; Y480-F484 HydrophobicContact CD2-CD2 3.83Å; Y480-F484 HydrophobicContact CD2-CE2 4.02Å; Y480-F484 HydrophobicContact CE1-CB 4.16Å; Y480-F484 AromaticContact CE1-CD2 3.83Å; Y480-F484 HydrophobicContact CE1-CD2 3.83Å; Y480-F484 HydrophobicContact CE1-CG 4.41Å; Y480-F484 AromaticContact CE2-CD2 3.78Å; Y480-F484 HydrophobicContact CE2-CD2 3.78Å; Y480-F484 AromaticContact CE2-CE2 3.97Å; Y480-F484 HydrophobicContact CE2-CE2 3.97Å; Y480-F484 AromaticContact CG-CD2 3.89Å; Y480-F484 HydrophobicContact CG-CD2 3.89Å; Y480-F484 HydrophobicContact CG-CE2 4.46Å; Y480-F484 AromaticContact CZ-CD2 3.78Å; Y480-F484 WeakPolarHBondContact O-CB 3.17Å; Y480-F484 WeakPolarHBondContact O-CD2 3.27Å; Y480-F484 PolarHBondContact O-N 3.29Å
481	K	92.9	Very high	78.9	Confident	54 Å²	54	60 Å²	60	24%	0.235	33%	0.334	C	S	.	.	H	α-helix	trans	-66.7	-42.3	178.6	-63.5	-179.5	-61.6	-149.1	0	111.6	A472 H473 F476 P477 P478 L479 L483 F484 A485	A472-K481 WeakPolarHBondContact O-CD 3.45Å; H473-K481 WeakPolarHBondContact O-CD 3.46Å; H473-K481 PolarHBondContact O-NZ 2.67Å; F476-K481 HydrophobicContact CB-CD 4.09Å; F476-K481 HydrophobicContact CB-CG 3.95Å; F476-K481 WeakPolarHBondContact O-CE 3.37Å; F476-K481 PolarHBondContact O-NZ 2.91Å; P477-K481 PolarHBondContact O-N 3.4Å; P477-K481 VanDerWaalsContact O-N 3.17Å; P478-K481 PolarHBondContact O-N 3.45Å; L479-K481 VanDerWaalsContact C-N 3.35Å; K481-L483 VanDerWaalsContact C-N 3.26Å; K481-L483 PolarHBondContact O-N 3.21Å; K481-F484 PolarHBondContact O-N 2.96Å; K481-A485 WeakPolarHBondContact O-CA 3.34Å; K481-A485 WeakPolarHBondContact O-CB 3.22Å; K481-A485 PolarHBondContact O-N 3.4Å
482	E	91.3	Very high	76.3	Confident	114 Å²	114	65.9 Å²	65.9	53%	0.533	37%	0.373	S	S	.	.	H	α-helix	trans	-57.3	-38.7	177.1	-171.2	178.7	166.9	0	0	112.6	K331 P478 L479	K331-E482 WeakPolarHBondContact CE-O 3.41Å; K331-E482 PolarHBondContact NZ-O 3.41Å; P478-E482 PolarHBondContact O-N 2.64Å; L479-E482 PolarHBondContact O-N 2.73Å
483	L	90.3	Very high	74.1	Confident	17 Å²	17	69.2 Å²	69.2	9%	0.089	41%	0.407	C	S	.	.	H	α-helix	trans	-85.1	-40.2	-178.6	-61.1	167.2	0	0	0	113.2	V305 K331 L479 Y480 K481	V305-L483 HydrophobicContact CG1-CD1 3.38Å; K331-L483 HydrophobicContact CB-CD2 4.12Å; K331-L483 VanDerWaalsContact CE-O 3.24Å; K331-L483 WeakPolarHBondContact CE-O 3.5Å; K331-L483 WeakPolarHBondContact CG-O 3.32Å; L479-L483 HydrophobicContact CD1-CD1 3.85Å; L479-L483 HydrophobicContact CD1-CG 4.14Å; L479-L483 HydrophobicContact CG-CD1 3.96Å; L479-L483 WeakPolarHBondContact O-CD1 3.48Å; L479-L483 VanDerWaalsContact O-CG 3.24Å; L479-L483 WeakPolarHBondContact O-CG 3.09Å; L479-L483 PolarHBondContact O-N 3.04Å; Y480-L483 PolarHBondContact O-N 3.21Å; K481-L483 VanDerWaalsContact C-N 3.26Å; K481-L483 PolarHBondContact O-N 3.21Å
484	F	89.1	Confident	71.5	Confident	15 Å²	15	69.9 Å²	69.9	7%	0.066	43%	0.428	C	S	.	.	H	α-helix	trans	-114.5	-5.4	-168.4	-52.9	-60.2	0	0	0	115.6	M335 M458 L461 Y480 K481	M335-F484 HydrophobicContact CB-CE1 3.89Å; M335-F484 HydrophobicContact CB-CZ 4Å; M335-F484 HydrophobicContact CE-CE1 4.05Å; M335-F484 HydrophobicContact CE-CE2 4.07Å; M335-F484 HydrophobicContact CE-CZ 3.64Å; M458-F484 WeakPolarHBondContact CE-O 3.41Å; M458-F484 HydrophobicContact SD-CB 4.18Å; M458-F484 HydrophobicContact SD-CD1 4.07Å; L461-F484 HydrophobicContact CD2-CB 3.53Å; Y480-F484 HydrophobicContact CD1-CB 4.42Å; Y480-F484 AromaticContact CD1-CD2 3.9Å; Y480-F484 HydrophobicContact CD1-CD2 3.9Å; Y480-F484 AromaticContact CD2-CD2 3.83Å; Y480-F484 HydrophobicContact CD2-CD2 3.83Å; Y480-F484 HydrophobicContact CD2-CE2 4.02Å; Y480-F484 HydrophobicContact CE1-CB 4.16Å; Y480-F484 AromaticContact CE1-CD2 3.83Å; Y480-F484 HydrophobicContact CE1-CD2 3.83Å; Y480-F484 HydrophobicContact CE1-CG 4.41Å; Y480-F484 AromaticContact CE2-CD2 3.78Å; Y480-F484 HydrophobicContact CE2-CD2 3.78Å; Y480-F484 AromaticContact CE2-CE2 3.97Å; Y480-F484 HydrophobicContact CE2-CE2 3.97Å; Y480-F484 AromaticContact CG-CD2 3.89Å; Y480-F484 HydrophobicContact CG-CD2 3.89Å; Y480-F484 HydrophobicContact CG-CE2 4.46Å; Y480-F484 AromaticContact CZ-CD2 3.78Å; Y480-F484 WeakPolarHBondContact O-CB 3.17Å; Y480-F484 WeakPolarHBondContact O-CD2 3.27Å; Y480-F484 PolarHBondContact O-N 3.29Å; K481-F484 PolarHBondContact O-N 2.96Å
485	A	76.1	Confident	68.7	Low	20 Å²	20	70.4 Å²	70.4	17%	0.165	44%	0.438	C	S	.	.	S	Bend	trans	-73.4	143.9	166.7	0	0	0	0	0	110.6	K331 K481 E489	K331-A485 PolarHBondContact NZ-O 2.98Å; K481-A485 WeakPolarHBondContact O-CA 3.34Å; K481-A485 WeakPolarHBondContact O-CB 3.22Å; K481-A485 PolarHBondContact O-N 3.4Å; A485-E489 HydrophobicContact CB-CB 4.46Å
486	S	62.7	Low	65.8	Low	47 Å²	47	79.2 Å²	79.2	33%	0.329	48%	0.476	S	S	.	.			trans	-70.4	155	169.9	69.1	0	0	0	0	111	A488 E489	S486-A488 PolarHBondContact O-N 3.43Å; S486-E489 VanDerWaalsContact CB-OE2 3.28Å; S486-E489 WeakPolarHBondContact CB-OE2 3.25Å; S486-E489 PolarHBondContact N-OE2 3.3Å; S486-E489 PolarHBondContact O-N 3Å; S486-E489 WeakPolarHBondContact OG-CG 3.46Å; S486-E489 PolarHBondContact OG-N 3.05Å; S486-E489 PolarHBondContact OG-OE2 3.08Å
487	E	51.9	Low	64.3	Low	152 Å²	152	82.9 Å²	82.9	71%	0.71	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-21	177.7	-63.6	178.7	163.6	0	0	112.3
488	A	44.9	Very low	62.6	Low	82 Å²	82	86.1 Å²	86.1	68%	0.678	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-30	173.5	0	0	0	0	0	113.6	S486 L490	S486-A488 PolarHBondContact O-N 3.43Å; A488-L490 VanDerWaalsContact C-N 3.29Å
489	E	47.9	Very low	60.8	Low	65 Å²	65	85.1 Å²	85.1	30%	0.304	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-10.5	177.7	-70.8	158.2	127.3	0	0	112.6	A485 S486	A485-E489 HydrophobicContact CB-CB 4.46Å; S486-E489 VanDerWaalsContact CB-OE2 3.28Å; S486-E489 WeakPolarHBondContact CB-OE2 3.25Å; S486-E489 PolarHBondContact N-OE2 3.3Å; S486-E489 PolarHBondContact O-N 3Å; S486-E489 WeakPolarHBondContact OG-CG 3.46Å; S486-E489 PolarHBondContact OG-N 3.05Å; S486-E489 PolarHBondContact OG-OE2 3.08Å
490	L	42.1	Very low	58.9	Low	96 Å²	96	87.6 Å²	87.6	50%	0.503	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	1.9	-179.2	-68.1	172	0	0	0	114.1	A488 P492	A488-L490 VanDerWaalsContact C-N 3.29Å; L490-P492 VanDerWaalsContact O-CD 3.24Å; L490-P492 WeakPolarHBondContact O-CD 3.32Å
491	L	35	Very low	56.7	Low	135 Å²	135	92.8 Å²	92.8	71%	0.707	56%	0.557	S	S	*	*			trans	-104.4	98.1	177.6	-72.1	176.4	0	0	0	112	G493	L491-G493 PolarHBondContact O-N 2.92Å; L491-G493 VanDerWaalsContact O-N 3.1Å
492	P	39.3	Very low	54.3	Low	135 Å²	135	95.3 Å²	95.3	88%	0.877	58%	0.579	S	S	*	*			trans	-75.6	98.3	172.6	30.7	-33.8	0	0	0	111	L490	L490-P492 VanDerWaalsContact O-CD 3.24Å; L490-P492 WeakPolarHBondContact O-CD 3.32Å
493	G	45.4	Very low	51.6	Low	75 Å²	75	94 Å²	94	77%	0.773	58%	0.582	S	S	*	*			trans	122	82.4	164.3	0	0	0	0	0	115.5	L491	L491-G493 PolarHBondContact O-N 2.92Å; L491-G493 VanDerWaalsContact O-N 3.1Å
494	A	32.9	Very low	48.7	Very low	105 Å²	105	99.9 Å²	99.9	87%	0.868	62%	0.62	S	S	*	*			trans	-149.8	40.8	167	0	0	0	0	0	112.2
495	A	32.3	Very low	45.3	Very low	98 Å²	98	107 Å²	107	81%	0.81	67%	0.666	S	S	*	*			trans	-148.2	105.6	174.1	0	0	0	0	0	110.6
496	H	33	Very low	42.5	Very low	274 Å²	274	114.9 Å²	114.9	100%	1.269	71%	0.711	S	S	*	*			trans	-134.8	0	164.7	-99	-47.9	0	0	0	107.4

Retrieved 496 of 496 residues in 146.8 ms (Link to these results)

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