A0A3Q0KDS3_SCHMA Loading...

Transporter

AlphaFold DB , UniProt , Accession A0A3Q0KDS3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 761 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	26	Very low	25.3	Very low	243 Å²	243	154.5 Å²	154.5	100%	1.197	81%	0.805	S	S	*	*				0	122.9	0	-83.4	169.7	168.4	0	0	107.4
2	T	25	Very low	25	Very low	130 Å²	130	148.9 Å²	148.9	80%	0.798	79%	0.787	S	S	*	*			trans	-50.9	166.9	156.6	38.1	0	0	0	0	111
3	D	25.9	Very low	24.9	Very low	132 Å²	132	152.7 Å²	152.7	71%	0.706	79%	0.793	S	S	*	*			trans	94.5	69.8	179.7	-62.8	-11.9	0	0	0	116.5
4	R	27	Very low	24.8	Very low	252 Å²	252	150.6 Å²	150.6	95%	0.951	78%	0.783	S	S	*	*			trans	-100.1	90.8	132.8	-79.6	-172.2	-178.7	-177.2	1.3	107.1	A6	R4-A6 PolarHBondContact O-N 3.44Å
5	K	28	Very low	24.8	Very low	169 Å²	169	147.5 Å²	147.5	74%	0.735	78%	0.779	S	S	*	*			trans	-47	123.2	167.5	-70	176.6	176.5	178.2	0	107.9	Q7	K5-Q7 PolarHBondContact O-N 3.1Å
6	A	27.8	Very low	25.2	Very low	91 Å²	91	146.8 Å²	146.8	75%	0.752	78%	0.776	S	S	*	*			trans	-46.9	115.2	157	0	0	0	0	0	106	R4 D8	R4-A6 PolarHBondContact O-N 3.44Å; A6-D8 PolarHBondContact O-N 3.05Å
7	Q	26.3	Very low	25.3	Very low	164 Å²	164	147.2 Å²	147.2	77%	0.766	78%	0.779	S	S	*	*			trans	-60.6	116.6	172.9	-79	174.2	-42	0	0	106	K5 V9	K5-Q7 PolarHBondContact O-N 3.1Å; Q7-V9 PolarHBondContact O-N 3.22Å
8	D	23.3	Very low	25.3	Very low	144 Å²	144	147.6 Å²	147.6	77%	0.77	78%	0.775	S	S	*	*			trans	-46.6	109.3	167.6	-69.6	-52.9	0	0	0	107.5	A6 D10	A6-D8 PolarHBondContact O-N 3.05Å; D8-D10 PolarHBondContact O-N 2.93Å
9	V	24.3	Very low	25.3	Very low	132 Å²	132	144.1 Å²	144.1	80%	0.8	78%	0.778	S	S	*	*			trans	-73.2	86.2	159	179.8	0	0	0	0	103.9	Q7 V11	Q7-V9 PolarHBondContact O-N 3.22Å; V9-V11 VanDerWaalsContact C-N 3.3Å; V9-V11 PolarHBondContact O-N 3.4Å
10	D	21.6	Very low	25.4	Very low	132 Å²	132	142.9 Å²	142.9	71%	0.706	77%	0.768	S	S	*	*			trans	-55.6	103	164.5	-90	-31.4	0	0	0	106.4	D8 C12	D8-D10 PolarHBondContact O-N 2.93Å; D10-C12 PolarHBondContact O-N 2.9Å
11	V	23.4	Very low	25.5	Very low	111 Å²	111	140.3 Å²	140.3	67%	0.673	76%	0.762	S	S	*	*			trans	-71.3	75.5	162.6	-176.4	0	0	0	0	105.4	V9 F13	V9-V11 VanDerWaalsContact C-N 3.3Å; V9-V11 PolarHBondContact O-N 3.4Å; V11-F13 PolarHBondContact O-N 2.94Å
12	C	21.4	Very low	25.7	Very low	87 Å²	87	135.4 Å²	135.4	59%	0.588	74%	0.739	S	S	*	*			trans	-58.8	108.9	165.1	-85.5	0	0	0	0	106.8	D10 L14	D10-C12 PolarHBondContact O-N 2.9Å; C12-L14 HydrophobicContact CB-CG 4.13Å; C12-L14 PolarHBondContact O-N 3.48Å
13	F	23.7	Very low	25.9	Very low	198 Å²	198	131.7 Å²	131.7	87%	0.868	72%	0.718	S	S	*	*			trans	-64.2	82.9	157.3	-75.7	-89.5	0	0	0	106.7	V11 S15	V11-F13 PolarHBondContact O-N 2.94Å; F13-S15 PolarHBondContact O-N 3.46Å
14	L	23.8	Very low	26.2	Very low	124 Å²	124	134.1 Å²	134.1	65%	0.649	73%	0.725	S	S	*	*			trans	-67.9	117.5	174.2	-78.1	166.2	0	0	0	108.2	C12	C12-L14 HydrophobicContact CB-CG 4.13Å; C12-L14 PolarHBondContact O-N 3.48Å
15	S	24.1	Very low	26.4	Very low	103 Å²	103	128.5 Å²	128.5	72%	0.72	71%	0.714	S	S	*	*			trans	-54.8	145.3	168.2	-50.9	0	0	0	0	110.7	F13 D17	F13-S15 PolarHBondContact O-N 3.46Å; S15-D17 PolarHBondContact O-N 3.06Å
16	D	32.5	Very low	26.6	Very low	137 Å²	137	124.5 Å²	124.5	73%	0.733	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	9.5	-166.9	-81.2	-37	0	0	0	117.9
17	D	25.9	Very low	26.9	Very low	154 Å²	154	124 Å²	124	82%	0.824	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	15.1	-171.4	-81.6	-24.9	0	0	0	116	S15	S15-D17 PolarHBondContact O-N 3.06Å
18	H	25.6	Very low	27.3	Very low	153 Å²	153	121.6 Å²	121.6	71%	0.708	70%	0.704	S	S	*	*	S	Bend	trans	-109.8	91.1	169.1	-77.3	-5.9	0	0	0	112.1	M20	H18-M20 PolarHBondContact O-N 3.31Å
19	G	25.3	Very low	27.8	Very low	81 Å²	81	120.2 Å²	120.2	84%	0.835	70%	0.697	S	S	*	*			trans	37.6	50.7	148.6	0	0	0	0	0	117.6	S21	G19-S21 PolarHBondContact O-N 3.25Å
20	M	27.7	Very low	28.1	Very low	120 Å²	120	119.8 Å²	119.8	59%	0.591	68%	0.684	S	S	*	*			trans	-71.5	108.4	173.3	-83.4	-177.7	-92.3	0	0	110.3	H18	H18-M20 PolarHBondContact O-N 3.31Å
21	S	27.4	Very low	28.9	Very low	89 Å²	89	116.8 Å²	116.8	62%	0.622	67%	0.668	S	S	*	*			trans	-91.6	119	166.6	59.2	0	0	0	0	110	G19	G19-S21 PolarHBondContact O-N 3.25Å
22	I	30.7	Very low	29.4	Very low	141 Å²	141	113 Å²	113	72%	0.723	65%	0.646	S	S	*	*			trans	-84.2	109.8	173.9	-61.6	170.8	0	0	0	107.2	Q24	I22-Q24 PolarHBondContact O-N 3.45Å
23	S	29	Very low	30.5	Very low	52 Å²	52	112.2 Å²	112.2	36%	0.364	63%	0.632	S	S	.	*			trans	-78.1	115.5	167.5	61.2	0	0	0	0	109.6	D25	S23-D25 PolarHBondContact O-N 3.44Å
24	Q	30.6	Very low	31.1	Very low	183 Å²	183	105.9 Å²	105.9	86%	0.855	61%	0.607	S	S	*	*			trans	-80.6	67.9	172.5	-70.3	-172.9	-4.5	0	0	110.2	I22 G26	I22-Q24 PolarHBondContact O-N 3.45Å; Q24-G26 VanDerWaalsContact C-N 3.28Å; Q24-G26 PolarHBondContact O-N 3.1Å
25	D	32.9	Very low	32.2	Very low	133 Å²	133	102.9 Å²	102.9	71%	0.711	59%	0.594	S	S	*	*			trans	-73.8	92.4	163.2	-88.5	-9.2	0	0	0	107.5	S23 N27	S23-D25 PolarHBondContact O-N 3.44Å; D25-N27 PolarHBondContact O-N 3.15Å
26	G	31.7	Very low	32.9	Very low	85 Å²	85	103.4 Å²	103.4	88%	0.876	59%	0.594	S	S	*	*	S	Bend	trans	-6.7	20.3	177.1	0	0	0	0	0	123.7	Q24	Q24-G26 VanDerWaalsContact C-N 3.28Å; Q24-G26 PolarHBondContact O-N 3.1Å
27	N	32.9	Very low	33.4	Very low	80 Å²	80	100.9 Å²	100.9	43%	0.428	58%	0.578	S	S	.	*			trans	-118.1	101.9	176.7	-174.4	-10.6	0	0	0	107.9	D25 N29 K30	D25-N27 PolarHBondContact O-N 3.15Å; N27-N29 PolarHBondContact O-N 2.96Å; N27-N29 PolarHBondContact OD1-N 3.04Å; N27-K30 PolarHBondContact O-N 3.47Å
28	P	34.9	Very low	34	Very low	115 Å²	115	101.4 Å²	101.4	75%	0.747	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-3.6	-174	24.8	-33.3	0	0	0	114.6
29	N	34.4	Very low	34.7	Very low	115 Å²	115	97.9 Å²	97.9	62%	0.615	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	4	-177.5	-68.6	-21	0	0	0	114.7	N27	N27-N29 PolarHBondContact O-N 2.96Å; N27-N29 PolarHBondContact OD1-N 3.04Å
30	K	31.8	Very low	35.8	Very low	123 Å²	123	98 Å²	98	54%	0.535	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.5	111.5	177.5	-70.5	-177.1	179.1	-178.1	0	110.2	N27 T32 V50	N27-K30 PolarHBondContact O-N 3.47Å; K30-T32 PolarHBondContact O-N 3.07Å; K30-V50 HydrophobicContact CB-CG1 4.43Å; K30-V50 HydrophobicContact CD-CG1 4.39Å; K30-V50 HydrophobicContact CG-CG1 4.21Å
31	N	37.6	Very low	36.7	Very low	69 Å²	69	98.1 Å²	98.1	37%	0.369	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.8	107.2	161.5	-74.3	15.9	0	0	0	107.2	F33 R51	N31-F33 HydrophobicContact CB-CD2 4.35Å; N31-F33 HydrophobicContact CB-CE2 3.56Å; N31-F33 HydrophobicContact CB-CZ 3.92Å; N31-R51 PolarHBondContact O-N 2.88Å
32	T	33.7	Very low	37.3	Very low	32 Å²	32	97 Å²	97	20%	0.196	57%	0.574	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.1	116	175.2	-53.3	0	0	0	0	107.5	K30 I48	K30-T32 PolarHBondContact O-N 3.07Å; T32-I48 HydrophobicContact CG2-CG2 3.4Å
33	F	44	Very low	37.3	Very low	69 Å²	69	96 Å²	96	30%	0.303	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.2	125.8	173.2	-61.1	-88.5	0	0	0	108.8	N31 L49 R51	N31-F33 HydrophobicContact CB-CD2 4.35Å; N31-F33 HydrophobicContact CB-CE2 3.56Å; N31-F33 HydrophobicContact CB-CZ 3.92Å; F33-L49 HydrophobicContact CB-CB 4.36Å; F33-L49 PolarHBondContact N-O 3.36Å; F33-L49 PolarHBondContact O-N 2.94Å; F33-R51 HydrophobicContact CD2-CB 4.33Å; F33-R51 HydrophobicContact CE2-CB 3.91Å
34	L	36.8	Very low	37.7	Very low	66 Å²	66	98.5 Å²	98.5	35%	0.346	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.6	112.3	174.1	-65.4	169.8	0	0	0	108.3	E46 I48	L34-E46 HydrophobicContact CD2-CB 4.49Å; L34-I48 HydrophobicContact CD2-CG1 3.89Å
35	V	45.8	Very low	38	Very low	61 Å²	61	91.5 Å²	91.5	37%	0.37	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.8	117.6	170.8	-176.2	0	0	0	0	108	H37 V47 L49	V35-H37 PolarHBondContact O-N 3.08Å; V35-V47 PolarHBondContact N-O 2.93Å; V35-V47 PolarHBondContact O-N 3.44Å; V35-L49 HydrophobicContact CG2-CD1 3.77Å; V35-L49 HydrophobicContact CG2-CG 4.3Å
36	P	39.3	Very low	38.4	Very low	113 Å²	113	91.7 Å²	91.7	73%	0.734	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-65.8	125.8	173.1	23.8	-28.9	0	0	0	109.8
37	H	44.5	Very low	39	Very low	84 Å²	84	90.7 Å²	90.7	39%	0.389	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.1	175.4	-169	-91	0	0	0	109.1	V35 D39 G45 V47	V35-H37 PolarHBondContact O-N 3.08Å; H37-D39 IonicContact CE1-OD1 2.78Å; H37-D39 PolarHBondContact CE1-OD1 2.98Å; H37-D39 IonicContact ND1-OD1 3.41Å; H37-D39 PolarHBondContact ND1-OD1 3.37Å; H37-D39 VanDerWaalsContact ND1-OD1 3.11Å; H37-D39 IonicContact ND1-OD2 3.27Å; H37-G45 CarbonylContact C-O 3.34Å; H37-G45 WeakPolarHBondContact CA-O 3.27Å; H37-G45 WeakPolarHBondContact CB-O 3.33Å; H37-G45 PolarHBondContact N-O 3.49Å; H37-G45 PolarHBondContact O-N 3.48Å; H37-V47 HydrophobicContact CB-CG2 3.76Å
38	Q	36.9	Very low	39.3	Very low	165 Å²	165	91.6 Å²	91.6	77%	0.771	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	109.3	167	-81.7	-176.4	-14.5	0	0	108
39	D	40	Very low	39.5	Very low	80 Å²	80	90.9 Å²	90.9	43%	0.428	53%	0.53	S	S	.	.			trans	-69.8	147.6	166.5	-75.7	-45.6	0	0	0	109.4	H37 T41 G42 N43	H37-D39 IonicContact CE1-OD1 2.78Å; H37-D39 PolarHBondContact CE1-OD1 2.98Å; H37-D39 IonicContact ND1-OD1 3.41Å; H37-D39 PolarHBondContact ND1-OD1 3.37Å; H37-D39 VanDerWaalsContact ND1-OD1 3.11Å; H37-D39 IonicContact ND1-OD2 3.27Å; D39-T41 PolarHBondContact O-N 3.42Å; D39-G42 PolarHBondContact O-N 2.93Å; D39-N43 PolarHBondContact N-O 3.42Å
40	G	48.5	Very low	39.4	Very low	82 Å²	82	88.6 Å²	88.6	85%	0.845	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	3	-176.7	0	0	0	0	0	116.2
41	T	46.9	Very low	39.7	Very low	123 Å²	123	90.2 Å²	90.2	76%	0.755	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	8.5	172.6	62	0	0	0	0	113.6	D39 N43	D39-T41 PolarHBondContact O-N 3.42Å; T41-N43 PolarHBondContact O-N 2.83Å
42	G	39.5	Very low	39.4	Very low	67 Å²	67	94.4 Å²	94.4	69%	0.691	54%	0.541	S	S	*	.	S	Bend	trans	81.4	8.2	175.7	0	0	0	0	0	115.2	D39	D39-G42 PolarHBondContact O-N 2.93Å
43	N	31.6	Very low	39.7	Very low	118 Å²	118	95.3 Å²	95.3	63%	0.631	54%	0.544	S	S	*	.			trans	-88.9	123.7	170.6	-84.4	-8.3	0	0	0	110	D39 T41	D39-N43 PolarHBondContact N-O 3.42Å; T41-N43 PolarHBondContact O-N 2.83Å
44	S	38.4	Very low	39.9	Very low	106 Å²	106	97.2 Å²	97.2	74%	0.741	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.7	112.6	169.1	46.2	0	0	0	0	109.8
45	G	34.9	Very low	40.5	Very low	35 Å²	35	98.5 Å²	98.5	36%	0.361	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.5	156.6	167.4	0	0	0	0	0	110.5	H37	H37-G45 CarbonylContact C-O 3.34Å; H37-G45 WeakPolarHBondContact CA-O 3.27Å; H37-G45 WeakPolarHBondContact CB-O 3.33Å; H37-G45 PolarHBondContact N-O 3.49Å; H37-G45 PolarHBondContact O-N 3.48Å
46	E	42	Very low	41.1	Very low	138 Å²	138	104 Å²	104	65%	0.645	60%	0.596	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.5	122.9	174.8	-68.9	179.1	170.3	0	0	109.5	L34	L34-E46 HydrophobicContact CD2-CB 4.49Å
47	V	44.7	Very low	42.6	Very low	64 Å²	64	100.8 Å²	100.8	39%	0.388	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.8	114.5	171	175.9	0	0	0	0	107.9	V35 H37 L49	V35-V47 PolarHBondContact N-O 2.93Å; V35-V47 PolarHBondContact O-N 3.44Å; H37-V47 HydrophobicContact CB-CG2 3.76Å; V47-L49 HydrophobicContact CG1-CD2 4.19Å; V47-L49 HydrophobicContact CG1-CG 4.33Å; V47-L49 PolarHBondContact O-N 3.04Å
48	I	39.6	Very low	44.1	Very low	99 Å²	99	98.9 Å²	98.9	51%	0.508	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.9	102.9	174.3	-62.8	172.3	0	0	0	108.7	T32 L34 V50	T32-I48 HydrophobicContact CG2-CG2 3.4Å; L34-I48 HydrophobicContact CD2-CG1 3.89Å; I48-V50 HydrophobicContact CG2-CG2 3.81Å; I48-V50 PolarHBondContact O-N 3.32Å
49	L	38.5	Very low	46.6	Very low	99 Å²	99	92.2 Å²	92.2	52%	0.518	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	99.6	168.5	-67.7	177.8	0	0	0	108.7	F33 V35 V47 R51	F33-L49 HydrophobicContact CB-CB 4.36Å; F33-L49 PolarHBondContact N-O 3.36Å; F33-L49 PolarHBondContact O-N 2.94Å; V35-L49 HydrophobicContact CG2-CD1 3.77Å; V35-L49 HydrophobicContact CG2-CG 4.3Å; V47-L49 HydrophobicContact CG1-CD2 4.19Å; V47-L49 HydrophobicContact CG1-CG 4.33Å; V47-L49 PolarHBondContact O-N 3.04Å; L49-R51 PolarHBondContact O-N 3.5Å
50	V	32.7	Very low	49.1	Very low	67 Å²	67	90.2 Å²	90.2	41%	0.406	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	100.5	168.4	-175	0	0	0	0	107.9	K30 I48 Q52	K30-V50 HydrophobicContact CB-CG1 4.43Å; K30-V50 HydrophobicContact CD-CG1 4.39Å; K30-V50 HydrophobicContact CG-CG1 4.21Å; I48-V50 HydrophobicContact CG2-CG2 3.81Å; I48-V50 PolarHBondContact O-N 3.32Å; V50-Q52 PolarHBondContact O-N 3.05Å
51	R	37.8	Very low	50.8	Low	158 Å²	158	90.6 Å²	90.6	60%	0.596	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	101.3	166.3	-168	177.7	-172.5	176.8	4.5	106.8	N31 F33 L49 N53	N31-R51 PolarHBondContact O-N 2.88Å; F33-R51 HydrophobicContact CD2-CB 4.33Å; F33-R51 HydrophobicContact CE2-CB 3.91Å; L49-R51 PolarHBondContact O-N 3.5Å; R51-N53 PolarHBondContact O-N 3.47Å
52	Q	31	Very low	52.6	Low	157 Å²	157	85.8 Å²	85.8	73%	0.734	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.8	111.3	163.1	-71.5	-174.9	-6.2	0	0	106.1	V50	V50-Q52 PolarHBondContact O-N 3.05Å
53	N	41.3	Very low	54.6	Low	51 Å²	51	92.7 Å²	92.7	27%	0.273	50%	0.503	S	S	.	.			trans	-52.7	133.2	164.2	-81.4	-30.5	0	0	0	106.1	R51 T55	R51-N53 PolarHBondContact O-N 3.47Å; N53-T55 PolarHBondContact O-N 3.48Å
54	P	47.7	Very low	57.5	Low	109 Å²	109	91.5 Å²	91.5	71%	0.708	50%	0.496	S	S	*	.			trans	-50.8	119.1	178.1	19.7	-30.1	0	0	0	107.2	E56	P54-E56 PolarHBondContact O-N 3.08Å
55	T	49	Very low	60.3	Low	92 Å²	92	87 Å²	87	56%	0.564	46%	0.463	S	S	*	.			trans	-47.6	114.6	-177.2	37.4	0	0	0	0	108.3	N53 R57	N53-T55 PolarHBondContact O-N 3.48Å; T55-R57 PolarHBondContact O-N 3.18Å
56	E	58.9	Low	63.2	Low	178 Å²	178	85.6 Å²	85.6	83%	0.832	45%	0.447	S	S	*	.			trans	-51.9	139.3	179.1	-69.7	-178.4	171.3	0	0	109	P54 G58	P54-E56 PolarHBondContact O-N 3.08Å; E56-G58 PolarHBondContact O-N 3.24Å
57	R	69.3	Low	65.8	Low	44 Å²	44	80.2 Å²	80.2	17%	0.166	42%	0.422	C	S	.	.			trans	-62.9	-4.3	-172.8	-164.5	161	173.5	-120.1	-14.3	113.6	T55 S122 L123 G124 S323 Y324 D425	T55-R57 PolarHBondContact O-N 3.18Å; R57-S122 WeakPolarHBondContact CD-O 3.42Å; R57-S122 PolarHBondContact NH1-O 2.86Å; R57-L123 PolarHBondContact NH1-O 2.93Å; R57-G124 VanDerWaalsContact NH1-N 3.14Å; R57-G124 VanDerWaalsContact NH2-N 3.15Å; R57-S323 PolarHBondContact NH1-OG 2.82Å; R57-S323 PolarHBondContact NH2-OG 2.9Å; R57-Y324 HydrophobicContact CG-CE1 3.93Å; R57-Y324 WeakPolarHBondContact O-CE1 3.45Å; R57-D425 IonicContact CZ-OD2 3.72Å; R57-D425 IonicContact NE-OD1 2.65Å; R57-D425 PolarHBondContact NE-OD1 2.59Å; R57-D425 IonicContact NE-OD2 2.92Å; R57-D425 PolarHBondContact NE-OD2 2.88Å; R57-D425 IonicContact NH2-OD2 3.5Å; R57-D425 PolarHBondContact NH2-OD2 3.21Å
58	G	77.3	Confident	68.3	Low	44 Å²	44	78.7 Å²	78.7	45%	0.454	41%	0.412	S	S	.	.			trans	80.2	169.3	-170	0	0	0	0	0	110.7	E56 Y324	E56-G58 PolarHBondContact O-N 3.24Å; G58-Y324 WeakPolarHBondContact O-CD1 3.35Å
59	G	88.2	Confident	71.1	Confident	26 Å²	26	74 Å²	74	27%	0.268	39%	0.388	S	S	.	.			trans	-151.6	-179.8	176.3	0	0	0	0	0	111.2	Y324	G59-Y324 WeakPolarHBondContact CA-O 3.49Å
60	W	92.7	Very high	73.9	Confident	37 Å²	37	69.3 Å²	69.3	14%	0.14	36%	0.363	C	S	.	.			trans	-64.4	137.1	175.4	-54	107.8	0	0	0	111.5	E65 F66 T69 V248 V321 N325	W60-E65 HydrophobicContact CB-CB 4.31Å; W60-E65 HydrophobicContact CD2-CB 4.42Å; W60-E65 HydrophobicContact CE3-CB 3.83Å; W60-F66 HydrophobicContact CD2-CB 4.13Å; W60-F66 AromaticContact CE2-CD2 3.87Å; W60-F66 HydrophobicContact CG-CB 4.09Å; W60-F66 HydrophobicContact CZ2-CB 4.46Å; W60-F66 AromaticContact CZ2-CD2 3.91Å; W60-F66 HydrophobicContact CZ2-CD2 3.91Å; W60-F66 AromaticContact NE1-CD2 3.57Å; W60-F66 AromaticContact NE1-CG 3.91Å; W60-T69 HydrophobicContact CH2-CG2 3.94Å; W60-T69 HydrophobicContact CZ3-CG2 4.5Å; W60-V248 HydrophobicContact CE3-CB 4.06Å; W60-V248 HydrophobicContact CH2-CB 3.98Å; W60-V248 HydrophobicContact CH2-CG1 3.9Å; W60-V248 HydrophobicContact CZ2-CG1 4.35Å; W60-V248 HydrophobicContact CZ3-CB 3.71Å; W60-V248 HydrophobicContact CZ3-CG1 4.16Å; W60-V321 HydrophobicContact CZ2-CB 4.2Å; W60-V321 WeakPolarHBondContact CZ2-O 3.24Å; W60-V321 PolarHBondContact NE1-O 3.37Å; W60-N325 PolarHBondContact NE1-OD1 2.92Å
61	N	85.4	Confident	77	Confident	91 Å²	91	66.8 Å²	66.8	49%	0.487	35%	0.347	S	S	.	.	S	Bend	trans	-78	-36	176.3	-65	-47.3	0	0	0	111.2	E65	N61-E65 WeakPolarHBondContact CA-OE2 3.37Å; N61-E65 WeakPolarHBondContact CB-OE2 3.2Å; N61-E65 PolarHBondContact N-OE2 3.43Å
62	G	83.8	Confident	79.8	Confident	21 Å²	21	59.5 Å²	59.5	22%	0.216	32%	0.321	C	S	.	.	S	Bend	trans	-112.8	149.2	-177.7	0	0	0	0	0	112.9	L64 E65	G62-L64 VanDerWaalsContact C-N 3.25Å; G62-L64 PolarHBondContact O-N 3.04Å; G62-E65 PolarHBondContact N-OE2 3.41Å; G62-E65 PolarHBondContact O-N 3.27Å
63	K	81.5	Confident	82.9	Confident	212 Å²	212	52.5 Å²	52.5	92%	0.922	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-29.8	179.4	-67.5	-175.3	-179.5	179.4	0	113.5
64	L	93.5	Very high	85.6	Confident	94 Å²	94	50.1 Å²	50.1	49%	0.492	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-8.7	-178.7	-63.8	178	0	0	0	113.4	G62 F66 M67 M68 Y256	G62-L64 VanDerWaalsContact C-N 3.25Å; G62-L64 PolarHBondContact O-N 3.04Å; L64-F66 VanDerWaalsContact C-N 3.3Å; L64-F66 PolarHBondContact O-N 2.96Å; L64-M67 PolarHBondContact O-N 2.9Å; L64-M68 HydrophobicContact CB-CG 4.5Å; L64-M68 VanDerWaalsContact O-CG 3.3Å; L64-M68 WeakPolarHBondContact O-CG 3.27Å; L64-M68 PolarHBondContact O-N 3.12Å; L64-Y256 HydrophobicContact CB-CE1 3.86Å; L64-Y256 HydrophobicContact CD1-CE1 4.48Å
65	E	95.5	Very high	87.9	Confident	10 Å²	10	45.2 Å²	45.2	5%	0.047	24%	0.243	C	C	.	.	H	α-helix	trans	-61.3	-39.8	-176	-72.9	-177.7	168.4	0	0	112	W60 N61 G62 T69 Y256	W60-E65 HydrophobicContact CB-CB 4.31Å; W60-E65 HydrophobicContact CD2-CB 4.42Å; W60-E65 HydrophobicContact CE3-CB 3.83Å; N61-E65 WeakPolarHBondContact CA-OE2 3.37Å; N61-E65 WeakPolarHBondContact CB-OE2 3.2Å; N61-E65 PolarHBondContact N-OE2 3.43Å; G62-E65 PolarHBondContact N-OE2 3.41Å; G62-E65 PolarHBondContact O-N 3.27Å; E65-T69 VanDerWaalsContact O-CB 3.29Å; E65-T69 WeakPolarHBondContact O-CB 3.3Å; E65-T69 PolarHBondContact O-N 2.98Å; E65-T69 PolarHBondContact O-OG1 3.05Å; E65-Y256 HydrophobicContact CG-CE2 3.58Å
66	F	96.1	Very high	90.1	Very high	7 Å²	7	41 Å²	41	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-59.5	-54.4	172.7	173.4	-116.3	0	0	0	111.6	W60 L64 M68 T69 C70 F115 V321 N325 D334	W60-F66 HydrophobicContact CD2-CB 4.13Å; W60-F66 AromaticContact CE2-CD2 3.87Å; W60-F66 HydrophobicContact CG-CB 4.09Å; W60-F66 HydrophobicContact CZ2-CB 4.46Å; W60-F66 AromaticContact CZ2-CD2 3.91Å; W60-F66 HydrophobicContact CZ2-CD2 3.91Å; W60-F66 AromaticContact NE1-CD2 3.57Å; W60-F66 AromaticContact NE1-CG 3.91Å; L64-F66 VanDerWaalsContact C-N 3.3Å; L64-F66 PolarHBondContact O-N 2.96Å; F66-M68 PolarHBondContact O-N 3.26Å; F66-T69 PolarHBondContact O-N 3.28Å; F66-C70 WeakPolarHBondContact CE2-SG 3.41Å; F66-C70 WeakPolarHBondContact CZ-SG 3.49Å; F66-C70 PolarHBondContact O-N 3.3Å; F66-C70 PolarHBondContact O-SG 2.94Å; F66-F115 HydrophobicContact CE1-CE2 4.16Å; F66-F115 HydrophobicContact CE2-CZ 4.37Å; F66-F115 HydrophobicContact CZ-CD2 4.13Å; F66-F115 HydrophobicContact CZ-CE1 4.26Å; F66-F115 AromaticContact CZ-CE2 3.64Å; F66-F115 HydrophobicContact CZ-CE2 3.64Å; F66-F115 AromaticContact CZ-CZ 3.71Å; F66-F115 HydrophobicContact CZ-CZ 3.71Å; F66-V321 HydrophobicContact CE2-CB 4.26Å; F66-V321 HydrophobicContact CE2-CG2 4.07Å; F66-N325 WeakPolarHBondContact CD2-OD1 3.34Å; F66-N325 WeakPolarHBondContact CE1-ND2 3.47Å; F66-N325 VanDerWaalsContact CE2-ND2 3.32Å; F66-N325 WeakPolarHBondContact CE2-ND2 3.45Å; F66-N325 WeakPolarHBondContact CG-OD1 3.49Å; F66-N325 WeakPolarHBondContact CZ-ND2 3.34Å; F66-D334 HydrophobicContact CE1-CB 3.84Å; F66-D334 WeakPolarHBondContact CE1-OD2 3.43Å
67	M	96.8	Very high	91.8	Very high	25 Å²	25	32.6 Å²	32.6	12%	0.123	18%	0.179	C	C	.	.	H	α-helix	trans	-59.3	-46.8	-177.8	-177.9	66.4	70.2	0	0	111.4	L64 C70 I71 D334 I337 V338	L64-M67 PolarHBondContact O-N 2.9Å; M67-C70 PolarHBondContact O-N 2.99Å; M67-I71 HydrophobicContact CG-CD1 4.07Å; M67-I71 WeakPolarHBondContact O-CG1 3.21Å; M67-I71 PolarHBondContact O-N 2.68Å; M67-I71 HydrophobicContact SD-CD1 4.43Å; M67-D334 HydrophobicContact CE-CB 3.91Å; M67-D334 VanDerWaalsContact CE-OD1 3.31Å; M67-D334 WeakPolarHBondContact CE-OD1 3.44Å; M67-I337 HydrophobicContact CE-CB 4.4Å; M67-I337 HydrophobicContact CE-CD1 4.32Å; M67-I337 HydrophobicContact CE-CG2 4.21Å; M67-I337 HydrophobicContact SD-CG2 3.97Å; M67-V338 HydrophobicContact SD-CG2 3.57Å; M67-V338 VanDerWaalsContact SD-CG2 3.57Å
68	M	97.5	Very high	92.9	Very high	32 Å²	32	31.3 Å²	31.3	16%	0.158	18%	0.18	C	C	.	.	H	α-helix	trans	-61.6	-47	176.6	-64.5	-60.6	150.9	0	0	110.3	L64 F66 C70 I71 G72 Y256 S259 V260	L64-M68 HydrophobicContact CB-CG 4.5Å; L64-M68 VanDerWaalsContact O-CG 3.3Å; L64-M68 WeakPolarHBondContact O-CG 3.27Å; L64-M68 PolarHBondContact O-N 3.12Å; F66-M68 PolarHBondContact O-N 3.26Å; M68-C70 VanDerWaalsContact C-N 3.25Å; M68-C70 PolarHBondContact O-N 3.41Å; M68-I71 PolarHBondContact O-N 3.24Å; M68-I71 VanDerWaalsContact O-N 3.13Å; M68-G72 PolarHBondContact O-N 3.18Å; M68-Y256 HydrophobicContact CG-CD1 3.86Å; M68-Y256 HydrophobicContact CG-CE1 4.06Å; M68-Y256 HydrophobicContact CG-CG 4.44Å; M68-S259 PolarHBondContact O-OG 3.3Å; M68-V260 HydrophobicContact SD-CG2 4.12Å
69	T	97.8	Very high	93.7	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-36.4	178.1	-54.7	0	0	0	0	112.2	W60 E65 F66 Y73 L251 S255 V321 S414	W60-T69 HydrophobicContact CH2-CG2 3.94Å; W60-T69 HydrophobicContact CZ3-CG2 4.5Å; E65-T69 VanDerWaalsContact O-CB 3.29Å; E65-T69 WeakPolarHBondContact O-CB 3.3Å; E65-T69 PolarHBondContact O-N 2.98Å; E65-T69 PolarHBondContact O-OG1 3.05Å; F66-T69 PolarHBondContact O-N 3.28Å; T69-Y73 VanDerWaalsContact O-CB 3.23Å; T69-Y73 WeakPolarHBondContact O-CB 3.5Å; T69-Y73 PolarHBondContact O-N 3.01Å; T69-L251 HydrophobicContact CG2-CD1 4.27Å; T69-L251 HydrophobicContact CG2-CD2 3.85Å; T69-L251 HydrophobicContact CG2-CG 3.88Å; T69-S255 WeakPolarHBondContact CA-OG 3.49Å; T69-S255 WeakPolarHBondContact OG1-CB 3.43Å; T69-S255 PolarHBondContact OG1-OG 3.13Å; T69-V321 HydrophobicContact CG2-CG1 4.09Å; T69-S414 WeakPolarHBondContact CG2-OG 3.3Å
70	C	97.6	Very high	93.9	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-69.6	-40.1	175.9	-63.9	0	0	0	0	112.6	F66 M67 M68 Y73 A74 F115 V338	F66-C70 WeakPolarHBondContact CE2-SG 3.41Å; F66-C70 WeakPolarHBondContact CZ-SG 3.49Å; F66-C70 PolarHBondContact O-N 3.3Å; F66-C70 PolarHBondContact O-SG 2.94Å; M67-C70 PolarHBondContact O-N 2.99Å; M68-C70 VanDerWaalsContact C-N 3.25Å; M68-C70 PolarHBondContact O-N 3.41Å; C70-Y73 PolarHBondContact O-N 2.89Å; C70-A74 WeakPolarHBondContact O-CB 3.34Å; C70-A74 PolarHBondContact O-N 2.78Å; C70-F115 HydrophobicContact CB-CZ 4.2Å; C70-F115 VanDerWaalsContact SG-CZ 3.55Å; C70-V338 HydrophobicContact CB-CG1 4.1Å; C70-V338 HydrophobicContact CB-CG2 3.69Å
71	I	97.7	Very high	93.5	Very high	14 Å²	14	28.2 Å²	28.2	7%	0.072	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-48.7	174	-67.2	167.4	0	0	0	109.8	M67 M68 Y73 A74 V75 Y263 V338 I341	M67-I71 HydrophobicContact CG-CD1 4.07Å; M67-I71 WeakPolarHBondContact O-CG1 3.21Å; M67-I71 PolarHBondContact O-N 2.68Å; M67-I71 HydrophobicContact SD-CD1 4.43Å; M68-I71 PolarHBondContact O-N 3.24Å; M68-I71 VanDerWaalsContact O-N 3.13Å; I71-Y73 PolarHBondContact O-N 3.34Å; I71-A74 PolarHBondContact O-N 3.38Å; I71-V75 HydrophobicContact CG2-CG2 4.02Å; I71-V75 VanDerWaalsContact O-CB 3.26Å; I71-V75 WeakPolarHBondContact O-CB 3.39Å; I71-V75 WeakPolarHBondContact O-CG2 3.48Å; I71-V75 PolarHBondContact O-N 3.06Å; I71-Y263 HydrophobicContact CG2-CE2 4.33Å; I71-V338 HydrophobicContact CG1-CG2 4.28Å; I71-I341 HydrophobicContact CD1-CD1 3.72Å; I71-I341 HydrophobicContact CG1-CD1 4.19Å; I71-I341 HydrophobicContact CG1-CG2 4.31Å; I71-I341 HydrophobicContact CG2-CG2 4.09Å
72	G	97	Very high	93.8	Very high	4 Å²	4	26.9 Å²	26.9	4%	0.041	14%	0.135	C	C	.	.	H	α-helix	trans	-62.9	-30.2	176.2	0	0	0	0	0	113.2	M68 S259 G410 S411	M68-G72 PolarHBondContact O-N 3.18Å; G72-S259 PolarHBondContact N-OG 2.95Å; G72-G410 CarbonylContact O-C 3.59Å; G72-S411 WeakPolarHBondContact O-CA 3.41Å; G72-S411 PolarHBondContact O-N 3.07Å; G72-S411 PolarHBondContact O-OG 3.41Å
73	Y	97.3	Very high	94.3	Very high	10 Å²	10	25.9 Å²	25.9	4%	0.039	12%	0.124	C	C	.	.	H	α-helix	trans	-70.2	-49.7	174.9	-179.7	-126.5	0	0	0	112.5	T69 C70 I71 G312 L318 S411 S414 I415	T69-Y73 VanDerWaalsContact O-CB 3.23Å; T69-Y73 WeakPolarHBondContact O-CB 3.5Å; T69-Y73 PolarHBondContact O-N 3.01Å; C70-Y73 PolarHBondContact O-N 2.89Å; I71-Y73 PolarHBondContact O-N 3.34Å; Y73-G312 PolarHBondContact OH-O 3.26Å; Y73-G312 VanDerWaalsContact OH-O 3.07Å; Y73-L318 HydrophobicContact CD1-CD2 3.58Å; Y73-L318 HydrophobicContact CE1-CD2 3.49Å; Y73-L318 VanDerWaalsContact CE1-CD2 3.49Å; Y73-L318 HydrophobicContact CE1-CG 3.96Å; Y73-S411 PolarHBondContact O-OG 2.86Å; Y73-S414 VanDerWaalsContact CD2-CB 3.43Å; Y73-I415 HydrophobicContact CD2-CG1 4.35Å; Y73-I415 HydrophobicContact CE2-CG1 3.7Å
74	A	97.1	Very high	94.8	Very high	2 Å²	2	15.9 Å²	15.9	2%	0.017	8%	0.081	C	C	.	.	H	α-helix	trans	-78.1	-39.7	-176.2	0	0	0	0	0	112.9	C70 I71 G76 N79 S310 V338 N342	C70-A74 WeakPolarHBondContact O-CB 3.34Å; C70-A74 PolarHBondContact O-N 2.78Å; I71-A74 PolarHBondContact O-N 3.38Å; A74-G76 PolarHBondContact O-N 3.19Å; A74-N79 PolarHBondContact O-OD1 3.48Å; A74-S310 CarbonylContact C-O 3.13Å; A74-S310 WeakPolarHBondContact CA-O 3.34Å; A74-V338 HydrophobicContact CB-CG1 3.97Å; A74-N342 HydrophobicContact CB-CB 4.19Å; A74-N342 PolarHBondContact O-OD1 3.35Å
75	V	97	Very high	94.6	Very high	5 Å²	5	14.1 Å²	14.1	3%	0.03	7%	0.068	C	C	.	.	S	Bend	trans	-84.5	97.1	178.6	-173.2	0	0	0	0	108.9	I71 I341 T345 L407	I71-V75 HydrophobicContact CG2-CG2 4.02Å; I71-V75 VanDerWaalsContact O-CB 3.26Å; I71-V75 WeakPolarHBondContact O-CB 3.39Å; I71-V75 WeakPolarHBondContact O-CG2 3.48Å; I71-V75 PolarHBondContact O-N 3.06Å; V75-I341 HydrophobicContact CG2-CG2 4.36Å; V75-T345 HydrophobicContact CG1-CG2 3.52Å; V75-L407 HydrophobicContact CB-CD2 4.48Å; V75-L407 HydrophobicContact CG1-CD2 3.72Å; V75-L407 WeakPolarHBondContact O-CD2 3.39Å
76	G	95.2	Very high	94.5	Very high	5 Å²	5	14.2 Å²	14.2	5%	0.052	7%	0.069	C	C	.	.			trans	-119.9	-168.8	-178.4	0	0	0	0	0	113.4	A74 G78 N79 S411	A74-G76 PolarHBondContact O-N 3.19Å; G76-G78 PolarHBondContact O-N 3.19Å; G76-N79 PolarHBondContact N-OD1 3.35Å; G76-N79 PolarHBondContact O-N 2.86Å; G76-N79 PolarHBondContact O-OD1 3.17Å; G76-S411 WeakPolarHBondContact CA-OG 3.23Å
77	L	93.8	Very high	94.3	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-55.1	-39.7	176.9	-62.2	175.9	0	0	0	111.3	N79 V80 W81 Y153 V156 M404 L407	L77-N79 PolarHBondContact O-N 3.11Å; L77-N79 VanDerWaalsContact O-N 3.14Å; L77-V80 PolarHBondContact O-N 3.48Å; L77-W81 HydrophobicContact CB-CZ2 4.23Å; L77-W81 PolarHBondContact O-N 3.25Å; L77-W81 PolarHBondContact O-NE1 3.35Å; L77-Y153 HydrophobicContact CB-CE2 4.44Å; L77-Y153 HydrophobicContact CD1-CE2 4.02Å; L77-Y153 HydrophobicContact CG-CE2 4.37Å; L77-Y153 WeakPolarHBondContact CG-OH 3.35Å; L77-Y153 PolarHBondContact N-OH 3.44Å; L77-V156 HydrophobicContact CD1-CB 4.33Å; L77-V156 HydrophobicContact CD1-CG1 3.55Å; L77-M404 HydrophobicContact CD2-CB 4.02Å; L77-M404 HydrophobicContact CD2-CE 3.58Å; L77-M404 WeakPolarHBondContact CD2-O 3.49Å; L77-M404 HydrophobicContact CD2-SD 3.83Å; L77-L407 HydrophobicContact CD2-CB 4.43Å
78	G	91.6	Very high	94.1	Very high	18 Å²	18	14 Å²	14	19%	0.186	7%	0.068	C	C	.	.	H	α-helix	trans	-49.5	-37.6	179	0	0	0	0	0	114.6	G76 V80 R82 F83	G76-G78 PolarHBondContact O-N 3.19Å; G78-V80 VanDerWaalsContact C-N 3.31Å; G78-V80 PolarHBondContact O-N 3.04Å; G78-R82 WeakPolarHBondContact O-CB 2.84Å; G78-R82 PolarHBondContact O-N 3.3Å; G78-R82 VanDerWaalsContact O-N 3.13Å; G78-F83 PolarHBondContact O-N 3.48Å
79	N	94.9	Very high	93.7	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-67.4	-32.3	179	-58	79.9	0	0	0	112.5	A74 G76 L77 S310 N342 S346	A74-N79 PolarHBondContact O-OD1 3.48Å; G76-N79 PolarHBondContact N-OD1 3.35Å; G76-N79 PolarHBondContact O-N 2.86Å; G76-N79 PolarHBondContact O-OD1 3.17Å; L77-N79 PolarHBondContact O-N 3.11Å; L77-N79 VanDerWaalsContact O-N 3.14Å; N79-S310 PolarHBondContact ND2-OG 3.48Å; N79-S310 VanDerWaalsContact ND2-OG 3.16Å; N79-N342 PolarHBondContact ND2-O 2.92Å; N79-N342 PolarHBondContact ND2-OD1 3.47Å; N79-S346 PolarHBondContact ND2-OG 3.18Å
80	V	92.4	Very high	93.5	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-88.2	-34.5	-174	179.6	0	0	0	0	112.5	L77 G78 P84 A349 I353 F400 M403 M404 L407	L77-V80 PolarHBondContact O-N 3.48Å; G78-V80 VanDerWaalsContact C-N 3.31Å; G78-V80 PolarHBondContact O-N 3.04Å; V80-P84 WeakPolarHBondContact O-CG 3.25Å; V80-A349 HydrophobicContact CB-CB 4.47Å; V80-A349 HydrophobicContact CG2-CB 4.17Å; V80-I353 HydrophobicContact CG1-CD1 4.05Å; V80-I353 VanDerWaalsContact O-CG1 3.22Å; V80-I353 WeakPolarHBondContact O-CG1 3.46Å; V80-F400 HydrophobicContact CG1-CE2 4.35Å; V80-M403 HydrophobicContact CG1-CE 3.83Å; V80-M403 HydrophobicContact CG2-CE 4.35Å; V80-M404 HydrophobicContact CB-SD 4.01Å; V80-M404 HydrophobicContact CG1-SD 3.8Å; V80-M404 HydrophobicContact CG2-SD 4.46Å; V80-L407 HydrophobicContact CG2-CD1 3.47Å; V80-L407 VanDerWaalsContact CG2-CD1 3.47Å
81	W	84.9	Confident	93.2	Very high	41 Å²	41	16.9 Å²	16.9	16%	0.155	8%	0.082	C	C	.	.	H	α-helix	trans	-115.6	-40.4	-173.6	68.1	-14.7	0	0	0	115.5	L77 Y85 V156 A379 F380	L77-W81 HydrophobicContact CB-CZ2 4.23Å; L77-W81 PolarHBondContact O-N 3.25Å; L77-W81 PolarHBondContact O-NE1 3.35Å; W81-Y85 WeakPolarHBondContact O-CB 3.28Å; W81-Y85 PolarHBondContact O-N 2.98Å; W81-V156 HydrophobicContact CH2-CG1 3.38Å; W81-V156 HydrophobicContact CZ2-CG1 3.83Å; W81-V156 HydrophobicContact CZ3-CG1 4.4Å; W81-A379 HydrophobicContact CB-CB 3.97Å; W81-A379 HydrophobicContact CD2-CB 4.03Å; W81-A379 HydrophobicContact CE3-CB 3.22Å; W81-A379 HydrophobicContact CG-CB 4.4Å; W81-A379 HydrophobicContact CZ3-CB 3.93Å; W81-F380 HydrophobicContact CE3-CE2 4.47Å; W81-F380 AromaticContact CH2-CE2 3.86Å; W81-F380 HydrophobicContact CH2-CE2 3.86Å; W81-F380 AromaticContact CZ3-CD2 3.82Å; W81-F380 HydrophobicContact CZ3-CD2 3.82Å; W81-F380 AromaticContact CZ3-CE2 3.41Å; W81-F380 HydrophobicContact CZ3-CE2 3.41Å; W81-F380 VanDerWaalsContact CZ3-CE2 3.41Å; W81-F380 HydrophobicContact CZ3-CZ 4.31Å
82	R	90.4	Very high	93	Very high	63 Å²	63	16.4 Å²	16.4	24%	0.238	8%	0.08	C	C	.	.	H	α-helix	trans	-83	-45	-171.6	-175.8	178.7	175.4	162.4	-2.2	109.2	G78 Y85 L86 Q306 S474	G78-R82 WeakPolarHBondContact O-CB 2.84Å; G78-R82 PolarHBondContact O-N 3.3Å; G78-R82 VanDerWaalsContact O-N 3.13Å; R82-Y85 WeakPolarHBondContact O-CB 3.37Å; R82-Y85 PolarHBondContact O-N 3.22Å; R82-L86 HydrophobicContact CG-CD1 4.24Å; R82-L86 HydrophobicContact CG-CG 4.47Å; R82-L86 VanDerWaalsContact O-CG 3.31Å; R82-L86 WeakPolarHBondContact O-CG 3.26Å; R82-L86 PolarHBondContact O-N 3.11Å; R82-Q306 VanDerWaalsContact CD-OE1 3.27Å; R82-S474 PolarHBondContact NH1-OG 3.47Å; R82-S474 VanDerWaalsContact NH1-OG 3.12Å; R82-S474 PolarHBondContact NH2-OG 3.27Å
83	F	94.2	Very high	92.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-59.3	-50.5	176.6	171.9	-89.5	0	0	0	112.9	G78 Y85 L86 C87 F95 L96 Y99 Q306 S346 V347	G78-F83 PolarHBondContact O-N 3.48Å; F83-Y85 VanDerWaalsContact C-N 3.29Å; F83-Y85 PolarHBondContact O-N 3.23Å; F83-L86 PolarHBondContact O-N 3.38Å; F83-C87 VanDerWaalsContact CE1-SG 3.57Å; F83-C87 WeakPolarHBondContact CZ-SG 3.39Å; F83-C87 PolarHBondContact O-N 2.91Å; F83-F95 HydrophobicContact CD2-CE1 4.39Å; F83-F95 HydrophobicContact CE2-CD1 4.48Å; F83-F95 HydrophobicContact CE2-CE1 4.28Å; F83-L96 HydrophobicContact CE2-CD2 4.43Å; F83-L96 HydrophobicContact CZ-CD2 3.69Å; F83-Y99 HydrophobicContact CD2-CD2 4.12Å; F83-Y99 HydrophobicContact CD2-CE1 4.36Å; F83-Y99 AromaticContact CD2-CE2 3.7Å; F83-Y99 HydrophobicContact CD2-CE2 3.7Å; F83-Y99 AromaticContact CD2-CZ 3.84Å; F83-Y99 AromaticContact CE2-CD1 3.81Å; F83-Y99 HydrophobicContact CE2-CD1 3.81Å; F83-Y99 AromaticContact CE2-CD2 3.83Å; F83-Y99 HydrophobicContact CE2-CD2 3.83Å; F83-Y99 AromaticContact CE2-CE1 3.69Å; F83-Y99 HydrophobicContact CE2-CE1 3.69Å; F83-Y99 AromaticContact CE2-CE2 3.7Å; F83-Y99 HydrophobicContact CE2-CE2 3.7Å; F83-Y99 AromaticContact CE2-CG 3.88Å; F83-Y99 HydrophobicContact CE2-CG 3.88Å; F83-Y99 AromaticContact CE2-CZ 3.63Å; F83-Y99 HydrophobicContact CZ-CE1 4.41Å; F83-Q306 HydrophobicContact CD2-CG 4.33Å; F83-S346 WeakPolarHBondContact CD1-O 3.37Å; F83-S346 VanDerWaalsContact CE1-C 3.48Å; F83-S346 VanDerWaalsContact CE1-O 3.3Å; F83-S346 WeakPolarHBondContact CE1-O 3.44Å; F83-V347 HydrophobicContact CE1-CG2 4.32Å; F83-V347 HydrophobicContact CZ-CG2 3.94Å
84	P	92.6	Very high	92.9	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.006	8%	0.082	C	C	.	.	H	α-helix	trans	-62	-36.5	178.1	-27.8	39.7	0	0	0	113.1	V80 C87 F88 I353 F354	V80-P84 WeakPolarHBondContact O-CG 3.25Å; P84-C87 WeakPolarHBondContact O-CB 3.36Å; P84-C87 PolarHBondContact O-N 2.93Å; P84-F88 PolarHBondContact O-N 3.36Å; P84-I353 HydrophobicContact CB-CB 4.08Å; P84-I353 HydrophobicContact CB-CG1 4.14Å; P84-I353 HydrophobicContact CB-CG2 3.69Å; P84-I353 HydrophobicContact CG-CB 4.23Å; P84-I353 HydrophobicContact CG-CG1 3.84Å; P84-I353 HydrophobicContact CG-CG2 4.37Å; P84-F354 HydrophobicContact CB-CD2 4.41Å; P84-F354 HydrophobicContact CB-CE2 4.04Å
85	Y	90	Very high	92.9	Very high	57 Å²	57	16.2 Å²	16.2	22%	0.224	8%	0.081	C	C	.	.	H	α-helix	trans	-61.5	-42.6	171.6	171.9	-102.7	0	0	0	112.4	W81 R82 F83 F88 K89	W81-Y85 WeakPolarHBondContact O-CB 3.28Å; W81-Y85 PolarHBondContact O-N 2.98Å; R82-Y85 WeakPolarHBondContact O-CB 3.37Å; R82-Y85 PolarHBondContact O-N 3.22Å; F83-Y85 VanDerWaalsContact C-N 3.29Å; F83-Y85 PolarHBondContact O-N 3.23Å; Y85-F88 WeakPolarHBondContact O-CB 3.32Å; Y85-F88 PolarHBondContact O-N 3.19Å; Y85-K89 HydrophobicContact CE1-CD 4.17Å; Y85-K89 WeakPolarHBondContact O-CB 3.45Å; Y85-K89 PolarHBondContact O-N 3.38Å
86	L	92.1	Very high	92.8	Very high	12 Å²	12	18 Å²	18	6%	0.063	9%	0.09	C	C	.	.	H	α-helix	trans	-66.4	-38.2	176.6	-69.9	176.4	0	0	0	111.9	R82 F83 F88 K89 N90 F95 D302 Q306	R82-L86 HydrophobicContact CG-CD1 4.24Å; R82-L86 HydrophobicContact CG-CG 4.47Å; R82-L86 VanDerWaalsContact O-CG 3.31Å; R82-L86 WeakPolarHBondContact O-CG 3.26Å; R82-L86 PolarHBondContact O-N 3.11Å; F83-L86 PolarHBondContact O-N 3.38Å; L86-F88 VanDerWaalsContact C-N 3.35Å; L86-K89 PolarHBondContact O-N 3.08Å; L86-N90 WeakPolarHBondContact O-CB 3.43Å; L86-N90 PolarHBondContact O-N 3.05Å; L86-N90 PolarHBondContact O-ND2 3.42Å; L86-F95 HydrophobicContact CB-CE1 3.83Å; L86-F95 HydrophobicContact CB-CE2 4.44Å; L86-F95 HydrophobicContact CB-CZ 3.76Å; L86-F95 HydrophobicContact CD1-CZ 4.23Å; L86-D302 HydrophobicContact CD2-CB 4.18Å; L86-Q306 HydrophobicContact CD1-CB 3.67Å; L86-Q306 HydrophobicContact CD1-CG 3.94Å
87	C	93.6	Very high	92.9	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.9	-46.4	169.9	-72.7	0	0	0	0	111.2	F83 P84 N90 G92 Y286	F83-C87 VanDerWaalsContact CE1-SG 3.57Å; F83-C87 WeakPolarHBondContact CZ-SG 3.39Å; F83-C87 PolarHBondContact O-N 2.91Å; P84-C87 WeakPolarHBondContact O-CB 3.36Å; P84-C87 PolarHBondContact O-N 2.93Å; C87-N90 PolarHBondContact O-N 2.95Å; C87-G92 VanDerWaalsContact O-CA 3.23Å; C87-G92 WeakPolarHBondContact O-CA 3.44Å; C87-G92 PolarHBondContact O-N 2.88Å; C87-Y286 HydrophobicContact CB-CD2 4.12Å; C87-Y286 HydrophobicContact CB-CE2 3.82Å
88	F	90.7	Very high	93.1	Very high	29 Å²	29	21.2 Å²	21.2	13%	0.127	11%	0.106	C	C	.	.	H	α-helix	trans	-56.3	-52.7	175.7	173.1	-102.5	0	0	0	112	P84 Y85 L86 N90 Y285 F354 V369 A372	P84-F88 PolarHBondContact O-N 3.36Å; Y85-F88 WeakPolarHBondContact O-CB 3.32Å; Y85-F88 PolarHBondContact O-N 3.19Å; L86-F88 VanDerWaalsContact C-N 3.35Å; F88-N90 VanDerWaalsContact C-N 3.33Å; F88-N90 PolarHBondContact O-N 2.99Å; F88-Y285 HydrophobicContact CD2-CD1 4.43Å; F88-Y285 AromaticContact CD2-CE1 3.49Å; F88-Y285 HydrophobicContact CD2-CE1 3.49Å; F88-Y285 VanDerWaalsContact CD2-CE1 3.49Å; F88-Y285 AromaticContact CD2-CZ 3.97Å; F88-Y285 AromaticContact CE2-CE1 3.82Å; F88-Y285 HydrophobicContact CE2-CE1 3.82Å; F88-Y285 AromaticContact CE2-CZ 3.82Å; F88-Y285 WeakPolarHBondContact CE2-OH 3.37Å; F88-F354 HydrophobicContact CB-CZ 3.88Å; F88-F354 HydrophobicContact CD2-CE1 4.45Å; F88-V369 HydrophobicContact CE2-CB 4.48Å; F88-V369 HydrophobicContact CE2-CG2 4.37Å; F88-V369 HydrophobicContact CZ-CB 4.42Å; F88-V369 HydrophobicContact CZ-CG1 4.12Å; F88-A372 HydrophobicContact CD1-CB 4.21Å; F88-A372 HydrophobicContact CD2-CB 3.64Å; F88-A372 HydrophobicContact CE1-CB 4.12Å; F88-A372 HydrophobicContact CE2-CB 3.58Å; F88-A372 HydrophobicContact CG-CB 3.98Å; F88-A372 HydrophobicContact CZ-CB 3.82Å
89	K	89.4	Confident	93.4	Very high	82 Å²	82	20.5 Å²	20.5	36%	0.357	10%	0.098	S	C	.	.	H	α-helix	trans	-65.4	-32.3	-176.7	-176.4	-170.3	170.6	-155.4	0	113.1	Y85 L86 D302	Y85-K89 HydrophobicContact CE1-CD 4.17Å; Y85-K89 WeakPolarHBondContact O-CB 3.45Å; Y85-K89 PolarHBondContact O-N 3.38Å; L86-K89 PolarHBondContact O-N 3.08Å; K89-D302 IonicContact NZ-OD2 2.55Å; K89-D302 PolarHBondContact NZ-OD2 3.4Å
90	N	93.8	Very high	93.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	30.6	-166.8	-64.6	-36.2	0	0	0	114.4	L86 C87 F88 F95 R293 V299 D302	L86-N90 WeakPolarHBondContact O-CB 3.43Å; L86-N90 PolarHBondContact O-N 3.05Å; L86-N90 PolarHBondContact O-ND2 3.42Å; C87-N90 PolarHBondContact O-N 2.95Å; F88-N90 VanDerWaalsContact C-N 3.33Å; F88-N90 PolarHBondContact O-N 2.99Å; N90-F95 HydrophobicContact CB-CB 4.14Å; N90-F95 HydrophobicContact CB-CD2 3.4Å; N90-F95 HydrophobicContact CB-CE2 4.04Å; N90-F95 HydrophobicContact CB-CG 4.02Å; N90-F95 WeakPolarHBondContact ND2-CE2 3.19Å; N90-R293 PolarHBondContact OD1-NH2 3Å; N90-V299 HydrophobicContact CB-CB 4.49Å; N90-V299 HydrophobicContact CB-CG1 4.08Å; N90-V299 HydrophobicContact CB-CG2 3.98Å; N90-D302 WeakPolarHBondContact ND2-CB 3.26Å; N90-D302 PolarHBondContact ND2-OD2 2.9Å
91	G	92.6	Very high	93.8	Very high	11 Å²	11	28 Å²	28	11%	0.113	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.6	29.2	169	0	0	0	0	0	115.1	G93 A94 D290	G91-G93 PolarHBondContact O-N 2.83Å; G91-A94 WeakPolarHBondContact O-CB 3.41Å; G91-A94 PolarHBondContact O-N 2.74Å; G91-D290 PolarHBondContact O-N 2.74Å
92	G	92.6	Very high	94.4	Very high	3 Å²	3	27.1 Å²	27.1	3%	0.031	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	61.2	-122.4	175.4	0	0	0	0	0	111.8	C87 A94 F95 Y286	C87-G92 VanDerWaalsContact O-CA 3.23Å; C87-G92 WeakPolarHBondContact O-CA 3.44Å; C87-G92 PolarHBondContact O-N 2.88Å; G92-A94 PolarHBondContact O-N 3.46Å; G92-A94 VanDerWaalsContact O-N 3.15Å; G92-F95 WeakPolarHBondContact O-CB 3.44Å; G92-F95 PolarHBondContact O-N 3.14Å; G92-F95 VanDerWaalsContact O-N 3.17Å; G92-Y286 CarbonylContact C-O 3.05Å
93	G	94.3	Very high	94.7	Very high	12 Å²	12	25.2 Å²	25.2	12%	0.124	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-60.8	-23.9	-178.2	0	0	0	0	0	113.9	G91 F95 L96 Y286 T288	G91-G93 PolarHBondContact O-N 2.83Å; G93-F95 VanDerWaalsContact C-N 3.27Å; G93-F95 PolarHBondContact O-N 3.44Å; G93-L96 WeakPolarHBondContact O-CB 3.45Å; G93-L96 PolarHBondContact O-N 3.37Å; G93-Y286 PolarHBondContact N-O 3.36Å; G93-T288 PolarHBondContact N-O 2.87Å
94	A	97	Very high	94.9	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-63.2	-33.6	178.6	0	0	0	0	0	112	G91 G92 L96 I97 P98 P289 D290 L294	G91-A94 WeakPolarHBondContact O-CB 3.41Å; G91-A94 PolarHBondContact O-N 2.74Å; G92-A94 PolarHBondContact O-N 3.46Å; G92-A94 VanDerWaalsContact O-N 3.15Å; A94-L96 PolarHBondContact O-N 3.08Å; A94-I97 WeakPolarHBondContact O-CB 3.5Å; A94-I97 PolarHBondContact O-N 3.29Å; A94-I97 VanDerWaalsContact O-N 3.16Å; A94-P98 WeakPolarHBondContact O-CD 3.4Å; A94-P289 HydrophobicContact CB-CB 4Å; A94-D290 WeakPolarHBondContact CB-O 3.33Å; A94-L294 HydrophobicContact CB-CD2 4.36Å; A94-L294 HydrophobicContact CB-CG 4.39Å
95	F	97.1	Very high	95.2	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-62.9	-23.1	178.5	-175.4	-106.9	0	0	0	113.4	F83 L86 N90 G92 G93 I97 P98 Y99 V299 D302 A303	F83-F95 HydrophobicContact CD2-CE1 4.39Å; F83-F95 HydrophobicContact CE2-CD1 4.48Å; F83-F95 HydrophobicContact CE2-CE1 4.28Å; L86-F95 HydrophobicContact CB-CE1 3.83Å; L86-F95 HydrophobicContact CB-CE2 4.44Å; L86-F95 HydrophobicContact CB-CZ 3.76Å; L86-F95 HydrophobicContact CD1-CZ 4.23Å; N90-F95 HydrophobicContact CB-CB 4.14Å; N90-F95 HydrophobicContact CB-CD2 3.4Å; N90-F95 HydrophobicContact CB-CE2 4.04Å; N90-F95 HydrophobicContact CB-CG 4.02Å; N90-F95 WeakPolarHBondContact ND2-CE2 3.19Å; G92-F95 WeakPolarHBondContact O-CB 3.44Å; G92-F95 PolarHBondContact O-N 3.14Å; G92-F95 VanDerWaalsContact O-N 3.17Å; G93-F95 VanDerWaalsContact C-N 3.27Å; G93-F95 PolarHBondContact O-N 3.44Å; F95-I97 PolarHBondContact O-N 3.37Å; F95-P98 HydrophobicContact CD2-CG 4.37Å; F95-P98 WeakPolarHBondContact O-CD 3.35Å; F95-P98 VanDerWaalsContact O-CG 3.29Å; F95-P98 WeakPolarHBondContact O-CG 3.38Å; F95-Y99 HydrophobicContact CE1-CD2 4.25Å; F95-Y99 VanDerWaalsContact O-CB 3.24Å; F95-Y99 WeakPolarHBondContact O-CB 3.49Å; F95-Y99 PolarHBondContact O-N 2.86Å; F95-Y99 VanDerWaalsContact O-N 3.09Å; F95-V299 HydrophobicContact CD2-CG1 4.11Å; F95-D302 HydrophobicContact CE2-CB 4.19Å; F95-A303 HydrophobicContact CD2-CB 4.47Å; F95-A303 HydrophobicContact CE2-CB 3.69Å; F95-A303 HydrophobicContact CZ-CB 3.86Å
96	L	96.4	Very high	95.5	Very high	42 Å²	42	26.3 Å²	26.3	22%	0.22	15%	0.147	C	C	.	.	H	α-helix	trans	-64	-27.8	177.3	-60.2	-179.9	0	0	0	112.1	F83 G93 A94 T100 V347	F83-L96 HydrophobicContact CE2-CD2 4.43Å; F83-L96 HydrophobicContact CZ-CD2 3.69Å; G93-L96 WeakPolarHBondContact O-CB 3.45Å; G93-L96 PolarHBondContact O-N 3.37Å; A94-L96 PolarHBondContact O-N 3.08Å; L96-T100 WeakPolarHBondContact O-CB 3.48Å; L96-T100 PolarHBondContact O-N 3.08Å; L96-T100 PolarHBondContact O-OG1 3.45Å; L96-V347 HydrophobicContact CD2-CG2 4.04Å
97	I	97.4	Very high	95.8	Very high	73 Å²	73	25.7 Å²	25.7	37%	0.374	14%	0.144	S	C	.	.	H	α-helix	trans	-64.2	-61.3	177.8	-62.7	167.6	0	0	0	111.5	A94 F95 Y99 T100 L101 F291 L294	A94-I97 WeakPolarHBondContact O-CB 3.5Å; A94-I97 PolarHBondContact O-N 3.29Å; A94-I97 VanDerWaalsContact O-N 3.16Å; F95-I97 PolarHBondContact O-N 3.37Å; I97-Y99 VanDerWaalsContact C-N 3.26Å; I97-Y99 PolarHBondContact O-N 2.94Å; I97-T100 PolarHBondContact O-N 3.4Å; I97-L101 HydrophobicContact CG2-CD1 4.12Å; I97-L101 WeakPolarHBondContact O-CG 3.41Å; I97-L101 PolarHBondContact O-N 2.98Å; I97-F291 HydrophobicContact CD1-CD1 4.43Å; I97-F291 HydrophobicContact CD1-CE1 3.85Å; I97-L294 HydrophobicContact CD1-CD1 4.1Å
98	P	97.4	Very high	96	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.5	-34.3	176.9	25.5	-34.3	0	0	0	111.5	A94 F95 L101 M102 L294 V299 W300 A303	A94-P98 WeakPolarHBondContact O-CD 3.4Å; F95-P98 HydrophobicContact CD2-CG 4.37Å; F95-P98 WeakPolarHBondContact O-CD 3.35Å; F95-P98 VanDerWaalsContact O-CG 3.29Å; F95-P98 WeakPolarHBondContact O-CG 3.38Å; P98-L101 PolarHBondContact O-N 3.38Å; P98-M102 WeakPolarHBondContact O-CB 3.48Å; P98-M102 WeakPolarHBondContact O-CG 3.49Å; P98-M102 PolarHBondContact O-N 3.46Å; P98-L294 HydrophobicContact CG-CD2 4.17Å; P98-V299 HydrophobicContact CG-CG1 3.99Å; P98-W300 HydrophobicContact CB-CD2 3.81Å; P98-W300 HydrophobicContact CB-CE3 3.52Å; P98-W300 HydrophobicContact CB-CG 4.39Å; P98-W300 HydrophobicContact CB-CH2 4.33Å; P98-W300 HydrophobicContact CB-CZ3 3.81Å; P98-A303 HydrophobicContact CB-CB 3.8Å; P98-A303 HydrophobicContact CG-CB 4.18Å
99	Y	97.6	Very high	96.3	Very high	3 Å²	3	25.5 Å²	25.5	1%	0.012	14%	0.144	C	C	.	.	H	α-helix	trans	-60.3	-49.2	176	-176	-103	0	0	0	112.7	F83 F95 I97 M102 L103 Q306 I307 C343 S346	F83-Y99 HydrophobicContact CD2-CD2 4.12Å; F83-Y99 HydrophobicContact CD2-CE1 4.36Å; F83-Y99 AromaticContact CD2-CE2 3.7Å; F83-Y99 HydrophobicContact CD2-CE2 3.7Å; F83-Y99 AromaticContact CD2-CZ 3.84Å; F83-Y99 AromaticContact CE2-CD1 3.81Å; F83-Y99 HydrophobicContact CE2-CD1 3.81Å; F83-Y99 AromaticContact CE2-CD2 3.83Å; F83-Y99 HydrophobicContact CE2-CD2 3.83Å; F83-Y99 AromaticContact CE2-CE1 3.69Å; F83-Y99 HydrophobicContact CE2-CE1 3.69Å; F83-Y99 AromaticContact CE2-CE2 3.7Å; F83-Y99 HydrophobicContact CE2-CE2 3.7Å; F83-Y99 AromaticContact CE2-CG 3.88Å; F83-Y99 HydrophobicContact CE2-CG 3.88Å; F83-Y99 AromaticContact CE2-CZ 3.63Å; F83-Y99 HydrophobicContact CZ-CE1 4.41Å; F95-Y99 HydrophobicContact CE1-CD2 4.25Å; F95-Y99 VanDerWaalsContact O-CB 3.24Å; F95-Y99 WeakPolarHBondContact O-CB 3.49Å; F95-Y99 PolarHBondContact O-N 2.86Å; F95-Y99 VanDerWaalsContact O-N 3.09Å; I97-Y99 VanDerWaalsContact C-N 3.26Å; I97-Y99 PolarHBondContact O-N 2.94Å; Y99-M102 PolarHBondContact O-N 2.85Å; Y99-L103 PolarHBondContact O-N 2.91Å; Y99-Q306 HydrophobicContact CD2-CG 4.43Å; Y99-Q306 HydrophobicContact CE2-CB 4.46Å; Y99-Q306 HydrophobicContact CE2-CG 3.86Å; Y99-I307 HydrophobicContact CD1-CD1 4.34Å; Y99-I307 HydrophobicContact CD2-CD1 3.7Å; Y99-I307 HydrophobicContact CD2-CG1 3.77Å; Y99-I307 HydrophobicContact CE1-CD1 3.98Å; Y99-I307 HydrophobicContact CE2-CD1 3.28Å; Y99-I307 HydrophobicContact CE2-CG1 3.71Å; Y99-I307 HydrophobicContact CG-CD1 4.22Å; Y99-I307 HydrophobicContact CG-CG1 4.47Å; Y99-I307 VanDerWaalsContact CZ-CD1 3.43Å; Y99-C343 HydrophobicContact CE1-CB 3.79Å; Y99-C343 PolarHBondContact OH-SG 3.47Å; Y99-C343 VanDerWaalsContact OH-SG 3.38Å; Y99-S346 PolarHBondContact OH-OG 2.98Å
100	T	97.8	Very high	96.7	Very high	84 Å²	84	21.6 Å²	21.6	52%	0.515	13%	0.127	S	C	.	.	H	α-helix	trans	-67	-37.2	177.2	-61.9	0	0	0	0	112.3	L96 I97 L103 A104	L96-T100 WeakPolarHBondContact O-CB 3.48Å; L96-T100 PolarHBondContact O-N 3.08Å; L96-T100 PolarHBondContact O-OG1 3.45Å; I97-T100 PolarHBondContact O-N 3.4Å; T100-L103 WeakPolarHBondContact O-CB 3.29Å; T100-L103 PolarHBondContact O-N 3.32Å; T100-A104 PolarHBondContact O-N 2.96Å; T100-A104 VanDerWaalsContact O-N 3.07Å
101	L	98	Very high	96.9	Very high	76 Å²	76	21.6 Å²	21.6	40%	0.398	13%	0.127	S	C	.	.	H	α-helix	trans	-66.9	-41.1	175.7	-71.6	174	0	0	0	111.9	I97 P98 L103 A104 L105 W300	I97-L101 HydrophobicContact CG2-CD1 4.12Å; I97-L101 WeakPolarHBondContact O-CG 3.41Å; I97-L101 PolarHBondContact O-N 2.98Å; P98-L101 PolarHBondContact O-N 3.38Å; L101-L103 VanDerWaalsContact C-N 3.34Å; L101-A104 PolarHBondContact O-N 3.24Å; L101-L105 WeakPolarHBondContact O-CB 3.02Å; L101-L105 WeakPolarHBondContact O-CG 3.38Å; L101-L105 PolarHBondContact O-N 3.29Å; L101-W300 HydrophobicContact CD1-CH2 3.87Å; L101-W300 HydrophobicContact CD1-CZ3 3.76Å
102	M	97.5	Very high	97.2	Very high	21 Å²	21	21.1 Å²	21.1	10%	0.103	12%	0.122	C	C	.	.	H	α-helix	trans	-68.1	-34.1	176.2	-69	-61.2	164	0	0	112	P98 Y99 A104 L106 G107 W300 A303 A304 I307 I525	P98-M102 WeakPolarHBondContact O-CB 3.48Å; P98-M102 WeakPolarHBondContact O-CG 3.49Å; P98-M102 PolarHBondContact O-N 3.46Å; Y99-M102 PolarHBondContact O-N 2.85Å; M102-A104 VanDerWaalsContact C-N 3.34Å; M102-A104 PolarHBondContact O-N 3.41Å; M102-L106 WeakPolarHBondContact O-CA 3.45Å; M102-L106 VanDerWaalsContact O-CB 3.31Å; M102-L106 WeakPolarHBondContact O-CB 3.48Å; M102-L106 PolarHBondContact O-N 3.45Å; M102-G107 PolarHBondContact O-N 3Å; M102-W300 HydrophobicContact CE-CE3 3.97Å; M102-A303 HydrophobicContact CG-CB 4.35Å; M102-A304 HydrophobicContact CB-CB 4.36Å; M102-A304 HydrophobicContact CE-CB 4.34Å; M102-A304 HydrophobicContact CG-CB 3.76Å; M102-A304 HydrophobicContact SD-CB 3.61Å; M102-I307 HydrophobicContact CB-CB 4.41Å; M102-I307 HydrophobicContact CB-CG1 4.05Å; M102-I525 HydrophobicContact SD-CD1 4.3Å; M102-I525 HydrophobicContact SD-CG2 4.02Å
103	L	98	Very high	97.4	Very high	24 Å²	24	21 Å²	21	13%	0.126	12%	0.12	C	C	.	.	I	π-helix	trans	-56.7	-49.7	167.8	177.3	63.7	0	0	0	111.1	Y99 T100 L101 G107 L108 I307 L311 A339 C343	Y99-L103 PolarHBondContact O-N 2.91Å; T100-L103 WeakPolarHBondContact O-CB 3.29Å; T100-L103 PolarHBondContact O-N 3.32Å; L101-L103 VanDerWaalsContact C-N 3.34Å; L103-G107 PolarHBondContact O-N 3.33Å; L103-L108 VanDerWaalsContact O-CB 3.25Å; L103-L108 WeakPolarHBondContact O-CB 3.25Å; L103-L108 PolarHBondContact O-N 3.46Å; L103-I307 HydrophobicContact CB-CD1 3.85Å; L103-I307 HydrophobicContact CD1-CD1 4.32Å; L103-L311 HydrophobicContact CD1-CD1 4.12Å; L103-A339 HydrophobicContact CD1-CB 4.06Å; L103-C343 HydrophobicContact CD2-CB 4.05Å; L103-C343 VanDerWaalsContact CD2-SG 3.58Å
104	A	98.2	Very high	97.6	Very high	36 Å²	36	20.4 Å²	20.4	30%	0.298	12%	0.115	S	C	.	.	I	π-helix	trans	-72	-32.7	-175.6	0	0	0	0	0	113.8	T100 L101 M102 Y513	T100-A104 PolarHBondContact O-N 2.96Å; T100-A104 VanDerWaalsContact O-N 3.07Å; L101-A104 PolarHBondContact O-N 3.24Å; M102-A104 VanDerWaalsContact C-N 3.34Å; M102-A104 PolarHBondContact O-N 3.41Å; A104-Y513 WeakPolarHBondContact O-CE2 3.49Å; A104-Y513 PolarHBondContact O-OH 3.39Å
105	L	97.9	Very high	97.6	Very high	44 Å²	44	20.4 Å²	20.4	23%	0.23	12%	0.115	C	C	.	.	I	π-helix	trans	-102.9	-23	-172	-61.3	177.9	0	0	0	114.2	L101 F521 T522 I525	L101-L105 WeakPolarHBondContact O-CB 3.02Å; L101-L105 WeakPolarHBondContact O-CG 3.38Å; L101-L105 PolarHBondContact O-N 3.29Å; L105-F521 HydrophobicContact CB-CB 4.34Å; L105-F521 HydrophobicContact CD1-CD1 4.49Å; L105-F521 HydrophobicContact CD2-CB 4.44Å; L105-F521 HydrophobicContact CD2-CD1 4.49Å; L105-F521 HydrophobicContact CD2-CD2 3.96Å; L105-F521 HydrophobicContact CD2-CE2 4.31Å; L105-F521 HydrophobicContact CD2-CG 4.07Å; L105-T522 PolarHBondContact O-OG1 2.9Å; L105-I525 HydrophobicContact CB-CD1 3.73Å; L105-I525 HydrophobicContact CD1-CD1 4.5Å
106	L	96.8	Very high	97.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.115	C	C	.	.	I	π-helix	trans	-121.2	-60.5	-175.8	176.6	69.4	0	0	0	111.2	M102 L110 A304 T522 I525 C526 L529	M102-L106 WeakPolarHBondContact O-CA 3.45Å; M102-L106 VanDerWaalsContact O-CB 3.31Å; M102-L106 WeakPolarHBondContact O-CB 3.48Å; M102-L106 PolarHBondContact O-N 3.45Å; L106-L110 HydrophobicContact CD1-CD1 3.67Å; L106-L110 HydrophobicContact CG-CD1 4.18Å; L106-L110 WeakPolarHBondContact O-CB 3.47Å; L106-L110 WeakPolarHBondContact O-CG 3.41Å; L106-L110 PolarHBondContact O-N 2.97Å; L106-L110 VanDerWaalsContact O-N 3.15Å; L106-A304 HydrophobicContact CD2-CB 4Å; L106-T522 HydrophobicContact CD1-CG2 4.2Å; L106-I525 HydrophobicContact CB-CG2 4.42Å; L106-I525 HydrophobicContact CD1-CG2 4.23Å; L106-I525 HydrophobicContact CD2-CG2 4.01Å; L106-I525 HydrophobicContact CG-CG2 4.46Å; L106-C526 VanDerWaalsContact CD1-SG 3.56Å; L106-L529 HydrophobicContact CD2-CD1 4.18Å
107	G	97.1	Very high	97.7	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.104	C	C	.	.	I	π-helix	trans	-62.2	-62.5	-171	0	0	0	0	0	113.4	M102 L103 L110 F111	M102-G107 PolarHBondContact O-N 3Å; L103-G107 PolarHBondContact O-N 3.33Å; G107-L110 PolarHBondContact O-N 3.25Å; G107-F111 WeakPolarHBondContact O-CB 3.38Å; G107-F111 PolarHBondContact O-N 3.22Å
108	L	98	Very high	97.7	Very high	24 Å²	24	14.9 Å²	14.9	13%	0.126	9%	0.086	C	C	.	.	H	α-helix	trans	-61.2	-42.9	-176.3	178.1	62.5	0	0	0	112.9	L103 F111 F112 V336 A339 W514	L103-L108 VanDerWaalsContact O-CB 3.25Å; L103-L108 WeakPolarHBondContact O-CB 3.25Å; L103-L108 PolarHBondContact O-N 3.46Å; L108-F111 PolarHBondContact O-N 3.33Å; L108-F112 PolarHBondContact O-N 3.34Å; L108-V336 HydrophobicContact CD1-CB 4.44Å; L108-V336 HydrophobicContact CD1-CG2 3.96Å; L108-V336 HydrophobicContact CD2-CG2 4.28Å; L108-A339 HydrophobicContact CD1-CB 3.94Å; L108-W514 HydrophobicContact CD1-CH2 3.93Å; L108-W514 HydrophobicContact CD1-CZ3 4.46Å; L108-W514 HydrophobicContact CD2-CH2 3.96Å; L108-W514 HydrophobicContact CD2-CZ3 4.48Å; L108-W514 HydrophobicContact CG-CH2 3.6Å; L108-W514 HydrophobicContact CG-CZ3 3.85Å
109	P	98.1	Very high	97.6	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-57.3	-48.5	172	-27.9	37.1	0	0	0	113.8	L113 C517 W518 T522	P109-L113 VanDerWaalsContact O-CB 3.27Å; P109-L113 WeakPolarHBondContact O-CB 3.26Å; P109-L113 PolarHBondContact O-N 3.22Å; P109-C517 HydrophobicContact CB-CB 3.74Å; P109-C517 HydrophobicContact CG-CB 3.45Å; P109-C517 VanDerWaalsContact CG-CB 3.45Å; P109-W518 PolarHBondContact O-NE1 3.15Å; P109-T522 WeakPolarHBondContact CB-OG1 3.36Å
110	L	97.4	Very high	97.6	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62.9	-43.9	177.8	-74.6	173.6	0	0	0	111.5	L106 G107 F112 L113 E114 F308 C313 A482 T486 T522	L106-L110 HydrophobicContact CD1-CD1 3.67Å; L106-L110 HydrophobicContact CG-CD1 4.18Å; L106-L110 WeakPolarHBondContact O-CB 3.47Å; L106-L110 WeakPolarHBondContact O-CG 3.41Å; L106-L110 PolarHBondContact O-N 2.97Å; L106-L110 VanDerWaalsContact O-N 3.15Å; G107-L110 PolarHBondContact O-N 3.25Å; L110-F112 PolarHBondContact O-N 3.43Å; L110-L113 PolarHBondContact O-N 3.22Å; L110-E114 PolarHBondContact O-N 2.92Å; L110-F308 HydrophobicContact CD1-CD2 4.04Å; L110-F308 HydrophobicContact CD1-CE2 3.97Å; L110-C313 HydrophobicContact CB-CB 4.25Å; L110-C313 HydrophobicContact CD1-CB 4.41Å; L110-A482 HydrophobicContact CD1-CB 4.36Å; L110-T486 VanDerWaalsContact CD2-OG1 3.31Å; L110-T486 WeakPolarHBondContact CD2-OG1 3.45Å; L110-T522 HydrophobicContact CD1-CG2 4.21Å; L110-T522 HydrophobicContact CD2-CG2 3.57Å; L110-T522 HydrophobicContact CG-CG2 3.62Å
111	F	97.5	Very high	97.3	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-58.6	-48.1	-179.3	-154.3	-85	0	0	0	112.2	G107 L108 F115 L311 L318 A335 V338	G107-F111 WeakPolarHBondContact O-CB 3.38Å; G107-F111 PolarHBondContact O-N 3.22Å; L108-F111 PolarHBondContact O-N 3.33Å; F111-F115 HydrophobicContact CD1-CD1 4.41Å; F111-F115 HydrophobicContact CD1-CD2 4.25Å; F111-F115 HydrophobicContact CD1-CE1 4.21Å; F111-F115 HydrophobicContact CD1-CE2 4.01Å; F111-F115 HydrophobicContact CD1-CG 4.44Å; F111-F115 AromaticContact CD1-CZ 4Å; F111-F115 HydrophobicContact CD1-CZ 4Å; F111-F115 HydrophobicContact CE1-CD1 4.33Å; F111-F115 HydrophobicContact CE1-CD2 4.17Å; F111-F115 AromaticContact CE1-CE1 3.69Å; F111-F115 HydrophobicContact CE1-CE1 3.69Å; F111-F115 AromaticContact CE1-CE2 3.48Å; F111-F115 HydrophobicContact CE1-CE2 3.48Å; F111-F115 VanDerWaalsContact CE1-CE2 3.48Å; F111-F115 AromaticContact CE1-CZ 3.21Å; F111-F115 HydrophobicContact CE1-CZ 3.21Å; F111-F115 HydrophobicContact CZ-CE1 4.19Å; F111-F115 HydrophobicContact CZ-CE2 4.5Å; F111-F115 AromaticContact CZ-CZ 3.85Å; F111-F115 HydrophobicContact CZ-CZ 3.85Å; F111-F115 WeakPolarHBondContact O-CB 3.43Å; F111-F115 PolarHBondContact O-N 3.14Å; F111-F115 VanDerWaalsContact O-N 3.09Å; F111-L311 HydrophobicContact CD2-CB 3.77Å; F111-L311 HydrophobicContact CD2-CD1 4.17Å; F111-L311 HydrophobicContact CD2-CD2 4Å; F111-L311 HydrophobicContact CD2-CG 4.2Å; F111-L311 HydrophobicContact CE2-CB 3.95Å; F111-L311 HydrophobicContact CE2-CD2 3.9Å; F111-L311 HydrophobicContact CE2-CG 4.43Å; F111-L311 WeakPolarHBondContact CE2-O 3.34Å; F111-L318 HydrophobicContact CB-CD1 4.28Å; F111-L318 HydrophobicContact CD1-CD1 4.29Å; F111-L318 HydrophobicContact CD2-CD1 3.23Å; F111-L318 HydrophobicContact CD2-CD2 4.1Å; F111-L318 HydrophobicContact CD2-CG 4.34Å; F111-L318 HydrophobicContact CE1-CD2 4.2Å; F111-L318 HydrophobicContact CE2-CD1 3.51Å; F111-L318 HydrophobicContact CE2-CD2 3.45Å; F111-L318 VanDerWaalsContact CE2-CD2 3.45Å; F111-L318 HydrophobicContact CE2-CG 4.17Å; F111-L318 HydrophobicContact CG-CD1 3.69Å; F111-L318 HydrophobicContact CZ-CD1 4.15Å; F111-L318 HydrophobicContact CZ-CD2 3.51Å; F111-A335 HydrophobicContact CD1-CB 3.71Å; F111-A335 HydrophobicContact CE1-CB 4.41Å; F111-V338 HydrophobicContact CE1-CB 4.05Å; F111-V338 HydrophobicContact CE1-CG1 4.08Å; F111-V338 HydrophobicContact CE2-CG1 4.48Å; F111-V338 HydrophobicContact CZ-CB 4.07Å; F111-V338 HydrophobicContact CZ-CG1 3.58Å
112	F	98.3	Very high	97.1	Very high	1 Å²	1	8.6 Å²	8.6	0%	0.004	5%	0.052	C	C	.	.	H	α-helix	trans	-68.1	-37.6	177.4	177.5	-143	0	0	0	112	L108 L110 F115 A116 C332 A335 I502 I506 P510 W514 W518	L108-F112 PolarHBondContact O-N 3.34Å; L110-F112 PolarHBondContact O-N 3.43Å; F112-F115 PolarHBondContact O-N 2.94Å; F112-A116 HydrophobicContact CE2-CB 4.3Å; F112-A116 WeakPolarHBondContact O-CB 3.49Å; F112-A116 PolarHBondContact O-N 2.84Å; F112-C332 HydrophobicContact CD2-CB 4.05Å; F112-C332 HydrophobicContact CE1-CB 4.19Å; F112-C332 HydrophobicContact CE2-CB 3.46Å; F112-C332 VanDerWaalsContact CE2-CB 3.46Å; F112-C332 HydrophobicContact CZ-CB 3.52Å; F112-A335 HydrophobicContact CB-CB 3.89Å; F112-A335 HydrophobicContact CD2-CB 4.37Å; F112-I502 HydrophobicContact CE1-CD1 4.4Å; F112-I502 HydrophobicContact CZ-CD1 4.14Å; F112-I502 HydrophobicContact CZ-CG2 3.8Å; F112-I506 HydrophobicContact CZ-CD1 4.35Å; F112-P510 HydrophobicContact CE1-CB 4.43Å; F112-P510 HydrophobicContact CE1-CG 4.17Å; F112-P510 HydrophobicContact CZ-CG 4.42Å; F112-W514 HydrophobicContact CB-CE3 4.37Å; F112-W514 HydrophobicContact CB-CH2 3.92Å; F112-W514 HydrophobicContact CB-CZ3 3.72Å; F112-W514 AromaticContact CD1-CD2 3.67Å; F112-W514 HydrophobicContact CD1-CD2 3.67Å; F112-W514 AromaticContact CD1-CE2 3.83Å; F112-W514 AromaticContact CD1-CE3 3.61Å; F112-W514 HydrophobicContact CD1-CE3 3.61Å; F112-W514 HydrophobicContact CD1-CG 4.34Å; F112-W514 AromaticContact CD1-CH2 3.84Å; F112-W514 HydrophobicContact CD1-CH2 3.84Å; F112-W514 AromaticContact CD1-CZ2 3.94Å; F112-W514 HydrophobicContact CD1-CZ2 3.94Å; F112-W514 AromaticContact CD1-CZ3 3.69Å; F112-W514 HydrophobicContact CD1-CZ3 3.69Å; F112-W514 HydrophobicContact CE1-CD2 4.06Å; F112-W514 HydrophobicContact CE1-CE3 4.44Å; F112-W514 HydrophobicContact CE1-CG 4.33Å; F112-W514 HydrophobicContact CE1-CZ2 4.44Å; F112-W514 HydrophobicContact CG-CE3 4.47Å; F112-W514 HydrophobicContact CG-CH2 4.17Å; F112-W514 HydrophobicContact CG-CZ3 4.14Å; F112-W518 HydrophobicContact CB-CZ2 4.46Å; F112-W518 AromaticContact CD1-CH2 3.67Å; F112-W518 HydrophobicContact CD1-CH2 3.67Å; F112-W518 AromaticContact CD1-CZ2 3.46Å; F112-W518 HydrophobicContact CD1-CZ2 3.46Å; F112-W518 VanDerWaalsContact CD1-CZ2 3.46Å; F112-W518 AromaticContact CE1-CH2 3.64Å; F112-W518 HydrophobicContact CE1-CH2 3.64Å; F112-W518 AromaticContact CE1-CZ2 3.97Å; F112-W518 HydrophobicContact CE1-CZ2 3.97Å; F112-W518 HydrophobicContact CG-CZ2 4.17Å
113	L	98.2	Very high	96.8	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-60.5	-48.4	177.3	177.7	151.2	0	0	0	111.5	P109 L110 F115 A116 F117 E485 I489 F498 W518	P109-L113 VanDerWaalsContact O-CB 3.27Å; P109-L113 WeakPolarHBondContact O-CB 3.26Å; P109-L113 PolarHBondContact O-N 3.22Å; L110-L113 PolarHBondContact O-N 3.22Å; L113-F115 PolarHBondContact O-N 2.65Å; L113-A116 PolarHBondContact O-N 3.3Å; L113-F117 VanDerWaalsContact O-CB 3.22Å; L113-F117 WeakPolarHBondContact O-CB 3.39Å; L113-F117 PolarHBondContact O-N 3.44Å; L113-E485 HydrophobicContact CD2-CG 3.86Å; L113-I489 HydrophobicContact CD1-CD1 4.38Å; L113-I489 HydrophobicContact CD1-CG2 4.31Å; L113-I489 HydrophobicContact CD2-CD1 3.5Å; L113-I489 VanDerWaalsContact CD2-CD1 3.5Å; L113-I489 HydrophobicContact CG-CD1 4.11Å; L113-F498 HydrophobicContact CG-CE1 4.2Å; L113-F498 HydrophobicContact CG-CZ 4.35Å; L113-W518 HydrophobicContact CB-CZ2 4.07Å; L113-W518 HydrophobicContact CD1-CD2 4.45Å; L113-W518 HydrophobicContact CD1-CG 4.22Å
114	E	98	Very high	96.5	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-65.5	-38.3	177.4	-79.6	-168.2	110	0	0	112.4	L110 F117 G118 C313 C314 L318 I319 E485	L110-E114 PolarHBondContact O-N 2.92Å; E114-F117 PolarHBondContact O-N 2.91Å; E114-G118 PolarHBondContact O-N 3.41Å; E114-C313 WeakPolarHBondContact OE2-CA 3.44Å; E114-C314 VanDerWaalsContact CD-N 3.3Å; E114-C314 WeakPolarHBondContact OE1-CA 3.24Å; E114-C314 PolarHBondContact OE1-N 3.31Å; E114-C314 PolarHBondContact OE2-N 2.91Å; E114-L318 HydrophobicContact CB-CB 3.73Å; E114-L318 HydrophobicContact CB-CD1 4.43Å; E114-L318 WeakPolarHBondContact OE2-CD1 3.22Å; E114-I319 HydrophobicContact CB-CG1 3.81Å; E114-I319 HydrophobicContact CG-CD1 4.19Å; E114-I319 HydrophobicContact CG-CG1 3.84Å; E114-E485 WeakPolarHBondContact CG-OE1 3.28Å
115	F	97.8	Very high	96.4	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-62.3	-46.1	175.1	-89.9	17.7	0	0	0	112.7	F66 C70 F111 F112 L113 F117 Q119 L318 V321 S322 C331 D334 A335	F66-F115 HydrophobicContact CE1-CE2 4.16Å; F66-F115 HydrophobicContact CE2-CZ 4.37Å; F66-F115 HydrophobicContact CZ-CD2 4.13Å; F66-F115 HydrophobicContact CZ-CE1 4.26Å; F66-F115 AromaticContact CZ-CE2 3.64Å; F66-F115 HydrophobicContact CZ-CE2 3.64Å; F66-F115 AromaticContact CZ-CZ 3.71Å; F66-F115 HydrophobicContact CZ-CZ 3.71Å; C70-F115 HydrophobicContact CB-CZ 4.2Å; C70-F115 VanDerWaalsContact SG-CZ 3.55Å; F111-F115 HydrophobicContact CD1-CD1 4.41Å; F111-F115 HydrophobicContact CD1-CD2 4.25Å; F111-F115 HydrophobicContact CD1-CE1 4.21Å; F111-F115 HydrophobicContact CD1-CE2 4.01Å; F111-F115 HydrophobicContact CD1-CG 4.44Å; F111-F115 AromaticContact CD1-CZ 4Å; F111-F115 HydrophobicContact CD1-CZ 4Å; F111-F115 HydrophobicContact CE1-CD1 4.33Å; F111-F115 HydrophobicContact CE1-CD2 4.17Å; F111-F115 AromaticContact CE1-CE1 3.69Å; F111-F115 HydrophobicContact CE1-CE1 3.69Å; F111-F115 AromaticContact CE1-CE2 3.48Å; F111-F115 HydrophobicContact CE1-CE2 3.48Å; F111-F115 VanDerWaalsContact CE1-CE2 3.48Å; F111-F115 AromaticContact CE1-CZ 3.21Å; F111-F115 HydrophobicContact CE1-CZ 3.21Å; F111-F115 HydrophobicContact CZ-CE1 4.19Å; F111-F115 HydrophobicContact CZ-CE2 4.5Å; F111-F115 AromaticContact CZ-CZ 3.85Å; F111-F115 HydrophobicContact CZ-CZ 3.85Å; F111-F115 WeakPolarHBondContact O-CB 3.43Å; F111-F115 PolarHBondContact O-N 3.14Å; F111-F115 VanDerWaalsContact O-N 3.09Å; F112-F115 PolarHBondContact O-N 2.94Å; L113-F115 PolarHBondContact O-N 2.65Å; F115-F117 VanDerWaalsContact C-N 3.33Å; F115-Q119 WeakPolarHBondContact O-CB 3.21Å; F115-Q119 PolarHBondContact O-N 2.83Å; F115-L318 HydrophobicContact CD1-CB 3.88Å; F115-L318 HydrophobicContact CD1-CD2 4.49Å; F115-L318 HydrophobicContact CE1-CB 3.87Å; F115-L318 HydrophobicContact CE1-CD2 3.7Å; F115-L318 HydrophobicContact CE1-CG 4.27Å; F115-L318 HydrophobicContact CZ-CD2 4.41Å; F115-V321 HydrophobicContact CE1-CG2 4.17Å; F115-S322 WeakPolarHBondContact O-CB 3.21Å; F115-S322 PolarHBondContact O-OG 3.38Å; F115-C331 HydrophobicContact CB-CB 4.16Å; F115-D334 HydrophobicContact CE2-CB 4.3Å; F115-A335 HydrophobicContact CD2-CB 3.85Å; F115-A335 HydrophobicContact CE2-CB 4.31Å
116	A	98.1	Very high	96.3	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-63.3	-42.7	175	0	0	0	0	0	111	F112 L113 F120 F498 I502 M505	F112-A116 HydrophobicContact CE2-CB 4.3Å; F112-A116 WeakPolarHBondContact O-CB 3.49Å; F112-A116 PolarHBondContact O-N 2.84Å; L113-A116 PolarHBondContact O-N 3.3Å; A116-F120 WeakPolarHBondContact O-CB 3.28Å; A116-F120 PolarHBondContact O-N 3.01Å; A116-F498 HydrophobicContact CB-CE1 4.47Å; A116-F498 HydrophobicContact CB-CZ 3.88Å; A116-I502 HydrophobicContact CB-CD1 3.76Å; A116-I502 HydrophobicContact CB-CG1 3.69Å; A116-M505 HydrophobicContact CB-CE 3.95Å; A116-M505 WeakPolarHBondContact O-CE 3.47Å
117	F	97.4	Very high	96	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-65.2	-47.3	-176.2	-170.3	-149.1	0	0	0	112.2	L113 E114 F115 V128 W129 I131 I319 I489 F498 W593	L113-F117 VanDerWaalsContact O-CB 3.22Å; L113-F117 WeakPolarHBondContact O-CB 3.39Å; L113-F117 PolarHBondContact O-N 3.44Å; E114-F117 PolarHBondContact O-N 2.91Å; F115-F117 VanDerWaalsContact C-N 3.33Å; F117-V128 HydrophobicContact CD1-CG1 3.98Å; F117-V128 HydrophobicContact CD1-CG2 4.01Å; F117-V128 HydrophobicContact CD2-CG2 3.49Å; F117-V128 VanDerWaalsContact CD2-CG2 3.49Å; F117-V128 HydrophobicContact CE1-CB 4.24Å; F117-V128 HydrophobicContact CE1-CG1 3.41Å; F117-V128 VanDerWaalsContact CE1-CG1 3.41Å; F117-V128 HydrophobicContact CE1-CG2 3.91Å; F117-V128 HydrophobicContact CE2-CB 4.3Å; F117-V128 HydrophobicContact CE2-CG1 4.3Å; F117-V128 HydrophobicContact CE2-CG2 3.38Å; F117-V128 HydrophobicContact CG-CG2 3.8Å; F117-V128 HydrophobicContact CZ-CB 4.04Å; F117-V128 HydrophobicContact CZ-CG1 3.58Å; F117-V128 HydrophobicContact CZ-CG2 3.59Å; F117-V128 WeakPolarHBondContact O-CG2 3.31Å; F117-W129 HydrophobicContact CE1-CD2 4.4Å; F117-W129 AromaticContact CE1-CE2 3.98Å; F117-W129 AromaticContact CE1-CH2 3.98Å; F117-W129 HydrophobicContact CE1-CH2 3.98Å; F117-W129 AromaticContact CE1-CZ2 3.77Å; F117-W129 HydrophobicContact CE1-CZ2 3.77Å; F117-W129 HydrophobicContact CE1-CZ3 4.44Å; F117-W129 HydrophobicContact CZ-CD2 4.32Å; F117-W129 HydrophobicContact CZ-CE3 4.35Å; F117-W129 HydrophobicContact CZ-CH2 4.35Å; F117-W129 HydrophobicContact CZ-CZ2 4.39Å; F117-W129 HydrophobicContact CZ-CZ3 4.36Å; F117-I131 HydrophobicContact CD2-CD1 4.44Å; F117-I131 HydrophobicContact CE2-CB 4.11Å; F117-I131 HydrophobicContact CE2-CD1 3.79Å; F117-I131 HydrophobicContact CE2-CG2 3.79Å; F117-I131 HydrophobicContact CZ-CG2 3.73Å; F117-I319 HydrophobicContact CD1-CD1 3.86Å; F117-I319 HydrophobicContact CD1-CG1 4.46Å; F117-I319 HydrophobicContact CE1-CD1 4.33Å; F117-I489 HydrophobicContact CD1-CD1 3.81Å; F117-I489 HydrophobicContact CD2-CD1 4.33Å; F117-I489 HydrophobicContact CE1-CD1 3.98Å; F117-I489 HydrophobicContact CE2-CD1 4.48Å; F117-I489 HydrophobicContact CG-CD1 4.01Å; F117-I489 HydrophobicContact CZ-CD1 4.33Å; F117-F498 HydrophobicContact CB-CZ 4.48Å; F117-W593 AromaticContact CD2-CH2 3.92Å; F117-W593 HydrophobicContact CD2-CH2 3.92Å; F117-W593 AromaticContact CE2-CH2 3.56Å; F117-W593 HydrophobicContact CE2-CH2 3.56Å; F117-W593 HydrophobicContact CE2-CZ2 4.2Å; F117-W593 HydrophobicContact CE2-CZ3 4.33Å
118	G	96.1	Very high	95.9	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-66.8	-45.7	176	0	0	0	0	0	113.2	E114 F120 S122 S323	E114-G118 PolarHBondContact O-N 3.41Å; G118-F120 PolarHBondContact O-N 3.37Å; G118-S122 WeakPolarHBondContact O-CA 2.98Å; G118-S122 PolarHBondContact O-N 2.71Å; G118-S122 VanDerWaalsContact O-N 3.07Å; G118-S323 VanDerWaalsContact O-CA 3.3Å; G118-S323 WeakPolarHBondContact O-CA 3.48Å; G118-S323 VanDerWaalsContact O-CB 3.32Å; G118-S323 WeakPolarHBondContact O-CB 3.49Å
119	Q	96.5	Very high	95.7	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-66.4	-36.8	-177.8	-173.9	175.3	-69.2	0	0	112.9	F115 S122 N325 F327 N329 M505	F115-Q119 WeakPolarHBondContact O-CB 3.21Å; F115-Q119 PolarHBondContact O-N 2.83Å; Q119-S122 PolarHBondContact O-N 3.32Å; Q119-N325 HydrophobicContact CG-CB 3.99Å; Q119-N325 PolarHBondContact OE1-ND2 3.24Å; Q119-N325 VanDerWaalsContact OE1-ND2 3.12Å; Q119-F327 PolarHBondContact NE2-O 3.43Å; Q119-N329 PolarHBondContact NE2-O 2.92Å; Q119-M505 HydrophobicContact CB-SD 4.13Å; Q119-M505 HydrophobicContact CG-SD 4.09Å
120	F	96.5	Very high	95.3	Very high	2 Å²	2	6.3 Å²	6.3	1%	0.009	4%	0.037	C	C	.	.	H	α-helix	trans	-60.8	-49.7	-175.4	179.9	-107.6	0	0	0	112.6	A116 G118 F327 D501 L504 M505 W593 P595 F604	A116-F120 WeakPolarHBondContact O-CB 3.28Å; A116-F120 PolarHBondContact O-N 3.01Å; G118-F120 PolarHBondContact O-N 3.37Å; F120-F327 AromaticContact CD2-CE2 3.81Å; F120-F327 HydrophobicContact CD2-CE2 3.81Å; F120-F327 HydrophobicContact CD2-CZ 4.08Å; F120-F327 HydrophobicContact CE2-CE2 4.22Å; F120-F327 HydrophobicContact CE2-CZ 4.17Å; F120-F327 WeakPolarHBondContact O-CE2 3.46Å; F120-D501 HydrophobicContact CD2-CB 3.83Å; F120-D501 HydrophobicContact CE1-CB 4.38Å; F120-D501 HydrophobicContact CE2-CB 3.51Å; F120-D501 HydrophobicContact CG-CB 4.39Å; F120-D501 HydrophobicContact CZ-CB 3.81Å; F120-L504 HydrophobicContact CE2-CD2 4.47Å; F120-M505 WeakPolarHBondContact CA-SD 3.25Å; F120-M505 HydrophobicContact CB-CE 3.88Å; F120-M505 HydrophobicContact CB-SD 3.62Å; F120-M505 HydrophobicContact CD2-CE 4.24Å; F120-M505 HydrophobicContact CD2-CG 3.99Å; F120-M505 HydrophobicContact CD2-SD 4.06Å; F120-M505 HydrophobicContact CG-SD 4.36Å; F120-M505 PolarHBondContact N-SD 3.32Å; F120-M505 VanDerWaalsContact N-SD 3.43Å; F120-W593 HydrophobicContact CD1-CH2 4.19Å; F120-W593 AromaticContact CD1-CZ2 3.68Å; F120-W593 HydrophobicContact CD1-CZ2 3.68Å; F120-W593 AromaticContact CE1-CE2 3.99Å; F120-W593 AromaticContact CE1-CZ2 3.91Å; F120-W593 HydrophobicContact CE1-CZ2 3.91Å; F120-W593 AromaticContact CE1-NE1 3.94Å; F120-P595 HydrophobicContact CE2-CG 4.01Å; F120-P595 HydrophobicContact CZ-CG 4.12Å; F120-P595 WeakPolarHBondContact O-CA 3.46Å; F120-F604 HydrophobicContact CE1-CE2 4.49Å; F120-F604 HydrophobicContact CE2-CD2 4.43Å; F120-F604 AromaticContact CZ-CD2 3.76Å; F120-F604 HydrophobicContact CZ-CD2 3.76Å; F120-F604 AromaticContact CZ-CE2 3.75Å; F120-F604 HydrophobicContact CZ-CE2 3.75Å; F120-F604 HydrophobicContact CZ-CG 4.24Å; F120-F604 HydrophobicContact CZ-CZ 4.16Å
121	A	92.1	Very high	95.1	Very high	2 Å²	2	6.3 Å²	6.3	2%	0.017	4%	0.037	C	C	.	.	H	α-helix	trans	-91.1	-12.9	-178.2	0	0	0	0	0	113.1	L123 V128 W593	A121-L123 HydrophobicContact CB-CB 4.06Å; A121-L123 HydrophobicContact CB-CD1 3.87Å; A121-L123 HydrophobicContact CB-CG 3.84Å; A121-L123 WeakPolarHBondContact O-CG 3.34Å; A121-L123 PolarHBondContact O-N 3.27Å; A121-V128 HydrophobicContact CB-CG2 4.46Å; A121-W593 HydrophobicContact CB-CE3 4.22Å; A121-W593 HydrophobicContact CB-CH2 3.82Å; A121-W593 HydrophobicContact CB-CZ3 3.52Å
122	S	93.2	Very high	94.9	Very high	26 Å²	26	6.3 Å²	6.3	18%	0.182	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	36.6	-168	-51	0	0	0	0	112.1	R57 G118 Q119 S323	R57-S122 WeakPolarHBondContact CD-O 3.42Å; R57-S122 PolarHBondContact NH1-O 2.86Å; G118-S122 WeakPolarHBondContact O-CA 2.98Å; G118-S122 PolarHBondContact O-N 2.71Å; G118-S122 VanDerWaalsContact O-N 3.07Å; Q119-S122 PolarHBondContact O-N 3.32Å; S122-S323 WeakPolarHBondContact CA-O 3.08Å; S122-S323 WeakPolarHBondContact CB-O 3.45Å
123	L	91.1	Very high	94.4	Very high	47 Å²	47	7 Å²	7	25%	0.246	4%	0.041	C	C	.	.			trans	-116.2	150.6	-177.6	-67.8	179.3	0	0	0	111.6	R57 A121 S127 V128 S323	R57-L123 PolarHBondContact NH1-O 2.93Å; A121-L123 HydrophobicContact CB-CB 4.06Å; A121-L123 HydrophobicContact CB-CD1 3.87Å; A121-L123 HydrophobicContact CB-CG 3.84Å; A121-L123 WeakPolarHBondContact O-CG 3.34Å; A121-L123 PolarHBondContact O-N 3.27Å; L123-S127 WeakPolarHBondContact CD1-O 3.43Å; L123-V128 HydrophobicContact CB-CB 4.22Å; L123-S323 WeakPolarHBondContact O-CB 3.36Å
124	G	92.1	Very high	94	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.042	C	C	.	.			trans	-75	175.5	176.6	0	0	0	0	0	112.9	R57 I126 S127 V128 D425	R57-G124 VanDerWaalsContact NH1-N 3.14Å; R57-G124 VanDerWaalsContact NH2-N 3.15Å; G124-I126 PolarHBondContact O-N 3.15Å; G124-I126 VanDerWaalsContact O-N 3.07Å; G124-S127 PolarHBondContact O-N 2.91Å; G124-S127 VanDerWaalsContact O-N 3.16Å; G124-V128 WeakPolarHBondContact O-CB 3.5Å; G124-V128 PolarHBondContact O-N 2.8Å; G124-D425 WeakPolarHBondContact CA-OD2 3.33Å; G124-D425 PolarHBondContact N-OD2 3.06Å; G124-D425 VanDerWaalsContact N-OD2 3.15Å
125	P	95.9	Very high	93.9	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-25.9	-170.2	22.9	-35.3	0	0	0	114.2	W129 G139 M142 V143 T320 T418	P125-W129 PolarHBondContact O-NE1 3.3Å; P125-W129 VanDerWaalsContact O-NE1 3.12Å; P125-G139 WeakPolarHBondContact O-CA 3.21Å; P125-M142 HydrophobicContact CB-CB 4.3Å; P125-M142 HydrophobicContact CB-SD 4.21Å; P125-V143 HydrophobicContact CB-CG2 4.29Å; P125-V143 HydrophobicContact CG-CG2 3.59Å; P125-T320 VanDerWaalsContact CD-OG1 3.28Å; P125-T320 WeakPolarHBondContact CD-OG1 3.27Å; P125-T418 HydrophobicContact CG-CG2 4.22Å
126	I	95.6	Very high	93.7	Very high	4 Å²	4	9.2 Å²	9.2	2%	0.021	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-50.2	175.1	-64.9	167	0	0	0	111.3	G124 V128 W129 K136 G139 Y140 V143 E426	G124-I126 PolarHBondContact O-N 3.15Å; G124-I126 VanDerWaalsContact O-N 3.07Å; I126-V128 VanDerWaalsContact C-N 3.33Å; I126-V128 PolarHBondContact O-N 3.26Å; I126-W129 PolarHBondContact O-N 2.96Å; I126-K136 HydrophobicContact CG2-CD 4.49Å; I126-K136 HydrophobicContact CG2-CG 4.34Å; I126-K136 WeakPolarHBondContact O-CE 3.18Å; I126-G139 WeakPolarHBondContact CG1-O 3.46Å; I126-Y140 HydrophobicContact CD1-CD1 3.68Å; I126-Y140 HydrophobicContact CD1-CE1 3.87Å; I126-Y140 HydrophobicContact CG1-CD1 4.05Å; I126-Y140 HydrophobicContact CG1-CE1 4.35Å; I126-Y140 HydrophobicContact CG1-CG 4.45Å; I126-Y140 HydrophobicContact CG2-CD1 4.2Å; I126-Y140 HydrophobicContact CG2-CD2 4.48Å; I126-Y140 HydrophobicContact CG2-CE1 3.78Å; I126-Y140 HydrophobicContact CG2-CE2 4.11Å; I126-V143 HydrophobicContact CD1-CB 4.14Å; I126-V143 HydrophobicContact CD1-CG1 4.42Å; I126-V143 HydrophobicContact CD1-CG2 3.71Å; I126-V143 HydrophobicContact CG1-CB 4.42Å; I126-V143 HydrophobicContact CG1-CG2 3.73Å; I126-E426 HydrophobicContact CB-CG 4.42Å; I126-E426 HydrophobicContact CD1-CG 4.06Å; I126-E426 HydrophobicContact CG2-CG 3.79Å; I126-E426 WeakPolarHBondContact CG2-OE1 3.3Å
127	S	91.6	Very high	93.6	Very high	11 Å²	11	9.2 Å²	9.2	8%	0.077	5%	0.051	C	C	.	.	G	3₁₀ helix	trans	-72.3	-25.5	-173	-66.5	0	0	0	0	113.5	L123 G124 W129 N130	L123-S127 WeakPolarHBondContact CD1-O 3.43Å; G124-S127 PolarHBondContact O-N 2.91Å; G124-S127 VanDerWaalsContact O-N 3.16Å; S127-W129 PolarHBondContact O-N 3.12Å; S127-N130 WeakPolarHBondContact O-CB 3.44Å; S127-N130 VanDerWaalsContact O-CG 3.24Å; S127-N130 PolarHBondContact O-N 3.05Å; S127-N130 VanDerWaalsContact O-N 3.13Å; S127-N130 PolarHBondContact O-ND2 3.2Å
128	V	94.1	Very high	93.6	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.051	C	C	.	.	G	3₁₀ helix	trans	-61.9	-23.1	177.5	77.1	0	0	0	0	112.3	F117 A121 L123 G124 I126 N130 I131 I319 W593	F117-V128 HydrophobicContact CD1-CG1 3.98Å; F117-V128 HydrophobicContact CD1-CG2 4.01Å; F117-V128 HydrophobicContact CD2-CG2 3.49Å; F117-V128 VanDerWaalsContact CD2-CG2 3.49Å; F117-V128 HydrophobicContact CE1-CB 4.24Å; F117-V128 HydrophobicContact CE1-CG1 3.41Å; F117-V128 VanDerWaalsContact CE1-CG1 3.41Å; F117-V128 HydrophobicContact CE1-CG2 3.91Å; F117-V128 HydrophobicContact CE2-CB 4.3Å; F117-V128 HydrophobicContact CE2-CG1 4.3Å; F117-V128 HydrophobicContact CE2-CG2 3.38Å; F117-V128 HydrophobicContact CG-CG2 3.8Å; F117-V128 HydrophobicContact CZ-CB 4.04Å; F117-V128 HydrophobicContact CZ-CG1 3.58Å; F117-V128 HydrophobicContact CZ-CG2 3.59Å; F117-V128 WeakPolarHBondContact O-CG2 3.31Å; A121-V128 HydrophobicContact CB-CG2 4.46Å; L123-V128 HydrophobicContact CB-CB 4.22Å; G124-V128 WeakPolarHBondContact O-CB 3.5Å; G124-V128 PolarHBondContact O-N 2.8Å; I126-V128 VanDerWaalsContact C-N 3.33Å; I126-V128 PolarHBondContact O-N 3.26Å; V128-N130 PolarHBondContact O-N 3.24Å; V128-I131 PolarHBondContact O-N 3.18Å; V128-I319 HydrophobicContact CB-CG2 4.42Å; V128-I319 HydrophobicContact CG1-CD1 4.39Å; V128-I319 HydrophobicContact CG1-CG2 4.11Å; V128-W593 HydrophobicContact CG2-CH2 3.93Å; V128-W593 HydrophobicContact CG2-CZ3 3.96Å; V128-W593 WeakPolarHBondContact O-CZ3 3.19Å
129	W	94.9	Very high	93.7	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.051	C	C	.	.	G	3₁₀ helix	trans	-73.3	6.3	175.5	-66.4	97.3	0	0	0	115	F117 P125 I126 S127 I131 S132 F135 K136 I138 G139 M142 E485 V488	F117-W129 HydrophobicContact CE1-CD2 4.4Å; F117-W129 AromaticContact CE1-CE2 3.98Å; F117-W129 AromaticContact CE1-CH2 3.98Å; F117-W129 HydrophobicContact CE1-CH2 3.98Å; F117-W129 AromaticContact CE1-CZ2 3.77Å; F117-W129 HydrophobicContact CE1-CZ2 3.77Å; F117-W129 HydrophobicContact CE1-CZ3 4.44Å; F117-W129 HydrophobicContact CZ-CD2 4.32Å; F117-W129 HydrophobicContact CZ-CE3 4.35Å; F117-W129 HydrophobicContact CZ-CH2 4.35Å; F117-W129 HydrophobicContact CZ-CZ2 4.39Å; F117-W129 HydrophobicContact CZ-CZ3 4.36Å; P125-W129 PolarHBondContact O-NE1 3.3Å; P125-W129 VanDerWaalsContact O-NE1 3.12Å; I126-W129 PolarHBondContact O-N 2.96Å; S127-W129 PolarHBondContact O-N 3.12Å; W129-I131 HydrophobicContact CE3-CG2 4.2Å; W129-I131 PolarHBondContact O-N 2.99Å; W129-I131 VanDerWaalsContact O-N 3.15Å; W129-S132 CarbonylContact O-C 3.46Å; W129-S132 PolarHBondContact O-N 3.16Å; W129-S132 VanDerWaalsContact O-O 3.1Å; W129-F135 HydrophobicContact CE3-CB 4.09Å; W129-F135 HydrophobicContact CZ3-CB 4.44Å; W129-K136 VanDerWaalsContact CB-CA 3.49Å; W129-K136 HydrophobicContact CB-CB 3.85Å; W129-K136 HydrophobicContact CB-CG 4.07Å; W129-I138 HydrophobicContact CD2-CB 4.09Å; W129-I138 HydrophobicContact CE3-CB 4.49Å; W129-I138 HydrophobicContact CE3-CD1 4.2Å; W129-I138 HydrophobicContact CH2-CB 4.18Å; W129-I138 HydrophobicContact CH2-CD1 3.72Å; W129-I138 HydrophobicContact CH2-CG2 3.9Å; W129-I138 HydrophobicContact CZ2-CB 3.68Å; W129-I138 HydrophobicContact CZ2-CD1 4.13Å; W129-I138 HydrophobicContact CZ2-CG2 3.26Å; W129-I138 HydrophobicContact CZ3-CD1 3.73Å; W129-G139 VanDerWaalsContact CD1-N 3.28Å; W129-G139 VanDerWaalsContact NE1-CA 3.31Å; W129-G139 VanDerWaalsContact NE1-N 3.13Å; W129-M142 HydrophobicContact CZ2-CE 4.06Å; W129-E485 HydrophobicContact CH2-CB 3.85Å; W129-E485 HydrophobicContact CH2-CG 3.87Å; W129-E485 HydrophobicContact CZ2-CB 4.12Å; W129-E485 HydrophobicContact CZ2-CG 4.12Å; W129-V488 HydrophobicContact CE3-CG1 4.45Å; W129-V488 HydrophobicContact CZ3-CB 4.06Å; W129-V488 HydrophobicContact CZ3-CG1 3.8Å
130	N	89.8	Confident	93.7	Very high	40 Å²	40	11.7 Å²	11.7	21%	0.214	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-59	-16.1	162.2	-76.6	-6.8	0	0	0	112.5	S127 V128 S132 V590 W593	S127-N130 WeakPolarHBondContact O-CB 3.44Å; S127-N130 VanDerWaalsContact O-CG 3.24Å; S127-N130 PolarHBondContact O-N 3.05Å; S127-N130 VanDerWaalsContact O-N 3.13Å; S127-N130 PolarHBondContact O-ND2 3.2Å; V128-N130 PolarHBondContact O-N 3.24Å; N130-S132 PolarHBondContact O-N 3.28Å; N130-V590 HydrophobicContact CB-CG2 3.74Å; N130-V590 PolarHBondContact O-N 3.49Å; N130-W593 HydrophobicContact CB-CE3 4.12Å
131	I	92.9	Very high	93.7	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-56.8	-32.2	167.3	-160.3	172.4	0	0	0	112.8	F117 V128 W129 Y493 P589 W593	F117-I131 HydrophobicContact CD2-CD1 4.44Å; F117-I131 HydrophobicContact CE2-CB 4.11Å; F117-I131 HydrophobicContact CE2-CD1 3.79Å; F117-I131 HydrophobicContact CE2-CG2 3.79Å; F117-I131 HydrophobicContact CZ-CG2 3.73Å; V128-I131 PolarHBondContact O-N 3.18Å; W129-I131 HydrophobicContact CE3-CG2 4.2Å; W129-I131 PolarHBondContact O-N 2.99Å; W129-I131 VanDerWaalsContact O-N 3.15Å; I131-Y493 HydrophobicContact CD1-CD1 3.6Å; I131-Y493 HydrophobicContact CD1-CD2 3.6Å; I131-Y493 HydrophobicContact CD1-CE1 3.84Å; I131-Y493 HydrophobicContact CD1-CE2 3.82Å; I131-Y493 HydrophobicContact CD1-CG 3.45Å; I131-Y493 VanDerWaalsContact CD1-CG 3.45Å; I131-Y493 HydrophobicContact CG1-CD1 4.23Å; I131-Y493 HydrophobicContact CG1-CD2 3.24Å; I131-Y493 HydrophobicContact CG1-CE1 4.44Å; I131-Y493 HydrophobicContact CG1-CE2 3.49Å; I131-Y493 VanDerWaalsContact CG1-CE2 3.49Å; I131-Y493 HydrophobicContact CG1-CG 3.61Å; I131-P589 VanDerWaalsContact O-CA 3.3Å; I131-P589 WeakPolarHBondContact O-CA 3.35Å; I131-W593 HydrophobicContact CB-CD2 3.92Å; I131-W593 HydrophobicContact CB-CE3 4.05Å; I131-W593 HydrophobicContact CB-CH2 3.9Å; I131-W593 HydrophobicContact CB-CZ2 3.74Å; I131-W593 HydrophobicContact CB-CZ3 4.05Å; I131-W593 HydrophobicContact CD1-CH2 4.18Å; I131-W593 HydrophobicContact CD1-CZ2 3.53Å; I131-W593 HydrophobicContact CG1-CD2 4.23Å; I131-W593 HydrophobicContact CG1-CH2 4.3Å; I131-W593 HydrophobicContact CG1-CZ2 3.65Å
132	S	91.7	Very high	94	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.059	C	C	.	.	S	Bend	trans	-157.5	93.4	177.2	-163.2	0	0	0	0	110.4	W129 N130 L134 F135 F586 L587	W129-S132 CarbonylContact O-C 3.46Å; W129-S132 PolarHBondContact O-N 3.16Å; W129-S132 VanDerWaalsContact O-O 3.1Å; N130-S132 PolarHBondContact O-N 3.28Å; S132-L134 VanDerWaalsContact C-N 3.26Å; S132-L134 PolarHBondContact O-N 3.19Å; S132-L134 VanDerWaalsContact O-N 3.11Å; S132-F135 PolarHBondContact O-N 3.15Å; S132-F135 WeakPolarHBondContact OG-CD2 3.36Å; S132-F586 PolarHBondContact OG-O 2.96Å; S132-L587 PolarHBondContact OG-O 2.69Å
133	P	88.5	Confident	94.2	Very high	16 Å²	16	10.9 Å²	10.9	10%	0.104	5%	0.054	C	C	.	.	G	3₁₀ helix	trans	-57.5	-28	-169.9	-30.4	36.7	0	0	0	116.6	F135 K136 W569 F586 V590	P133-F135 PolarHBondContact O-N 3.35Å; P133-K136 PolarHBondContact O-N 3.39Å; P133-W569 PolarHBondContact O-NE1 3.45Å; P133-W569 VanDerWaalsContact O-NE1 3.08Å; P133-F586 WeakPolarHBondContact CD-O 3.34Å; P133-V590 HydrophobicContact CG-CG1 3.49Å; P133-V590 VanDerWaalsContact CG-CG1 3.49Å
134	L	90.8	Very high	94.4	Very high	1 Å²	1	11 Å²	11	1%	0.005	5%	0.053	C	C	.	.	G	3₁₀ helix	trans	-61.9	-28	174.5	-88.1	167.6	0	0	0	112.7	S132 F570 K573 L583 F586 L587	S132-L134 VanDerWaalsContact C-N 3.26Å; S132-L134 PolarHBondContact O-N 3.19Å; S132-L134 VanDerWaalsContact O-N 3.11Å; L134-F570 HydrophobicContact CB-CD2 4.05Å; L134-F570 HydrophobicContact CB-CE2 4.13Å; L134-F570 HydrophobicContact CD1-CE2 4.19Å; L134-F570 HydrophobicContact CD2-CD2 4.18Å; L134-F570 HydrophobicContact CD2-CE2 4.19Å; L134-F570 HydrophobicContact CG-CE2 4.39Å; L134-K573 HydrophobicContact CD2-CB 3.99Å; L134-L583 HydrophobicContact CD1-CD1 3.69Å; L134-F586 HydrophobicContact CD1-CB 3.44Å; L134-F586 VanDerWaalsContact CD1-CB 3.44Å; L134-F586 HydrophobicContact CD1-CD2 4.41Å; L134-F586 HydrophobicContact CD1-CG 4.42Å; L134-F586 HydrophobicContact CD2-CB 4.49Å; L134-F586 HydrophobicContact CD2-CD2 4.45Å; L134-F586 HydrophobicContact CG-CB 3.52Å; L134-F586 HydrophobicContact CG-CD2 4.33Å; L134-F586 HydrophobicContact CG-CG 4.3Å; L134-L587 HydrophobicContact CD1-CD2 4.29Å
135	F	94.9	Very high	94.6	Very high	39 Å²	39	11 Å²	11	17%	0.171	5%	0.053	C	C	.	.	G	3₁₀ helix	trans	-102.5	12.3	-175	-65.6	-75.4	0	0	0	113.3	W129 S132 P133 G137 I138 V488 V492 F570 L587	W129-F135 HydrophobicContact CE3-CB 4.09Å; W129-F135 HydrophobicContact CZ3-CB 4.44Å; S132-F135 PolarHBondContact O-N 3.15Å; S132-F135 WeakPolarHBondContact OG-CD2 3.36Å; P133-F135 PolarHBondContact O-N 3.35Å; F135-G137 PolarHBondContact O-N 2.86Å; F135-G137 VanDerWaalsContact O-N 3.08Å; F135-I138 HydrophobicContact CB-CD1 3.85Å; F135-I138 HydrophobicContact CB-CG1 4.39Å; F135-I138 HydrophobicContact CD1-CD1 4.25Å; F135-I138 HydrophobicContact CG-CD1 4.42Å; F135-I138 WeakPolarHBondContact O-CB 3.36Å; F135-I138 VanDerWaalsContact O-CG1 3.29Å; F135-I138 WeakPolarHBondContact O-CG1 3.38Å; F135-I138 PolarHBondContact O-N 2.95Å; F135-V488 HydrophobicContact CB-CG1 4.22Å; F135-V488 HydrophobicContact CB-CG2 4.09Å; F135-V488 HydrophobicContact CD1-CG2 3.58Å; F135-V488 HydrophobicContact CD2-CB 4.48Å; F135-V488 HydrophobicContact CD2-CG1 3.84Å; F135-V488 HydrophobicContact CD2-CG2 3.7Å; F135-V488 HydrophobicContact CE1-CG2 3.83Å; F135-V488 HydrophobicContact CE2-CG1 4.45Å; F135-V488 HydrophobicContact CE2-CG2 3.93Å; F135-V488 HydrophobicContact CG-CB 4.48Å; F135-V488 HydrophobicContact CG-CG1 4.11Å; F135-V488 HydrophobicContact CG-CG2 3.5Å; F135-V488 HydrophobicContact CZ-CG2 3.99Å; F135-V492 HydrophobicContact CE2-CG1 4.37Å; F135-V492 HydrophobicContact CE2-CG2 4.23Å; F135-F570 HydrophobicContact CD1-CD2 4.33Å; F135-F570 AromaticContact CE1-CD2 3.95Å; F135-F570 HydrophobicContact CE1-CD2 3.95Å; F135-F570 HydrophobicContact CE1-CE2 4.05Å; F135-F570 HydrophobicContact CZ-CD2 4.24Å; F135-F570 AromaticContact CZ-CE2 3.9Å; F135-F570 HydrophobicContact CZ-CE2 3.9Å; F135-L587 HydrophobicContact CE2-CD2 3.71Å; F135-L587 HydrophobicContact CZ-CD2 4.43Å
136	K	93.9	Very high	94.6	Very high	5 Å²	5	11 Å²	11	2%	0.022	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-19.9	177.1	-176.8	170.1	-176.4	170.2	0	114.1	I126 W129 P133 I138 G139 Y140 E426 W569	I126-K136 HydrophobicContact CG2-CD 4.49Å; I126-K136 HydrophobicContact CG2-CG 4.34Å; I126-K136 WeakPolarHBondContact O-CE 3.18Å; W129-K136 VanDerWaalsContact CB-CA 3.49Å; W129-K136 HydrophobicContact CB-CB 3.85Å; W129-K136 HydrophobicContact CB-CG 4.07Å; P133-K136 PolarHBondContact O-N 3.39Å; K136-I138 PolarHBondContact O-N 3.44Å; K136-G139 PolarHBondContact O-N 2.89Å; K136-G139 VanDerWaalsContact O-N 3.1Å; K136-Y140 HydrophobicContact CD-CE2 4.42Å; K136-Y140 HydrophobicContact CG-CD2 4.42Å; K136-Y140 HydrophobicContact CG-CE2 3.94Å; K136-Y140 WeakPolarHBondContact O-CD2 3.31Å; K136-Y140 PolarHBondContact O-N 2.92Å; K136-E426 WeakPolarHBondContact CE-OE1 3.46Å; K136-E426 IonicContact NZ-OE1 2.57Å; K136-E426 PolarHBondContact NZ-OE1 3.21Å; K136-E426 IonicContact NZ-OE2 2.9Å; K136-W569 HydrophobicContact CB-CZ2 4.11Å; K136-W569 HydrophobicContact CD-CZ2 4.04Å; K136-W569 HydrophobicContact CG-CZ2 4.21Å
137	G	96.6	Very high	94.7	Very high	0 Å²	0	14 Å²	14	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-53.3	-30.5	167	0	0	0	0	0	114.6	F135 G139 Y140 A141 L565 W569	F135-G137 PolarHBondContact O-N 2.86Å; F135-G137 VanDerWaalsContact O-N 3.08Å; G137-G139 VanDerWaalsContact C-N 3.33Å; G137-G139 PolarHBondContact O-N 2.63Å; G137-Y140 PolarHBondContact O-N 3.03Å; G137-A141 WeakPolarHBondContact O-CB 3.47Å; G137-A141 PolarHBondContact O-N 3.3Å; G137-L565 VanDerWaalsContact CA-O 3.23Å; G137-L565 WeakPolarHBondContact CA-O 3.48Å; G137-W569 VanDerWaalsContact N-CD1 3.28Å
138	I	97.7	Very high	94.9	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-62.1	-42.5	176.4	-58.6	174.2	0	0	0	110.6	W129 F135 K136 A141 M142 V481 V488 I566	W129-I138 HydrophobicContact CD2-CB 4.09Å; W129-I138 HydrophobicContact CE3-CB 4.49Å; W129-I138 HydrophobicContact CE3-CD1 4.2Å; W129-I138 HydrophobicContact CH2-CB 4.18Å; W129-I138 HydrophobicContact CH2-CD1 3.72Å; W129-I138 HydrophobicContact CH2-CG2 3.9Å; W129-I138 HydrophobicContact CZ2-CB 3.68Å; W129-I138 HydrophobicContact CZ2-CD1 4.13Å; W129-I138 HydrophobicContact CZ2-CG2 3.26Å; W129-I138 HydrophobicContact CZ3-CD1 3.73Å; F135-I138 HydrophobicContact CB-CD1 3.85Å; F135-I138 HydrophobicContact CB-CG1 4.39Å; F135-I138 HydrophobicContact CD1-CD1 4.25Å; F135-I138 HydrophobicContact CG-CD1 4.42Å; F135-I138 WeakPolarHBondContact O-CB 3.36Å; F135-I138 VanDerWaalsContact O-CG1 3.29Å; F135-I138 WeakPolarHBondContact O-CG1 3.38Å; F135-I138 PolarHBondContact O-N 2.95Å; K136-I138 PolarHBondContact O-N 3.44Å; I138-A141 WeakPolarHBondContact O-CB 3.31Å; I138-A141 PolarHBondContact O-N 3.14Å; I138-M142 HydrophobicContact CG2-CE 4.06Å; I138-M142 HydrophobicContact CG2-SD 4.5Å; I138-M142 WeakPolarHBondContact O-CG 3.37Å; I138-M142 PolarHBondContact O-N 3.36Å; I138-V481 HydrophobicContact CG2-CG1 3.92Å; I138-V488 HydrophobicContact CD1-CG2 4.1Å; I138-I566 HydrophobicContact CG1-CD1 4.46Å; I138-I566 HydrophobicContact CG1-CG1 4.36Å; I138-I566 HydrophobicContact CG1-CG2 3.99Å
139	G	97.3	Very high	94.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-67.1	-37.9	178	0	0	0	0	0	113.7	P125 I126 W129 K136 G137 A141 M142 V143	P125-G139 WeakPolarHBondContact O-CA 3.21Å; I126-G139 WeakPolarHBondContact CG1-O 3.46Å; W129-G139 VanDerWaalsContact CD1-N 3.28Å; W129-G139 VanDerWaalsContact NE1-CA 3.31Å; W129-G139 VanDerWaalsContact NE1-N 3.13Å; K136-G139 PolarHBondContact O-N 2.89Å; K136-G139 VanDerWaalsContact O-N 3.1Å; G137-G139 VanDerWaalsContact C-N 3.33Å; G137-G139 PolarHBondContact O-N 2.63Å; G139-A141 VanDerWaalsContact C-N 3.33Å; G139-M142 PolarHBondContact O-N 3.05Å; G139-V143 PolarHBondContact O-N 3.35Å; G139-V143 VanDerWaalsContact O-N 3.1Å
140	Y	96.7	Very high	95.1	Very high	52 Å²	52	14.6 Å²	14.6	20%	0.204	7%	0.066	C	C	.	.	H	α-helix	trans	-65	-40.1	172.4	-68.6	-71.2	0	0	0	111.2	I126 K136 G137 V143 F144 E426 R429 W569	I126-Y140 HydrophobicContact CD1-CD1 3.68Å; I126-Y140 HydrophobicContact CD1-CE1 3.87Å; I126-Y140 HydrophobicContact CG1-CD1 4.05Å; I126-Y140 HydrophobicContact CG1-CE1 4.35Å; I126-Y140 HydrophobicContact CG1-CG 4.45Å; I126-Y140 HydrophobicContact CG2-CD1 4.2Å; I126-Y140 HydrophobicContact CG2-CD2 4.48Å; I126-Y140 HydrophobicContact CG2-CE1 3.78Å; I126-Y140 HydrophobicContact CG2-CE2 4.11Å; K136-Y140 HydrophobicContact CD-CE2 4.42Å; K136-Y140 HydrophobicContact CG-CD2 4.42Å; K136-Y140 HydrophobicContact CG-CE2 3.94Å; K136-Y140 WeakPolarHBondContact O-CD2 3.31Å; K136-Y140 PolarHBondContact O-N 2.92Å; G137-Y140 PolarHBondContact O-N 3.03Å; Y140-V143 PolarHBondContact O-N 2.97Å; Y140-F144 WeakPolarHBondContact O-CB 3.34Å; Y140-F144 PolarHBondContact O-N 3.36Å; Y140-E426 HydrophobicContact CE1-CG 4.11Å; Y140-E426 VanDerWaalsContact OH-CD 3.28Å; Y140-E426 PolarHBondContact OH-OE2 3.46Å; Y140-R429 PolarHBondContact OH-NH1 2.97Å; Y140-W569 HydrophobicContact CD2-CD2 4.45Å; Y140-W569 HydrophobicContact CD2-CE3 4.13Å; Y140-W569 HydrophobicContact CD2-CZ3 4.39Å; Y140-W569 HydrophobicContact CE2-CD2 4.17Å; Y140-W569 AromaticContact CE2-CE3 3.71Å; Y140-W569 HydrophobicContact CE2-CE3 3.71Å; Y140-W569 AromaticContact CE2-CH2 3.85Å; Y140-W569 HydrophobicContact CE2-CH2 3.85Å; Y140-W569 HydrophobicContact CE2-CZ2 4.3Å; Y140-W569 AromaticContact CE2-CZ3 3.54Å; Y140-W569 HydrophobicContact CE2-CZ3 3.54Å
141	A	97.3	Very high	95.4	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-61.3	-42.7	174.5	0	0	0	0	0	112.2	G137 I138 G139 F144 L145 V481 T562 L565 I566	G137-A141 WeakPolarHBondContact O-CB 3.47Å; G137-A141 PolarHBondContact O-N 3.3Å; I138-A141 WeakPolarHBondContact O-CB 3.31Å; I138-A141 PolarHBondContact O-N 3.14Å; G139-A141 VanDerWaalsContact C-N 3.33Å; A141-F144 PolarHBondContact O-N 2.93Å; A141-L145 WeakPolarHBondContact O-CG 3.26Å; A141-L145 PolarHBondContact O-N 3.14Å; A141-V481 HydrophobicContact CB-CG2 4.04Å; A141-T562 HydrophobicContact CB-CG2 3.77Å; A141-L565 HydrophobicContact CB-CB 4.3Å; A141-I566 HydrophobicContact CB-CD1 4.1Å; A141-I566 HydrophobicContact CB-CG1 3.73Å
142	M	97.2	Very high	95.5	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-58.6	-49.3	174.2	-73	170.1	167.5	0	0	112.2	P125 W129 I138 G139 F144 L145 S146 N315 I319 V481 E485	P125-M142 HydrophobicContact CB-CB 4.3Å; P125-M142 HydrophobicContact CB-SD 4.21Å; W129-M142 HydrophobicContact CZ2-CE 4.06Å; I138-M142 HydrophobicContact CG2-CE 4.06Å; I138-M142 HydrophobicContact CG2-SD 4.5Å; I138-M142 WeakPolarHBondContact O-CG 3.37Å; I138-M142 PolarHBondContact O-N 3.36Å; G139-M142 PolarHBondContact O-N 3.05Å; M142-F144 VanDerWaalsContact C-N 3.33Å; M142-F144 PolarHBondContact O-N 3.27Å; M142-L145 PolarHBondContact O-N 3.15Å; M142-S146 PolarHBondContact O-N 3.38Å; M142-N315 VanDerWaalsContact O-O 3.06Å; M142-I319 HydrophobicContact CE-CD1 3.86Å; M142-I319 HydrophobicContact SD-CD1 3.78Å; M142-V481 HydrophobicContact CE-CG1 3.81Å; M142-V481 HydrophobicContact CG-CG1 3.66Å; M142-E485 HydrophobicContact CE-CB 4.38Å; M142-E485 HydrophobicContact CE-CG 4.4Å; M142-E485 VanDerWaalsContact CE-OE2 3.24Å; M142-E485 WeakPolarHBondContact CE-OE2 3.49Å
143	V	97.2	Very high	95.7	Very high	13 Å²	13	14.9 Å²	14.9	8%	0.079	7%	0.065	C	C	.	.	H	α-helix	trans	-65	-38	179	170.2	0	0	0	0	111.6	P125 I126 G139 Y140 S146 W147 T419	P125-V143 HydrophobicContact CB-CG2 4.29Å; P125-V143 HydrophobicContact CG-CG2 3.59Å; I126-V143 HydrophobicContact CD1-CB 4.14Å; I126-V143 HydrophobicContact CD1-CG1 4.42Å; I126-V143 HydrophobicContact CD1-CG2 3.71Å; I126-V143 HydrophobicContact CG1-CB 4.42Å; I126-V143 HydrophobicContact CG1-CG2 3.73Å; G139-V143 PolarHBondContact O-N 3.35Å; G139-V143 VanDerWaalsContact O-N 3.1Å; Y140-V143 PolarHBondContact O-N 2.97Å; V143-S146 PolarHBondContact O-N 3.49Å; V143-W147 WeakPolarHBondContact O-CB 3.14Å; V143-W147 PolarHBondContact O-N 2.81Å; V143-T419 HydrophobicContact CG1-CG2 4.47Å
144	F	96.2	Very high	96.2	Very high	50 Å²	50	14.1 Å²	14.1	22%	0.219	6%	0.06	C	C	.	.	H	α-helix	trans	-64.7	-44.6	175.8	179.3	-107.8	0	0	0	112.2	Y140 A141 M142 W147 L148 T562 L565	Y140-F144 WeakPolarHBondContact O-CB 3.34Å; Y140-F144 PolarHBondContact O-N 3.36Å; A141-F144 PolarHBondContact O-N 2.93Å; M142-F144 VanDerWaalsContact C-N 3.33Å; M142-F144 PolarHBondContact O-N 3.27Å; F144-W147 AromaticContact CD2-CE3 3.91Å; F144-W147 HydrophobicContact CD2-CE3 3.91Å; F144-W147 HydrophobicContact CD2-CZ3 4.28Å; F144-W147 AromaticContact CE2-CE3 3.91Å; F144-W147 HydrophobicContact CE2-CE3 3.91Å; F144-W147 AromaticContact CE2-CZ3 3.89Å; F144-W147 HydrophobicContact CE2-CZ3 3.89Å; F144-W147 WeakPolarHBondContact O-CB 3.17Å; F144-W147 PolarHBondContact O-N 2.8Å; F144-W147 VanDerWaalsContact O-N 3.15Å; F144-L148 HydrophobicContact CD1-CD1 4.15Å; F144-L148 HydrophobicContact CE1-CD1 3.56Å; F144-L148 HydrophobicContact CE1-CG 4.2Å; F144-L148 HydrophobicContact CE2-CD2 4.4Å; F144-L148 HydrophobicContact CE2-CG 4.42Å; F144-L148 HydrophobicContact CZ-CD1 3.81Å; F144-L148 HydrophobicContact CZ-CD2 4.17Å; F144-L148 HydrophobicContact CZ-CG 4.12Å; F144-L148 WeakPolarHBondContact O-CG 3.41Å; F144-L148 PolarHBondContact O-N 3.4Å; F144-T562 WeakPolarHBondContact CD1-OG1 3.28Å; F144-L565 HydrophobicContact CB-CD1 3.64Å; F144-L565 HydrophobicContact CD1-CD1 4.15Å; F144-L565 HydrophobicContact CG-CD1 3.86Å
145	L	95.6	Very high	96.5	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.7	-46.9	173.8	-74.3	172	0	0	0	111.6	A141 M142 W147 L148 L149 M473 A477 P478 V481 T562	A141-L145 WeakPolarHBondContact O-CG 3.26Å; A141-L145 PolarHBondContact O-N 3.14Å; M142-L145 PolarHBondContact O-N 3.15Å; L145-W147 PolarHBondContact O-N 2.85Å; L145-L148 PolarHBondContact O-N 3.11Å; L145-L149 VanDerWaalsContact O-CB 3.27Å; L145-L149 WeakPolarHBondContact O-CB 3.32Å; L145-L149 PolarHBondContact O-N 2.84Å; L145-M473 HydrophobicContact CD2-CE 4.1Å; L145-M473 HydrophobicContact CD2-SD 4.32Å; L145-A477 HydrophobicContact CD2-CB 4.42Å; L145-P478 HydrophobicContact CD1-CB 3.93Å; L145-V481 HydrophobicContact CD1-CG2 3.87Å; L145-T562 HydrophobicContact CD1-CG2 3.79Å; L145-T562 HydrophobicContact CD2-CG2 3.95Å; L145-T562 HydrophobicContact CG-CG2 3.7Å
146	S	96.5	Very high	96.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-58.3	-35.5	174	-84.9	0	0	0	0	112.4	M142 V143 L149 N150 N315 I415 T418	M142-S146 PolarHBondContact O-N 3.38Å; V143-S146 PolarHBondContact O-N 3.49Å; S146-L149 PolarHBondContact O-N 2.88Å; S146-N150 WeakPolarHBondContact O-CB 3.41Å; S146-N150 PolarHBondContact O-N 3.45Å; S146-N150 PolarHBondContact O-ND2 2.97Å; S146-N315 PolarHBondContact OG-O 3.04Å; S146-I415 WeakPolarHBondContact O-CG2 3.41Å; S146-T418 WeakPolarHBondContact OG-CG2 3.46Å
147	W	96.8	Very high	96.7	Very high	66 Å²	66	12.9 Å²	12.9	25%	0.25	6%	0.056	C	C	.	.	H	α-helix	trans	-70.4	-43.3	176.9	179.3	57.1	0	0	0	113	V143 F144 L145 L149 N150 I151 T419 N450 M453	V143-W147 WeakPolarHBondContact O-CB 3.14Å; V143-W147 PolarHBondContact O-N 2.81Å; F144-W147 AromaticContact CD2-CE3 3.91Å; F144-W147 HydrophobicContact CD2-CE3 3.91Å; F144-W147 HydrophobicContact CD2-CZ3 4.28Å; F144-W147 AromaticContact CE2-CE3 3.91Å; F144-W147 HydrophobicContact CE2-CE3 3.91Å; F144-W147 AromaticContact CE2-CZ3 3.89Å; F144-W147 HydrophobicContact CE2-CZ3 3.89Å; F144-W147 WeakPolarHBondContact O-CB 3.17Å; F144-W147 PolarHBondContact O-N 2.8Å; F144-W147 VanDerWaalsContact O-N 3.15Å; L145-W147 PolarHBondContact O-N 2.85Å; W147-L149 VanDerWaalsContact C-N 3.29Å; W147-L149 PolarHBondContact O-N 2.77Å; W147-N150 WeakPolarHBondContact O-CB 3.26Å; W147-N150 PolarHBondContact O-N 3.3Å; W147-I151 HydrophobicContact CD2-CD1 4.36Å; W147-I151 HydrophobicContact CZ2-CD1 4.35Å; W147-I151 WeakPolarHBondContact O-CG1 3.42Å; W147-I151 PolarHBondContact O-N 3.27Å; W147-T419 HydrophobicContact CB-CG2 3.98Å; W147-T419 HydrophobicContact CG-CG2 4.3Å; W147-T419 PolarHBondContact N-OG1 3.25Å; W147-N450 PolarHBondContact NE1-OD1 3.21Å; W147-M453 HydrophobicContact CH2-CE 3.86Å; W147-M453 HydrophobicContact CH2-SD 3.83Å; W147-M453 HydrophobicContact CZ2-CE 3.59Å; W147-M453 HydrophobicContact CZ2-SD 3.21Å; W147-M453 WeakPolarHBondContact CZ2-SD 3.49Å
148	L	95.6	Very high	96.8	Very high	3 Å²	3	12.9 Å²	12.9	2%	0.016	6%	0.056	C	C	.	.	H	α-helix	trans	-60.9	-42.2	172	-65.3	179.2	0	0	0	111.1	F144 L145 N150 I151 Y152 Y469 M473 L558	F144-L148 HydrophobicContact CD1-CD1 4.15Å; F144-L148 HydrophobicContact CE1-CD1 3.56Å; F144-L148 HydrophobicContact CE1-CG 4.2Å; F144-L148 HydrophobicContact CE2-CD2 4.4Å; F144-L148 HydrophobicContact CE2-CG 4.42Å; F144-L148 HydrophobicContact CZ-CD1 3.81Å; F144-L148 HydrophobicContact CZ-CD2 4.17Å; F144-L148 HydrophobicContact CZ-CG 4.12Å; F144-L148 WeakPolarHBondContact O-CG 3.41Å; F144-L148 PolarHBondContact O-N 3.4Å; L145-L148 PolarHBondContact O-N 3.11Å; L148-N150 PolarHBondContact O-N 3.24Å; L148-I151 PolarHBondContact O-N 2.86Å; L148-Y152 WeakPolarHBondContact O-CD1 3.24Å; L148-Y152 PolarHBondContact O-N 3.44Å; L148-Y469 HydrophobicContact CB-CD1 4.47Å; L148-Y469 HydrophobicContact CB-CE1 4.27Å; L148-Y469 HydrophobicContact CD2-CE1 3.81Å; L148-M473 HydrophobicContact CB-CE 3.54Å; L148-M473 HydrophobicContact CB-SD 4.44Å; L148-M473 HydrophobicContact CD1-CE 3.67Å; L148-M473 HydrophobicContact CG-CE 4.27Å; L148-L558 HydrophobicContact CD2-CD2 4.27Å
149	L	95.7	Very high	96.7	Very high	21 Å²	21	13.2 Å²	13.2	11%	0.11	6%	0.058	C	C	.	.	H	α-helix	trans	-61	-42.6	177.3	-178	64.5	0	0	0	112.2	L145 S146 W147 I151 Y152 Y153 I415 M473	L145-L149 VanDerWaalsContact O-CB 3.27Å; L145-L149 WeakPolarHBondContact O-CB 3.32Å; L145-L149 PolarHBondContact O-N 2.84Å; S146-L149 PolarHBondContact O-N 2.88Å; W147-L149 VanDerWaalsContact C-N 3.29Å; W147-L149 PolarHBondContact O-N 2.77Å; L149-I151 PolarHBondContact O-N 2.6Å; L149-Y152 HydrophobicContact CB-CE1 4.19Å; L149-Y152 HydrophobicContact CD1-CD1 4.31Å; L149-Y152 HydrophobicContact CD1-CE1 3.24Å; L149-Y152 VanDerWaalsContact CD1-OH 3.26Å; L149-Y152 WeakPolarHBondContact CD1-OH 3.3Å; L149-Y152 HydrophobicContact CG-CE1 4.22Å; L149-Y153 WeakPolarHBondContact O-CB 3.39Å; L149-Y153 PolarHBondContact O-N 3.03Å; L149-I415 HydrophobicContact CB-CG2 4.03Å; L149-I415 HydrophobicContact CD2-CD1 3.61Å; L149-I415 HydrophobicContact CD2-CG1 3.83Å; L149-I415 HydrophobicContact CD2-CG2 3.83Å; L149-I415 HydrophobicContact CG-CD1 3.81Å; L149-I415 HydrophobicContact CG-CG1 4.36Å; L149-I415 HydrophobicContact CG-CG2 3.88Å; L149-M473 HydrophobicContact CB-SD 4.26Å
150	N	97.6	Very high	96.7	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-54.2	-40.4	173.8	-89.4	-50.9	0	0	0	112.8	S146 W147 L148 Q154 W237 Q412 I415 L416 T419	S146-N150 WeakPolarHBondContact O-CB 3.41Å; S146-N150 PolarHBondContact O-N 3.45Å; S146-N150 PolarHBondContact O-ND2 2.97Å; W147-N150 WeakPolarHBondContact O-CB 3.26Å; W147-N150 PolarHBondContact O-N 3.3Å; L148-N150 PolarHBondContact O-N 3.24Å; N150-Q154 WeakPolarHBondContact O-CB 3.45Å; N150-W237 HydrophobicContact CB-CH2 4.15Å; N150-W237 WeakPolarHBondContact O-CZ2 3.32Å; N150-Q412 PolarHBondContact O-NE2 3.33Å; N150-Q412 PolarHBondContact OD1-NE2 3.45Å; N150-I415 HydrophobicContact CB-CG2 4.39Å; N150-I415 PolarHBondContact ND2-O 2.87Å; N150-I415 WeakPolarHBondContact OD1-CG2 3.37Å; N150-L416 WeakPolarHBondContact OD1-CA 3.46Å; N150-L416 WeakPolarHBondContact OD1-CB 3.32Å; N150-L416 PolarHBondContact OD1-N 2.64Å; N150-T419 PolarHBondContact ND2-OG1 2.92Å
151	I	97	Very high	96.8	Very high	3 Å²	3	12.2 Å²	12.2	2%	0.015	6%	0.055	C	C	.	.	H	α-helix	trans	-72.4	-57.5	-175.2	-62.6	162.8	0	0	0	110.3	W147 L148 L149 N450 M453 M457	W147-I151 HydrophobicContact CD2-CD1 4.36Å; W147-I151 HydrophobicContact CZ2-CD1 4.35Å; W147-I151 WeakPolarHBondContact O-CG1 3.42Å; W147-I151 PolarHBondContact O-N 3.27Å; L148-I151 PolarHBondContact O-N 2.86Å; L149-I151 PolarHBondContact O-N 2.6Å; I151-N450 HydrophobicContact CG1-CB 4.47Å; I151-M453 HydrophobicContact CD1-CB 3.95Å; I151-M453 HydrophobicContact CD1-SD 4.06Å; I151-M453 HydrophobicContact CG1-CB 4.28Å; I151-M453 HydrophobicContact CG2-CB 4.33Å; I151-M457 HydrophobicContact CG2-CE 4.21Å; I151-M457 HydrophobicContact CG2-SD 4.12Å
152	Y	94.7	Very high	96.8	Very high	17 Å²	17	13.2 Å²	13.2	7%	0.067	6%	0.059	C	C	.	.	H	α-helix	trans	-76.4	-36.5	-172.9	92.5	-85.4	0	0	0	113	L148 L149 Q154 V155 V156 Y469 D470 M473	L148-Y152 WeakPolarHBondContact O-CD1 3.24Å; L148-Y152 PolarHBondContact O-N 3.44Å; L149-Y152 HydrophobicContact CB-CE1 4.19Å; L149-Y152 HydrophobicContact CD1-CD1 4.31Å; L149-Y152 HydrophobicContact CD1-CE1 3.24Å; L149-Y152 VanDerWaalsContact CD1-OH 3.26Å; L149-Y152 WeakPolarHBondContact CD1-OH 3.3Å; L149-Y152 HydrophobicContact CG-CE1 4.22Å; Y152-Q154 VanDerWaalsContact C-N 3.28Å; Y152-Q154 PolarHBondContact O-N 2.88Å; Y152-V155 WeakPolarHBondContact O-CB 3.2Å; Y152-V155 PolarHBondContact O-N 3.07Å; Y152-V155 VanDerWaalsContact O-N 3.12Å; Y152-V156 PolarHBondContact O-N 3.07Å; Y152-Y469 HydrophobicContact CD1-CD1 4.35Å; Y152-Y469 HydrophobicContact CG-CD1 4.48Å; Y152-D470 HydrophobicContact CE2-CB 4.34Å; Y152-M473 HydrophobicContact CD1-CG 4.21Å; Y152-M473 HydrophobicContact CE1-CB 4.38Å; Y152-M473 HydrophobicContact CE1-CG 3.39Å; Y152-M473 HydrophobicContact CE1-SD 4.33Å
153	Y	96.2	Very high	96.9	Very high	27 Å²	27	13.2 Å²	13.2	11%	0.106	6%	0.059	C	C	.	.	H	α-helix	trans	-65.6	-35.8	-179.5	-169.4	-104.7	0	0	0	110.9	L77 L149 V155 V156 V157 G408 S411 Q412 I415	L77-Y153 HydrophobicContact CB-CE2 4.44Å; L77-Y153 HydrophobicContact CD1-CE2 4.02Å; L77-Y153 HydrophobicContact CG-CE2 4.37Å; L77-Y153 WeakPolarHBondContact CG-OH 3.35Å; L77-Y153 PolarHBondContact N-OH 3.44Å; L149-Y153 WeakPolarHBondContact O-CB 3.39Å; L149-Y153 PolarHBondContact O-N 3.03Å; Y153-V155 VanDerWaalsContact C-N 3.25Å; Y153-V155 PolarHBondContact O-N 2.53Å; Y153-V156 WeakPolarHBondContact O-CB 3.49Å; Y153-V156 PolarHBondContact O-N 3.12Å; Y153-V156 VanDerWaalsContact O-N 3.11Å; Y153-V157 HydrophobicContact CD1-CG2 4.14Å; Y153-V157 HydrophobicContact CE1-CG2 4.11Å; Y153-V157 WeakPolarHBondContact O-CG2 3.45Å; Y153-V157 PolarHBondContact O-N 2.75Å; Y153-G408 VanDerWaalsContact CE1-O 3.3Å; Y153-G408 WeakPolarHBondContact CE1-O 3.42Å; Y153-S411 PolarHBondContact OH-OG 2.99Å; Y153-Q412 HydrophobicContact CD1-CB 4.16Å; Y153-Q412 HydrophobicContact CE1-CB 4.31Å; Y153-I415 HydrophobicContact CD1-CD1 4.39Å
154	Q	98	Very high	96.9	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-61.8	-33.3	174.9	-163.5	72.9	74.2	0	0	112.8	N150 Y152 V156 V157 A158 L233 C236 W237 C240 Q412	N150-Q154 WeakPolarHBondContact O-CB 3.45Å; Y152-Q154 VanDerWaalsContact C-N 3.28Å; Y152-Q154 PolarHBondContact O-N 2.88Å; Q154-V156 VanDerWaalsContact C-N 3.32Å; Q154-V157 CarbonylContact O-C 3.57Å; Q154-V157 PolarHBondContact O-N 2.91Å; Q154-A158 PolarHBondContact O-N 2.86Å; Q154-L233 HydrophobicContact CB-CD1 4.17Å; Q154-L233 HydrophobicContact CG-CD1 3.78Å; Q154-C236 HydrophobicContact CG-CB 4.08Å; Q154-C236 VanDerWaalsContact NE2-CB 3.35Å; Q154-W237 HydrophobicContact CB-CZ2 3.85Å; Q154-W237 HydrophobicContact CG-CD2 4.27Å; Q154-W237 HydrophobicContact CG-CG 4.48Å; Q154-W237 HydrophobicContact CG-CZ2 3.93Å; Q154-C240 PolarHBondContact OE1-SG 3.18Å; Q154-Q412 VanDerWaalsContact OE1-CD 3.27Å
155	V	97.5	Very high	97	Very high	1 Å²	1	15 Å²	15	1%	0.006	8%	0.079	C	C	.	.	H	α-helix	trans	-62.8	-43.2	175.5	175.1	0	0	0	0	109.8	Y152 Y153 V157 A158 H159 L233 M457 V458 V466	Y152-V155 WeakPolarHBondContact O-CB 3.2Å; Y152-V155 PolarHBondContact O-N 3.07Å; Y152-V155 VanDerWaalsContact O-N 3.12Å; Y153-V155 VanDerWaalsContact C-N 3.25Å; Y153-V155 PolarHBondContact O-N 2.53Å; V155-V157 VanDerWaalsContact C-N 3.34Å; V155-V157 PolarHBondContact O-N 3.35Å; V155-A158 WeakPolarHBondContact O-CB 3.43Å; V155-A158 PolarHBondContact O-N 2.95Å; V155-A158 VanDerWaalsContact O-N 3.11Å; V155-H159 PolarHBondContact O-N 3.39Å; V155-H159 VanDerWaalsContact O-N 3.09Å; V155-H159 PolarHBondContact O-ND1 2.87Å; V155-L233 HydrophobicContact CG2-CD1 4.25Å; V155-M457 HydrophobicContact CB-CB 4.48Å; V155-M457 HydrophobicContact CG1-CB 4.2Å; V155-M457 HydrophobicContact CG2-CB 3.74Å; V155-M457 HydrophobicContact CG2-SD 4.01Å; V155-V458 HydrophobicContact CG1-CG1 4.09Å; V155-V466 HydrophobicContact CG1-CG2 4.18Å
156	V	95.4	Very high	97.1	Very high	17 Å²	17	16.5 Å²	16.5	10%	0.103	9%	0.088	C	C	.	.	H	α-helix	trans	-61.7	-42.4	174.2	-176.5	0	0	0	0	111.3	L77 W81 Y152 Y153 Q154 A158 H159 C160 F380	L77-V156 HydrophobicContact CD1-CB 4.33Å; L77-V156 HydrophobicContact CD1-CG1 3.55Å; W81-V156 HydrophobicContact CH2-CG1 3.38Å; W81-V156 HydrophobicContact CZ2-CG1 3.83Å; W81-V156 HydrophobicContact CZ3-CG1 4.4Å; Y152-V156 PolarHBondContact O-N 3.07Å; Y153-V156 WeakPolarHBondContact O-CB 3.49Å; Y153-V156 PolarHBondContact O-N 3.12Å; Y153-V156 VanDerWaalsContact O-N 3.11Å; Q154-V156 VanDerWaalsContact C-N 3.32Å; V156-A158 VanDerWaalsContact C-N 3.27Å; V156-A158 PolarHBondContact O-N 3.41Å; V156-H159 WeakPolarHBondContact O-CB 3.45Å; V156-H159 PolarHBondContact O-N 2.98Å; V156-H159 VanDerWaalsContact O-N 3.15Å; V156-C160 PolarHBondContact O-N 2.95Å; V156-C160 VanDerWaalsContact O-N 3.16Å; V156-F380 HydrophobicContact CG1-CE2 4.19Å; V156-F380 HydrophobicContact CG1-CZ 4.27Å
157	V	97.6	Very high	97.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.7	-34.6	174.5	-176.5	0	0	0	0	111.7	Y153 Q154 V155 H159 C160 L161 L405 F409	Y153-V157 HydrophobicContact CD1-CG2 4.14Å; Y153-V157 HydrophobicContact CE1-CG2 4.11Å; Y153-V157 WeakPolarHBondContact O-CG2 3.45Å; Y153-V157 PolarHBondContact O-N 2.75Å; Q154-V157 CarbonylContact O-C 3.57Å; Q154-V157 PolarHBondContact O-N 2.91Å; V155-V157 VanDerWaalsContact C-N 3.34Å; V155-V157 PolarHBondContact O-N 3.35Å; V157-H159 VanDerWaalsContact C-N 3.33Å; V157-H159 PolarHBondContact O-N 3.18Å; V157-C160 WeakPolarHBondContact O-CB 3.26Å; V157-C160 PolarHBondContact O-N 3.09Å; V157-L161 PolarHBondContact O-N 3.05Å; V157-L405 HydrophobicContact CG1-CD2 4.08Å; V157-F409 HydrophobicContact CG1-CD1 4.11Å; V157-F409 HydrophobicContact CG1-CD2 4.42Å; V157-F409 HydrophobicContact CG1-CE1 3.92Å; V157-F409 HydrophobicContact CG1-CE2 4.25Å; V157-F409 HydrophobicContact CG1-CG 4.35Å; V157-F409 HydrophobicContact CG1-CZ 3.98Å
158	A	98.3	Very high	97.1	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.5	-34.6	175.3	0	0	0	0	0	112.2	Q154 V155 V156 L161 Y162 C232 L233	Q154-A158 PolarHBondContact O-N 2.86Å; V155-A158 WeakPolarHBondContact O-CB 3.43Å; V155-A158 PolarHBondContact O-N 2.95Å; V155-A158 VanDerWaalsContact O-N 3.11Å; V156-A158 VanDerWaalsContact C-N 3.27Å; V156-A158 PolarHBondContact O-N 3.41Å; A158-L161 WeakPolarHBondContact O-CB 3.24Å; A158-L161 PolarHBondContact O-N 3.26Å; A158-Y162 PolarHBondContact O-N 3.39Å; A158-C232 HydrophobicContact CB-CB 4.06Å; A158-C232 WeakPolarHBondContact O-CB 3.49Å; A158-L233 HydrophobicContact CB-CB 4.12Å; A158-L233 HydrophobicContact CB-CD1 4.3Å
159	H	97.1	Very high	97.1	Very high	8 Å²	8	22 Å²	22	4%	0.037	12%	0.119	C	C	.	.	H	α-helix	trans	-64	-43.4	170.5	-68.9	78.7	0	0	0	111.2	V155 V156 V157 L161 Y162 Y163 Y208 L213 F380	V155-H159 PolarHBondContact O-N 3.39Å; V155-H159 VanDerWaalsContact O-N 3.09Å; V155-H159 PolarHBondContact O-ND1 2.87Å; V156-H159 WeakPolarHBondContact O-CB 3.45Å; V156-H159 PolarHBondContact O-N 2.98Å; V156-H159 VanDerWaalsContact O-N 3.15Å; V157-H159 VanDerWaalsContact C-N 3.33Å; V157-H159 PolarHBondContact O-N 3.18Å; H159-L161 PolarHBondContact O-N 3.45Å; H159-Y162 WeakPolarHBondContact O-CB 3.19Å; H159-Y162 PolarHBondContact O-N 3.17Å; H159-Y163 WeakPolarHBondContact O-CD2 3.35Å; H159-Y163 PolarHBondContact O-N 3.33Å; H159-Y208 AromaticContact CD2-CE2 3.83Å; H159-L213 WeakPolarHBondContact NE2-CD2 3.34Å; H159-F380 HydrophobicContact CB-CD1 4.43Å; H159-F380 HydrophobicContact CB-CE1 3.78Å; H159-F380 HydrophobicContact CB-CE2 4.12Å; H159-F380 HydrophobicContact CB-CZ 3.61Å
160	C	97.4	Very high	96.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57.3	-38.8	172.6	-60.8	0	0	0	0	111.6	V156 V157 F164 M404 L405	V156-C160 PolarHBondContact O-N 2.95Å; V156-C160 VanDerWaalsContact O-N 3.16Å; V157-C160 WeakPolarHBondContact O-CB 3.26Å; V157-C160 PolarHBondContact O-N 3.09Å; C160-F164 VanDerWaalsContact O-CB 3.27Å; C160-F164 WeakPolarHBondContact O-CB 3.39Å; C160-F164 PolarHBondContact O-N 3.4Å; C160-M404 HydrophobicContact CB-CB 4.39Å; C160-L405 HydrophobicContact CB-CD2 3.73Å; C160-L405 HydrophobicContact CB-CG 3.84Å
161	L	98.3	Very high	96.7	Very high	30 Å²	30	33.4 Å²	33.4	16%	0.157	18%	0.176	C	C	.	.	H	α-helix	trans	-68.7	-40.8	178.3	-171.9	57.4	0	0	0	112.4	V157 A158 H159 F164 G165 C232 L405	V157-L161 PolarHBondContact O-N 3.05Å; A158-L161 WeakPolarHBondContact O-CB 3.24Å; A158-L161 PolarHBondContact O-N 3.26Å; H159-L161 PolarHBondContact O-N 3.45Å; L161-F164 HydrophobicContact CD1-CD1 4.12Å; L161-F164 PolarHBondContact O-N 3.25Å; L161-G165 PolarHBondContact O-N 3.29Å; L161-C232 HydrophobicContact CB-CB 4.3Å; L161-C232 HydrophobicContact CD2-CB 4.27Å; L161-C232 HydrophobicContact CG-CB 4.45Å; L161-L405 HydrophobicContact CB-CD2 3.82Å; L161-L405 HydrophobicContact CD1-CD1 3.97Å; L161-L405 HydrophobicContact CD1-CD2 4.27Å
162	Y	98.2	Very high	96.7	Very high	21 Å²	21	33.4 Å²	33.4	8%	0.082	18%	0.176	C	C	.	.	H	α-helix	trans	-58	-54.5	174.6	178.2	-84.1	0	0	0	110.5	A158 H159 F164 G165 V166 Y207 V212 E228 L229	A158-Y162 PolarHBondContact O-N 3.39Å; H159-Y162 WeakPolarHBondContact O-CB 3.19Å; H159-Y162 PolarHBondContact O-N 3.17Å; Y162-F164 VanDerWaalsContact C-N 3.34Å; Y162-F164 PolarHBondContact O-N 2.98Å; Y162-G165 PolarHBondContact O-N 2.97Å; Y162-G165 VanDerWaalsContact O-N 3.11Å; Y162-V166 HydrophobicContact CD1-CG2 4.39Å; Y162-V166 HydrophobicContact CE1-CG1 4.14Å; Y162-V166 HydrophobicContact CE1-CG2 4.16Å; Y162-V166 WeakPolarHBondContact O-CG2 3.17Å; Y162-V166 PolarHBondContact O-N 3.26Å; Y162-Y207 HydrophobicContact CE1-CE1 4.07Å; Y162-Y207 PolarHBondContact OH-OH 3.33Å; Y162-V212 HydrophobicContact CD1-CG1 3.86Å; Y162-V212 HydrophobicContact CD1-CG2 4.04Å; Y162-V212 HydrophobicContact CE1-CB 4.24Å; Y162-V212 HydrophobicContact CE1-CG1 3.99Å; Y162-V212 HydrophobicContact CE1-CG2 3.47Å; Y162-V212 VanDerWaalsContact CE1-CG2 3.47Å; Y162-V212 HydrophobicContact CG-CG1 4.27Å; Y162-E228 HydrophobicContact CD2-CB 4.23Å; Y162-E228 HydrophobicContact CE2-CB 3.88Å; Y162-E228 HydrophobicContact CE2-CG 4.49Å; Y162-L229 HydrophobicContact CD2-CD2 4.1Å; Y162-L229 HydrophobicContact CG-CD2 4.12Å
163	Y	97.8	Very high	96.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-39.4	180	-88.8	-93	0	0	0	112.5	H159 G165 V166 S167 W174 Y207 Y208 V212 F380 P384 F401	H159-Y163 WeakPolarHBondContact O-CD2 3.35Å; H159-Y163 PolarHBondContact O-N 3.33Å; Y163-G165 PolarHBondContact O-N 3.34Å; Y163-V166 WeakPolarHBondContact O-CG2 3.32Å; Y163-V166 PolarHBondContact O-N 3.32Å; Y163-S167 WeakPolarHBondContact O-CB 3.35Å; Y163-S167 PolarHBondContact O-N 3.43Å; Y163-S167 PolarHBondContact O-OG 2.93Å; Y163-W174 HydrophobicContact CD1-CE3 4.05Å; Y163-W174 AromaticContact CD1-CH2 3.48Å; Y163-W174 HydrophobicContact CD1-CH2 3.48Å; Y163-W174 VanDerWaalsContact CD1-CH2 3.48Å; Y163-W174 HydrophobicContact CD1-CZ2 4.17Å; Y163-W174 AromaticContact CD1-CZ3 3.39Å; Y163-W174 HydrophobicContact CD1-CZ3 3.39Å; Y163-W174 HydrophobicContact CE1-CD2 4.25Å; Y163-W174 AromaticContact CE1-CE3 3.76Å; Y163-W174 HydrophobicContact CE1-CE3 3.76Å; Y163-W174 HydrophobicContact CE1-CH2 4.01Å; Y163-W174 HydrophobicContact CE1-CZ2 4.46Å; Y163-W174 AromaticContact CE1-CZ3 3.61Å; Y163-W174 HydrophobicContact CE1-CZ3 3.61Å; Y163-W174 HydrophobicContact CG-CZ3 4.45Å; Y163-Y207 HydrophobicContact CE1-CD1 4.49Å; Y163-Y207 HydrophobicContact CE1-CE1 4.47Å; Y163-Y208 AromaticContact CE2-CD2 3.98Å; Y163-Y208 HydrophobicContact CE2-CD2 3.98Å; Y163-Y208 HydrophobicContact CE2-CE2 4.43Å; Y163-Y208 WeakPolarHBondContact OH-CB 3.19Å; Y163-Y208 WeakPolarHBondContact OH-CD2 3.09Å; Y163-V212 HydrophobicContact CE2-CG1 4.29Å; Y163-V212 HydrophobicContact CE2-CG2 4.01Å; Y163-F380 AromaticContact CD2-CD1 3.68Å; Y163-F380 HydrophobicContact CD2-CD1 3.68Å; Y163-F380 HydrophobicContact CD2-CE1 4.22Å; Y163-F380 HydrophobicContact CE2-CB 4.08Å; Y163-F380 AromaticContact CE2-CD1 3.75Å; Y163-F380 HydrophobicContact CE2-CD1 3.75Å; Y163-F380 HydrophobicContact CE2-CG 4.25Å; Y163-F380 HydrophobicContact CG-CD1 4.29Å; Y163-F380 PolarHBondContact OH-O 3.01Å; Y163-P384 HydrophobicContact CD1-CG 4.48Å; Y163-P384 HydrophobicContact CE1-CB 4.43Å; Y163-P384 HydrophobicContact CE1-CG 4.15Å; Y163-F401 VanDerWaalsContact CB-CZ 3.4Å; Y163-F401 HydrophobicContact CD1-CE1 4.09Å; Y163-F401 AromaticContact CD1-CE2 3.62Å; Y163-F401 HydrophobicContact CD1-CE2 3.62Å; Y163-F401 AromaticContact CD1-CZ 3.33Å; Y163-F401 HydrophobicContact CD1-CZ 3.33Å; Y163-F401 HydrophobicContact CD2-CE1 4.41Å; Y163-F401 HydrophobicContact CD2-CZ 4.41Å; Y163-F401 HydrophobicContact CE1-CZ 4.18Å; Y163-F401 HydrophobicContact CG-CD1 4.38Å; Y163-F401 AromaticContact CG-CE1 3.73Å; Y163-F401 HydrophobicContact CG-CE1 3.73Å; Y163-F401 AromaticContact CG-CE2 3.94Å; Y163-F401 HydrophobicContact CG-CE2 3.94Å; Y163-F401 AromaticContact CG-CZ 3.47Å; Y163-F401 HydrophobicContact CG-CZ 3.47Å; Y163-F401 VanDerWaalsContact CG-CZ 3.47Å
164	F	97.8	Very high	96.7	Very high	55 Å²	55	33.4 Å²	33.4	24%	0.241	18%	0.181	C	C	.	.	H	α-helix	trans	-56.5	-49	171.6	170.4	-102.3	0	0	0	111.4	C160 L161 Y162 V166 S167 F168 V398 F401 T402 L405	C160-F164 VanDerWaalsContact O-CB 3.27Å; C160-F164 WeakPolarHBondContact O-CB 3.39Å; C160-F164 PolarHBondContact O-N 3.4Å; L161-F164 HydrophobicContact CD1-CD1 4.12Å; L161-F164 PolarHBondContact O-N 3.25Å; Y162-F164 VanDerWaalsContact C-N 3.34Å; Y162-F164 PolarHBondContact O-N 2.98Å; F164-V166 PolarHBondContact O-N 2.69Å; F164-S167 WeakPolarHBondContact O-CB 3.41Å; F164-S167 PolarHBondContact O-N 2.87Å; F164-F168 HydrophobicContact CD1-CE2 4.18Å; F164-F168 HydrophobicContact CD2-CE2 4.04Å; F164-F168 HydrophobicContact CD2-CZ 4.48Å; F164-F168 AromaticContact CE1-CE2 3.79Å; F164-F168 HydrophobicContact CE1-CE2 3.79Å; F164-F168 HydrophobicContact CE1-CZ 4.33Å; F164-F168 AromaticContact CE2-CE2 3.62Å; F164-F168 HydrophobicContact CE2-CE2 3.62Å; F164-F168 AromaticContact CE2-CZ 3.69Å; F164-F168 HydrophobicContact CE2-CZ 3.69Å; F164-F168 HydrophobicContact CG-CE2 4.31Å; F164-F168 AromaticContact CZ-CE2 3.49Å; F164-F168 HydrophobicContact CZ-CE2 3.49Å; F164-F168 VanDerWaalsContact CZ-CE2 3.49Å; F164-F168 AromaticContact CZ-CZ 3.61Å; F164-F168 HydrophobicContact CZ-CZ 3.61Å; F164-F168 WeakPolarHBondContact O-CD2 3.43Å; F164-F168 VanDerWaalsContact O-CE2 3.31Å; F164-F168 WeakPolarHBondContact O-CE2 3.4Å; F164-V398 HydrophobicContact CE2-CG1 4.17Å; F164-F401 HydrophobicContact CB-CB 3.93Å; F164-T402 VanDerWaalsContact CE2-OG1 3.28Å; F164-T402 WeakPolarHBondContact CE2-OG1 3.27Å; F164-L405 HydrophobicContact CB-CD1 3.54Å; F164-L405 HydrophobicContact CD1-CD1 3.96Å; F164-L405 HydrophobicContact CD2-CD1 4.14Å; F164-L405 HydrophobicContact CG-CD1 3.61Å
165	G	97.7	Very high	96.4	Very high	45 Å²	45	35.1 Å²	35.1	46%	0.464	19%	0.192	S	C	.	.	H	α-helix	trans	-61	-44	-179	0	0	0	0	0	113.3	L161 Y162 Y163 S167	L161-G165 PolarHBondContact O-N 3.29Å; Y162-G165 PolarHBondContact O-N 2.97Å; Y162-G165 VanDerWaalsContact O-N 3.11Å; Y163-G165 PolarHBondContact O-N 3.34Å; G165-S167 VanDerWaalsContact C-N 3.31Å; G165-S167 PolarHBondContact O-N 3.28Å
166	V	97.2	Very high	96.2	Very high	33 Å²	33	39.7 Å²	39.7	20%	0.2	21%	0.214	C	C	.	.	H	α-helix	trans	-80.4	-10.4	-179.6	-58.3	0	0	0	0	113.9	Y162 Y163 F164 F168 T169 P173 W174	Y162-V166 HydrophobicContact CD1-CG2 4.39Å; Y162-V166 HydrophobicContact CE1-CG1 4.14Å; Y162-V166 HydrophobicContact CE1-CG2 4.16Å; Y162-V166 WeakPolarHBondContact O-CG2 3.17Å; Y162-V166 PolarHBondContact O-N 3.26Å; Y163-V166 WeakPolarHBondContact O-CG2 3.32Å; Y163-V166 PolarHBondContact O-N 3.32Å; F164-V166 PolarHBondContact O-N 2.69Å; V166-F168 PolarHBondContact O-N 2.76Å; V166-T169 WeakPolarHBondContact O-CG2 3.47Å; V166-T169 PolarHBondContact O-OG1 3.48Å; V166-P173 HydrophobicContact CB-CG 4.14Å; V166-P173 HydrophobicContact CG2-CG 4.45Å; V166-W174 HydrophobicContact CG2-CH2 4.18Å; V166-W174 HydrophobicContact CG2-CZ3 3.56Å
167	S	97.6	Very high	96	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-14	175.1	-64.4	0	0	0	0	113.3	Y163 F164 G165 T169 S397	Y163-S167 WeakPolarHBondContact O-CB 3.35Å; Y163-S167 PolarHBondContact O-N 3.43Å; Y163-S167 PolarHBondContact O-OG 2.93Å; F164-S167 WeakPolarHBondContact O-CB 3.41Å; F164-S167 PolarHBondContact O-N 2.87Å; G165-S167 VanDerWaalsContact C-N 3.31Å; G165-S167 PolarHBondContact O-N 3.28Å; S167-T169 PolarHBondContact O-N 2.83Å; S167-S397 WeakPolarHBondContact OG-CB 3.31Å; S167-S397 PolarHBondContact OG-OG 3.34Å
168	F	97	Very high	95.7	Very high	130 Å²	130	43.2 Å²	43.2	57%	0.57	23%	0.233	S	C	*	.	S	Bend	trans	-81.8	48.6	175.1	-66.4	-85.5	0	0	0	112.4	F164 V166 V398	F164-F168 HydrophobicContact CD1-CE2 4.18Å; F164-F168 HydrophobicContact CD2-CE2 4.04Å; F164-F168 HydrophobicContact CD2-CZ 4.48Å; F164-F168 AromaticContact CE1-CE2 3.79Å; F164-F168 HydrophobicContact CE1-CE2 3.79Å; F164-F168 HydrophobicContact CE1-CZ 4.33Å; F164-F168 AromaticContact CE2-CE2 3.62Å; F164-F168 HydrophobicContact CE2-CE2 3.62Å; F164-F168 AromaticContact CE2-CZ 3.69Å; F164-F168 HydrophobicContact CE2-CZ 3.69Å; F164-F168 HydrophobicContact CG-CE2 4.31Å; F164-F168 AromaticContact CZ-CE2 3.49Å; F164-F168 HydrophobicContact CZ-CE2 3.49Å; F164-F168 VanDerWaalsContact CZ-CE2 3.49Å; F164-F168 AromaticContact CZ-CZ 3.61Å; F164-F168 HydrophobicContact CZ-CZ 3.61Å; F164-F168 WeakPolarHBondContact O-CD2 3.43Å; F164-F168 VanDerWaalsContact O-CE2 3.31Å; F164-F168 WeakPolarHBondContact O-CE2 3.4Å; V166-F168 PolarHBondContact O-N 2.76Å; F168-V398 HydrophobicContact CD1-CG2 4.23Å; F168-V398 HydrophobicContact CD2-CG2 4.41Å; F168-V398 HydrophobicContact CE1-CG1 4.16Å; F168-V398 HydrophobicContact CE1-CG2 4.03Å; F168-V398 HydrophobicContact CE2-CG2 4.21Å; F168-V398 HydrophobicContact CG-CG2 4.42Å; F168-V398 HydrophobicContact CZ-CG1 3.83Å; F168-V398 HydrophobicContact CZ-CG2 4.02Å
169	T	95.3	Very high	95.2	Very high	55 Å²	55	48.6 Å²	48.6	34%	0.337	27%	0.267	S	S	.	.	S	Bend	trans	-124	154.2	178.5	47.3	0	0	0	0	109.2	V166 S167 T171 S394	V166-T169 WeakPolarHBondContact O-CG2 3.47Å; V166-T169 PolarHBondContact O-OG1 3.48Å; S167-T169 PolarHBondContact O-N 2.83Å; T169-T171 WeakPolarHBondContact CB-O 3.3Å; T169-T171 PolarHBondContact OG1-O 3.4Å; T169-S394 WeakPolarHBondContact O-CB 3.46Å; T169-S394 PolarHBondContact O-OG 3.49Å
170	H	91.9	Very high	94.9	Very high	181 Å²	181	52.1 Å²	52.1	84%	0.838	30%	0.298	S	S	*	.	S	Bend	trans	-65.5	-44.9	176.7	175	-82.2	0	0	0	111.5	S394	H170-S394 PolarHBondContact O-OG 3.2Å
171	T	93.5	Very high	94.8	Very high	78 Å²	78	53.4 Å²	53.4	48%	0.479	30%	0.303	S	S	.	.	S	Bend	trans	-116	127.8	174.7	-54.6	0	0	0	0	107.2	T169 T175	T169-T171 WeakPolarHBondContact CB-O 3.3Å; T169-T171 PolarHBondContact OG1-O 3.4Å; T171-T175 HydrophobicContact CG2-CG2 3.99Å
172	L	96.2	Very high	94.5	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.016	30%	0.302	C	S	.	.			trans	-63.6	140.5	-177.5	-67.1	167.6	0	0	0	110.5	W174 T175	L172-W174 HydrophobicContact CB-CD2 4.28Å; L172-W174 HydrophobicContact CB-CZ2 4.08Å; L172-W174 HydrophobicContact CD1-CZ2 3.89Å; L172-W174 HydrophobicContact CD2-CH2 3.98Å; L172-W174 HydrophobicContact CD2-CZ2 3.7Å; L172-W174 HydrophobicContact CG-CZ2 4.11Å; L172-W174 PolarHBondContact O-N 2.88Å; L172-W174 VanDerWaalsContact O-N 3.1Å; L172-T175 PolarHBondContact N-OG1 2.88Å; L172-T175 VanDerWaalsContact O-CB 3.26Å; L172-T175 WeakPolarHBondContact O-CB 3.41Å; L172-T175 PolarHBondContact O-N 2.8Å; L172-T175 PolarHBondContact O-OG1 2.62Å
173	P	95.5	Very high	94.1	Very high	42 Å²	42	53.7 Å²	53.7	27%	0.273	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.9	-174.8	-26.8	35.6	0	0	0	114.7	V166 W181 Y207	V166-P173 HydrophobicContact CB-CG 4.14Å; V166-P173 HydrophobicContact CG2-CG 4.45Å; P173-W181 WeakPolarHBondContact O-CZ2 3.44Å; P173-Y207 HydrophobicContact CB-CD2 4.27Å; P173-Y207 HydrophobicContact CB-CE2 3.46Å; P173-Y207 VanDerWaalsContact CB-CE2 3.46Å
174	W	94.9	Very high	93.6	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.008	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	23.5	177.5	57.3	81.9	0	0	0	113.4	Y163 V166 L172 P203 Y207 P384 T388 S397 F401	Y163-W174 HydrophobicContact CD1-CE3 4.05Å; Y163-W174 AromaticContact CD1-CH2 3.48Å; Y163-W174 HydrophobicContact CD1-CH2 3.48Å; Y163-W174 VanDerWaalsContact CD1-CH2 3.48Å; Y163-W174 HydrophobicContact CD1-CZ2 4.17Å; Y163-W174 AromaticContact CD1-CZ3 3.39Å; Y163-W174 HydrophobicContact CD1-CZ3 3.39Å; Y163-W174 HydrophobicContact CE1-CD2 4.25Å; Y163-W174 AromaticContact CE1-CE3 3.76Å; Y163-W174 HydrophobicContact CE1-CE3 3.76Å; Y163-W174 HydrophobicContact CE1-CH2 4.01Å; Y163-W174 HydrophobicContact CE1-CZ2 4.46Å; Y163-W174 AromaticContact CE1-CZ3 3.61Å; Y163-W174 HydrophobicContact CE1-CZ3 3.61Å; Y163-W174 HydrophobicContact CG-CZ3 4.45Å; V166-W174 HydrophobicContact CG2-CH2 4.18Å; V166-W174 HydrophobicContact CG2-CZ3 3.56Å; L172-W174 HydrophobicContact CB-CD2 4.28Å; L172-W174 HydrophobicContact CB-CZ2 4.08Å; L172-W174 HydrophobicContact CD1-CZ2 3.89Å; L172-W174 HydrophobicContact CD2-CH2 3.98Å; L172-W174 HydrophobicContact CD2-CZ2 3.7Å; L172-W174 HydrophobicContact CG-CZ2 4.11Å; L172-W174 PolarHBondContact O-N 2.88Å; L172-W174 VanDerWaalsContact O-N 3.1Å; W174-P203 WeakPolarHBondContact O-CB 3.42Å; W174-Y207 HydrophobicContact CB-CD1 4.14Å; W174-Y207 HydrophobicContact CB-CD2 4.38Å; W174-Y207 HydrophobicContact CB-CG 3.87Å; W174-Y207 AromaticContact CE3-CD1 3.91Å; W174-Y207 HydrophobicContact CE3-CD1 3.91Å; W174-Y207 AromaticContact CE3-CE1 3.69Å; W174-Y207 HydrophobicContact CE3-CE1 3.69Å; W174-Y207 HydrophobicContact CZ3-CE1 4.22Å; W174-P384 HydrophobicContact CD2-CB 4.28Å; W174-P384 HydrophobicContact CG-CB 4.37Å; W174-P384 HydrophobicContact CZ2-CB 4.11Å; W174-P384 PolarHBondContact NE1-O 3.06Å; W174-T388 PolarHBondContact NE1-OG1 3.32Å; W174-S397 WeakPolarHBondContact CZ2-OG 3.4Å; W174-F401 HydrophobicContact CH2-CE2 4.33Å; W174-F401 HydrophobicContact CZ2-CE2 4.38Å
175	T	93.4	Very high	93.1	Very high	36 Å²	36	59.2 Å²	59.2	22%	0.221	35%	0.347	C	S	.	.	S	Bend	trans	-75.7	-41.8	177	-58.7	0	0	0	0	111.7	T171 L172 T388	T171-T175 HydrophobicContact CG2-CG2 3.99Å; L172-T175 PolarHBondContact N-OG1 2.88Å; L172-T175 VanDerWaalsContact O-CB 3.26Å; L172-T175 WeakPolarHBondContact O-CB 3.41Å; L172-T175 PolarHBondContact O-N 2.8Å; L172-T175 PolarHBondContact O-OG1 2.62Å; T175-T388 HydrophobicContact CG2-CG2 3.64Å
176	E	92	Very high	92.7	Very high	98 Å²	98	57.1 Å²	57.1	46%	0.458	33%	0.325	S	S	.	.	S	Bend	trans	-132.8	157	-174.4	-57.5	-176.1	173	0	0	110.5	N178 W181	E176-N178 PolarHBondContact O-N 3.28Å; E176-W181 WeakPolarHBondContact O-CH2 3.31Å; E176-W181 WeakPolarHBondContact O-CZ2 3.4Å
177	C	91.9	Very high	92.2	Very high	13 Å²	13	57.8 Å²	57.8	9%	0.088	33%	0.327	C	S	.	.			trans	-71.3	116	175.6	-61.7	0	0	0	0	110.1	C186 D188	C177-C186 HydrophobicContact CB-CB 3.9Å; C177-C186 WeakPolarHBondContact CB-SG 3.44Å; C177-C186 WeakPolarHBondContact SG-CB 3.47Å; C177-C186 PolarHBondContact SG-O 3.35Å; C177-C186 VanDerWaalsContact SG-O 3.35Å; C177-C186 CovalentContact SG-SG 2.04Å; C177-C186 PolarHBondContact SG-SG 3.28Å; C177-D188 WeakPolarHBondContact CB-OD2 3.37Å; C177-D188 PolarHBondContact N-OD2 3.48Å
178	N	90.6	Very high	91.6	Very high	78 Å²	78	58.5 Å²	58.5	42%	0.417	33%	0.331	S	S	.	.			trans	-104.8	128.2	179.1	-173.6	-38.1	0	0	0	111.5	E176 A180 W181 S182	E176-N178 PolarHBondContact O-N 3.28Å; N178-A180 PolarHBondContact O-N 3.48Å; N178-A180 VanDerWaalsContact OD1-CB 3.31Å; N178-A180 WeakPolarHBondContact OD1-CB 3.28Å; N178-A180 PolarHBondContact OD1-N 3.47Å; N178-W181 HydrophobicContact CB-CD2 4.42Å; N178-W181 HydrophobicContact CB-CZ2 3.79Å; N178-W181 PolarHBondContact O-N 3.06Å; N178-W181 VanDerWaalsContact O-N 3.13Å; N178-S182 PolarHBondContact N-OG 2.81Å; N178-S182 VanDerWaalsContact O-CB 3.25Å; N178-S182 WeakPolarHBondContact O-CB 3.5Å; N178-S182 PolarHBondContact O-N 3.08Å; N178-S182 PolarHBondContact O-OG 2.57Å
179	P	87.1	Confident	90.7	Very high	112 Å²	112	56.1 Å²	56.1	73%	0.727	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-20.1	178.2	-26.1	34.1	0	0	0	115.9	W181	P179-W181 VanDerWaalsContact C-N 3.28Å; P179-W181 PolarHBondContact O-N 2.88Å
180	A	92.6	Very high	89.7	Confident	83 Å²	83	58.7 Å²	58.7	69%	0.686	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-27.6	179.2	0	0	0	0	0	113.8	N178	N178-A180 PolarHBondContact O-N 3.48Å; N178-A180 VanDerWaalsContact OD1-CB 3.31Å; N178-A180 WeakPolarHBondContact OD1-CB 3.28Å; N178-A180 PolarHBondContact OD1-N 3.47Å
181	W	93.6	Very high	88.8	Confident	27 Å²	27	53.2 Å²	53.2	10%	0.102	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.2	-14.4	-177	53.8	-105.8	0	0	0	114.3	P173 E176 N178 P179 P203 D206 Y207 N210 Q211	P173-W181 WeakPolarHBondContact O-CZ2 3.44Å; E176-W181 WeakPolarHBondContact O-CH2 3.31Å; E176-W181 WeakPolarHBondContact O-CZ2 3.4Å; N178-W181 HydrophobicContact CB-CD2 4.42Å; N178-W181 HydrophobicContact CB-CZ2 3.79Å; N178-W181 PolarHBondContact O-N 3.06Å; N178-W181 VanDerWaalsContact O-N 3.13Å; P179-W181 VanDerWaalsContact C-N 3.28Å; P179-W181 PolarHBondContact O-N 2.88Å; W181-P203 HydrophobicContact CH2-CB 4.44Å; W181-D206 HydrophobicContact CZ3-CB 4.17Å; W181-Y207 HydrophobicContact CD2-CD2 4.07Å; W181-Y207 AromaticContact CE2-CD2 3.68Å; W181-Y207 HydrophobicContact CE3-CD2 4.44Å; W181-Y207 HydrophobicContact CH2-CD2 4.23Å; W181-Y207 AromaticContact CZ2-CD2 3.79Å; W181-Y207 HydrophobicContact CZ2-CD2 3.79Å; W181-Y207 AromaticContact NE1-CD2 3.94Å; W181-N210 WeakPolarHBondContact O-CB 3.49Å; W181-N210 PolarHBondContact O-ND2 3.01Å; W181-N210 VanDerWaalsContact O-ND2 3.17Å; W181-Q211 HydrophobicContact CB-CB 3.84Å; W181-Q211 HydrophobicContact CB-CG 4.46Å; W181-Q211 HydrophobicContact CD2-CB 4.33Å; W181-Q211 HydrophobicContact CG-CB 3.88Å; W181-Q211 HydrophobicContact CG-CG 4.31Å
182	S	92.7	Very high	87.5	Confident	19 Å²	19	55.8 Å²	55.8	13%	0.133	32%	0.322	C	S	.	.			trans	-83.6	139	-174.9	63	0	0	0	0	112.7	N178 D206	N178-S182 PolarHBondContact N-OG 2.81Å; N178-S182 VanDerWaalsContact O-CB 3.25Å; N178-S182 WeakPolarHBondContact O-CB 3.5Å; N178-S182 PolarHBondContact O-N 3.08Å; N178-S182 PolarHBondContact O-OG 2.57Å; S182-D206 WeakPolarHBondContact CA-OD2 3.27Å; S182-D206 WeakPolarHBondContact CB-OD2 3.08Å
183	T	90.2	Very high	86	Confident	37 Å²	37	62.6 Å²	62.6	23%	0.227	36%	0.359	C	S	.	.			trans	-74.7	164.2	171.3	58	0	0	0	0	110.9	D185 C186 R191 D206 N210	T183-D185 PolarHBondContact O-N 2.94Å; T183-C186 WeakPolarHBondContact O-CB 3.24Å; T183-C186 PolarHBondContact O-N 2.68Å; T183-R191 PolarHBondContact O-NH1 2.83Å; T183-D206 PolarHBondContact N-OD2 3.01Å; T183-D206 VanDerWaalsContact OG1-CG 3.28Å; T183-D206 PolarHBondContact OG1-OD1 3.4Å; T183-D206 PolarHBondContact OG1-OD2 3.32Å; T183-N210 VanDerWaalsContact CG2-ND2 3.26Å; T183-N210 WeakPolarHBondContact CG2-ND2 3.34Å
184	P	87.6	Confident	84.5	Confident	109 Å²	109	69 Å²	69	71%	0.708	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.2	171.3	-24.7	35.8	0	0	0	113.9	C186	P184-C186 VanDerWaalsContact C-N 3.3Å; P184-C186 PolarHBondContact O-N 2.97Å
185	D	86.8	Confident	83	Confident	63 Å²	63	76.2 Å²	76.2	34%	0.337	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-8.9	-179	-59.5	-42.2	0	0	0	113.5	T183 I187 I197 K201	T183-D185 PolarHBondContact O-N 2.94Å; D185-I187 PolarHBondContact O-N 3.11Å; D185-I197 HydrophobicContact CB-CG2 4.09Å; D185-K201 PolarHBondContact O-N 2.69Å
186	C	89.3	Confident	82	Confident	0 Å²	0	82.2 Å²	82.2	0%	0	45%	0.447	C	S	.	.	B	Isolated β-bridge	trans	-69.7	123.7	176.2	-174.1	0	0	0	0	111.1	C177 T183 P184 R191 K201 D206	C177-C186 HydrophobicContact CB-CB 3.9Å; C177-C186 WeakPolarHBondContact CB-SG 3.44Å; C177-C186 WeakPolarHBondContact SG-CB 3.47Å; C177-C186 PolarHBondContact SG-O 3.35Å; C177-C186 VanDerWaalsContact SG-O 3.35Å; C177-C186 CovalentContact SG-SG 2.04Å; C177-C186 PolarHBondContact SG-SG 3.28Å; T183-C186 WeakPolarHBondContact O-CB 3.24Å; T183-C186 PolarHBondContact O-N 2.68Å; P184-C186 VanDerWaalsContact C-N 3.3Å; P184-C186 PolarHBondContact O-N 2.97Å; C186-R191 VanDerWaalsContact O-CD 3.32Å; C186-R191 WeakPolarHBondContact O-CD 3.41Å; C186-R191 PolarHBondContact O-NH1 3.15Å; C186-K201 WeakPolarHBondContact CA-O 3.47Å; C186-D206 HydrophobicContact CB-CB 4.27Å; C186-D206 WeakPolarHBondContact CB-OD2 3.4Å
187	I	87	Confident	81.2	Confident	48 Å²	48	79.5 Å²	79.5	25%	0.246	44%	0.435	C	S	.	.			trans	-117.1	124.7	177	-54.4	-170.9	0	0	0	110.3	D185 M192 I197 P200 K201 P203	D185-I187 PolarHBondContact O-N 3.11Å; I187-M192 HydrophobicContact CG2-CG 4.35Å; I187-I197 HydrophobicContact CD1-CB 4.32Å; I187-I197 HydrophobicContact CD1-CD1 3.61Å; I187-I197 HydrophobicContact CG1-CD1 3.55Å; I187-P200 HydrophobicContact CD1-CB 3.41Å; I187-P200 VanDerWaalsContact CD1-CB 3.41Å; I187-P200 HydrophobicContact CG1-CB 4.08Å; I187-K201 PolarHBondContact N-O 2.89Å; I187-P203 WeakPolarHBondContact O-CD 3.5Å
188	D	85.4	Confident	80.3	Confident	14 Å²	14	84.4 Å²	84.4	8%	0.075	46%	0.464	C	S	.	.			trans	-121.6	-174.6	168.5	61.4	19.6	0	0	0	110.6	C177 N190 R191 M192 P203	C177-D188 WeakPolarHBondContact CB-OD2 3.37Å; C177-D188 PolarHBondContact N-OD2 3.48Å; D188-N190 PolarHBondContact O-N 2.88Å; D188-N190 WeakPolarHBondContact OD1-CA 3.46Å; D188-N190 WeakPolarHBondContact OD1-CB 3.46Å; D188-N190 PolarHBondContact OD1-N 3.43Å; D188-R191 PolarHBondContact O-N 3.1Å; D188-R191 PolarHBondContact OD1-N 2.6Å; D188-M192 PolarHBondContact O-N 3.41Å; D188-P203 HydrophobicContact CB-CG 3.9Å
189	S	76.7	Confident	79.7	Confident	81 Å²	81	88.2 Å²	88.2	57%	0.566	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.6	176.2	49.3	0	0	0	0	113.8
190	N	75.2	Confident	79.5	Confident	108 Å²	108	86.8 Å²	86.8	58%	0.578	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-28.2	-179	-63.1	-37.5	0	0	0	112.1	D188	D188-N190 PolarHBondContact O-N 2.88Å; D188-N190 WeakPolarHBondContact OD1-CA 3.46Å; D188-N190 WeakPolarHBondContact OD1-CB 3.46Å; D188-N190 PolarHBondContact OD1-N 3.43Å
191	R	73.3	Confident	79.3	Confident	66 Å²	66	85.2 Å²	85.2	25%	0.249	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	0.3	-177.9	-68	-174.1	179.6	-172	4.7	115.2	T183 C186 D188 N193 Y194	T183-R191 PolarHBondContact O-NH1 2.83Å; C186-R191 VanDerWaalsContact O-CD 3.32Å; C186-R191 WeakPolarHBondContact O-CD 3.41Å; C186-R191 PolarHBondContact O-NH1 3.15Å; D188-R191 PolarHBondContact O-N 3.1Å; D188-R191 PolarHBondContact OD1-N 2.6Å; R191-N193 PolarHBondContact O-N 2.94Å; R191-Y194 HydrophobicContact CB-CD2 4.33Å; R191-Y194 PolarHBondContact O-N 3.5Å
192	M	64.7	Low	79	Confident	132 Å²	132	84.5 Å²	84.5	65%	0.65	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-21.9	-178.9	-93.8	-164	-90.3	0	0	115.3	I187 D188	I187-M192 HydrophobicContact CG2-CG 4.35Å; D188-M192 PolarHBondContact O-N 3.41Å
193	N	65.2	Low	79	Confident	147 Å²	147	84.1 Å²	84.1	79%	0.786	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-5.2	179.5	-70.2	-20.1	0	0	0	115	R191 I195	R191-N193 PolarHBondContact O-N 2.94Å; N193-I195 WeakPolarHBondContact O-CG1 3.38Å; N193-I195 PolarHBondContact O-N 2.96Å
194	Y	64.3	Low	79.1	Confident	175 Å²	175	82.3 Å²	82.3	69%	0.686	43%	0.428	S	S	*	.			trans	-92.9	84.4	178.8	-67.7	-89.1	0	0	0	110.5	R191 N196	R191-Y194 HydrophobicContact CB-CD2 4.33Å; R191-Y194 PolarHBondContact O-N 3.5Å; Y194-N196 VanDerWaalsContact C-N 3.34Å; Y194-N196 PolarHBondContact O-N 2.88Å
195	I	64	Low	79.3	Confident	154 Å²	154	79.2 Å²	79.2	79%	0.79	40%	0.404	S	S	*	.			trans	-81.4	6.8	-161.8	-11.2	174.7	0	0	0	116.3	N193	N193-I195 WeakPolarHBondContact O-CG1 3.38Å; N193-I195 PolarHBondContact O-N 2.96Å
196	N	72.7	Confident	79.5	Confident	163 Å²	163	76.2 Å²	76.2	87%	0.872	39%	0.388	S	S	*	.			trans	-111.1	45.4	-175.7	-82.6	-2.1	0	0	0	113.2	Y194	Y194-N196 VanDerWaalsContact C-N 3.34Å; Y194-N196 PolarHBondContact O-N 2.88Å
197	I	73.5	Confident	79.8	Confident	41 Å²	41	76.7 Å²	76.7	21%	0.21	39%	0.39	C	S	.	.			trans	-103.7	125.4	174.7	-62.4	168.2	0	0	0	109.1	D185 I187 P200	D185-I197 HydrophobicContact CB-CG2 4.09Å; I187-I197 HydrophobicContact CD1-CB 4.32Å; I187-I197 HydrophobicContact CD1-CD1 3.61Å; I187-I197 HydrophobicContact CG1-CD1 3.55Å; I197-P200 HydrophobicContact CG2-CB 4.3Å
198	T	74	Confident	80.2	Confident	115 Å²	115	75.1 Å²	75.1	71%	0.706	38%	0.381	S	S	*	.	S	Bend	trans	-78.8	-32.7	-175	-51.1	0	0	0	0	112.1
199	Y	78.5	Confident	80.5	Confident	158 Å²	158	75 Å²	75	62%	0.62	38%	0.38	S	S	*	.	S	Bend	trans	-135.8	81.3	179.3	-61.3	-76	0	0	0	109.9	K201	Y199-K201 PolarHBondContact O-N 3.23Å
200	P	83	Confident	81.4	Confident	83 Å²	83	73.5 Å²	73.5	54%	0.539	37%	0.365	S	S	.	.			trans	-64.8	133.7	-176.8	28.4	-36.1	0	0	0	111.4	I187 I197	I187-P200 HydrophobicContact CD1-CB 3.41Å; I187-P200 VanDerWaalsContact CD1-CB 3.41Å; I187-P200 HydrophobicContact CG1-CB 4.08Å; I197-P200 HydrophobicContact CG2-CB 4.3Å
201	K	86.5	Confident	82.3	Confident	49 Å²	49	70.6 Å²	70.6	21%	0.213	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-113.3	144.5	176.6	-67.2	-173.5	176	179.6	0	111.5	D185 C186 I187 Y199 E205 D206	D185-K201 PolarHBondContact O-N 2.69Å; C186-K201 WeakPolarHBondContact CA-O 3.47Å; I187-K201 PolarHBondContact N-O 2.89Å; Y199-K201 PolarHBondContact O-N 3.23Å; K201-E205 HydrophobicContact CD-CG 4.42Å; K201-D206 HydrophobicContact CB-CB 4.47Å
202	S	88	Confident	83.4	Confident	13 Å²	13	67.8 Å²	67.8	9%	0.091	34%	0.338	C	S	.	.			trans	-75.8	157.7	171.7	69.6	0	0	0	0	111.6	S204 E205 D206 E385	S202-S204 PolarHBondContact O-N 2.92Å; S202-S204 PolarHBondContact OG-OG 3.3Å; S202-S204 VanDerWaalsContact OG-OG 3.09Å; S202-E205 PolarHBondContact O-N 2.95Å; S202-E205 PolarHBondContact OG-N 3.48Å; S202-D206 PolarHBondContact O-N 3.4Å; S202-E385 WeakPolarHBondContact CB-OE1 3.42Å; S202-E385 WeakPolarHBondContact CB-OE2 3.38Å; S202-E385 PolarHBondContact OG-OE2 3.37Å
203	P	92.4	Very high	84.8	Confident	10 Å²	10	62.1 Å²	62.1	7%	0.065	31%	0.311	C	S	.	.	H	α-helix	trans	-59.9	-31.3	178.1	-25	36.1	0	0	0	113.3	W174 W181 I187 D188 Y207	W174-P203 WeakPolarHBondContact O-CB 3.42Å; W181-P203 HydrophobicContact CH2-CB 4.44Å; I187-P203 WeakPolarHBondContact O-CD 3.5Å; D188-P203 HydrophobicContact CB-CG 3.9Å; P203-Y207 WeakPolarHBondContact O-CB 3.41Å; P203-Y207 PolarHBondContact O-N 3.44Å
204	S	92.7	Very high	86.3	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-73.3	-37.9	176.3	55.7	0	0	0	0	113.6	S202 Y208 I381 E385	S202-S204 PolarHBondContact O-N 2.92Å; S202-S204 PolarHBondContact OG-OG 3.3Å; S202-S204 VanDerWaalsContact OG-OG 3.09Å; S204-Y208 WeakPolarHBondContact O-CB 3.15Å; S204-Y208 PolarHBondContact O-N 3.03Å; S204-I381 VanDerWaalsContact CB-O 3.27Å; S204-I381 WeakPolarHBondContact CB-O 3.26Å; S204-I381 PolarHBondContact OG-O 2.87Å; S204-E385 WeakPolarHBondContact OG-CB 3.44Å; S204-E385 PolarHBondContact OG-OE2 3.29Å
205	E	91.1	Very high	87.7	Confident	44 Å²	44	52.3 Å²	52.3	21%	0.206	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-51.4	173.3	-177.9	175.9	160.3	0	0	110.5	K201 S202 Y207 Y208 F209 I381	K201-E205 HydrophobicContact CD-CG 4.42Å; S202-E205 PolarHBondContact O-N 2.95Å; S202-E205 PolarHBondContact OG-N 3.48Å; E205-Y207 PolarHBondContact O-N 3.41Å; E205-Y208 PolarHBondContact O-N 2.91Å; E205-F209 HydrophobicContact CG-CD2 3.85Å; E205-F209 HydrophobicContact CG-CE2 3.81Å; E205-F209 VanDerWaalsContact O-CD2 3.25Å; E205-F209 WeakPolarHBondContact O-CD2 3.23Å; E205-F209 PolarHBondContact O-N 2.83Å; E205-F209 VanDerWaalsContact O-N 3.1Å; E205-I381 HydrophobicContact CB-CG2 3.63Å; E205-I381 HydrophobicContact CG-CD1 4.24Å; E205-I381 HydrophobicContact CG-CG2 4.25Å
206	D	92.4	Very high	89.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-70.4	-35.3	-175.3	-156.1	51.4	0	0	0	111.6	W181 S182 T183 C186 K201 S202 N210	W181-D206 HydrophobicContact CZ3-CB 4.17Å; S182-D206 WeakPolarHBondContact CA-OD2 3.27Å; S182-D206 WeakPolarHBondContact CB-OD2 3.08Å; T183-D206 PolarHBondContact N-OD2 3.01Å; T183-D206 VanDerWaalsContact OG1-CG 3.28Å; T183-D206 PolarHBondContact OG1-OD1 3.4Å; T183-D206 PolarHBondContact OG1-OD2 3.32Å; C186-D206 HydrophobicContact CB-CB 4.27Å; C186-D206 WeakPolarHBondContact CB-OD2 3.4Å; K201-D206 HydrophobicContact CB-CB 4.47Å; S202-D206 PolarHBondContact O-N 3.4Å; D206-N210 VanDerWaalsContact O-CB 3.31Å; D206-N210 WeakPolarHBondContact O-CB 3.42Å; D206-N210 PolarHBondContact O-N 3.29Å; D206-N210 PolarHBondContact O-ND2 3.4Å; D206-N210 PolarHBondContact OD1-ND2 3.28Å; D206-N210 PolarHBondContact OD2-ND2 3.49Å
207	Y	95.2	Very high	90	Very high	9 Å²	9	42.2 Å²	42.2	4%	0.035	22%	0.22	C	C	.	.	I	π-helix	trans	-60.5	-45.9	169.9	-176.4	-93.3	0	0	0	111.7	Y162 Y163 P173 W174 W181 P203 E205 Q211 V212	Y162-Y207 HydrophobicContact CE1-CE1 4.07Å; Y162-Y207 PolarHBondContact OH-OH 3.33Å; Y163-Y207 HydrophobicContact CE1-CD1 4.49Å; Y163-Y207 HydrophobicContact CE1-CE1 4.47Å; P173-Y207 HydrophobicContact CB-CD2 4.27Å; P173-Y207 HydrophobicContact CB-CE2 3.46Å; P173-Y207 VanDerWaalsContact CB-CE2 3.46Å; W174-Y207 HydrophobicContact CB-CD1 4.14Å; W174-Y207 HydrophobicContact CB-CD2 4.38Å; W174-Y207 HydrophobicContact CB-CG 3.87Å; W174-Y207 AromaticContact CE3-CD1 3.91Å; W174-Y207 HydrophobicContact CE3-CD1 3.91Å; W174-Y207 AromaticContact CE3-CE1 3.69Å; W174-Y207 HydrophobicContact CE3-CE1 3.69Å; W174-Y207 HydrophobicContact CZ3-CE1 4.22Å; W181-Y207 HydrophobicContact CD2-CD2 4.07Å; W181-Y207 AromaticContact CE2-CD2 3.68Å; W181-Y207 HydrophobicContact CE3-CD2 4.44Å; W181-Y207 HydrophobicContact CH2-CD2 4.23Å; W181-Y207 AromaticContact CZ2-CD2 3.79Å; W181-Y207 HydrophobicContact CZ2-CD2 3.79Å; W181-Y207 AromaticContact NE1-CD2 3.94Å; P203-Y207 WeakPolarHBondContact O-CB 3.41Å; P203-Y207 PolarHBondContact O-N 3.44Å; E205-Y207 PolarHBondContact O-N 3.41Å; Y207-Q211 HydrophobicContact CD2-CB 3.81Å; Y207-Q211 HydrophobicContact CD2-CG 3.91Å; Y207-Q211 HydrophobicContact CE2-CB 3.92Å; Y207-Q211 HydrophobicContact CE2-CG 3.47Å; Y207-Q211 VanDerWaalsContact CE2-CG 3.47Å; Y207-Q211 HydrophobicContact CG-CB 4.21Å; Y207-Q211 WeakPolarHBondContact O-CA 3.37Å; Y207-Q211 VanDerWaalsContact O-CB 3.24Å; Y207-Q211 WeakPolarHBondContact O-CB 3.45Å; Y207-Q211 PolarHBondContact O-N 2.84Å; Y207-V212 HydrophobicContact CD1-CG2 3.63Å; Y207-V212 HydrophobicContact CE1-CG2 3.39Å; Y207-V212 PolarHBondContact O-N 3.41Å
208	Y	94.7	Very high	90.8	Very high	16 Å²	16	40.3 Å²	40.3	6%	0.063	21%	0.21	C	C	.	.	I	π-helix	trans	-60.6	-50.9	-179.9	-178.4	-116.3	0	0	0	111.6	H159 Y163 S204 E205 V212 L213 F380 I381 Y463	H159-Y208 AromaticContact CD2-CE2 3.83Å; Y163-Y208 AromaticContact CE2-CD2 3.98Å; Y163-Y208 HydrophobicContact CE2-CD2 3.98Å; Y163-Y208 HydrophobicContact CE2-CE2 4.43Å; Y163-Y208 WeakPolarHBondContact OH-CB 3.19Å; Y163-Y208 WeakPolarHBondContact OH-CD2 3.09Å; S204-Y208 WeakPolarHBondContact O-CB 3.15Å; S204-Y208 PolarHBondContact O-N 3.03Å; E205-Y208 PolarHBondContact O-N 2.91Å; Y208-V212 HydrophobicContact CD2-CB 4.28Å; Y208-V212 HydrophobicContact CD2-CG1 4.5Å; Y208-V212 WeakPolarHBondContact O-CB 3.27Å; Y208-V212 PolarHBondContact O-N 3.48Å; Y208-L213 HydrophobicContact CD1-CD1 3.9Å; Y208-L213 HydrophobicContact CE1-CD1 3.46Å; Y208-L213 VanDerWaalsContact CE1-CD1 3.46Å; Y208-L213 HydrophobicContact CE1-CG 4.28Å; Y208-L213 HydrophobicContact CE2-CD1 4.28Å; Y208-L213 HydrophobicContact CE2-CG 4.24Å; Y208-L213 HydrophobicContact CG-CD1 4.49Å; Y208-L213 WeakPolarHBondContact O-CB 3.23Å; Y208-L213 WeakPolarHBondContact O-CG 3.36Å; Y208-L213 PolarHBondContact O-N 3.02Å; Y208-F380 HydrophobicContact CD2-CB 3.69Å; Y208-F380 HydrophobicContact CD2-CG 4.43Å; Y208-F380 HydrophobicContact CE2-CB 3.66Å; Y208-F380 HydrophobicContact CE2-CD2 4.11Å; Y208-F380 AromaticContact CE2-CG 3.96Å; Y208-F380 HydrophobicContact CE2-CG 3.96Å; Y208-F380 HydrophobicContact CG-CB 4.26Å; Y208-I381 HydrophobicContact CD1-CD1 3.92Å; Y208-I381 HydrophobicContact CD1-CG1 3.97Å; Y208-I381 HydrophobicContact CG-CG1 4.17Å; Y208-Y463 HydrophobicContact CE1-CE2 4.14Å
209	F	93.5	Very high	91.6	Very high	11 Å²	11	35.2 Å²	35.2	5%	0.048	18%	0.178	C	C	.	.	I	π-helix	trans	-74.2	-39.9	-176	-69.2	-63	0	0	0	113.5	E205 L213 K214 L215 I381 Y463 M543	E205-F209 HydrophobicContact CG-CD2 3.85Å; E205-F209 HydrophobicContact CG-CE2 3.81Å; E205-F209 VanDerWaalsContact O-CD2 3.25Å; E205-F209 WeakPolarHBondContact O-CD2 3.23Å; E205-F209 PolarHBondContact O-N 2.83Å; E205-F209 VanDerWaalsContact O-N 3.1Å; F209-L213 HydrophobicContact CD1-CD1 3.74Å; F209-L213 HydrophobicContact CE1-CD1 4.13Å; F209-K214 PolarHBondContact O-N 2.9Å; F209-K214 VanDerWaalsContact O-N 3.09Å; F209-L215 HydrophobicContact CD1-CD2 3.69Å; F209-L215 HydrophobicContact CE1-CD2 4.25Å; F209-L215 HydrophobicContact CG-CD2 4.46Å; F209-L215 WeakPolarHBondContact O-CB 3.33Å; F209-L215 PolarHBondContact O-N 3.29Å; F209-I381 HydrophobicContact CE2-CD1 3.72Å; F209-I381 HydrophobicContact CZ-CD1 4.04Å; F209-Y463 HydrophobicContact CE1-CE2 4.49Å; F209-M543 HydrophobicContact CD1-CE 4.35Å; F209-M543 HydrophobicContact CE1-CE 3.99Å; F209-M543 HydrophobicContact CE1-SD 4.29Å; F209-M543 HydrophobicContact CE2-SD 4.08Å; F209-M543 HydrophobicContact CZ-CE 4.21Å; F209-M543 HydrophobicContact CZ-SD 3.92Å
210	N	94.3	Very high	92.2	Very high	49 Å²	49	33 Å²	33	26%	0.262	17%	0.173	S	C	.	.	I	π-helix	trans	-96.3	-34.4	-173	-56	-28.1	0	0	0	113.9	W181 T183 D206 K214	W181-N210 WeakPolarHBondContact O-CB 3.49Å; W181-N210 PolarHBondContact O-ND2 3.01Å; W181-N210 VanDerWaalsContact O-ND2 3.17Å; T183-N210 VanDerWaalsContact CG2-ND2 3.26Å; T183-N210 WeakPolarHBondContact CG2-ND2 3.34Å; D206-N210 VanDerWaalsContact O-CB 3.31Å; D206-N210 WeakPolarHBondContact O-CB 3.42Å; D206-N210 PolarHBondContact O-N 3.29Å; D206-N210 PolarHBondContact O-ND2 3.4Å; D206-N210 PolarHBondContact OD1-ND2 3.28Å; D206-N210 PolarHBondContact OD2-ND2 3.49Å; N210-K214 WeakPolarHBondContact O-CA 3.45Å; N210-K214 WeakPolarHBondContact O-CG 3.29Å
211	Q	95.1	Very high	92.6	Very high	48 Å²	48	34.5 Å²	34.5	22%	0.224	17%	0.173	C	C	.	.	I	π-helix	trans	-95.4	-43.8	-177.2	-179.9	55.6	61.7	0	0	112.5	W181 Y207	W181-Q211 HydrophobicContact CB-CB 3.84Å; W181-Q211 HydrophobicContact CB-CG 4.46Å; W181-Q211 HydrophobicContact CD2-CB 4.33Å; W181-Q211 HydrophobicContact CG-CB 3.88Å; W181-Q211 HydrophobicContact CG-CG 4.31Å; Y207-Q211 HydrophobicContact CD2-CB 3.81Å; Y207-Q211 HydrophobicContact CD2-CG 3.91Å; Y207-Q211 HydrophobicContact CE2-CB 3.92Å; Y207-Q211 HydrophobicContact CE2-CG 3.47Å; Y207-Q211 VanDerWaalsContact CE2-CG 3.47Å; Y207-Q211 HydrophobicContact CG-CB 4.21Å; Y207-Q211 WeakPolarHBondContact O-CA 3.37Å; Y207-Q211 VanDerWaalsContact O-CB 3.24Å; Y207-Q211 WeakPolarHBondContact O-CB 3.45Å; Y207-Q211 PolarHBondContact O-N 2.84Å
212	V	95.8	Very high	93	Very high	6 Å²	6	35.3 Å²	35.3	4%	0.036	18%	0.177	C	C	.	.	I	π-helix	trans	-81.7	-58.1	-177.3	-172.8	0	0	0	0	110.8	Y162 Y163 Y207 Y208 L229	Y162-V212 HydrophobicContact CD1-CG1 3.86Å; Y162-V212 HydrophobicContact CD1-CG2 4.04Å; Y162-V212 HydrophobicContact CE1-CB 4.24Å; Y162-V212 HydrophobicContact CE1-CG1 3.99Å; Y162-V212 HydrophobicContact CE1-CG2 3.47Å; Y162-V212 VanDerWaalsContact CE1-CG2 3.47Å; Y162-V212 HydrophobicContact CG-CG1 4.27Å; Y163-V212 HydrophobicContact CE2-CG1 4.29Å; Y163-V212 HydrophobicContact CE2-CG2 4.01Å; Y207-V212 HydrophobicContact CD1-CG2 3.63Å; Y207-V212 HydrophobicContact CE1-CG2 3.39Å; Y207-V212 PolarHBondContact O-N 3.41Å; Y208-V212 HydrophobicContact CD2-CB 4.28Å; Y208-V212 HydrophobicContact CD2-CG1 4.5Å; Y208-V212 WeakPolarHBondContact O-CB 3.27Å; Y208-V212 PolarHBondContact O-N 3.48Å; V212-L229 HydrophobicContact CG1-CD1 4.35Å; V212-L229 HydrophobicContact CG1-CD2 4.08Å; V212-L229 WeakPolarHBondContact O-CD1 3.47Å
213	L	94.8	Very high	93.3	Very high	14 Å²	14	37.2 Å²	37.2	7%	0.073	20%	0.198	C	C	.	.	S	Bend	trans	-79.3	-31.5	-178.6	-66.8	175.2	0	0	0	112.8	H159 Y208 F209 L215 Y463	H159-L213 WeakPolarHBondContact NE2-CD2 3.34Å; Y208-L213 HydrophobicContact CD1-CD1 3.9Å; Y208-L213 HydrophobicContact CE1-CD1 3.46Å; Y208-L213 VanDerWaalsContact CE1-CD1 3.46Å; Y208-L213 HydrophobicContact CE1-CG 4.28Å; Y208-L213 HydrophobicContact CE2-CD1 4.28Å; Y208-L213 HydrophobicContact CE2-CG 4.24Å; Y208-L213 HydrophobicContact CG-CD1 4.49Å; Y208-L213 WeakPolarHBondContact O-CB 3.23Å; Y208-L213 WeakPolarHBondContact O-CG 3.36Å; Y208-L213 PolarHBondContact O-N 3.02Å; F209-L213 HydrophobicContact CD1-CD1 3.74Å; F209-L213 HydrophobicContact CE1-CD1 4.13Å; L213-L215 HydrophobicContact CB-CB 4.25Å; L213-L215 PolarHBondContact O-N 3.12Å; L213-Y463 HydrophobicContact CD1-CD2 3.37Å; L213-Y463 HydrophobicContact CD1-CE2 3.87Å; L213-Y463 HydrophobicContact CD1-CG 4.06Å; L213-Y463 HydrophobicContact CD2-CD2 4.06Å; L213-Y463 HydrophobicContact CG-CD2 4.38Å
214	K	95.2	Very high	93.4	Very high	82 Å²	82	40.5 Å²	40.5	36%	0.357	23%	0.226	S	C	.	.			trans	50.7	46.8	-168.2	-59.9	169.1	-177.8	168.1	0	109.7	F209 N210 S216 E228 A460	F209-K214 PolarHBondContact O-N 2.9Å; F209-K214 VanDerWaalsContact O-N 3.09Å; N210-K214 WeakPolarHBondContact O-CA 3.45Å; N210-K214 WeakPolarHBondContact O-CG 3.29Å; K214-S216 PolarHBondContact O-N 3.32Å; K214-E228 IonicContact NZ-OE1 2.88Å; K214-E228 PolarHBondContact NZ-OE1 3.4Å; K214-E228 IonicContact NZ-OE2 2.85Å; K214-E228 PolarHBondContact NZ-OE2 3.02Å; K214-A460 WeakPolarHBondContact O-CA 3.49Å; K214-A460 WeakPolarHBondContact O-CB 3.4Å
215	L	93.3	Very high	93.6	Very high	33 Å²	33	43.3 Å²	43.3	17%	0.173	24%	0.244	C	C	.	.			trans	-57.4	129.9	-166	-177.4	67.8	0	0	0	111.1	F209 L213 Y463 Y464 M543	F209-L215 HydrophobicContact CD1-CD2 3.69Å; F209-L215 HydrophobicContact CE1-CD2 4.25Å; F209-L215 HydrophobicContact CG-CD2 4.46Å; F209-L215 WeakPolarHBondContact O-CB 3.33Å; F209-L215 PolarHBondContact O-N 3.29Å; L213-L215 HydrophobicContact CB-CB 4.25Å; L213-L215 PolarHBondContact O-N 3.12Å; L215-Y463 HydrophobicContact CD1-CD1 4.27Å; L215-Y463 HydrophobicContact CD1-CG 4.07Å; L215-Y464 HydrophobicContact CD1-CE2 3.93Å; L215-M543 HydrophobicContact CD2-CE 3.57Å
216	S	94.5	Very high	93.8	Very high	10 Å²	10	42 Å²	42	7%	0.07	24%	0.243	C	C	.	.			trans	-73.5	157	172.8	60.7	0	0	0	0	111.4	K214 G218 E221 A460 G461 Y464	K214-S216 PolarHBondContact O-N 3.32Å; S216-G218 PolarHBondContact O-N 2.88Å; S216-G218 VanDerWaalsContact O-N 3.1Å; S216-G218 PolarHBondContact OG-O 3.42Å; S216-E221 WeakPolarHBondContact CB-O 3.34Å; S216-E221 PolarHBondContact OG-O 3.39Å; S216-A460 PolarHBondContact N-O 3.1Å; S216-A460 VanDerWaalsContact N-O 3.09Å; S216-A460 PolarHBondContact OG-O 2.9Å; S216-G461 VanDerWaalsContact OG-CA 3.23Å; S216-G461 WeakPolarHBondContact OG-CA 3.4Å; S216-G461 PolarHBondContact OG-N 3.34Å; S216-Y464 PolarHBondContact O-OH 3.38Å; S216-Y464 VanDerWaalsContact O-OH 3.07Å
217	P	91.2	Very high	94	Very high	96 Å²	96	50 Å²	50	62%	0.623	27%	0.273	S	S	*	.	S	Bend	trans	-58.2	-25.2	175.8	-24.7	34.6	0	0	0	113.9	Y464 Y545	P217-Y464 PolarHBondContact O-OH 3.18Å; P217-Y545 WeakPolarHBondContact O-CD2 3.38Å
218	G	90.7	Very high	94.1	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.28	C	S	.	.	S	Bend	trans	-164.7	170.3	179.1	0	0	0	0	0	113.2	S216 E220 E221 Y464	S216-G218 PolarHBondContact O-N 2.88Å; S216-G218 VanDerWaalsContact O-N 3.1Å; S216-G218 PolarHBondContact OG-O 3.42Å; G218-E220 VanDerWaalsContact C-N 3.29Å; G218-E220 WeakPolarHBondContact CA-OE1 3.46Å; G218-E220 PolarHBondContact O-N 3.02Å; G218-E221 PolarHBondContact O-N 3.01Å; G218-Y464 VanDerWaalsContact C-CE2 3.46Å
219	F	91.2	Very high	94.3	Very high	9 Å²	9	50.9 Å²	50.9	4%	0.039	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-30.5	-174.3	-171.5	-134.6	0	0	0	113.9	E221 F222 G461 Y464 L465 I468 Y545 W550 T551 L554	F219-E221 PolarHBondContact O-N 3.21Å; F219-F222 HydrophobicContact CD2-CD2 4.29Å; F219-F222 HydrophobicContact CD2-CE2 4.4Å; F219-F222 HydrophobicContact CE2-CD2 4.04Å; F219-F222 AromaticContact CE2-CE2 3.77Å; F219-F222 HydrophobicContact CE2-CE2 3.77Å; F219-G461 WeakPolarHBondContact CD2-O 2.99Å; F219-Y464 HydrophobicContact CB-CD2 3.96Å; F219-Y464 HydrophobicContact CB-CG 4.06Å; F219-Y464 HydrophobicContact CD2-CD2 4.22Å; F219-Y464 HydrophobicContact CD2-CG 4.28Å; F219-L465 HydrophobicContact CE2-CB 3.93Å; F219-L465 HydrophobicContact CZ-CB 4.36Å; F219-L465 HydrophobicContact CZ-CD1 4.2Å; F219-I468 HydrophobicContact CE1-CD1 4.14Å; F219-I468 HydrophobicContact CZ-CD1 4.21Å; F219-Y545 HydrophobicContact CB-CE1 4.39Å; F219-Y545 WeakPolarHBondContact CB-OH 3.07Å; F219-Y545 PolarHBondContact N-OH 3Å; F219-W550 AromaticContact CD1-CH2 3.18Å; F219-W550 HydrophobicContact CD1-CH2 3.18Å; F219-W550 AromaticContact CD1-CZ2 3.37Å; F219-W550 HydrophobicContact CD1-CZ2 3.37Å; F219-W550 AromaticContact CD1-CZ3 3.97Å; F219-W550 HydrophobicContact CD1-CZ3 3.97Å; F219-W550 HydrophobicContact CE1-CE3 4.41Å; F219-W550 AromaticContact CE1-CH2 2.94Å; F219-W550 HydrophobicContact CE1-CH2 2.94Å; F219-W550 AromaticContact CE1-CZ2 3.69Å; F219-W550 HydrophobicContact CE1-CZ2 3.69Å; F219-W550 AromaticContact CE1-CZ3 3.37Å; F219-W550 HydrophobicContact CE1-CZ3 3.37Å; F219-W550 HydrophobicContact CG-CH2 4.32Å; F219-W550 HydrophobicContact CG-CZ2 4.4Å; F219-W550 AromaticContact CZ-CH2 3.92Å; F219-W550 HydrophobicContact CZ-CH2 3.92Å; F219-W550 HydrophobicContact CZ-CZ3 4.32Å; F219-T551 HydrophobicContact CD1-CG2 3.36Å; F219-T551 HydrophobicContact CE1-CG2 3.67Å; F219-T551 HydrophobicContact CG-CG2 4.45Å; F219-L554 HydrophobicContact CE1-CD2 4.44Å; F219-L554 HydrophobicContact CZ-CD2 4.34Å
220	E	90.4	Very high	94.5	Very high	111 Å²	111	51.2 Å²	51.2	52%	0.519	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.4	174.3	55.3	-76.7	172	0	0	113.6	G218 F222 Y545 P548	G218-E220 VanDerWaalsContact C-N 3.29Å; G218-E220 WeakPolarHBondContact CA-OE1 3.46Å; G218-E220 PolarHBondContact O-N 3.02Å; E220-F222 PolarHBondContact O-N 2.83Å; E220-Y545 PolarHBondContact OE2-OH 3.32Å; E220-P548 WeakPolarHBondContact OE2-CG 3.15Å
221	E	92.5	Very high	94.7	Very high	115 Å²	115	53.1 Å²	53.1	54%	0.537	29%	0.292	S	S	.	.			trans	-95	65.2	175.2	-70.5	-174.1	-153.3	0	0	110.6	S216 G218 F219 G223	S216-E221 WeakPolarHBondContact CB-O 3.34Å; S216-E221 PolarHBondContact OG-O 3.39Å; G218-E221 PolarHBondContact O-N 3.01Å; F219-E221 PolarHBondContact O-N 3.21Å; E221-G223 VanDerWaalsContact C-N 3.31Å; E221-G223 PolarHBondContact O-N 3.09Å
222	F	93.3	Very high	94.9	Very high	66 Å²	66	51.7 Å²	51.7	29%	0.289	29%	0.287	S	S	.	.			trans	-60.9	-36.3	-167.9	-158.3	-101.5	0	0	0	114.3	F219 E220 P456 C459 A460 G461 L465	F219-F222 HydrophobicContact CD2-CD2 4.29Å; F219-F222 HydrophobicContact CD2-CE2 4.4Å; F219-F222 HydrophobicContact CE2-CD2 4.04Å; F219-F222 AromaticContact CE2-CE2 3.77Å; F219-F222 HydrophobicContact CE2-CE2 3.77Å; E220-F222 PolarHBondContact O-N 2.83Å; F222-P456 HydrophobicContact CE1-CB 3.79Å; F222-P456 WeakPolarHBondContact CE1-O 3.44Å; F222-P456 HydrophobicContact CZ-CB 3.56Å; F222-P456 WeakPolarHBondContact CZ-O 3.2Å; F222-C459 HydrophobicContact CD1-CB 3.84Å; F222-C459 HydrophobicContact CE1-CB 3.69Å; F222-C459 VanDerWaalsContact CE1-SG 3.53Å; F222-C459 HydrophobicContact CZ-CB 4.35Å; F222-C459 WeakPolarHBondContact O-CB 3.46Å; F222-A460 PolarHBondContact O-N 3.01Å; F222-G461 PolarHBondContact O-N 3.48Å; F222-L465 HydrophobicContact CZ-CD2 4.32Å
223	G	95	Very high	95	Very high	52 Å²	52	51.4 Å²	51.4	54%	0.536	29%	0.285	S	S	.	.			trans	70.1	-173.4	-179.1	0	0	0	0	0	114.3	E221	E221-G223 VanDerWaalsContact C-N 3.31Å; E221-G223 PolarHBondContact O-N 3.09Å
224	A	95.5	Very high	95.2	Very high	79 Å²	79	53.9 Å²	53.9	65%	0.653	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-97.5	156.7	176.2	0	0	0	0	0	111.3	G226 C459	A224-G226 PolarHBondContact O-N 2.98Å; A224-C459 VanDerWaalsContact C-SG 3.59Å
225	P	96.3	Very high	95.4	Very high	60 Å²	60	52.4 Å²	52.4	39%	0.39	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-59.3	127.5	176.3	-22.5	32	0	0	0	111.6	W227 L455 V458 C459	P225-W227 PolarHBondContact O-N 3.42Å; P225-L455 HydrophobicContact CB-CD2 4.46Å; P225-L455 HydrophobicContact CG-CB 4.43Å; P225-V458 HydrophobicContact CB-CG2 4.12Å; P225-C459 VanDerWaalsContact CD-SG 3.59Å
226	G	95	Very high	95.7	Very high	17 Å²	17	50.9 Å²	50.9	18%	0.175	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-63.8	127.1	174	0	0	0	0	0	110.7	A224 E228 S230 V458	A224-G226 PolarHBondContact O-N 2.98Å; G226-E228 VanDerWaalsContact C-N 3.3Å; G226-E228 PolarHBondContact O-N 2.78Å; G226-S230 VanDerWaalsContact O-CB 3.23Å; G226-S230 WeakPolarHBondContact O-CB 3.35Å; G226-S230 PolarHBondContact O-N 3.27Å; G226-S230 PolarHBondContact O-OG 3.3Å; G226-V458 PolarHBondContact N-O 2.98Å
227	W	97	Very high	95.8	Very high	167 Å²	167	50.7 Å²	50.7	63%	0.633	29%	0.288	S	S	*	.	H	α-helix	trans	-65.4	-34.3	-173.3	74.5	-88.1	0	0	0	112.3	P225 S230 L231	P225-W227 PolarHBondContact O-N 3.42Å; W227-S230 PolarHBondContact O-N 3.26Å; W227-L231 HydrophobicContact CE3-CD1 3.55Å; W227-L231 HydrophobicContact CE3-CG 4.42Å; W227-L231 HydrophobicContact CZ3-CD1 3.59Å; W227-L231 WeakPolarHBondContact O-CG 3.29Å; W227-L231 PolarHBondContact O-N 3.23Å
228	E	97.6	Very high	96.2	Very high	39 Å²	39	50.5 Å²	50.5	18%	0.182	28%	0.281	C	S	.	.	H	α-helix	trans	-64.9	-54.1	179.5	-55.9	88.7	158.5	0	0	111.3	Y162 K214 G226 S230 L231 C232	Y162-E228 HydrophobicContact CD2-CB 4.23Å; Y162-E228 HydrophobicContact CE2-CB 3.88Å; Y162-E228 HydrophobicContact CE2-CG 4.49Å; K214-E228 IonicContact NZ-OE1 2.88Å; K214-E228 PolarHBondContact NZ-OE1 3.4Å; K214-E228 IonicContact NZ-OE2 2.85Å; K214-E228 PolarHBondContact NZ-OE2 3.02Å; G226-E228 VanDerWaalsContact C-N 3.3Å; G226-E228 PolarHBondContact O-N 2.78Å; E228-S230 VanDerWaalsContact C-N 3.3Å; E228-S230 PolarHBondContact O-N 2.84Å; E228-L231 PolarHBondContact O-N 3.46Å; E228-C232 PolarHBondContact O-N 3.5Å; E228-C232 VanDerWaalsContact O-N 3.09Å; E228-C232 PolarHBondContact O-SG 3.18Å
229	L	97.9	Very high	96.6	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-66.8	-32.6	177.6	-73.3	-179.1	0	0	0	112.1	Y162 V212 L231 C232 L233 V458	Y162-L229 HydrophobicContact CD2-CD2 4.1Å; Y162-L229 HydrophobicContact CG-CD2 4.12Å; V212-L229 HydrophobicContact CG1-CD1 4.35Å; V212-L229 HydrophobicContact CG1-CD2 4.08Å; V212-L229 WeakPolarHBondContact O-CD1 3.47Å; L229-L231 VanDerWaalsContact C-N 3.34Å; L229-L231 PolarHBondContact O-N 3.25Å; L229-C232 PolarHBondContact O-N 3.06Å; L229-L233 WeakPolarHBondContact O-CB 3.25Å; L229-L233 PolarHBondContact O-N 3.33Å; L229-V458 HydrophobicContact CB-CB 3.96Å; L229-V458 HydrophobicContact CB-CG1 4.08Å
230	S	98.5	Very high	96.9	Very high	18 Å²	18	54 Å²	54	13%	0.126	30%	0.299	C	S	.	.	H	α-helix	trans	-62.3	-40.6	174.2	-61.7	0	0	0	0	111.8	G226 W227 E228 L233 L234	G226-S230 VanDerWaalsContact O-CB 3.23Å; G226-S230 WeakPolarHBondContact O-CB 3.35Å; G226-S230 PolarHBondContact O-N 3.27Å; G226-S230 PolarHBondContact O-OG 3.3Å; W227-S230 PolarHBondContact O-N 3.26Å; E228-S230 VanDerWaalsContact C-N 3.3Å; E228-S230 PolarHBondContact O-N 2.84Å; S230-L233 PolarHBondContact O-N 2.98Å; S230-L234 WeakPolarHBondContact O-CB 3.39Å; S230-L234 PolarHBondContact O-N 2.67Å
231	L	98.5	Very high	97.2	Very high	90 Å²	90	49.1 Å²	49.1	47%	0.471	28%	0.279	S	S	.	.	H	α-helix	trans	-68	-39.1	174.5	-72.4	177	0	0	0	112.3	W227 E228 L229 L234 S235	W227-L231 HydrophobicContact CE3-CD1 3.55Å; W227-L231 HydrophobicContact CE3-CG 4.42Å; W227-L231 HydrophobicContact CZ3-CD1 3.59Å; W227-L231 WeakPolarHBondContact O-CG 3.29Å; W227-L231 PolarHBondContact O-N 3.23Å; E228-L231 PolarHBondContact O-N 3.46Å; L229-L231 VanDerWaalsContact C-N 3.34Å; L229-L231 PolarHBondContact O-N 3.25Å; L231-L234 PolarHBondContact O-N 2.87Å; L231-S235 WeakPolarHBondContact O-CB 3.48Å; L231-S235 PolarHBondContact O-N 3.22Å; L231-S235 PolarHBondContact O-OG 3.07Å
232	C	98.7	Very high	97.5	Very high	17 Å²	17	48.5 Å²	48.5	12%	0.115	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-46.5	173	-68.8	0	0	0	0	111.1	A158 L161 E228 L229 L234 S235 C236	A158-C232 HydrophobicContact CB-CB 4.06Å; A158-C232 WeakPolarHBondContact O-CB 3.49Å; L161-C232 HydrophobicContact CB-CB 4.3Å; L161-C232 HydrophobicContact CD2-CB 4.27Å; L161-C232 HydrophobicContact CG-CB 4.45Å; E228-C232 PolarHBondContact O-N 3.5Å; E228-C232 VanDerWaalsContact O-N 3.09Å; E228-C232 PolarHBondContact O-SG 3.18Å; L229-C232 PolarHBondContact O-N 3.06Å; C232-L234 PolarHBondContact O-N 2.87Å; C232-S235 PolarHBondContact O-N 3.26Å; C232-C236 WeakPolarHBondContact O-CB 3.24Å; C232-C236 PolarHBondContact O-N 2.96Å; C232-C236 PolarHBondContact O-SG 3.45Å
233	L	98.7	Very high	97.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.3	-43.6	177.9	-176.7	63.9	0	0	0	111.6	Q154 V155 A158 L229 S230 C236 W237 F451 L455 V458	Q154-L233 HydrophobicContact CB-CD1 4.17Å; Q154-L233 HydrophobicContact CG-CD1 3.78Å; V155-L233 HydrophobicContact CG2-CD1 4.25Å; A158-L233 HydrophobicContact CB-CB 4.12Å; A158-L233 HydrophobicContact CB-CD1 4.3Å; L229-L233 WeakPolarHBondContact O-CB 3.25Å; L229-L233 PolarHBondContact O-N 3.33Å; S230-L233 PolarHBondContact O-N 2.98Å; L233-C236 WeakPolarHBondContact O-CB 3.38Å; L233-C236 PolarHBondContact O-N 2.94Å; L233-W237 VanDerWaalsContact O-CD1 3.24Å; L233-W237 PolarHBondContact O-N 3.17Å; L233-F451 HydrophobicContact CB-CE2 4.48Å; L233-F451 HydrophobicContact CD2-CD2 4.18Å; L233-F451 HydrophobicContact CD2-CE2 4.41Å; L233-F451 HydrophobicContact CG-CD2 4.02Å; L233-F451 HydrophobicContact CG-CE2 4.38Å; L233-L455 HydrophobicContact CD2-CD2 4.45Å; L233-V458 HydrophobicContact CD2-CG1 4.21Å
234	L	98.7	Very high	97.8	Very high	66 Å²	66	43.2 Å²	43.2	35%	0.346	24%	0.242	S	C	.	.	H	α-helix	trans	-60.6	-47.6	175.2	-178.9	61.6	0	0	0	111.5	S230 L231 C232 C236 W237 I238 F451	S230-L234 WeakPolarHBondContact O-CB 3.39Å; S230-L234 PolarHBondContact O-N 2.67Å; L231-L234 PolarHBondContact O-N 2.87Å; C232-L234 PolarHBondContact O-N 2.87Å; L234-C236 VanDerWaalsContact C-N 3.31Å; L234-C236 PolarHBondContact O-N 2.73Å; L234-W237 PolarHBondContact O-N 3.1Å; L234-I238 HydrophobicContact CD1-CD1 4.37Å; L234-I238 HydrophobicContact CG-CD1 4.05Å; L234-I238 WeakPolarHBondContact O-CG1 3.34Å; L234-I238 PolarHBondContact O-N 3.38Å; L234-F451 HydrophobicContact CB-CD2 4.09Å; L234-F451 HydrophobicContact CB-CE2 3.6Å; L234-F451 HydrophobicContact CB-CZ 4.14Å; L234-F451 HydrophobicContact CD1-CD1 4.36Å; L234-F451 HydrophobicContact CD1-CD2 4.13Å; L234-F451 HydrophobicContact CD1-CE1 4.3Å; L234-F451 HydrophobicContact CD1-CE2 4.09Å; L234-F451 HydrophobicContact CD1-CG 4.27Å; L234-F451 HydrophobicContact CD1-CZ 4.17Å; L234-F451 HydrophobicContact CG-CE2 4.4Å
235	S	98.7	Very high	97.8	Very high	52 Å²	52	41.6 Å²	41.6	36%	0.364	22%	0.222	S	C	.	.	H	α-helix	trans	-61	-42.4	179	-59	0	0	0	0	111.5	L231 C232 I238 L239	L231-S235 WeakPolarHBondContact O-CB 3.48Å; L231-S235 PolarHBondContact O-N 3.22Å; L231-S235 PolarHBondContact O-OG 3.07Å; C232-S235 PolarHBondContact O-N 3.26Å; S235-I238 PolarHBondContact O-N 3.43Å; S235-L239 WeakPolarHBondContact O-CG 3.33Å; S235-L239 PolarHBondContact O-N 3.02Å
236	C	98.8	Very high	97.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-57.7	-47.8	173.1	-84.9	0	0	0	0	112.4	Q154 C232 L233 L234 I238 L239 C240 F409	Q154-C236 HydrophobicContact CG-CB 4.08Å; Q154-C236 VanDerWaalsContact NE2-CB 3.35Å; C232-C236 WeakPolarHBondContact O-CB 3.24Å; C232-C236 PolarHBondContact O-N 2.96Å; C232-C236 PolarHBondContact O-SG 3.45Å; L233-C236 WeakPolarHBondContact O-CB 3.38Å; L233-C236 PolarHBondContact O-N 2.94Å; L234-C236 VanDerWaalsContact C-N 3.31Å; L234-C236 PolarHBondContact O-N 2.73Å; C236-I238 VanDerWaalsContact C-N 3.35Å; C236-I238 PolarHBondContact O-N 3.45Å; C236-L239 PolarHBondContact O-N 2.75Å; C236-C240 WeakPolarHBondContact O-CB 3.45Å; C236-C240 PolarHBondContact O-N 3.35Å; C236-C240 PolarHBondContact O-SG 3.35Å; C236-C240 VanDerWaalsContact O-SG 3.41Å; C236-F409 HydrophobicContact CB-CE1 4.28Å; C236-F409 HydrophobicContact CB-CZ 4.36Å
237	W	98.7	Very high	97.6	Very high	6 Å²	6	45.1 Å²	45.1	2%	0.023	23%	0.227	C	C	.	.	H	α-helix	trans	-65.7	-34.7	176.9	-82.4	112.3	0	0	0	113.4	N150 Q154 L233 L234 C240 G241 L416 C447 N450 F451	N150-W237 HydrophobicContact CB-CH2 4.15Å; N150-W237 WeakPolarHBondContact O-CZ2 3.32Å; Q154-W237 HydrophobicContact CB-CZ2 3.85Å; Q154-W237 HydrophobicContact CG-CD2 4.27Å; Q154-W237 HydrophobicContact CG-CG 4.48Å; Q154-W237 HydrophobicContact CG-CZ2 3.93Å; L233-W237 VanDerWaalsContact O-CD1 3.24Å; L233-W237 PolarHBondContact O-N 3.17Å; L234-W237 PolarHBondContact O-N 3.1Å; W237-C240 HydrophobicContact CE3-CB 4.47Å; W237-G241 PolarHBondContact O-N 2.94Å; W237-L416 HydrophobicContact CZ3-CD1 4.03Å; W237-L416 HydrophobicContact CZ3-CD2 4.06Å; W237-C447 HydrophobicContact CE3-CB 3.86Å; W237-N450 HydrophobicContact CD2-CB 4.27Å; W237-N450 HydrophobicContact CE3-CB 4.33Å; W237-N450 HydrophobicContact CH2-CB 3.35Å; W237-N450 HydrophobicContact CZ2-CB 3.23Å; W237-N450 HydrophobicContact CZ3-CB 3.9Å; W237-F451 HydrophobicContact CB-CB 4.44Å; W237-F451 HydrophobicContact CG-CB 4.01Å
238	I	98.6	Very high	97.4	Very high	93 Å²	93	37.5 Å²	37.5	48%	0.477	20%	0.2	S	C	.	.	H	α-helix	trans	-63	-48.9	172.9	-68.7	166.3	0	0	0	110	L234 S235 C236 G241 L242	L234-I238 HydrophobicContact CD1-CD1 4.37Å; L234-I238 HydrophobicContact CG-CD1 4.05Å; L234-I238 WeakPolarHBondContact O-CG1 3.34Å; L234-I238 PolarHBondContact O-N 3.38Å; S235-I238 PolarHBondContact O-N 3.43Å; C236-I238 VanDerWaalsContact C-N 3.35Å; C236-I238 PolarHBondContact O-N 3.45Å; I238-G241 PolarHBondContact O-N 3.11Å; I238-L242 HydrophobicContact CG2-CD1 4.09Å; I238-L242 VanDerWaalsContact O-CG 3.28Å; I238-L242 WeakPolarHBondContact O-CG 3.36Å; I238-L242 PolarHBondContact O-N 3.44Å
239	L	98.2	Very high	97.2	Very high	82 Å²	82	39.7 Å²	39.7	43%	0.429	21%	0.21	S	C	.	.	H	α-helix	trans	-62.3	-43.8	178.6	-70	172.6	0	0	0	111.9	S235 C236 L242 A243 F409	S235-L239 WeakPolarHBondContact O-CG 3.33Å; S235-L239 PolarHBondContact O-N 3.02Å; C236-L239 PolarHBondContact O-N 2.75Å; L239-L242 PolarHBondContact O-N 2.93Å; L239-A243 WeakPolarHBondContact O-CB 3.22Å; L239-A243 PolarHBondContact O-N 3.33Å; L239-F409 HydrophobicContact CB-CE1 4.17Å; L239-F409 HydrophobicContact CB-CZ 4.11Å; L239-F409 HydrophobicContact CD1-CE2 4.05Å; L239-F409 HydrophobicContact CD1-CZ 3.71Å
240	C	98.1	Very high	97.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-48.1	173.6	-74.4	0	0	0	0	112.3	Q154 C236 W237 L242 A243 V244 F413 L416	Q154-C240 PolarHBondContact OE1-SG 3.18Å; C236-C240 WeakPolarHBondContact O-CB 3.45Å; C236-C240 PolarHBondContact O-N 3.35Å; C236-C240 PolarHBondContact O-SG 3.35Å; C236-C240 VanDerWaalsContact O-SG 3.41Å; W237-C240 HydrophobicContact CE3-CB 4.47Å; C240-L242 VanDerWaalsContact C-N 3.31Å; C240-L242 PolarHBondContact O-N 2.87Å; C240-A243 PolarHBondContact O-N 3.47Å; C240-A243 VanDerWaalsContact O-N 3.15Å; C240-V244 WeakPolarHBondContact O-CG2 3.47Å; C240-V244 PolarHBondContact O-N 3.43Å; C240-F413 HydrophobicContact CB-CD1 4.17Å; C240-F413 HydrophobicContact CB-CE1 4.12Å; C240-F413 VanDerWaalsContact SG-CE1 3.51Å; C240-L416 HydrophobicContact CB-CD2 4.09Å
241	G	97.9	Very high	97	Very high	9 Å²	9	39.5 Å²	39.5	9%	0.093	21%	0.209	C	C	.	.	H	α-helix	trans	-57.8	-43.1	177.6	0	0	0	0	0	112.4	W237 I238 V244 I245	W237-G241 PolarHBondContact O-N 2.94Å; I238-G241 PolarHBondContact O-N 3.11Å; G241-V244 PolarHBondContact O-N 2.94Å; G241-I245 WeakPolarHBondContact O-CA 3.27Å; G241-I245 VanDerWaalsContact O-CB 3.29Å; G241-I245 WeakPolarHBondContact O-CB 3.22Å; G241-I245 PolarHBondContact O-N 3.22Å
242	L	97.5	Very high	96.8	Very high	102 Å²	102	35.2 Å²	35.2	53%	0.534	19%	0.186	S	C	.	.	H	α-helix	trans	-64.9	-41	175.3	-69.7	173.7	0	0	0	112.4	I238 L239 C240 V244 I245	I238-L242 HydrophobicContact CG2-CD1 4.09Å; I238-L242 VanDerWaalsContact O-CG 3.28Å; I238-L242 WeakPolarHBondContact O-CG 3.36Å; I238-L242 PolarHBondContact O-N 3.44Å; L239-L242 PolarHBondContact O-N 2.93Å; C240-L242 VanDerWaalsContact C-N 3.31Å; C240-L242 PolarHBondContact O-N 2.87Å; L242-V244 VanDerWaalsContact C-N 3.34Å; L242-V244 PolarHBondContact O-N 3.1Å; L242-I245 VanDerWaalsContact O-CG2 3.24Å; L242-I245 WeakPolarHBondContact O-CG2 3.4Å; L242-I245 PolarHBondContact O-N 2.94Å
243	A	97.5	Very high	96.7	Very high	6 Å²	6	40.5 Å²	40.5	5%	0.05	21%	0.207	C	C	.	.	H	α-helix	trans	-64.7	-36.2	179.4	0	0	0	0	0	112.6	L239 C240 S250 L251 V254 F413	L239-A243 WeakPolarHBondContact O-CB 3.22Å; L239-A243 PolarHBondContact O-N 3.33Å; C240-A243 PolarHBondContact O-N 3.47Å; C240-A243 VanDerWaalsContact O-N 3.15Å; A243-S250 CarbonylContact O-C 3.57Å; A243-S250 WeakPolarHBondContact O-CB 3.37Å; A243-S250 PolarHBondContact O-OG 2.92Å; A243-L251 PolarHBondContact O-N 3.08Å; A243-V254 HydrophobicContact CB-CG1 4.44Å; A243-V254 HydrophobicContact CB-CG2 4.31Å; A243-F413 HydrophobicContact CB-CD1 3.73Å; A243-F413 HydrophobicContact CB-CD2 4.02Å; A243-F413 HydrophobicContact CB-CE1 3.54Å; A243-F413 HydrophobicContact CB-CE2 3.82Å; A243-F413 HydrophobicContact CB-CG 3.97Å; A243-F413 HydrophobicContact CB-CZ 3.55Å
244	V	96.6	Very high	96.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	9.2	-179.6	-51.3	0	0	0	0	113.9	C240 G241 L242 K246 G247 F413 L416 L420 R443	C240-V244 WeakPolarHBondContact O-CG2 3.47Å; C240-V244 PolarHBondContact O-N 3.43Å; G241-V244 PolarHBondContact O-N 2.94Å; L242-V244 VanDerWaalsContact C-N 3.34Å; L242-V244 PolarHBondContact O-N 3.1Å; V244-K246 PolarHBondContact O-N 2.75Å; V244-K246 VanDerWaalsContact O-N 3.17Å; V244-G247 WeakPolarHBondContact O-CA 3.35Å; V244-G247 PolarHBondContact O-N 3.32Å; V244-F413 HydrophobicContact CG1-CB 4.1Å; V244-L416 HydrophobicContact CG1-CD2 4.36Å; V244-L416 HydrophobicContact CG2-CD2 3.62Å; V244-L416 HydrophobicContact CG2-CG 4.14Å; V244-L420 HydrophobicContact CG2-CD1 3.82Å; V244-R443 PolarHBondContact O-NH1 3.47Å
245	I	96.2	Very high	96.6	Very high	46 Å²	46	39.9 Å²	39.9	24%	0.236	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-31.3	-171.1	-159.5	169.5	0	0	0	113.2	G241 L242 S250 I440	G241-I245 WeakPolarHBondContact O-CA 3.27Å; G241-I245 VanDerWaalsContact O-CB 3.29Å; G241-I245 WeakPolarHBondContact O-CB 3.22Å; G241-I245 PolarHBondContact O-N 3.22Å; L242-I245 VanDerWaalsContact O-CG2 3.24Å; L242-I245 WeakPolarHBondContact O-CG2 3.4Å; L242-I245 PolarHBondContact O-N 2.94Å; I245-S250 PolarHBondContact N-OG 3.33Å; I245-I440 HydrophobicContact CD1-CG2 4.02Å; I245-I440 HydrophobicContact CG1-CG1 4.33Å; I245-I440 HydrophobicContact CG1-CG2 3.88Å
246	K	93.6	Very high	96.5	Very high	146 Å²	146	41.5 Å²	41.5	64%	0.635	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106	22.7	174.4	-59.8	-175.7	178.1	179.7	0	112.2	V244 Q249 S250	V244-K246 PolarHBondContact O-N 2.75Å; V244-K246 VanDerWaalsContact O-N 3.17Å; K246-Q249 HydrophobicContact CB-CB 4.41Å; K246-S250 PolarHBondContact N-OG 3.46Å; K246-S250 VanDerWaalsContact N-OG 3.1Å
247	G	93.3	Very high	96.4	Very high	4 Å²	4	46.7 Å²	46.7	4%	0.041	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	-140.4	-174	0	0	0	0	0	112.3	V244 Q249 S250 L251	V244-G247 WeakPolarHBondContact O-CA 3.35Å; V244-G247 PolarHBondContact O-N 3.32Å; G247-Q249 PolarHBondContact O-N 2.91Å; G247-S250 PolarHBondContact O-N 2.92Å; G247-S250 VanDerWaalsContact O-N 3.17Å; G247-S250 PolarHBondContact O-OG 3.42Å; G247-L251 PolarHBondContact O-N 3.39Å; G247-L251 VanDerWaalsContact O-N 3.09Å
248	V	93.6	Very high	96.3	Very high	8 Å²	8	46.8 Å²	46.8	5%	0.048	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-23.9	-177.5	-64.5	0	0	0	0	114.7	W60 G252 Y324 E417	W60-V248 HydrophobicContact CE3-CB 4.06Å; W60-V248 HydrophobicContact CH2-CB 3.98Å; W60-V248 HydrophobicContact CH2-CG1 3.9Å; W60-V248 HydrophobicContact CZ2-CG1 4.35Å; W60-V248 HydrophobicContact CZ3-CB 3.71Å; W60-V248 HydrophobicContact CZ3-CG1 4.16Å; V248-G252 PolarHBondContact O-N 2.88Å; V248-Y324 HydrophobicContact CB-CD1 4.49Å; V248-Y324 HydrophobicContact CB-CD2 4.5Å; V248-Y324 HydrophobicContact CB-CG 4.37Å; V248-Y324 HydrophobicContact CG1-CD1 4.05Å; V248-Y324 HydrophobicContact CG1-CD2 3.42Å; V248-Y324 VanDerWaalsContact CG1-CD2 3.42Å; V248-Y324 HydrophobicContact CG1-CE1 4.05Å; V248-Y324 HydrophobicContact CG1-CE2 3.46Å; V248-Y324 VanDerWaalsContact CG1-CE2 3.46Å; V248-Y324 HydrophobicContact CG1-CG 3.73Å; V248-Y324 HydrophobicContact CG2-CD1 3.7Å; V248-Y324 HydrophobicContact CG2-CE1 3.98Å; V248-Y324 HydrophobicContact CG2-CG 3.99Å; V248-E417 HydrophobicContact CG1-CG 4.29Å
249	Q	93.1	Very high	96.2	Very high	85 Å²	85	42.5 Å²	42.5	40%	0.397	21%	0.207	S	C	.	.	H	α-helix	trans	-71.2	-32.2	179.9	-65.8	-175.9	-11	0	0	113.8	K246 G247 K253	K246-Q249 HydrophobicContact CB-CB 4.41Å; G247-Q249 PolarHBondContact O-N 2.91Å; Q249-K253 WeakPolarHBondContact O-CE 3.39Å; Q249-K253 WeakPolarHBondContact O-CG 3.32Å
250	S	95.2	Very high	96.1	Very high	17 Å²	17	41.9 Å²	41.9	12%	0.119	21%	0.206	C	C	.	.	H	α-helix	trans	-88.3	-39.7	172.6	52.8	0	0	0	0	110.8	A243 I245 K246 G247 G252 K253 V254	A243-S250 CarbonylContact O-C 3.57Å; A243-S250 WeakPolarHBondContact O-CB 3.37Å; A243-S250 PolarHBondContact O-OG 2.92Å; I245-S250 PolarHBondContact N-OG 3.33Å; K246-S250 PolarHBondContact N-OG 3.46Å; K246-S250 VanDerWaalsContact N-OG 3.1Å; G247-S250 PolarHBondContact O-N 2.92Å; G247-S250 VanDerWaalsContact O-N 3.17Å; G247-S250 PolarHBondContact O-OG 3.42Å; S250-G252 PolarHBondContact O-N 3.12Å; S250-K253 PolarHBondContact O-N 3.37Å; S250-V254 WeakPolarHBondContact O-CG2 3.18Å; S250-V254 PolarHBondContact O-N 3.44Å; S250-V254 VanDerWaalsContact O-N 3.15Å
251	L	96.2	Very high	96	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-54.5	-54	176.8	174.1	52	0	0	0	111.3	T69 A243 G247 K253 V254 S255 F413 E417	T69-L251 HydrophobicContact CG2-CD1 4.27Å; T69-L251 HydrophobicContact CG2-CD2 3.85Å; T69-L251 HydrophobicContact CG2-CG 3.88Å; A243-L251 PolarHBondContact O-N 3.08Å; G247-L251 PolarHBondContact O-N 3.39Å; G247-L251 VanDerWaalsContact O-N 3.09Å; L251-K253 PolarHBondContact O-N 3.29Å; L251-K253 VanDerWaalsContact O-N 3.09Å; L251-V254 PolarHBondContact O-N 3.28Å; L251-S255 PolarHBondContact O-N 3.22Å; L251-S255 PolarHBondContact O-OG 3.47Å; L251-F413 HydrophobicContact CD1-CB 3.41Å; L251-F413 VanDerWaalsContact CD1-CB 3.41Å; L251-F413 HydrophobicContact CD1-CD2 4.13Å; L251-F413 HydrophobicContact CD1-CG 4.2Å; L251-E417 HydrophobicContact CD2-CB 4.14Å; L251-E417 HydrophobicContact CD2-CG 4.42Å
252	G	95.8	Very high	95.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-55.5	-32.9	-179.1	0	0	0	0	0	114.3	V248 S250 Y256	V248-G252 PolarHBondContact O-N 2.88Å; S250-G252 PolarHBondContact O-N 3.12Å; G252-Y256 WeakPolarHBondContact O-CD2 3.37Å
253	K	96.5	Very high	95.9	Very high	128 Å²	128	42 Å²	42	56%	0.557	20%	0.199	S	C	*	.	H	α-helix	trans	-73	-44.3	177.3	-65.4	178.7	-175.7	-178.3	0	112	Q249 S250 L251 S255 Y256	Q249-K253 WeakPolarHBondContact O-CE 3.39Å; Q249-K253 WeakPolarHBondContact O-CG 3.32Å; S250-K253 PolarHBondContact O-N 3.37Å; L251-K253 PolarHBondContact O-N 3.29Å; L251-K253 VanDerWaalsContact O-N 3.09Å; K253-S255 VanDerWaalsContact C-N 3.26Å; K253-S255 PolarHBondContact O-N 3.39Å; K253-Y256 PolarHBondContact O-N 2.93Å
254	V	97	Very high	95.9	Very high	49 Å²	49	45.8 Å²	45.8	30%	0.297	22%	0.218	S	C	.	.	H	α-helix	trans	-67.8	-30.7	177.1	-179.8	0	0	0	0	110.8	A243 S250 L251 Y256 F257 T258 F413	A243-V254 HydrophobicContact CB-CG1 4.44Å; A243-V254 HydrophobicContact CB-CG2 4.31Å; S250-V254 WeakPolarHBondContact O-CG2 3.18Å; S250-V254 PolarHBondContact O-N 3.44Å; S250-V254 VanDerWaalsContact O-N 3.15Å; L251-V254 PolarHBondContact O-N 3.28Å; V254-Y256 VanDerWaalsContact C-N 3.27Å; V254-Y256 PolarHBondContact O-N 3.46Å; V254-F257 PolarHBondContact O-N 3.22Å; V254-F257 VanDerWaalsContact O-N 3.16Å; V254-T258 HydrophobicContact CG1-CG2 4.04Å; V254-T258 PolarHBondContact O-N 3.26Å; V254-T258 PolarHBondContact O-OG1 3.09Å; V254-T258 VanDerWaalsContact O-OG1 3.12Å; V254-F413 HydrophobicContact CB-CE2 4.5Å; V254-F413 HydrophobicContact CG1-CD2 4.16Å; V254-F413 HydrophobicContact CG1-CE2 3.47Å; V254-F413 VanDerWaalsContact CG1-CE2 3.47Å; V254-F413 HydrophobicContact CG1-CZ 4.25Å
255	S	96.8	Very high	95.8	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-59.2	-31.2	177.4	-62.5	0	0	0	0	113.9	T69 L251 K253 F257 T258 S259	T69-S255 WeakPolarHBondContact CA-OG 3.49Å; T69-S255 WeakPolarHBondContact OG1-CB 3.43Å; T69-S255 PolarHBondContact OG1-OG 3.13Å; L251-S255 PolarHBondContact O-N 3.22Å; L251-S255 PolarHBondContact O-OG 3.47Å; K253-S255 VanDerWaalsContact C-N 3.26Å; K253-S255 PolarHBondContact O-N 3.39Å; S255-F257 VanDerWaalsContact C-N 3.34Å; S255-F257 PolarHBondContact O-N 3.19Å; S255-T258 VanDerWaalsContact CA-OG1 3.29Å; S255-T258 WeakPolarHBondContact CA-OG1 3.31Å; S255-T258 PolarHBondContact O-N 3.43Å; S255-S259 WeakPolarHBondContact O-CB 3.36Å; S255-S259 PolarHBondContact O-N 3.06Å; S255-S259 PolarHBondContact O-OG 3.36Å
256	Y	96.7	Very high	95.8	Very high	86 Å²	86	44 Å²	44	34%	0.337	21%	0.209	S	C	.	.	H	α-helix	trans	-59.5	-45.6	175.1	-76.3	-78.2	0	0	0	111.9	L64 E65 M68 G252 K253 V254 V260	L64-Y256 HydrophobicContact CB-CE1 3.86Å; L64-Y256 HydrophobicContact CD1-CE1 4.48Å; E65-Y256 HydrophobicContact CG-CE2 3.58Å; M68-Y256 HydrophobicContact CG-CD1 3.86Å; M68-Y256 HydrophobicContact CG-CE1 4.06Å; M68-Y256 HydrophobicContact CG-CG 4.44Å; G252-Y256 WeakPolarHBondContact O-CD2 3.37Å; K253-Y256 PolarHBondContact O-N 2.93Å; V254-Y256 VanDerWaalsContact C-N 3.27Å; V254-Y256 PolarHBondContact O-N 3.46Å; Y256-V260 VanDerWaalsContact O-CB 3.29Å; Y256-V260 WeakPolarHBondContact O-CB 3.41Å; Y256-V260 WeakPolarHBondContact O-CG2 3.42Å; Y256-V260 PolarHBondContact O-N 2.91Å
257	F	97.1	Very high	96	Very high	110 Å²	110	39.8 Å²	39.8	48%	0.482	20%	0.195	S	C	.	.	H	α-helix	trans	-70.1	-51.7	177.2	174.7	-102.4	0	0	0	110.3	V254 S255 S259 V260 F261 T406	V254-F257 PolarHBondContact O-N 3.22Å; V254-F257 VanDerWaalsContact O-N 3.16Å; S255-F257 VanDerWaalsContact C-N 3.34Å; S255-F257 PolarHBondContact O-N 3.19Å; F257-S259 PolarHBondContact O-N 2.87Å; F257-V260 PolarHBondContact O-N 2.89Å; F257-F261 HydrophobicContact CD2-CB 4Å; F257-F261 HydrophobicContact CD2-CD2 4.41Å; F257-F261 HydrophobicContact CD2-CG 4.29Å; F257-F261 HydrophobicContact CE2-CB 3.72Å; F257-F261 HydrophobicContact CE2-CD1 4.15Å; F257-F261 AromaticContact CE2-CD2 3.56Å; F257-F261 HydrophobicContact CE2-CD2 3.56Å; F257-F261 HydrophobicContact CE2-CE2 4.19Å; F257-F261 AromaticContact CE2-CG 3.53Å; F257-F261 HydrophobicContact CE2-CG 3.53Å; F257-F261 HydrophobicContact CZ-CB 4Å; F257-F261 AromaticContact CZ-CD1 3.79Å; F257-F261 HydrophobicContact CZ-CD1 3.79Å; F257-F261 HydrophobicContact CZ-CD2 4.04Å; F257-F261 HydrophobicContact CZ-CE1 4.28Å; F257-F261 HydrophobicContact CZ-CE2 4.49Å; F257-F261 AromaticContact CZ-CG 3.66Å; F257-F261 HydrophobicContact CZ-CG 3.66Å; F257-F261 WeakPolarHBondContact O-CB 3.48Å; F257-F261 PolarHBondContact O-N 3.35Å; F257-T406 HydrophobicContact CD1-CG2 4.35Å; F257-T406 HydrophobicContact CE1-CG2 4.04Å
258	T	96.7	Very high	96.1	Very high	7 Å²	7	42.7 Å²	42.7	4%	0.043	21%	0.209	C	C	.	.	H	α-helix	trans	-66.5	-24.3	-172.1	50.8	0	0	0	0	114.4	V254 S255 P262 T406 F413	V254-T258 HydrophobicContact CG1-CG2 4.04Å; V254-T258 PolarHBondContact O-N 3.26Å; V254-T258 PolarHBondContact O-OG1 3.09Å; V254-T258 VanDerWaalsContact O-OG1 3.12Å; S255-T258 VanDerWaalsContact CA-OG1 3.29Å; S255-T258 WeakPolarHBondContact CA-OG1 3.31Å; S255-T258 PolarHBondContact O-N 3.43Å; T258-P262 WeakPolarHBondContact O-CD 3.32Å; T258-P262 WeakPolarHBondContact O-CG 3.49Å; T258-T406 VanDerWaalsContact CA-CG2 3.42Å; T258-T406 HydrophobicContact CG2-CG2 4.04Å; T258-T406 WeakPolarHBondContact O-CG2 3.46Å; T258-F413 HydrophobicContact CG2-CE2 4.01Å
259	S	96	Very high	96.1	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-91.4	-32.7	178.6	-50.1	0	0	0	0	113	M68 G72 S255 F257 Y263	M68-S259 PolarHBondContact O-OG 3.3Å; G72-S259 PolarHBondContact N-OG 2.95Å; S255-S259 WeakPolarHBondContact O-CB 3.36Å; S255-S259 PolarHBondContact O-N 3.06Å; S255-S259 PolarHBondContact O-OG 3.36Å; F257-S259 PolarHBondContact O-N 2.87Å; S259-Y263 WeakPolarHBondContact O-CD2 3.05Å; S259-Y263 WeakPolarHBondContact O-CE2 3.29Å
260	V	96.2	Very high	96.2	Very high	69 Å²	69	40.5 Å²	40.5	42%	0.418	20%	0.199	S	C	.	.	H	α-helix	trans	-88	-43	-176	176.6	0	0	0	0	111.7	M68 Y256 F257 P262 Y263	M68-V260 HydrophobicContact SD-CG2 4.12Å; Y256-V260 VanDerWaalsContact O-CB 3.29Å; Y256-V260 WeakPolarHBondContact O-CB 3.41Å; Y256-V260 WeakPolarHBondContact O-CG2 3.42Å; Y256-V260 PolarHBondContact O-N 2.91Å; F257-V260 PolarHBondContact O-N 2.89Å; V260-P262 VanDerWaalsContact C-CD 3.45Å; V260-Y263 PolarHBondContact O-N 3.13Å; V260-Y263 VanDerWaalsContact O-N 3.12Å
261	F	96.7	Very high	96.3	Very high	47 Å²	47	44.4 Å²	44.4	21%	0.206	22%	0.218	C	C	.	.	H	α-helix	trans	-58.9	-38	-173.4	-172.2	-100.8	0	0	0	114.2	F257 Y263 I264 M265 T402 T406	F257-F261 HydrophobicContact CD2-CB 4Å; F257-F261 HydrophobicContact CD2-CD2 4.41Å; F257-F261 HydrophobicContact CD2-CG 4.29Å; F257-F261 HydrophobicContact CE2-CB 3.72Å; F257-F261 HydrophobicContact CE2-CD1 4.15Å; F257-F261 AromaticContact CE2-CD2 3.56Å; F257-F261 HydrophobicContact CE2-CD2 3.56Å; F257-F261 HydrophobicContact CE2-CE2 4.19Å; F257-F261 AromaticContact CE2-CG 3.53Å; F257-F261 HydrophobicContact CE2-CG 3.53Å; F257-F261 HydrophobicContact CZ-CB 4Å; F257-F261 AromaticContact CZ-CD1 3.79Å; F257-F261 HydrophobicContact CZ-CD1 3.79Å; F257-F261 HydrophobicContact CZ-CD2 4.04Å; F257-F261 HydrophobicContact CZ-CE1 4.28Å; F257-F261 HydrophobicContact CZ-CE2 4.49Å; F257-F261 AromaticContact CZ-CG 3.66Å; F257-F261 HydrophobicContact CZ-CG 3.66Å; F257-F261 WeakPolarHBondContact O-CB 3.48Å; F257-F261 PolarHBondContact O-N 3.35Å; F261-Y263 VanDerWaalsContact C-N 3.25Å; F261-Y263 PolarHBondContact O-N 2.93Å; F261-I264 HydrophobicContact CD2-CD1 4.42Å; F261-I264 WeakPolarHBondContact O-CB 3.39Å; F261-I264 PolarHBondContact O-N 3.49Å; F261-I264 VanDerWaalsContact O-N 3.12Å; F261-M265 HydrophobicContact CD1-CG 3.94Å; F261-M265 HydrophobicContact CE1-CE 4.19Å; F261-M265 HydrophobicContact CE1-CG 3.49Å; F261-M265 VanDerWaalsContact CE1-CG 3.49Å; F261-M265 HydrophobicContact CE1-SD 3.82Å; F261-M265 HydrophobicContact CE2-CE 3.83Å; F261-M265 HydrophobicContact CE2-SD 4.49Å; F261-M265 HydrophobicContact CZ-CE 3.6Å; F261-M265 HydrophobicContact CZ-CG 3.92Å; F261-M265 HydrophobicContact CZ-SD 3.68Å; F261-M265 PolarHBondContact O-N 2.78Å; F261-M265 VanDerWaalsContact O-N 3.14Å; F261-T402 HydrophobicContact CD1-CG2 4.48Å; F261-T402 HydrophobicContact CE1-CG2 3.54Å; F261-T402 HydrophobicContact CZ-CG2 4.16Å; F261-T406 HydrophobicContact CB-CG2 4.32Å; F261-T406 HydrophobicContact CD1-CG2 4.31Å
262	P	96.3	Very high	96.3	Very high	2 Å²	2	47 Å²	47	1%	0.013	23%	0.227	C	C	.	.	H	α-helix	trans	-58.4	-33.1	175.9	-27.1	37	0	0	0	114.1	T258 V260 M265 L266 M403 T406 L407	T258-P262 WeakPolarHBondContact O-CD 3.32Å; T258-P262 WeakPolarHBondContact O-CG 3.49Å; V260-P262 VanDerWaalsContact C-CD 3.45Å; P262-M265 PolarHBondContact O-N 2.91Å; P262-L266 WeakPolarHBondContact O-CB 3.25Å; P262-L266 VanDerWaalsContact O-CG 3.3Å; P262-L266 WeakPolarHBondContact O-CG 3.47Å; P262-L266 PolarHBondContact O-N 3.42Å; P262-M403 HydrophobicContact CB-CG 4.2Å; P262-T406 HydrophobicContact CG-CG2 3.78Å; P262-L407 HydrophobicContact CB-CD1 4.34Å; P262-L407 HydrophobicContact CB-CD2 3.53Å; P262-L407 HydrophobicContact CB-CG 3.79Å; P262-L407 HydrophobicContact CG-CD2 3.55Å; P262-L407 HydrophobicContact CG-CG 3.81Å
263	Y	96.6	Very high	96.2	Very high	65 Å²	65	47 Å²	47	26%	0.255	23%	0.227	S	C	.	.	H	α-helix	trans	-69.6	-36.2	177.2	-64.5	-74.3	0	0	0	112.6	I71 S259 V260 F261 M265 T267 I341 T345	I71-Y263 HydrophobicContact CG2-CE2 4.33Å; S259-Y263 WeakPolarHBondContact O-CD2 3.05Å; S259-Y263 WeakPolarHBondContact O-CE2 3.29Å; V260-Y263 PolarHBondContact O-N 3.13Å; V260-Y263 VanDerWaalsContact O-N 3.12Å; F261-Y263 VanDerWaalsContact C-N 3.25Å; F261-Y263 PolarHBondContact O-N 2.93Å; Y263-M265 VanDerWaalsContact C-N 3.29Å; Y263-M265 PolarHBondContact O-N 3.36Å; Y263-T267 VanDerWaalsContact O-CB 3.3Å; Y263-T267 WeakPolarHBondContact O-CB 3.3Å; Y263-T267 PolarHBondContact O-N 3.2Å; Y263-T267 PolarHBondContact O-OG1 3.17Å; Y263-I341 WeakPolarHBondContact OH-CG2 3.27Å; Y263-T345 HydrophobicContact CE1-CG2 4Å; Y263-T345 WeakPolarHBondContact CE1-OG1 3.49Å; Y263-T345 PolarHBondContact OH-OG1 3.28Å
264	I	97.2	Very high	96.2	Very high	85 Å²	85	43.6 Å²	43.6	44%	0.436	22%	0.223	S	C	.	.	H	α-helix	trans	-60.2	-46.9	173.1	-55.1	177.1	0	0	0	108.6	F261 T267 I268	F261-I264 HydrophobicContact CD2-CD1 4.42Å; F261-I264 WeakPolarHBondContact O-CB 3.39Å; F261-I264 PolarHBondContact O-N 3.49Å; F261-I264 VanDerWaalsContact O-N 3.12Å; I264-T267 PolarHBondContact O-N 2.94Å; I264-I268 HydrophobicContact CG2-CD1 4.07Å; I264-I268 WeakPolarHBondContact O-CG1 3.4Å; I264-I268 PolarHBondContact O-N 3.32Å
265	M	95.9	Very high	96.2	Very high	10 Å²	10	47.4 Å²	47.4	5%	0.049	24%	0.242	C	C	.	.	H	α-helix	trans	-67.5	-47.4	-179.7	-62.4	-60.1	98.3	0	0	112.7	F261 P262 Y263 T267 I268 L269 L399 M403	F261-M265 HydrophobicContact CD1-CG 3.94Å; F261-M265 HydrophobicContact CE1-CE 4.19Å; F261-M265 HydrophobicContact CE1-CG 3.49Å; F261-M265 VanDerWaalsContact CE1-CG 3.49Å; F261-M265 HydrophobicContact CE1-SD 3.82Å; F261-M265 HydrophobicContact CE2-CE 3.83Å; F261-M265 HydrophobicContact CE2-SD 4.49Å; F261-M265 HydrophobicContact CZ-CE 3.6Å; F261-M265 HydrophobicContact CZ-CG 3.92Å; F261-M265 HydrophobicContact CZ-SD 3.68Å; F261-M265 PolarHBondContact O-N 2.78Å; F261-M265 VanDerWaalsContact O-N 3.14Å; P262-M265 PolarHBondContact O-N 2.91Å; Y263-M265 VanDerWaalsContact C-N 3.29Å; Y263-M265 PolarHBondContact O-N 3.36Å; M265-T267 PolarHBondContact O-N 3.42Å; M265-I268 HydrophobicContact CE-CD1 3.77Å; M265-I268 PolarHBondContact O-N 3.49Å; M265-L269 WeakPolarHBondContact O-CB 3.47Å; M265-L269 WeakPolarHBondContact O-CG 3.38Å; M265-L269 PolarHBondContact O-N 3.48Å; M265-L399 HydrophobicContact CE-CD2 4.36Å; M265-L399 HydrophobicContact SD-CB 4.22Å; M265-L399 HydrophobicContact SD-CD2 3.61Å; M265-L399 HydrophobicContact SD-CG 4.49Å; M265-M403 HydrophobicContact CB-CB 3.65Å; M265-M403 HydrophobicContact CB-CG 3.87Å; M265-M403 HydrophobicContact CB-SD 4.16Å; M265-M403 HydrophobicContact CG-CB 3.99Å
266	L	95.3	Very high	96.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-56.2	-41	175.6	-75.4	169.9	0	0	0	111	P262 L269 L270 T345 Y348 A349 V352 M403	P262-L266 WeakPolarHBondContact O-CB 3.25Å; P262-L266 VanDerWaalsContact O-CG 3.3Å; P262-L266 WeakPolarHBondContact O-CG 3.47Å; P262-L266 PolarHBondContact O-N 3.42Å; L266-L269 PolarHBondContact O-N 3.08Å; L266-L270 VanDerWaalsContact O-CB 3.3Å; L266-L270 WeakPolarHBondContact O-CB 3.42Å; L266-L270 PolarHBondContact O-N 3.23Å; L266-T345 HydrophobicContact CD1-CG2 3.97Å; L266-Y348 HydrophobicContact CB-CD1 4Å; L266-Y348 HydrophobicContact CB-CE1 3.68Å; L266-Y348 HydrophobicContact CD1-CD1 4.22Å; L266-A349 HydrophobicContact CD2-CB 4.1Å; L266-V352 HydrophobicContact CB-CG2 4.41Å; L266-V352 HydrophobicContact CD2-CB 4.48Å; L266-V352 HydrophobicContact CD2-CG2 3.97Å; L266-V352 WeakPolarHBondContact O-CG2 3.47Å; L266-M403 HydrophobicContact CD2-CE 4.27Å; L266-M403 HydrophobicContact CD2-SD 3.46Å; L266-M403 WeakPolarHBondContact CD2-SD 3.48Å; L266-M403 HydrophobicContact CG-SD 3.58Å; L266-M403 VanDerWaalsContact CG-SD 3.58Å
267	T	97.2	Very high	96.1	Very high	56 Å²	56	46.6 Å²	46.6	34%	0.344	25%	0.246	S	C	.	.	H	α-helix	trans	-66.6	-45.1	178.6	-54.8	0	0	0	0	111.9	Y263 I264 M265 L269 L270 I271 Y348	Y263-T267 VanDerWaalsContact O-CB 3.3Å; Y263-T267 WeakPolarHBondContact O-CB 3.3Å; Y263-T267 PolarHBondContact O-N 3.2Å; Y263-T267 PolarHBondContact O-OG1 3.17Å; I264-T267 PolarHBondContact O-N 2.94Å; M265-T267 PolarHBondContact O-N 3.42Å; T267-L269 PolarHBondContact O-N 3.43Å; T267-L270 PolarHBondContact O-N 3.19Å; T267-I271 HydrophobicContact CG2-CD1 3.99Å; T267-I271 VanDerWaalsContact O-CG1 3.31Å; T267-I271 WeakPolarHBondContact O-CG1 3.39Å; T267-I271 PolarHBondContact O-N 3.07Å; T267-Y348 WeakPolarHBondContact CA-OH 2.95Å; T267-Y348 PolarHBondContact OG1-OH 2.88Å
268	I	96.5	Very high	96	Very high	66 Å²	66	42.7 Å²	42.7	34%	0.338	24%	0.236	S	C	.	.	H	α-helix	trans	-60.5	-46.4	176.5	-70	169.5	0	0	0	110.7	I264 M265 I271 R272 W396 L399	I264-I268 HydrophobicContact CG2-CD1 4.07Å; I264-I268 WeakPolarHBondContact O-CG1 3.4Å; I264-I268 PolarHBondContact O-N 3.32Å; M265-I268 HydrophobicContact CE-CD1 3.77Å; M265-I268 PolarHBondContact O-N 3.49Å; I268-I271 PolarHBondContact O-N 3.38Å; I268-R272 WeakPolarHBondContact O-CB 3.32Å; I268-R272 PolarHBondContact O-N 2.98Å; I268-W396 HydrophobicContact CG2-CZ3 4.12Å; I268-L399 HydrophobicContact CG2-CD1 4.08Å
269	L	93.6	Very high	95.9	Very high	11 Å²	11	43 Å²	43	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-67.1	-35.2	179.1	-67.9	173.7	0	0	0	112.1	M265 L266 T267 G273 V352 W396 F400 M403	M265-L269 WeakPolarHBondContact O-CB 3.47Å; M265-L269 WeakPolarHBondContact O-CG 3.38Å; M265-L269 PolarHBondContact O-N 3.48Å; L266-L269 PolarHBondContact O-N 3.08Å; T267-L269 PolarHBondContact O-N 3.43Å; L269-G273 PolarHBondContact O-N 2.92Å; L269-V352 HydrophobicContact CB-CG1 3.67Å; L269-V352 HydrophobicContact CD1-CG1 4.49Å; L269-W396 HydrophobicContact CD2-CE3 4.19Å; L269-F400 HydrophobicContact CD1-CB 4.29Å; L269-F400 HydrophobicContact CD1-CD2 4.12Å; L269-M403 HydrophobicContact CD1-CE 4.35Å; L269-M403 HydrophobicContact CD1-SD 4.14Å
270	L	95.4	Very high	95.9	Very high	35 Å²	35	45.1 Å²	45.1	18%	0.183	26%	0.261	C	S	.	.	H	α-helix	trans	-65.8	-49.5	174.7	-178.1	58.2	0	0	0	111.4	L266 T267 R272 G273 A274 Y348 F351 V352	L266-L270 VanDerWaalsContact O-CB 3.3Å; L266-L270 WeakPolarHBondContact O-CB 3.42Å; L266-L270 PolarHBondContact O-N 3.23Å; T267-L270 PolarHBondContact O-N 3.19Å; L270-R272 VanDerWaalsContact C-N 3.26Å; L270-R272 PolarHBondContact O-N 2.8Å; L270-G273 PolarHBondContact O-N 3.47Å; L270-A274 VanDerWaalsContact O-CB 3.23Å; L270-A274 WeakPolarHBondContact O-CB 3.22Å; L270-A274 PolarHBondContact O-N 3.07Å; L270-Y348 HydrophobicContact CD2-CD2 4.2Å; L270-Y348 HydrophobicContact CD2-CE2 3.33Å; L270-Y348 WeakPolarHBondContact CD2-OH 3.2Å; L270-F351 HydrophobicContact CD1-CB 3.72Å; L270-V352 HydrophobicContact CB-CG2 3.79Å; L270-V352 HydrophobicContact CD1-CG2 4.37Å
271	I	97.1	Very high	95.9	Very high	100 Å²	100	44.4 Å²	44.4	51%	0.513	26%	0.263	S	S	.	.	H	α-helix	trans	-58.3	-45.5	179.1	-68.3	167.3	0	0	0	109	T267 I268 L275	T267-I271 HydrophobicContact CG2-CD1 3.99Å; T267-I271 VanDerWaalsContact O-CG1 3.31Å; T267-I271 WeakPolarHBondContact O-CG1 3.39Å; T267-I271 PolarHBondContact O-N 3.07Å; I268-I271 PolarHBondContact O-N 3.38Å; I271-L275 HydrophobicContact CG2-CD1 3.98Å; I271-L275 WeakPolarHBondContact O-CD1 3.5Å; I271-L275 WeakPolarHBondContact O-CG 3.4Å; I271-L275 PolarHBondContact O-N 3.49Å
272	R	94.9	Very high	95.8	Very high	54 Å²	54	42.2 Å²	42.2	20%	0.204	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-51.9	176.6	179.4	57.3	-179.9	146.8	-2.4	111.7	I268 L270 A274 L275 L276 M390 P391 W396	I268-R272 WeakPolarHBondContact O-CB 3.32Å; I268-R272 PolarHBondContact O-N 2.98Å; L270-R272 VanDerWaalsContact C-N 3.26Å; L270-R272 PolarHBondContact O-N 2.8Å; R272-A274 PolarHBondContact O-N 2.95Å; R272-L275 PolarHBondContact O-N 3.15Å; R272-L276 VanDerWaalsContact CZ-CD2 3.44Å; R272-L276 WeakPolarHBondContact O-CG 3.41Å; R272-L276 PolarHBondContact O-N 3.01Å; R272-M390 HydrophobicContact CG-SD 4.49Å; R272-P391 VanDerWaalsContact NH2-CG 3.27Å; R272-W396 HydrophobicContact CB-CE3 4.31Å; R272-W396 HydrophobicContact CB-CH2 3.8Å; R272-W396 HydrophobicContact CB-CZ2 4.44Å; R272-W396 HydrophobicContact CB-CZ3 3.72Å; R272-W396 VanDerWaalsContact CD-CZ2 3.49Å; R272-W396 HydrophobicContact CG-CD2 4.14Å; R272-W396 HydrophobicContact CG-CE3 4.01Å; R272-W396 HydrophobicContact CG-CH2 3.52Å; R272-W396 HydrophobicContact CG-CZ2 3.65Å; R272-W396 HydrophobicContact CG-CZ3 3.7Å
273	G	94.1	Very high	95.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.9	-43.4	-178.2	0	0	0	0	0	112.7	L269 L270 L275 L276 S279	L269-G273 PolarHBondContact O-N 2.92Å; L270-G273 PolarHBondContact O-N 3.47Å; G273-L275 VanDerWaalsContact C-N 3.29Å; G273-L275 PolarHBondContact O-N 3.26Å; G273-L276 WeakPolarHBondContact O-CB 3.42Å; G273-L276 PolarHBondContact O-N 3.02Å; G273-S279 WeakPolarHBondContact O-CB 3.44Å
274	A	96.4	Very high	95.8	Very high	57 Å²	57	46.1 Å²	46.1	47%	0.471	28%	0.279	S	S	.	.	H	α-helix	trans	-67.9	-25.2	178.9	0	0	0	0	0	113.7	L270 R272 L276 S279	L270-A274 VanDerWaalsContact O-CB 3.23Å; L270-A274 WeakPolarHBondContact O-CB 3.22Å; L270-A274 PolarHBondContact O-N 3.07Å; R272-A274 PolarHBondContact O-N 2.95Å; A274-L276 VanDerWaalsContact C-N 3.33Å; A274-S279 PolarHBondContact O-OG 3.48Å
275	L	96.6	Very high	95.6	Very high	130 Å²	130	45.8 Å²	45.8	68%	0.681	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-4.9	177	-68.8	173.1	0	0	0	113.4	I271 R272 G273	I271-L275 HydrophobicContact CG2-CD1 3.98Å; I271-L275 WeakPolarHBondContact O-CD1 3.5Å; I271-L275 WeakPolarHBondContact O-CG 3.4Å; I271-L275 PolarHBondContact O-N 3.49Å; R272-L275 PolarHBondContact O-N 3.15Å; G273-L275 VanDerWaalsContact C-N 3.29Å; G273-L275 PolarHBondContact O-N 3.26Å
276	L	95.3	Very high	95.5	Very high	10 Å²	10	45.4 Å²	45.4	5%	0.052	27%	0.271	C	S	.	.	S	Bend	trans	-82.2	147.4	178.3	-69.5	170.9	0	0	0	111.6	R272 G273 A274 S279 F359 M390	R272-L276 VanDerWaalsContact CZ-CD2 3.44Å; R272-L276 WeakPolarHBondContact O-CG 3.41Å; R272-L276 PolarHBondContact O-N 3.01Å; G273-L276 WeakPolarHBondContact O-CB 3.42Å; G273-L276 PolarHBondContact O-N 3.02Å; A274-L276 VanDerWaalsContact C-N 3.33Å; L276-S279 VanDerWaalsContact O-CB 3.26Å; L276-S279 WeakPolarHBondContact O-CB 3.29Å; L276-S279 PolarHBondContact O-N 3.41Å; L276-S279 PolarHBondContact O-OG 2.96Å; L276-F359 HydrophobicContact CB-CB 3.89Å; L276-F359 HydrophobicContact CB-CD2 3.64Å; L276-F359 HydrophobicContact CB-CE2 4.15Å; L276-F359 HydrophobicContact CB-CG 3.81Å; L276-F359 HydrophobicContact CD1-CB 4.12Å; L276-F359 HydrophobicContact CD1-CD1 3.71Å; L276-F359 HydrophobicContact CD1-CD2 4.21Å; L276-F359 HydrophobicContact CD1-CE1 3.97Å; L276-F359 HydrophobicContact CD1-CE2 4.43Å; L276-F359 HydrophobicContact CD1-CG 3.76Å; L276-F359 HydrophobicContact CD1-CZ 4.24Å; L276-F359 HydrophobicContact CD2-CD2 4.13Å; L276-F359 HydrophobicContact CD2-CE1 4.36Å; L276-F359 HydrophobicContact CD2-CE2 3.76Å; L276-F359 HydrophobicContact CD2-CG 4.49Å; L276-F359 HydrophobicContact CD2-CZ 3.81Å; L276-F359 HydrophobicContact CG-CD2 4.2Å; L276-F359 HydrophobicContact CG-CE2 4.33Å; L276-F359 HydrophobicContact CG-CG 4.22Å; L276-F359 HydrophobicContact CG-CZ 4.49Å; L276-M390 HydrophobicContact CD1-CE 3.62Å; L276-M390 HydrophobicContact CD1-CG 4.06Å; L276-M390 HydrophobicContact CD1-SD 3.83Å
277	P	96.3	Very high	95.5	Very high	62 Å²	62	49.2 Å²	49.2	40%	0.403	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	144	176.3	28.1	-34.8	0	0	0	111	S279 F359 Y362	P277-S279 PolarHBondContact O-N 2.89Å; P277-S279 VanDerWaalsContact O-N 3.14Å; P277-F359 HydrophobicContact CG-CD2 3.91Å; P277-F359 HydrophobicContact CG-CE2 3.93Å; P277-F359 WeakPolarHBondContact O-CA 3.45Å; P277-F359 WeakPolarHBondContact O-CD2 3.48Å; P277-Y362 HydrophobicContact CB-CD1 3.98Å; P277-Y362 HydrophobicContact CB-CE1 3.74Å; P277-Y362 HydrophobicContact CG-CD1 4Å; P277-Y362 HydrophobicContact CG-CE1 3.86Å
278	G	95.2	Very high	95.5	Very high	27 Å²	27	50.1 Å²	50.1	28%	0.278	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	-11.3	-178.8	0	0	0	0	0	115.7	G280 A281 G358	G278-G280 PolarHBondContact O-N 2.71Å; G278-G280 VanDerWaalsContact O-N 3.16Å; G278-A281 WeakPolarHBondContact O-CB 3.38Å; G278-A281 PolarHBondContact O-N 3.22Å; G278-G358 CarbonylContact O-C 3.45Å
279	S	95.9	Very high	95.5	Very high	13 Å²	13	49.7 Å²	49.7	9%	0.091	30%	0.298	C	S	.	.	H	α-helix	trans	-53.8	-37.8	178.9	61.2	0	0	0	0	113.5	G273 A274 L276 P277 A281 G282 V283 S355	G273-S279 WeakPolarHBondContact O-CB 3.44Å; A274-S279 PolarHBondContact O-OG 3.48Å; L276-S279 VanDerWaalsContact O-CB 3.26Å; L276-S279 WeakPolarHBondContact O-CB 3.29Å; L276-S279 PolarHBondContact O-N 3.41Å; L276-S279 PolarHBondContact O-OG 2.96Å; P277-S279 PolarHBondContact O-N 2.89Å; P277-S279 VanDerWaalsContact O-N 3.14Å; S279-A281 VanDerWaalsContact C-N 3.28Å; S279-A281 PolarHBondContact O-N 3.16Å; S279-G282 WeakPolarHBondContact O-CA 3.36Å; S279-G282 PolarHBondContact O-N 3.24Å; S279-G282 VanDerWaalsContact O-N 3.09Å; S279-V283 PolarHBondContact O-N 2.86Å; S279-S355 WeakPolarHBondContact CA-O 2.98Å; S279-S355 WeakPolarHBondContact CB-O 3.45Å
280	G	96.3	Very high	95.6	Very high	48 Å²	48	52.6 Å²	52.6	50%	0.495	31%	0.313	S	S	.	.	H	α-helix	trans	-59.6	-33.4	176.6	0	0	0	0	0	113.8	G278 V283 L284	G278-G280 PolarHBondContact O-N 2.71Å; G278-G280 VanDerWaalsContact O-N 3.16Å; G280-V283 PolarHBondContact O-N 3.39Å; G280-L284 VanDerWaalsContact O-CB 3.25Å; G280-L284 WeakPolarHBondContact O-CB 3.35Å; G280-L284 PolarHBondContact O-N 3.03Å
281	A	95.3	Very high	95.7	Very high	55 Å²	55	56.9 Å²	56.9	46%	0.455	33%	0.331	S	S	.	.	H	α-helix	trans	-66.6	-40.5	175.2	0	0	0	0	0	111.1	G278 S279 L284 Y285 I368	G278-A281 WeakPolarHBondContact O-CB 3.38Å; G278-A281 PolarHBondContact O-N 3.22Å; S279-A281 VanDerWaalsContact C-N 3.28Å; S279-A281 PolarHBondContact O-N 3.16Å; A281-L284 PolarHBondContact O-N 2.88Å; A281-Y285 WeakPolarHBondContact O-CB 3.1Å; A281-Y285 PolarHBondContact O-N 3.17Å; A281-I368 VanDerWaalsContact C-CD1 3.45Å; A281-I368 HydrophobicContact CB-CD1 4.24Å; A281-I368 VanDerWaalsContact O-CD1 3.23Å; A281-I368 WeakPolarHBondContact O-CD1 3.07Å
282	G	94.5	Very high	95.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-50.1	174.1	0	0	0	0	0	112.5	S279 L284 Y285 Y286 F354	S279-G282 WeakPolarHBondContact O-CA 3.36Å; S279-G282 PolarHBondContact O-N 3.24Å; S279-G282 VanDerWaalsContact O-N 3.09Å; G282-L284 VanDerWaalsContact C-N 3.32Å; G282-L284 PolarHBondContact O-N 2.95Å; G282-Y285 PolarHBondContact O-N 3.4Å; G282-Y286 PolarHBondContact O-N 2.54Å; G282-F354 VanDerWaalsContact CA-O 3.28Å; G282-F354 WeakPolarHBondContact CA-O 3.05Å
283	V	96.4	Very high	95.7	Very high	35 Å²	35	56 Å²	56	21%	0.212	33%	0.332	C	S	.	.	H	α-helix	trans	-62.3	-40.3	176.8	175.2	0	0	0	0	111.6	S279 G280 Y286 L287 F351	S279-V283 PolarHBondContact O-N 2.86Å; G280-V283 PolarHBondContact O-N 3.39Å; V283-Y286 WeakPolarHBondContact O-CB 3.16Å; V283-Y286 PolarHBondContact O-N 3.06Å; V283-L287 HydrophobicContact CG1-CD1 4.03Å; V283-L287 WeakPolarHBondContact O-CG 3.32Å; V283-L287 PolarHBondContact O-N 3.11Å; V283-L287 VanDerWaalsContact O-N 3.11Å; V283-F351 HydrophobicContact CG1-CD1 3.91Å; V283-F351 HydrophobicContact CG1-CE1 3.82Å; V283-F351 HydrophobicContact CG2-CD1 4.4Å
284	L	96.4	Very high	95.8	Very high	115 Å²	115	57.8 Å²	57.8	60%	0.602	34%	0.341	S	S	*	.	H	α-helix	trans	-63.1	-44.9	176.9	-177.7	62.2	0	0	0	111.1	G280 A281 G282 Y286 L287 T288	G280-L284 VanDerWaalsContact O-CB 3.25Å; G280-L284 WeakPolarHBondContact O-CB 3.35Å; G280-L284 PolarHBondContact O-N 3.03Å; A281-L284 PolarHBondContact O-N 2.88Å; G282-L284 VanDerWaalsContact C-N 3.32Å; G282-L284 PolarHBondContact O-N 2.95Å; L284-Y286 VanDerWaalsContact C-N 3.34Å; L284-Y286 PolarHBondContact O-N 2.76Å; L284-L287 PolarHBondContact O-N 2.88Å; L284-T288 WeakPolarHBondContact O-CB 3.14Å; L284-T288 PolarHBondContact O-N 3.49Å; L284-T288 PolarHBondContact O-OG1 3.07Å
285	Y	93	Very high	95.9	Very high	78 Å²	78	61 Å²	61	31%	0.306	36%	0.356	S	S	.	.	H	α-helix	trans	-60.2	-44.3	176	-174.6	-80.4	0	0	0	111.6	F88 A281 G282 L287 T288 F354 I368 V369	F88-Y285 HydrophobicContact CD2-CD1 4.43Å; F88-Y285 AromaticContact CD2-CE1 3.49Å; F88-Y285 HydrophobicContact CD2-CE1 3.49Å; F88-Y285 VanDerWaalsContact CD2-CE1 3.49Å; F88-Y285 AromaticContact CD2-CZ 3.97Å; F88-Y285 AromaticContact CE2-CE1 3.82Å; F88-Y285 HydrophobicContact CE2-CE1 3.82Å; F88-Y285 AromaticContact CE2-CZ 3.82Å; F88-Y285 WeakPolarHBondContact CE2-OH 3.37Å; A281-Y285 WeakPolarHBondContact O-CB 3.1Å; A281-Y285 PolarHBondContact O-N 3.17Å; G282-Y285 PolarHBondContact O-N 3.4Å; Y285-L287 VanDerWaalsContact C-N 3.29Å; Y285-L287 PolarHBondContact O-N 3.23Å; Y285-T288 PolarHBondContact O-N 3.07Å; Y285-F354 HydrophobicContact CD1-CD1 4.4Å; Y285-F354 AromaticContact CD1-CE1 3.73Å; Y285-F354 HydrophobicContact CD1-CE1 3.73Å; Y285-F354 HydrophobicContact CE1-CE1 4.27Å; Y285-I368 HydrophobicContact CD1-CG2 4.06Å; Y285-I368 HydrophobicContact CD2-CB 4.45Å; Y285-I368 HydrophobicContact CD2-CD1 4.45Å; Y285-I368 HydrophobicContact CG-CB 4.4Å; Y285-I368 HydrophobicContact CG-CD1 4.19Å; Y285-I368 HydrophobicContact CG-CG2 4.07Å; Y285-V369 HydrophobicContact CE2-CG2 3.84Å
286	Y	94.6	Very high	95.7	Very high	1 Å²	1	57.1 Å²	57.1	0%	0.004	34%	0.335	C	S	.	.	H	α-helix	trans	-57.3	-40.6	177.6	175.4	-131.8	0	0	0	113	C87 G92 G93 G282 V283 L284 V347 F351 F354	C87-Y286 HydrophobicContact CB-CD2 4.12Å; C87-Y286 HydrophobicContact CB-CE2 3.82Å; G92-Y286 CarbonylContact C-O 3.05Å; G93-Y286 PolarHBondContact N-O 3.36Å; G282-Y286 PolarHBondContact O-N 2.54Å; V283-Y286 WeakPolarHBondContact O-CB 3.16Å; V283-Y286 PolarHBondContact O-N 3.06Å; L284-Y286 VanDerWaalsContact C-N 3.34Å; L284-Y286 PolarHBondContact O-N 2.76Å; Y286-V347 WeakPolarHBondContact OH-CA 3.11Å; Y286-V347 PolarHBondContact OH-O 3.24Å; Y286-V347 VanDerWaalsContact OH-O 3.05Å; Y286-F351 HydrophobicContact CD1-CD1 4.44Å; Y286-F351 HydrophobicContact CD1-CE1 4.48Å; Y286-F351 HydrophobicContact CE1-CD1 4.49Å; Y286-F351 HydrophobicContact CE1-CD2 4.01Å; Y286-F351 HydrophobicContact CE1-CE2 4.03Å; Y286-F351 HydrophobicContact CE1-CG 4.25Å; Y286-F351 HydrophobicContact CE1-CZ 4.3Å; Y286-F354 HydrophobicContact CD1-CD2 4.5Å; Y286-F354 AromaticContact CD2-CD2 3.55Å; Y286-F354 HydrophobicContact CD2-CD2 3.55Å; Y286-F354 AromaticContact CD2-CE2 3.45Å; Y286-F354 HydrophobicContact CD2-CE2 3.45Å; Y286-F354 VanDerWaalsContact CD2-CE2 3.45Å; Y286-F354 HydrophobicContact CD2-CG 4.28Å; Y286-F354 HydrophobicContact CD2-CZ 4.11Å; Y286-F354 HydrophobicContact CE2-CD2 4.3Å; Y286-F354 HydrophobicContact CE2-CE2 4.16Å; Y286-F354 HydrophobicContact CG-CB 4.34Å; Y286-F354 AromaticContact CG-CD2 3.68Å; Y286-F354 HydrophobicContact CG-CD2 3.68Å; Y286-F354 HydrophobicContact CG-CE2 4.03Å; Y286-F354 HydrophobicContact CG-CG 4.01Å
287	L	95.4	Very high	95.6	Very high	80 Å²	80	61.5 Å²	61.5	42%	0.419	37%	0.365	S	S	.	.	H	α-helix	trans	-89.8	-20.6	-175.8	-65.4	178.4	0	0	0	114.1	V283 L284 Y285 P289 F351	V283-L287 HydrophobicContact CG1-CD1 4.03Å; V283-L287 WeakPolarHBondContact O-CG 3.32Å; V283-L287 PolarHBondContact O-N 3.11Å; V283-L287 VanDerWaalsContact O-N 3.11Å; L284-L287 PolarHBondContact O-N 2.88Å; Y285-L287 VanDerWaalsContact C-N 3.29Å; Y285-L287 PolarHBondContact O-N 3.23Å; L287-P289 VanDerWaalsContact O-CD 3.25Å; L287-P289 WeakPolarHBondContact O-CD 3.47Å; L287-F351 HydrophobicContact CD1-CE1 4.02Å; L287-F351 HydrophobicContact CD1-CZ 4.26Å; L287-F351 HydrophobicContact CD2-CE1 4.34Å; L287-F351 HydrophobicContact CD2-CZ 3.96Å; L287-F351 HydrophobicContact CG-CE1 4.4Å
288	T	96.5	Very high	95.3	Very high	76 Å²	76	61.9 Å²	61.9	47%	0.466	36%	0.361	S	S	.	.			trans	-68.2	117.9	-178.2	-62.5	0	0	0	0	109.5	G93 L284 Y285	G93-T288 PolarHBondContact N-O 2.87Å; L284-T288 WeakPolarHBondContact O-CB 3.14Å; L284-T288 PolarHBondContact O-N 3.49Å; L284-T288 PolarHBondContact O-OG1 3.07Å; Y285-T288 PolarHBondContact O-N 3.07Å
289	P	96.5	Very high	95.3	Very high	56 Å²	56	60.6 Å²	60.6	36%	0.364	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-85.8	126	-177.5	32.3	-31.5	0	0	0	111.3	A94 L287 F291	A94-P289 HydrophobicContact CB-CB 4Å; L287-P289 VanDerWaalsContact O-CD 3.25Å; L287-P289 WeakPolarHBondContact O-CD 3.47Å; P289-F291 HydrophobicContact CB-CD2 4.33Å; P289-F291 HydrophobicContact CB-CE1 4.22Å; P289-F291 HydrophobicContact CB-CE2 3.86Å; P289-F291 HydrophobicContact CB-CZ 3.8Å; P289-F291 HydrophobicContact CG-CD2 4.36Å; P289-F291 HydrophobicContact CG-CE2 3.59Å; P289-F291 HydrophobicContact CG-CZ 3.75Å
290	D	95.6	Very high	95.2	Very high	72 Å²	72	64 Å²	64	39%	0.385	36%	0.358	S	S	.	.			trans	-96.2	92.7	162.1	179.8	8.4	0	0	0	109.8	G91 A94 S292 R293	G91-D290 PolarHBondContact O-N 2.74Å; A94-D290 WeakPolarHBondContact CB-O 3.33Å; D290-S292 VanDerWaalsContact CG-OG 3.25Å; D290-S292 PolarHBondContact O-N 2.95Å; D290-S292 VanDerWaalsContact OD1-CB 3.29Å; D290-S292 WeakPolarHBondContact OD1-CB 3.49Å; D290-S292 PolarHBondContact OD1-N 3.49Å; D290-S292 VanDerWaalsContact OD1-N 3.08Å; D290-S292 PolarHBondContact OD1-OG 3.3Å; D290-S292 PolarHBondContact OD2-OG 2.73Å; D290-R293 HydrophobicContact CB-CG 4.32Å; D290-R293 PolarHBondContact O-N 3.32Å
291	F	97.3	Very high	95	Very high	125 Å²	125	62.2 Å²	62.2	55%	0.548	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-64.7	-18.7	-178.7	-66.5	-72.9	0	0	0	113.7	I97 P289 R293 L294	I97-F291 HydrophobicContact CD1-CD1 4.43Å; I97-F291 HydrophobicContact CD1-CE1 3.85Å; P289-F291 HydrophobicContact CB-CD2 4.33Å; P289-F291 HydrophobicContact CB-CE1 4.22Å; P289-F291 HydrophobicContact CB-CE2 3.86Å; P289-F291 HydrophobicContact CB-CZ 3.8Å; P289-F291 HydrophobicContact CG-CD2 4.36Å; P289-F291 HydrophobicContact CG-CE2 3.59Å; P289-F291 HydrophobicContact CG-CZ 3.75Å; F291-R293 PolarHBondContact O-N 3.3Å; F291-L294 HydrophobicContact CD1-CD1 3.89Å; F291-L294 WeakPolarHBondContact O-CB 3.37Å; F291-L294 PolarHBondContact O-N 3.19Å; F291-L294 VanDerWaalsContact O-N 3.12Å
292	S	97.7	Very high	94.8	Very high	71 Å²	71	60.4 Å²	60.4	50%	0.497	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-62.6	-32.2	178	75.2	0	0	0	0	111.6	D290 L294 T295	D290-S292 VanDerWaalsContact CG-OG 3.25Å; D290-S292 PolarHBondContact O-N 2.95Å; D290-S292 VanDerWaalsContact OD1-CB 3.29Å; D290-S292 WeakPolarHBondContact OD1-CB 3.49Å; D290-S292 PolarHBondContact OD1-N 3.49Å; D290-S292 VanDerWaalsContact OD1-N 3.08Å; D290-S292 PolarHBondContact OD1-OG 3.3Å; D290-S292 PolarHBondContact OD2-OG 2.73Å; S292-L294 PolarHBondContact O-N 3.08Å; S292-T295 PolarHBondContact O-N 3.42Å; S292-T295 PolarHBondContact O-OG1 3.01Å
293	R	95	Very high	94.9	Very high	65 Å²	65	60.4 Å²	60.4	25%	0.245	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-62.7	-24.7	176.4	-64.6	-67.4	-66.9	129.9	6.1	112.9	N90 D290 F291 T295 D296 V299	N90-R293 PolarHBondContact OD1-NH2 3Å; D290-R293 HydrophobicContact CB-CG 4.32Å; D290-R293 PolarHBondContact O-N 3.32Å; F291-R293 PolarHBondContact O-N 3.3Å; R293-T295 PolarHBondContact O-N 2.95Å; R293-T295 VanDerWaalsContact O-N 3.16Å; R293-D296 IonicContact CZ-OD2 3.88Å; R293-D296 IonicContact NH1-OD2 2.69Å; R293-D296 PolarHBondContact NH1-OD2 3.33Å; R293-D296 IonicContact NH2-OD2 3.53Å; R293-D296 PolarHBondContact NH2-OD2 2.76Å; R293-D296 WeakPolarHBondContact O-CB 3.34Å; R293-D296 PolarHBondContact O-N 3.31Å; R293-V299 HydrophobicContact CB-CG2 4.23Å; R293-V299 VanDerWaalsContact O-CG2 3.26Å; R293-V299 WeakPolarHBondContact O-CG2 3.41Å
294	L	96.5	Very high	94.8	Very high	37 Å²	37	58.7 Å²	58.7	19%	0.194	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-67.5	-15.1	179	-61.8	-177.7	0	0	0	113.8	A94 I97 P98 F291 S292 D296 V299 W300	A94-L294 HydrophobicContact CB-CD2 4.36Å; A94-L294 HydrophobicContact CB-CG 4.39Å; I97-L294 HydrophobicContact CD1-CD1 4.1Å; P98-L294 HydrophobicContact CG-CD2 4.17Å; F291-L294 HydrophobicContact CD1-CD1 3.89Å; F291-L294 WeakPolarHBondContact O-CB 3.37Å; F291-L294 PolarHBondContact O-N 3.19Å; F291-L294 VanDerWaalsContact O-N 3.12Å; S292-L294 PolarHBondContact O-N 3.08Å; L294-D296 VanDerWaalsContact C-N 3.28Å; L294-V299 HydrophobicContact CD2-CG1 4.33Å; L294-W300 PolarHBondContact O-NE1 3.29Å
295	T	96.9	Very high	94.5	Very high	126 Å²	126	54.1 Å²	54.1	77%	0.773	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-75	-18.4	173.8	63.9	0	0	0	0	113	S292 R293 P297	S292-T295 PolarHBondContact O-N 3.42Å; S292-T295 PolarHBondContact O-OG1 3.01Å; R293-T295 PolarHBondContact O-N 2.95Å; R293-T295 VanDerWaalsContact O-N 3.16Å; T295-P297 WeakPolarHBondContact O-CD 3.43Å
296	D	94.2	Very high	94.5	Very high	48 Å²	48	50.6 Å²	50.6	26%	0.257	28%	0.275	S	S	.	.			trans	-84.3	115.6	179.8	-179.2	-4	0	0	0	110.4	R293 L294 Q298 V299	R293-D296 IonicContact CZ-OD2 3.88Å; R293-D296 IonicContact NH1-OD2 2.69Å; R293-D296 PolarHBondContact NH1-OD2 3.33Å; R293-D296 IonicContact NH2-OD2 3.53Å; R293-D296 PolarHBondContact NH2-OD2 2.76Å; R293-D296 WeakPolarHBondContact O-CB 3.34Å; R293-D296 PolarHBondContact O-N 3.31Å; L294-D296 VanDerWaalsContact C-N 3.28Å; D296-Q298 PolarHBondContact O-N 2.9Å; D296-Q298 VanDerWaalsContact O-N 3.13Å; D296-Q298 VanDerWaalsContact OD1-CB 3.26Å; D296-Q298 WeakPolarHBondContact OD1-CB 3.25Å; D296-Q298 PolarHBondContact OD1-N 3.37Å; D296-V299 HydrophobicContact CB-CG2 4.05Å; D296-V299 WeakPolarHBondContact O-CB 3.26Å; D296-V299 PolarHBondContact O-N 2.88Å
297	P	92.1	Very high	94.6	Very high	102 Å²	102	50.6 Å²	50.6	66%	0.662	27%	0.274	S	S	*	.	H	α-helix	trans	-58.1	-25.5	178	-24.6	35.5	0	0	0	113.9	T295 V299 W300 A301	T295-P297 WeakPolarHBondContact O-CD 3.43Å; P297-V299 PolarHBondContact O-N 3.29Å; P297-W300 PolarHBondContact O-N 3.37Å; P297-A301 PolarHBondContact O-N 3.24Å; P297-A301 VanDerWaalsContact O-N 3.08Å
298	Q	90.3	Very high	94.3	Very high	69 Å²	69	46.8 Å²	46.8	32%	0.322	25%	0.254	S	S	.	.	H	α-helix	trans	-64.5	-31.4	178.1	-170.9	60.7	36.8	0	0	111.8	D296 W300 A301 D302	D296-Q298 PolarHBondContact O-N 2.9Å; D296-Q298 VanDerWaalsContact O-N 3.13Å; D296-Q298 VanDerWaalsContact OD1-CB 3.26Å; D296-Q298 WeakPolarHBondContact OD1-CB 3.25Å; D296-Q298 PolarHBondContact OD1-N 3.37Å; Q298-W300 VanDerWaalsContact C-N 3.28Å; Q298-W300 PolarHBondContact O-N 3.06Å; Q298-A301 PolarHBondContact O-N 3.24Å; Q298-D302 PolarHBondContact NE2-OD1 3.04Å; Q298-D302 WeakPolarHBondContact O-CB 3.26Å; Q298-D302 PolarHBondContact O-N 3.26Å
299	V	94.3	Very high	93.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62	-39.6	176.7	170.5	0	0	0	0	111.1	N90 F95 P98 R293 L294 D296 P297 A303	N90-V299 HydrophobicContact CB-CB 4.49Å; N90-V299 HydrophobicContact CB-CG1 4.08Å; N90-V299 HydrophobicContact CB-CG2 3.98Å; F95-V299 HydrophobicContact CD2-CG1 4.11Å; P98-V299 HydrophobicContact CG-CG1 3.99Å; R293-V299 HydrophobicContact CB-CG2 4.23Å; R293-V299 VanDerWaalsContact O-CG2 3.26Å; R293-V299 WeakPolarHBondContact O-CG2 3.41Å; L294-V299 HydrophobicContact CD2-CG1 4.33Å; D296-V299 HydrophobicContact CB-CG2 4.05Å; D296-V299 WeakPolarHBondContact O-CB 3.26Å; D296-V299 PolarHBondContact O-N 2.88Å; P297-V299 PolarHBondContact O-N 3.29Å; V299-A303 WeakPolarHBondContact O-CB 3.25Å; V299-A303 PolarHBondContact O-N 3.1Å; V299-A303 VanDerWaalsContact O-N 3.15Å
300	W	94.9	Very high	93.7	Very high	85 Å²	85	43 Å²	43	32%	0.322	23%	0.228	S	C	.	.	H	α-helix	trans	-72.6	-39.3	177.1	-64.2	85.3	0	0	0	112	P98 L101 M102 L294 P297 Q298 A303 A304	P98-W300 HydrophobicContact CB-CD2 3.81Å; P98-W300 HydrophobicContact CB-CE3 3.52Å; P98-W300 HydrophobicContact CB-CG 4.39Å; P98-W300 HydrophobicContact CB-CH2 4.33Å; P98-W300 HydrophobicContact CB-CZ3 3.81Å; L101-W300 HydrophobicContact CD1-CH2 3.87Å; L101-W300 HydrophobicContact CD1-CZ3 3.76Å; M102-W300 HydrophobicContact CE-CE3 3.97Å; L294-W300 PolarHBondContact O-NE1 3.29Å; P297-W300 PolarHBondContact O-N 3.37Å; Q298-W300 VanDerWaalsContact C-N 3.28Å; Q298-W300 PolarHBondContact O-N 3.06Å; W300-A303 PolarHBondContact O-N 3.07Å; W300-A304 WeakPolarHBondContact O-CB 3.39Å; W300-A304 PolarHBondContact O-N 2.93Å
301	A	91.5	Very high	93.7	Very high	10 Å²	10	39.6 Å²	39.6	8%	0.083	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-43.4	175.7	0	0	0	0	0	112.2	P297 Q298 A303 A304 T305 L529	P297-A301 PolarHBondContact O-N 3.24Å; P297-A301 VanDerWaalsContact O-N 3.08Å; Q298-A301 PolarHBondContact O-N 3.24Å; A301-A303 VanDerWaalsContact C-N 3.35Å; A301-A303 PolarHBondContact O-N 3.03Å; A301-A304 PolarHBondContact O-N 3.47Å; A301-T305 VanDerWaalsContact O-CB 3.25Å; A301-T305 WeakPolarHBondContact O-CB 3.46Å; A301-T305 PolarHBondContact O-N 3.39Å; A301-T305 PolarHBondContact O-OG1 2.9Å; A301-L529 HydrophobicContact CB-CD2 4.04Å
302	D	91.9	Very high	93.5	Very high	17 Å²	17	34 Å²	34	9%	0.091	19%	0.187	C	C	.	.	H	α-helix	trans	-61	-43	176	-79.5	1.1	0	0	0	110.9	L86 K89 N90 F95 Q298 Q306	L86-D302 HydrophobicContact CD2-CB 4.18Å; K89-D302 IonicContact NZ-OD2 2.55Å; K89-D302 PolarHBondContact NZ-OD2 3.4Å; N90-D302 WeakPolarHBondContact ND2-CB 3.26Å; N90-D302 PolarHBondContact ND2-OD2 2.9Å; F95-D302 HydrophobicContact CE2-CB 4.19Å; Q298-D302 PolarHBondContact NE2-OD1 3.04Å; Q298-D302 WeakPolarHBondContact O-CB 3.26Å; Q298-D302 PolarHBondContact O-N 3.26Å; D302-Q306 WeakPolarHBondContact O-CB 3.35Å; D302-Q306 PolarHBondContact O-N 3.29Å
303	A	95.8	Very high	93.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63	-45.8	176.4	0	0	0	0	0	112.5	F95 P98 M102 V299 W300 A301 Q306 I307	F95-A303 HydrophobicContact CD2-CB 4.47Å; F95-A303 HydrophobicContact CE2-CB 3.69Å; F95-A303 HydrophobicContact CZ-CB 3.86Å; P98-A303 HydrophobicContact CB-CB 3.8Å; P98-A303 HydrophobicContact CG-CB 4.18Å; M102-A303 HydrophobicContact CG-CB 4.35Å; V299-A303 WeakPolarHBondContact O-CB 3.25Å; V299-A303 PolarHBondContact O-N 3.1Å; V299-A303 VanDerWaalsContact O-N 3.15Å; W300-A303 PolarHBondContact O-N 3.07Å; A301-A303 VanDerWaalsContact C-N 3.35Å; A301-A303 PolarHBondContact O-N 3.03Å; A303-Q306 PolarHBondContact O-N 2.86Å; A303-I307 WeakPolarHBondContact O-CG1 3.15Å; A303-I307 PolarHBondContact O-N 3.16Å
304	A	94.2	Very high	93.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.2	-45.3	179.6	0	0	0	0	0	111.7	M102 L106 W300 A301 Q306 I307 F308 L529	M102-A304 HydrophobicContact CB-CB 4.36Å; M102-A304 HydrophobicContact CE-CB 4.34Å; M102-A304 HydrophobicContact CG-CB 3.76Å; M102-A304 HydrophobicContact SD-CB 3.61Å; L106-A304 HydrophobicContact CD2-CB 4Å; W300-A304 WeakPolarHBondContact O-CB 3.39Å; W300-A304 PolarHBondContact O-N 2.93Å; A301-A304 PolarHBondContact O-N 3.47Å; A304-Q306 PolarHBondContact O-N 3.14Å; A304-I307 PolarHBondContact O-N 2.8Å; A304-F308 VanDerWaalsContact O-CB 3.26Å; A304-F308 WeakPolarHBondContact O-CB 3.3Å; A304-F308 PolarHBondContact O-N 3.27Å; A304-L529 HydrophobicContact CB-CD1 3.65Å; A304-L529 HydrophobicContact CB-CD2 3.9Å; A304-L529 HydrophobicContact CB-CG 4.35Å
305	T	89.9	Confident	93	Very high	19 Å²	19	26 Å²	26	12%	0.117	14%	0.143	C	C	.	.	H	α-helix	trans	-57.3	-49.7	175	-59.4	0	0	0	0	110	A301 I307 F308 F309	A301-T305 VanDerWaalsContact O-CB 3.25Å; A301-T305 WeakPolarHBondContact O-CB 3.46Å; A301-T305 PolarHBondContact O-N 3.39Å; A301-T305 PolarHBondContact O-OG1 2.9Å; T305-I307 PolarHBondContact O-N 3.2Å; T305-F308 PolarHBondContact O-N 3.07Å; T305-F309 HydrophobicContact CG2-CD2 3.59Å; T305-F309 HydrophobicContact CG2-CE2 3.65Å; T305-F309 WeakPolarHBondContact O-CD2 3.46Å; T305-F309 PolarHBondContact O-N 3.48Å
306	Q	93.7	Very high	92.9	Very high	4 Å²	4	20 Å²	20	2%	0.019	11%	0.106	C	C	.	.	H	α-helix	trans	-59.2	-44.7	178.3	-178.5	61.1	27.6	0	0	112.7	R82 F83 L86 Y99 D302 A303 A304 S310	R82-Q306 VanDerWaalsContact CD-OE1 3.27Å; F83-Q306 HydrophobicContact CD2-CG 4.33Å; L86-Q306 HydrophobicContact CD1-CB 3.67Å; L86-Q306 HydrophobicContact CD1-CG 3.94Å; Y99-Q306 HydrophobicContact CD2-CG 4.43Å; Y99-Q306 HydrophobicContact CE2-CB 4.46Å; Y99-Q306 HydrophobicContact CE2-CG 3.86Å; D302-Q306 WeakPolarHBondContact O-CB 3.35Å; D302-Q306 PolarHBondContact O-N 3.29Å; A303-Q306 PolarHBondContact O-N 2.86Å; A304-Q306 PolarHBondContact O-N 3.14Å; Q306-S310 WeakPolarHBondContact O-CB 3.44Å; Q306-S310 PolarHBondContact O-N 2.82Å
307	I	95.8	Very high	93	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.9	-46.6	177.2	-74.2	-67.2	0	0	0	111	Y99 M102 L103 A303 A304 T305 L311	Y99-I307 HydrophobicContact CD1-CD1 4.34Å; Y99-I307 HydrophobicContact CD2-CD1 3.7Å; Y99-I307 HydrophobicContact CD2-CG1 3.77Å; Y99-I307 HydrophobicContact CE1-CD1 3.98Å; Y99-I307 HydrophobicContact CE2-CD1 3.28Å; Y99-I307 HydrophobicContact CE2-CG1 3.71Å; Y99-I307 HydrophobicContact CG-CD1 4.22Å; Y99-I307 HydrophobicContact CG-CG1 4.47Å; Y99-I307 VanDerWaalsContact CZ-CD1 3.43Å; M102-I307 HydrophobicContact CB-CB 4.41Å; M102-I307 HydrophobicContact CB-CG1 4.05Å; L103-I307 HydrophobicContact CB-CD1 3.85Å; L103-I307 HydrophobicContact CD1-CD1 4.32Å; A303-I307 WeakPolarHBondContact O-CG1 3.15Å; A303-I307 PolarHBondContact O-N 3.16Å; A304-I307 PolarHBondContact O-N 2.8Å; T305-I307 PolarHBondContact O-N 3.2Å; I307-L311 HydrophobicContact CG2-CD1 4.04Å; I307-L311 WeakPolarHBondContact O-CB 3.26Å; I307-L311 WeakPolarHBondContact O-CG 3.45Å; I307-L311 PolarHBondContact O-N 3.46Å
308	F	90.2	Very high	93.3	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.7	-50	-178	-175.5	-83.9	0	0	0	111.8	L110 A304 T305 G312 C313 C314 P478 L479 A482	L110-F308 HydrophobicContact CD1-CD2 4.04Å; L110-F308 HydrophobicContact CD1-CE2 3.97Å; A304-F308 VanDerWaalsContact O-CB 3.26Å; A304-F308 WeakPolarHBondContact O-CB 3.3Å; A304-F308 PolarHBondContact O-N 3.27Å; T305-F308 PolarHBondContact O-N 3.07Å; F308-G312 PolarHBondContact O-N 3.41Å; F308-C313 HydrophobicContact CD2-CB 4.31Å; F308-C313 HydrophobicContact CE2-CB 4.2Å; F308-C313 PolarHBondContact O-N 2.77Å; F308-C314 HydrophobicContact CE2-CB 4.24Å; F308-C314 HydrophobicContact CZ-CB 3.81Å; F308-P478 HydrophobicContact CE1-CB 3.71Å; F308-P478 HydrophobicContact CE1-CG 4.12Å; F308-P478 HydrophobicContact CZ-CB 4.02Å; F308-L479 HydrophobicContact CD2-CD2 4.39Å; F308-L479 HydrophobicContact CE2-CD2 4.45Å; F308-A482 HydrophobicContact CE2-CB 3.51Å; F308-A482 HydrophobicContact CZ-CB 3.91Å
309	F	85.8	Confident	93.6	Very high	41 Å²	41	9.5 Å²	9.5	18%	0.18	5%	0.047	C	C	.	.	H	α-helix	trans	-70.4	-43.1	178.3	-75.8	-68.7	0	0	0	113	T305 L311 G312 M473 S474 P478	T305-F309 HydrophobicContact CG2-CD2 3.59Å; T305-F309 HydrophobicContact CG2-CE2 3.65Å; T305-F309 WeakPolarHBondContact O-CD2 3.46Å; T305-F309 PolarHBondContact O-N 3.48Å; F309-L311 VanDerWaalsContact C-N 3.31Å; F309-L311 PolarHBondContact O-N 3.27Å; F309-G312 PolarHBondContact O-N 3.4Å; F309-M473 VanDerWaalsContact CE1-C 3.45Å; F309-M473 HydrophobicContact CE1-CB 4.33Å; F309-M473 WeakPolarHBondContact CE1-O 3.46Å; F309-M473 VanDerWaalsContact CZ-C 3.48Å; F309-M473 WeakPolarHBondContact CZ-O 3.45Å; F309-S474 VanDerWaalsContact CE2-CA 3.45Å; F309-P478 HydrophobicContact CE1-CG 4.06Å; F309-P478 HydrophobicContact CZ-CG 3.69Å
310	S	94.5	Very high	93.7	Very high	12 Å²	12	9.5 Å²	9.5	8%	0.084	5%	0.047	C	C	.	.	H	α-helix	trans	-63.7	-37.9	-177	-178.6	0	0	0	0	111.8	A74 N79 Q306 G312 N342	A74-S310 CarbonylContact C-O 3.13Å; A74-S310 WeakPolarHBondContact CA-O 3.34Å; N79-S310 PolarHBondContact ND2-OG 3.48Å; N79-S310 VanDerWaalsContact ND2-OG 3.16Å; Q306-S310 WeakPolarHBondContact O-CB 3.44Å; Q306-S310 PolarHBondContact O-N 2.82Å; S310-G312 VanDerWaalsContact C-N 3.26Å; S310-G312 PolarHBondContact O-N 2.73Å; S310-N342 PolarHBondContact OG-ND2 3.37Å; S310-N342 PolarHBondContact OG-OD1 3.34Å
311	L	95.7	Very high	93.8	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.033	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-10.9	176.6	-71.1	177.8	0	0	0	113.5	L103 F111 I307 F309 C313 A339 N342	L103-L311 HydrophobicContact CD1-CD1 4.12Å; F111-L311 HydrophobicContact CD2-CB 3.77Å; F111-L311 HydrophobicContact CD2-CD1 4.17Å; F111-L311 HydrophobicContact CD2-CD2 4Å; F111-L311 HydrophobicContact CD2-CG 4.2Å; F111-L311 HydrophobicContact CE2-CB 3.95Å; F111-L311 HydrophobicContact CE2-CD2 3.9Å; F111-L311 HydrophobicContact CE2-CG 4.43Å; F111-L311 WeakPolarHBondContact CE2-O 3.34Å; I307-L311 HydrophobicContact CG2-CD1 4.04Å; I307-L311 WeakPolarHBondContact O-CB 3.26Å; I307-L311 WeakPolarHBondContact O-CG 3.45Å; I307-L311 PolarHBondContact O-N 3.46Å; F309-L311 VanDerWaalsContact C-N 3.31Å; F309-L311 PolarHBondContact O-N 3.27Å; L311-C313 VanDerWaalsContact C-N 3.29Å; L311-C313 PolarHBondContact O-N 2.9Å; L311-A339 HydrophobicContact CD2-CB 4.08Å; L311-N342 HydrophobicContact CD2-CB 3.8Å; L311-N342 WeakPolarHBondContact CD2-ND2 3.39Å
312	G	91.7	Very high	94	Very high	7 Å²	7	5.1 Å²	5.1	7%	0.072	3%	0.029	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	25.4	-176.9	0	0	0	0	0	113.8	Y73 F308 F309 S310	Y73-G312 PolarHBondContact OH-O 3.26Å; Y73-G312 VanDerWaalsContact OH-O 3.07Å; F308-G312 PolarHBondContact O-N 3.41Å; F309-G312 PolarHBondContact O-N 3.4Å; S310-G312 VanDerWaalsContact C-N 3.26Å; S310-G312 PolarHBondContact O-N 2.73Å
313	C	93.5	Very high	94.2	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	145.5	-178.2	-63.4	0	0	0	0	111.9	L110 E114 F308 L311 N315	L110-C313 HydrophobicContact CB-CB 4.25Å; L110-C313 HydrophobicContact CD1-CB 4.41Å; E114-C313 WeakPolarHBondContact OE2-CA 3.44Å; F308-C313 HydrophobicContact CD2-CB 4.31Å; F308-C313 HydrophobicContact CE2-CB 4.2Å; F308-C313 PolarHBondContact O-N 2.77Å; L311-C313 VanDerWaalsContact C-N 3.29Å; L311-C313 PolarHBondContact O-N 2.9Å; C313-N315 PolarHBondContact O-N 3.23Å; C313-N315 VanDerWaalsContact O-N 3.14Å; C313-N315 PolarHBondContact O-ND2 3.5Å
314	C	91.8	Very high	94.1	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	20.9	168.8	-52.9	0	0	0	0	115.4	E114 F308 V481 A482 E485	E114-C314 VanDerWaalsContact CD-N 3.3Å; E114-C314 WeakPolarHBondContact OE1-CA 3.24Å; E114-C314 PolarHBondContact OE1-N 3.31Å; E114-C314 PolarHBondContact OE2-N 2.91Å; F308-C314 HydrophobicContact CE2-CB 4.24Å; F308-C314 HydrophobicContact CZ-CB 3.81Å; C314-V481 HydrophobicContact CB-CG1 4.08Å; C314-V481 VanDerWaalsContact O-CG1 3.29Å; C314-V481 WeakPolarHBondContact O-CG1 3.48Å; C314-A482 HydrophobicContact CB-CB 3.93Å; C314-A482 WeakPolarHBondContact SG-CA 3.37Å; C314-A482 WeakPolarHBondContact SG-CB 3.5Å; C314-E485 PolarHBondContact SG-OE2 3.26Å
315	N	93.5	Very high	94.1	Very high	5 Å²	5	5.8 Å²	5.8	3%	0.027	3%	0.031	C	C	.	.	S	Bend	trans	-102	5.8	167	-62.5	-64.8	0	0	0	111.6	M142 S146 C313 G317	M142-N315 VanDerWaalsContact O-O 3.06Å; S146-N315 PolarHBondContact OG-O 3.04Å; C313-N315 PolarHBondContact O-N 3.23Å; C313-N315 VanDerWaalsContact O-N 3.14Å; C313-N315 PolarHBondContact O-ND2 3.5Å; N315-G317 PolarHBondContact O-N 3.09Å
316	G	95.7	Very high	94.3	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.063	C	C	.	.	S	Bend	trans	79	-2.7	-178.4	0	0	0	0	0	114.8	T320	G316-T320 WeakPolarHBondContact O-CB 3.22Å; G316-T320 PolarHBondContact O-N 2.96Å; G316-T320 PolarHBondContact O-OG1 2.93Å
317	G	96.4	Very high	94.3	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-65.2	-47.3	178.8	0	0	0	0	0	113	N315 I319 T320 V321 T418	N315-G317 PolarHBondContact O-N 3.09Å; G317-I319 PolarHBondContact O-N 3.34Å; G317-T320 WeakPolarHBondContact O-CB 3.29Å; G317-T320 PolarHBondContact O-N 3.48Å; G317-T320 VanDerWaalsContact O-N 3.16Å; G317-V321 WeakPolarHBondContact O-CG2 3.43Å; G317-V321 PolarHBondContact O-N 3.07Å; G317-T418 VanDerWaalsContact CA-OG1 3.27Å; G317-T418 WeakPolarHBondContact CA-OG1 3.29Å
318	L	97.4	Very high	94.3	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.4	-41.3	177.7	-60.1	-174.2	0	0	0	112.1	Y73 F111 E114 F115 T320 S322	Y73-L318 HydrophobicContact CD1-CD2 3.58Å; Y73-L318 HydrophobicContact CE1-CD2 3.49Å; Y73-L318 VanDerWaalsContact CE1-CD2 3.49Å; Y73-L318 HydrophobicContact CE1-CG 3.96Å; F111-L318 HydrophobicContact CB-CD1 4.28Å; F111-L318 HydrophobicContact CD1-CD1 4.29Å; F111-L318 HydrophobicContact CD2-CD1 3.23Å; F111-L318 HydrophobicContact CD2-CD2 4.1Å; F111-L318 HydrophobicContact CD2-CG 4.34Å; F111-L318 HydrophobicContact CE1-CD2 4.2Å; F111-L318 HydrophobicContact CE2-CD1 3.51Å; F111-L318 HydrophobicContact CE2-CD2 3.45Å; F111-L318 VanDerWaalsContact CE2-CD2 3.45Å; F111-L318 HydrophobicContact CE2-CG 4.17Å; F111-L318 HydrophobicContact CG-CD1 3.69Å; F111-L318 HydrophobicContact CZ-CD1 4.15Å; F111-L318 HydrophobicContact CZ-CD2 3.51Å; E114-L318 HydrophobicContact CB-CB 3.73Å; E114-L318 HydrophobicContact CB-CD1 4.43Å; E114-L318 WeakPolarHBondContact OE2-CD1 3.22Å; F115-L318 HydrophobicContact CD1-CB 3.88Å; F115-L318 HydrophobicContact CD1-CD2 4.49Å; F115-L318 HydrophobicContact CE1-CB 3.87Å; F115-L318 HydrophobicContact CE1-CD2 3.7Å; F115-L318 HydrophobicContact CE1-CG 4.27Å; F115-L318 HydrophobicContact CZ-CD2 4.41Å; L318-T320 VanDerWaalsContact C-N 3.35Å; L318-S322 VanDerWaalsContact O-CB 3.25Å; L318-S322 WeakPolarHBondContact O-CB 3.27Å; L318-S322 PolarHBondContact O-N 3.09Å; L318-S322 PolarHBondContact O-OG 3.46Å
319	I	97.4	Very high	94.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.5	-47.3	172.8	-60	176.5	0	0	0	109.8	E114 F117 V128 M142 G317 S322 S323	E114-I319 HydrophobicContact CB-CG1 3.81Å; E114-I319 HydrophobicContact CG-CD1 4.19Å; E114-I319 HydrophobicContact CG-CG1 3.84Å; F117-I319 HydrophobicContact CD1-CD1 3.86Å; F117-I319 HydrophobicContact CD1-CG1 4.46Å; F117-I319 HydrophobicContact CE1-CD1 4.33Å; V128-I319 HydrophobicContact CB-CG2 4.42Å; V128-I319 HydrophobicContact CG1-CD1 4.39Å; V128-I319 HydrophobicContact CG1-CG2 4.11Å; M142-I319 HydrophobicContact CE-CD1 3.86Å; M142-I319 HydrophobicContact SD-CD1 3.78Å; G317-I319 PolarHBondContact O-N 3.34Å; I319-S322 PolarHBondContact O-OG 3.15Å; I319-S322 VanDerWaalsContact O-OG 3.09Å; I319-S323 WeakPolarHBondContact O-CB 3.44Å; I319-S323 PolarHBondContact O-N 2.72Å; I319-S323 PolarHBondContact O-OG 3.12Å
320	T	96.8	Very high	95	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.1	-56.8	-179.8	-62	0	0	0	0	111.2	P125 G316 G317 L318 S322 S323 Y324 E417 T418 S421	P125-T320 VanDerWaalsContact CD-OG1 3.28Å; P125-T320 WeakPolarHBondContact CD-OG1 3.27Å; G316-T320 WeakPolarHBondContact O-CB 3.22Å; G316-T320 PolarHBondContact O-N 2.96Å; G316-T320 PolarHBondContact O-OG1 2.93Å; G317-T320 WeakPolarHBondContact O-CB 3.29Å; G317-T320 PolarHBondContact O-N 3.48Å; G317-T320 VanDerWaalsContact O-N 3.16Å; L318-T320 VanDerWaalsContact C-N 3.35Å; T320-S322 VanDerWaalsContact C-N 3.35Å; T320-S322 PolarHBondContact O-N 2.78Å; T320-S323 PolarHBondContact O-N 3.02Å; T320-S323 PolarHBondContact O-OG 2.76Å; T320-Y324 HydrophobicContact CG2-CE2 3.91Å; T320-Y324 WeakPolarHBondContact O-CD2 3.27Å; T320-Y324 WeakPolarHBondContact O-CE2 3.3Å; T320-E417 HydrophobicContact CG2-CG 4.34Å; T320-T418 WeakPolarHBondContact OG1-CG2 3.47Å; T320-S421 VanDerWaalsContact CG2-OG 3.27Å; T320-S421 WeakPolarHBondContact CG2-OG 3.38Å
321	V	96.1	Very high	95.1	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.012	9%	0.09	C	C	.	.	H	α-helix	trans	-64.9	-38.4	-175	-62.9	0	0	0	0	112.2	W60 F66 T69 F115 G317 S323	W60-V321 HydrophobicContact CZ2-CB 4.2Å; W60-V321 WeakPolarHBondContact CZ2-O 3.24Å; W60-V321 PolarHBondContact NE1-O 3.37Å; F66-V321 HydrophobicContact CE2-CB 4.26Å; F66-V321 HydrophobicContact CE2-CG2 4.07Å; T69-V321 HydrophobicContact CG2-CG1 4.09Å; F115-V321 HydrophobicContact CE1-CG2 4.17Å; G317-V321 WeakPolarHBondContact O-CG2 3.43Å; G317-V321 PolarHBondContact O-N 3.07Å; V321-S323 VanDerWaalsContact C-N 3.33Å; V321-S323 PolarHBondContact O-N 3.04Å
322	S	96.3	Very high	95.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-71.3	-28.1	178.8	62.8	0	0	0	0	113	F115 L318 I319 T320 Y324 N325	F115-S322 WeakPolarHBondContact O-CB 3.21Å; F115-S322 PolarHBondContact O-OG 3.38Å; L318-S322 VanDerWaalsContact O-CB 3.25Å; L318-S322 WeakPolarHBondContact O-CB 3.27Å; L318-S322 PolarHBondContact O-N 3.09Å; L318-S322 PolarHBondContact O-OG 3.46Å; I319-S322 PolarHBondContact O-OG 3.15Å; I319-S322 VanDerWaalsContact O-OG 3.09Å; T320-S322 VanDerWaalsContact C-N 3.35Å; T320-S322 PolarHBondContact O-N 2.78Å; S322-Y324 PolarHBondContact O-N 3.04Å; S322-Y324 VanDerWaalsContact O-N 3.15Å; S322-N325 WeakPolarHBondContact O-CB 3.39Å; S322-N325 PolarHBondContact O-N 3.1Å
323	S	95.1	Very high	95.5	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.021	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-12.1	-179.6	72	0	0	0	0	115.2	R57 G118 S122 L123 I319 T320 V321	R57-S323 PolarHBondContact NH1-OG 2.82Å; R57-S323 PolarHBondContact NH2-OG 2.9Å; G118-S323 VanDerWaalsContact O-CA 3.3Å; G118-S323 WeakPolarHBondContact O-CA 3.48Å; G118-S323 VanDerWaalsContact O-CB 3.32Å; G118-S323 WeakPolarHBondContact O-CB 3.49Å; S122-S323 WeakPolarHBondContact CA-O 3.08Å; S122-S323 WeakPolarHBondContact CB-O 3.45Å; L123-S323 WeakPolarHBondContact O-CB 3.36Å; I319-S323 WeakPolarHBondContact O-CB 3.44Å; I319-S323 PolarHBondContact O-N 2.72Å; I319-S323 PolarHBondContact O-OG 3.12Å; T320-S323 PolarHBondContact O-N 3.02Å; T320-S323 PolarHBondContact O-OG 2.76Å; V321-S323 VanDerWaalsContact C-N 3.33Å; V321-S323 PolarHBondContact O-N 3.04Å
324	Y	94.9	Very high	95.7	Very high	16 Å²	16	26 Å²	26	6%	0.063	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-1	172	-64.7	-80.1	0	0	0	113.5	R57 G58 G59 V248 T320 S322 S421	R57-Y324 HydrophobicContact CG-CE1 3.93Å; R57-Y324 WeakPolarHBondContact O-CE1 3.45Å; G58-Y324 WeakPolarHBondContact O-CD1 3.35Å; G59-Y324 WeakPolarHBondContact CA-O 3.49Å; V248-Y324 HydrophobicContact CB-CD1 4.49Å; V248-Y324 HydrophobicContact CB-CD2 4.5Å; V248-Y324 HydrophobicContact CB-CG 4.37Å; V248-Y324 HydrophobicContact CG1-CD1 4.05Å; V248-Y324 HydrophobicContact CG1-CD2 3.42Å; V248-Y324 VanDerWaalsContact CG1-CD2 3.42Å; V248-Y324 HydrophobicContact CG1-CE1 4.05Å; V248-Y324 HydrophobicContact CG1-CE2 3.46Å; V248-Y324 VanDerWaalsContact CG1-CE2 3.46Å; V248-Y324 HydrophobicContact CG1-CG 3.73Å; V248-Y324 HydrophobicContact CG2-CD1 3.7Å; V248-Y324 HydrophobicContact CG2-CE1 3.98Å; V248-Y324 HydrophobicContact CG2-CG 3.99Å; T320-Y324 HydrophobicContact CG2-CE2 3.91Å; T320-Y324 WeakPolarHBondContact O-CD2 3.27Å; T320-Y324 WeakPolarHBondContact O-CE2 3.3Å; S322-Y324 PolarHBondContact O-N 3.04Å; S322-Y324 VanDerWaalsContact O-N 3.15Å; Y324-S421 WeakPolarHBondContact OH-CB 3.25Å
325	N	94.8	Very high	96	Very high	12 Å²	12	26 Å²	26	6%	0.064	12%	0.118	C	C	.	.	S	Bend	trans	-72.4	156.6	176	-71.8	-17.2	0	0	0	111.7	W60 F66 Q119 S322 N329	W60-N325 PolarHBondContact NE1-OD1 2.92Å; F66-N325 WeakPolarHBondContact CD2-OD1 3.34Å; F66-N325 WeakPolarHBondContact CE1-ND2 3.47Å; F66-N325 VanDerWaalsContact CE2-ND2 3.32Å; F66-N325 WeakPolarHBondContact CE2-ND2 3.45Å; F66-N325 WeakPolarHBondContact CG-OD1 3.49Å; F66-N325 WeakPolarHBondContact CZ-ND2 3.34Å; Q119-N325 HydrophobicContact CG-CB 3.99Å; Q119-N325 PolarHBondContact OE1-ND2 3.24Å; Q119-N325 VanDerWaalsContact OE1-ND2 3.12Å; S322-N325 WeakPolarHBondContact O-CB 3.39Å; S322-N325 PolarHBondContact O-N 3.1Å; N325-N329 HydrophobicContact CB-CB 4.11Å; N325-N329 PolarHBondContact ND2-ND2 3.49Å
326	K	93.4	Very high	96.2	Very high	178 Å²	178	28 Å²	28	77%	0.774	13%	0.129	S	C	*	.			trans	-62.9	141	163.7	-62.6	-175.8	179.8	-174.7	0	108.9	K328 N329	K326-K328 PolarHBondContact O-N 3.2Å; K326-K328 VanDerWaalsContact O-N 3.1Å; K326-N329 VanDerWaalsContact O-CB 3.24Å; K326-N329 WeakPolarHBondContact O-CB 3.29Å; K326-N329 PolarHBondContact O-N 3.27Å
327	F	94	Very high	96.3	Very high	14 Å²	14	31 Å²	31	6%	0.061	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-39.3	-176.1	-175.6	-100.9	0	0	0	113.9	Q119 F120 N329 L504 M505 P595 H600	Q119-F327 PolarHBondContact NE2-O 3.43Å; F120-F327 AromaticContact CD2-CE2 3.81Å; F120-F327 HydrophobicContact CD2-CE2 3.81Å; F120-F327 HydrophobicContact CD2-CZ 4.08Å; F120-F327 HydrophobicContact CE2-CE2 4.22Å; F120-F327 HydrophobicContact CE2-CZ 4.17Å; F120-F327 WeakPolarHBondContact O-CE2 3.46Å; F327-N329 PolarHBondContact O-N 3.31Å; F327-L504 HydrophobicContact CE1-CG 4.11Å; F327-L504 HydrophobicContact CZ-CD2 4.18Å; F327-L504 HydrophobicContact CZ-CG 4.11Å; F327-M505 HydrophobicContact CD1-CG 4.47Å; F327-M505 HydrophobicContact CD2-CG 4.17Å; F327-M505 HydrophobicContact CE1-CG 4.02Å; F327-M505 HydrophobicContact CE2-CG 3.68Å; F327-M505 HydrophobicContact CE2-SD 4.45Å; F327-M505 HydrophobicContact CZ-CG 3.6Å; F327-P595 HydrophobicContact CD2-CB 4.09Å; F327-P595 HydrophobicContact CD2-CG 4.46Å; F327-P595 HydrophobicContact CE2-CB 3.63Å; F327-P595 HydrophobicContact CE2-CG 3.53Å; F327-P595 HydrophobicContact CZ-CB 4.12Å; F327-P595 HydrophobicContact CZ-CG 3.67Å; F327-H600 HydrophobicContact CD1-CB 3.74Å; F327-H600 AromaticContact CD1-CD2 3.32Å; F327-H600 WeakPolarHBondContact CD1-CD2 3.42Å; F327-H600 AromaticContact CD1-CE1 3.89Å; F327-H600 AromaticContact CD1-CG 3.27Å; F327-H600 AromaticContact CD1-ND1 3.64Å; F327-H600 AromaticContact CD1-NE2 3.71Å; F327-H600 HydrophobicContact CD2-CB 4.46Å; F327-H600 HydrophobicContact CE1-CB 3.68Å; F327-H600 AromaticContact CE1-CG 3.63Å; F327-H600 AromaticContact CE1-ND1 3.9Å; F327-H600 HydrophobicContact CE2-CB 4.42Å; F327-H600 HydrophobicContact CG-CB 4.14Å; F327-H600 AromaticContact CG-CD2 3.52Å; F327-H600 AromaticContact CG-CG 3.82Å; F327-H600 HydrophobicContact CZ-CB 4.04Å
328	K	95.1	Very high	96.4	Very high	80 Å²	80	31 Å²	31	35%	0.348	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	13.6	180	-58.7	-68.8	-170.2	174	0	114.9	K326 L504 M505 H600 E603	K326-K328 PolarHBondContact O-N 3.2Å; K326-K328 VanDerWaalsContact O-N 3.1Å; K328-L504 PolarHBondContact NZ-O 3.4Å; K328-M505 VanDerWaalsContact CA-O 3.29Å; K328-M505 WeakPolarHBondContact CA-O 3.24Å; K328-M505 WeakPolarHBondContact CD-O 3.17Å; K328-H600 VanDerWaalsContact CE-CE1 3.41Å; K328-H600 WeakPolarHBondContact CE-CE1 3.47Å; K328-E603 IonicContact NZ-OE2 3.38Å; K328-E603 PolarHBondContact NZ-OE2 3.09Å
329	N	95.1	Very high	96.4	Very high	42 Å²	42	31.1 Å²	31.1	23%	0.225	15%	0.146	C	C	.	.	S	Bend	trans	-68.4	139.8	176.1	-179.2	62.7	0	0	0	110.6	Q119 N325 K326 F327 C331 D334 I506	Q119-N329 PolarHBondContact NE2-O 2.92Å; N325-N329 HydrophobicContact CB-CB 4.11Å; N325-N329 PolarHBondContact ND2-ND2 3.49Å; K326-N329 VanDerWaalsContact O-CB 3.24Å; K326-N329 WeakPolarHBondContact O-CB 3.29Å; K326-N329 PolarHBondContact O-N 3.27Å; F327-N329 PolarHBondContact O-N 3.31Å; N329-C331 VanDerWaalsContact C-N 3.3Å; N329-C331 PolarHBondContact O-N 2.62Å; N329-D334 PolarHBondContact ND2-OD2 3.33Å; N329-I506 VanDerWaalsContact O-CG2 3.3Å; N329-I506 WeakPolarHBondContact O-CG2 3.36Å
330	N	96.6	Very high	96.4	Very high	42 Å²	42	35.8 Å²	35.8	23%	0.225	17%	0.17	C	C	.	.			trans	-78.1	81.4	-178.6	-169.6	-23.8	0	0	0	111.2	C332 R333 D334	N330-C332 VanDerWaalsContact C-N 3.27Å; N330-C332 PolarHBondContact O-N 3.12Å; N330-C332 PolarHBondContact OD1-N 3.28Å; N330-R333 HydrophobicContact CB-CB 4.22Å; N330-R333 PolarHBondContact O-N 3.09Å; N330-R333 WeakPolarHBondContact OD1-CB 3.43Å; N330-R333 PolarHBondContact OD1-N 3.36Å; N330-D334 PolarHBondContact O-N 2.96Å; N330-D334 VanDerWaalsContact O-N 3.15Å
331	C	96.5	Very high	96.5	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.7	-24.5	-178.6	57.8	0	0	0	0	113.8	F115 N329 A335	F115-C331 HydrophobicContact CB-CB 4.16Å; N329-C331 VanDerWaalsContact C-N 3.3Å; N329-C331 PolarHBondContact O-N 2.62Å; C331-A335 VanDerWaalsContact O-CB 3.27Å; C331-A335 WeakPolarHBondContact O-CB 3.31Å; C331-A335 PolarHBondContact O-N 3.02Å
332	C	97.9	Very high	96.6	Very high	22 Å²	22	38 Å²	38	15%	0.149	18%	0.181	C	C	.	.	H	α-helix	trans	-66.4	-51.4	174.2	-176.9	0	0	0	0	111.2	F112 N330 D334 A335 V336 I506	F112-C332 HydrophobicContact CD2-CB 4.05Å; F112-C332 HydrophobicContact CE1-CB 4.19Å; F112-C332 HydrophobicContact CE2-CB 3.46Å; F112-C332 VanDerWaalsContact CE2-CB 3.46Å; F112-C332 HydrophobicContact CZ-CB 3.52Å; N330-C332 VanDerWaalsContact C-N 3.27Å; N330-C332 PolarHBondContact O-N 3.12Å; N330-C332 PolarHBondContact OD1-N 3.28Å; C332-D334 VanDerWaalsContact C-N 3.28Å; C332-D334 PolarHBondContact O-N 3.36Å; C332-A335 PolarHBondContact O-N 3Å; C332-V336 WeakPolarHBondContact O-CG2 3.43Å; C332-V336 PolarHBondContact O-N 2.93Å; C332-I506 HydrophobicContact CB-CD1 3.67Å
333	R	97.4	Very high	96.6	Very high	127 Å²	127	38.5 Å²	38.5	48%	0.479	19%	0.185	S	C	.	.	H	α-helix	trans	-57.9	-45.5	176.3	-178.2	-163.1	65.4	-158.4	-5.9	110.6	N330 V336 I337	N330-R333 HydrophobicContact CB-CB 4.22Å; N330-R333 PolarHBondContact O-N 3.09Å; N330-R333 WeakPolarHBondContact OD1-CB 3.43Å; N330-R333 PolarHBondContact OD1-N 3.36Å; R333-V336 PolarHBondContact O-N 3.39Å; R333-I337 HydrophobicContact CG-CD1 3.72Å; R333-I337 HydrophobicContact CG-CG1 4.38Å; R333-I337 WeakPolarHBondContact O-CB 3.41Å; R333-I337 VanDerWaalsContact O-CG1 3.3Å; R333-I337 WeakPolarHBondContact O-CG1 3.39Å; R333-I337 PolarHBondContact O-N 2.9Å
334	D	97.2	Very high	96.7	Very high	4 Å²	4	41 Å²	41	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-66	-40.1	-177.7	-59.7	-15.4	0	0	0	111.3	F66 M67 F115 N329 N330 C332 I337 V338	F66-D334 HydrophobicContact CE1-CB 3.84Å; F66-D334 WeakPolarHBondContact CE1-OD2 3.43Å; M67-D334 HydrophobicContact CE-CB 3.91Å; M67-D334 VanDerWaalsContact CE-OD1 3.31Å; M67-D334 WeakPolarHBondContact CE-OD1 3.44Å; F115-D334 HydrophobicContact CE2-CB 4.3Å; N329-D334 PolarHBondContact ND2-OD2 3.33Å; N330-D334 PolarHBondContact O-N 2.96Å; N330-D334 VanDerWaalsContact O-N 3.15Å; C332-D334 VanDerWaalsContact C-N 3.28Å; C332-D334 PolarHBondContact O-N 3.36Å; D334-I337 PolarHBondContact O-N 3.42Å; D334-V338 WeakPolarHBondContact O-CB 3.32Å; D334-V338 VanDerWaalsContact O-CG2 3.25Å; D334-V338 WeakPolarHBondContact O-CG2 3.34Å; D334-V338 PolarHBondContact O-N 3.15Å
335	A	97.8	Very high	96.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.8	-47.7	173.1	0	0	0	0	0	112.4	F111 F112 F115 C331 C332 A339	F111-A335 HydrophobicContact CD1-CB 3.71Å; F111-A335 HydrophobicContact CE1-CB 4.41Å; F112-A335 HydrophobicContact CB-CB 3.89Å; F112-A335 HydrophobicContact CD2-CB 4.37Å; F115-A335 HydrophobicContact CD2-CB 3.85Å; F115-A335 HydrophobicContact CE2-CB 4.31Å; C331-A335 VanDerWaalsContact O-CB 3.27Å; C331-A335 WeakPolarHBondContact O-CB 3.31Å; C331-A335 PolarHBondContact O-N 3.02Å; C332-A335 PolarHBondContact O-N 3Å; A335-A339 WeakPolarHBondContact O-CB 3.48Å; A335-A339 PolarHBondContact O-N 3.29Å
336	V	98.2	Very high	97	Very high	45 Å²	45	39.9 Å²	39.9	27%	0.273	20%	0.201	S	C	.	.	H	α-helix	trans	-62.5	-47	178.8	173.1	0	0	0	0	111.3	L108 C332 R333 I340 W514	L108-V336 HydrophobicContact CD1-CB 4.44Å; L108-V336 HydrophobicContact CD1-CG2 3.96Å; L108-V336 HydrophobicContact CD2-CG2 4.28Å; C332-V336 WeakPolarHBondContact O-CG2 3.43Å; C332-V336 PolarHBondContact O-N 2.93Å; R333-V336 PolarHBondContact O-N 3.39Å; V336-I340 HydrophobicContact CG1-CD1 3.72Å; V336-I340 WeakPolarHBondContact O-CB 3.5Å; V336-I340 VanDerWaalsContact O-CG1 3.27Å; V336-I340 WeakPolarHBondContact O-CG1 3.44Å; V336-I340 PolarHBondContact O-N 3.35Å; V336-W514 HydrophobicContact CG2-CH2 4.27Å; V336-W514 HydrophobicContact CG2-CZ2 4.23Å
337	I	98.2	Very high	97.1	Very high	65 Å²	65	33.5 Å²	33.5	33%	0.333	18%	0.176	S	C	.	.	H	α-helix	trans	-61.4	-51	-179.4	-71.1	172.7	0	0	0	110.6	M67 R333 D334 A339 I340 I341	M67-I337 HydrophobicContact CE-CB 4.4Å; M67-I337 HydrophobicContact CE-CD1 4.32Å; M67-I337 HydrophobicContact CE-CG2 4.21Å; M67-I337 HydrophobicContact SD-CG2 3.97Å; R333-I337 HydrophobicContact CG-CD1 3.72Å; R333-I337 HydrophobicContact CG-CG1 4.38Å; R333-I337 WeakPolarHBondContact O-CB 3.41Å; R333-I337 VanDerWaalsContact O-CG1 3.3Å; R333-I337 WeakPolarHBondContact O-CG1 3.39Å; R333-I337 PolarHBondContact O-N 2.9Å; D334-I337 PolarHBondContact O-N 3.42Å; I337-A339 PolarHBondContact O-N 3.34Å; I337-I340 PolarHBondContact O-N 2.87Å; I337-I341 HydrophobicContact CG2-CD1 3.61Å; I337-I341 HydrophobicContact CG2-CG1 4.37Å; I337-I341 WeakPolarHBondContact O-CB 3.38Å; I337-I341 VanDerWaalsContact O-CG1 3.27Å; I337-I341 WeakPolarHBondContact O-CG1 3.46Å; I337-I341 PolarHBondContact O-N 3.16Å
338	V	97.9	Very high	97.3	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.7	-42.2	-177.1	176.6	0	0	0	0	111.1	M67 C70 I71 A74 F111 D334 I340 I341 N342	M67-V338 HydrophobicContact SD-CG2 3.57Å; M67-V338 VanDerWaalsContact SD-CG2 3.57Å; C70-V338 HydrophobicContact CB-CG1 4.1Å; C70-V338 HydrophobicContact CB-CG2 3.69Å; I71-V338 HydrophobicContact CG1-CG2 4.28Å; A74-V338 HydrophobicContact CB-CG1 3.97Å; F111-V338 HydrophobicContact CE1-CB 4.05Å; F111-V338 HydrophobicContact CE1-CG1 4.08Å; F111-V338 HydrophobicContact CE2-CG1 4.48Å; F111-V338 HydrophobicContact CZ-CB 4.07Å; F111-V338 HydrophobicContact CZ-CG1 3.58Å; D334-V338 WeakPolarHBondContact O-CB 3.32Å; D334-V338 VanDerWaalsContact O-CG2 3.25Å; D334-V338 WeakPolarHBondContact O-CG2 3.34Å; D334-V338 PolarHBondContact O-N 3.15Å; V338-I340 PolarHBondContact O-N 3.08Å; V338-I341 PolarHBondContact O-N 2.99Å; V338-N342 WeakPolarHBondContact O-CB 3.28Å; V338-N342 PolarHBondContact O-N 3.38Å
339	A	97.8	Very high	97.3	Very high	2 Å²	2	32.2 Å²	32.2	2%	0.017	17%	0.169	C	C	.	.	H	α-helix	trans	-65.3	-38.7	-180	0	0	0	0	0	112.7	L103 L108 L311 A335 I337 C343	L103-A339 HydrophobicContact CD1-CB 4.06Å; L108-A339 HydrophobicContact CD1-CB 3.94Å; L311-A339 HydrophobicContact CD2-CB 4.08Å; A335-A339 WeakPolarHBondContact O-CB 3.48Å; A335-A339 PolarHBondContact O-N 3.29Å; I337-A339 PolarHBondContact O-N 3.34Å; A339-C343 PolarHBondContact O-N 3.22Å; A339-C343 PolarHBondContact O-SG 3.45Å; A339-C343 VanDerWaalsContact O-SG 3.35Å
340	I	97.7	Very high	97.3	Very high	98 Å²	98	30.2 Å²	30.2	50%	0.503	16%	0.159	S	C	.	.	H	α-helix	trans	-66.6	-47.3	173.5	-70	171.1	0	0	0	110.5	V336 I337 V338 N342 C343 A344	V336-I340 HydrophobicContact CG1-CD1 3.72Å; V336-I340 WeakPolarHBondContact O-CB 3.5Å; V336-I340 VanDerWaalsContact O-CG1 3.27Å; V336-I340 WeakPolarHBondContact O-CG1 3.44Å; V336-I340 PolarHBondContact O-N 3.35Å; I337-I340 PolarHBondContact O-N 2.87Å; V338-I340 PolarHBondContact O-N 3.08Å; I340-N342 VanDerWaalsContact C-N 3.29Å; I340-N342 PolarHBondContact O-N 2.95Å; I340-C343 PolarHBondContact O-N 3.08Å; I340-A344 VanDerWaalsContact O-CB 3.26Å; I340-A344 WeakPolarHBondContact O-CB 3.27Å; I340-A344 PolarHBondContact O-N 3.2Å
341	I	98.1	Very high	97.3	Very high	47 Å²	47	30.9 Å²	30.9	24%	0.241	16%	0.16	C	C	.	.	H	α-helix	trans	-57.4	-45.4	177.8	-73.4	172.6	0	0	0	110.3	I71 V75 Y263 I337 V338 C343 A344 T345	I71-I341 HydrophobicContact CD1-CD1 3.72Å; I71-I341 HydrophobicContact CG1-CD1 4.19Å; I71-I341 HydrophobicContact CG1-CG2 4.31Å; I71-I341 HydrophobicContact CG2-CG2 4.09Å; V75-I341 HydrophobicContact CG2-CG2 4.36Å; Y263-I341 WeakPolarHBondContact OH-CG2 3.27Å; I337-I341 HydrophobicContact CG2-CD1 3.61Å; I337-I341 HydrophobicContact CG2-CG1 4.37Å; I337-I341 WeakPolarHBondContact O-CB 3.38Å; I337-I341 VanDerWaalsContact O-CG1 3.27Å; I337-I341 WeakPolarHBondContact O-CG1 3.46Å; I337-I341 PolarHBondContact O-N 3.16Å; V338-I341 PolarHBondContact O-N 2.99Å; I341-C343 PolarHBondContact O-N 3.12Å; I341-A344 PolarHBondContact O-N 3.21Å; I341-T345 VanDerWaalsContact O-CB 3.3Å; I341-T345 WeakPolarHBondContact O-CB 2.91Å; I341-T345 PolarHBondContact O-N 3Å; I341-T345 PolarHBondContact O-OG1 3.26Å
342	N	97.7	Very high	97.2	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-54.8	-51.9	176.9	178.5	62.6	0	0	0	112	A74 N79 S310 L311 V338 I340 T345 S346	A74-N342 HydrophobicContact CB-CB 4.19Å; A74-N342 PolarHBondContact O-OD1 3.35Å; N79-N342 PolarHBondContact ND2-O 2.92Å; N79-N342 PolarHBondContact ND2-OD1 3.47Å; S310-N342 PolarHBondContact OG-ND2 3.37Å; S310-N342 PolarHBondContact OG-OD1 3.34Å; L311-N342 HydrophobicContact CD2-CB 3.8Å; L311-N342 WeakPolarHBondContact CD2-ND2 3.39Å; V338-N342 WeakPolarHBondContact O-CB 3.28Å; V338-N342 PolarHBondContact O-N 3.38Å; I340-N342 VanDerWaalsContact C-N 3.29Å; I340-N342 PolarHBondContact O-N 2.95Å; N342-T345 PolarHBondContact O-N 3.06Å; N342-S346 PolarHBondContact O-N 2.83Å; N342-S346 PolarHBondContact O-OG 3.19Å
343	C	97.5	Very high	96.9	Very high	12 Å²	12	30 Å²	30	8%	0.081	15%	0.154	C	C	.	.	H	α-helix	trans	-70.9	-39.5	-177.5	-65.6	0	0	0	0	113.1	Y99 L103 A339 I340 I341 T345 S346 V347	Y99-C343 HydrophobicContact CE1-CB 3.79Å; Y99-C343 PolarHBondContact OH-SG 3.47Å; Y99-C343 VanDerWaalsContact OH-SG 3.38Å; L103-C343 HydrophobicContact CD2-CB 4.05Å; L103-C343 VanDerWaalsContact CD2-SG 3.58Å; A339-C343 PolarHBondContact O-N 3.22Å; A339-C343 PolarHBondContact O-SG 3.45Å; A339-C343 VanDerWaalsContact O-SG 3.35Å; I340-C343 PolarHBondContact O-N 3.08Å; I341-C343 PolarHBondContact O-N 3.12Å; C343-T345 VanDerWaalsContact C-N 3.26Å; C343-T345 PolarHBondContact O-N 2.94Å; C343-S346 WeakPolarHBondContact O-CB 3.27Å; C343-S346 PolarHBondContact O-N 3.41Å; C343-V347 WeakPolarHBondContact O-CG2 3.43Å; C343-V347 PolarHBondContact O-N 3.46Å; C343-V347 VanDerWaalsContact O-N 3.07Å
344	A	97.6	Very high	96.7	Very high	55 Å²	55	24 Å²	24	46%	0.455	13%	0.131	S	C	.	.	H	α-helix	trans	-61.6	-38.1	173.7	0	0	0	0	0	111	I340 I341 V347 Y348	I340-A344 VanDerWaalsContact O-CB 3.26Å; I340-A344 WeakPolarHBondContact O-CB 3.27Å; I340-A344 PolarHBondContact O-N 3.2Å; I341-A344 PolarHBondContact O-N 3.21Å; A344-V347 PolarHBondContact O-N 2.81Å; A344-Y348 VanDerWaalsContact O-CB 3.25Å; A344-Y348 WeakPolarHBondContact O-CB 2.74Å; A344-Y348 PolarHBondContact O-N 3.31Å
345	T	97.7	Very high	96.6	Very high	5 Å²	5	23.9 Å²	23.9	3%	0.031	13%	0.131	C	C	.	.	H	α-helix	trans	-66.7	-41.1	176.8	-54.4	0	0	0	0	111.8	V75 Y263 L266 I341 N342 C343 V347 Y348 A349	V75-T345 HydrophobicContact CG1-CG2 3.52Å; Y263-T345 HydrophobicContact CE1-CG2 4Å; Y263-T345 WeakPolarHBondContact CE1-OG1 3.49Å; Y263-T345 PolarHBondContact OH-OG1 3.28Å; L266-T345 HydrophobicContact CD1-CG2 3.97Å; I341-T345 VanDerWaalsContact O-CB 3.3Å; I341-T345 WeakPolarHBondContact O-CB 2.91Å; I341-T345 PolarHBondContact O-N 3Å; I341-T345 PolarHBondContact O-OG1 3.26Å; N342-T345 PolarHBondContact O-N 3.06Å; C343-T345 VanDerWaalsContact C-N 3.26Å; C343-T345 PolarHBondContact O-N 2.94Å; T345-V347 VanDerWaalsContact C-N 3.34Å; T345-V347 PolarHBondContact O-N 3.41Å; T345-Y348 PolarHBondContact O-N 2.86Å; T345-A349 VanDerWaalsContact O-CB 3.29Å; T345-A349 WeakPolarHBondContact O-CB 3.42Å; T345-A349 PolarHBondContact O-N 3.03Å
346	S	97.1	Very high	96.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-56.4	-48.9	172.2	-57.2	0	0	0	0	111.6	N79 F83 Y99 N342 C343 Y348 A349 G350	N79-S346 PolarHBondContact ND2-OG 3.18Å; F83-S346 WeakPolarHBondContact CD1-O 3.37Å; F83-S346 VanDerWaalsContact CE1-C 3.48Å; F83-S346 VanDerWaalsContact CE1-O 3.3Å; F83-S346 WeakPolarHBondContact CE1-O 3.44Å; Y99-S346 PolarHBondContact OH-OG 2.98Å; N342-S346 PolarHBondContact O-N 2.83Å; N342-S346 PolarHBondContact O-OG 3.19Å; C343-S346 WeakPolarHBondContact O-CB 3.27Å; C343-S346 PolarHBondContact O-N 3.41Å; S346-Y348 PolarHBondContact O-N 3.46Å; S346-A349 PolarHBondContact O-N 3.28Å; S346-G350 PolarHBondContact O-N 3.44Å
347	V	97	Very high	95.9	Very high	43 Å²	43	22.6 Å²	22.6	26%	0.261	12%	0.122	S	C	.	.	H	α-helix	trans	-63.7	-43.4	179.4	173.6	0	0	0	0	111.3	F83 L96 Y286 C343 A344 T345 G350 F351	F83-V347 HydrophobicContact CE1-CG2 4.32Å; F83-V347 HydrophobicContact CZ-CG2 3.94Å; L96-V347 HydrophobicContact CD2-CG2 4.04Å; Y286-V347 WeakPolarHBondContact OH-CA 3.11Å; Y286-V347 PolarHBondContact OH-O 3.24Å; Y286-V347 VanDerWaalsContact OH-O 3.05Å; C343-V347 WeakPolarHBondContact O-CG2 3.43Å; C343-V347 PolarHBondContact O-N 3.46Å; C343-V347 VanDerWaalsContact O-N 3.07Å; A344-V347 PolarHBondContact O-N 2.81Å; T345-V347 VanDerWaalsContact C-N 3.34Å; T345-V347 PolarHBondContact O-N 3.41Å; V347-G350 WeakPolarHBondContact O-CA 3.34Å; V347-G350 PolarHBondContact O-N 3.35Å; V347-F351 HydrophobicContact CG1-CD2 4.49Å; V347-F351 HydrophobicContact CG1-CE2 3.97Å; V347-F351 VanDerWaalsContact O-CD2 3.25Å; V347-F351 WeakPolarHBondContact O-CD2 3.33Å; V347-F351 PolarHBondContact O-N 2.97Å
348	Y	97.1	Very high	95.7	Very high	67 Å²	67	19.6 Å²	19.6	26%	0.263	11%	0.107	S	C	.	.	H	α-helix	trans	-63.8	-44.4	178.6	-171.5	-111.7	0	0	0	112.2	L266 T267 L270 A344 T345 S346 G350 F351 V352	L266-Y348 HydrophobicContact CB-CD1 4Å; L266-Y348 HydrophobicContact CB-CE1 3.68Å; L266-Y348 HydrophobicContact CD1-CD1 4.22Å; T267-Y348 WeakPolarHBondContact CA-OH 2.95Å; T267-Y348 PolarHBondContact OG1-OH 2.88Å; L270-Y348 HydrophobicContact CD2-CD2 4.2Å; L270-Y348 HydrophobicContact CD2-CE2 3.33Å; L270-Y348 WeakPolarHBondContact CD2-OH 3.2Å; A344-Y348 VanDerWaalsContact O-CB 3.25Å; A344-Y348 WeakPolarHBondContact O-CB 2.74Å; A344-Y348 PolarHBondContact O-N 3.31Å; T345-Y348 PolarHBondContact O-N 2.86Å; S346-Y348 PolarHBondContact O-N 3.46Å; Y348-G350 VanDerWaalsContact C-N 3.26Å; Y348-G350 PolarHBondContact O-N 3.15Å; Y348-F351 WeakPolarHBondContact O-CB 3.5Å; Y348-F351 PolarHBondContact O-N 3.49Å; Y348-F351 VanDerWaalsContact O-N 3.1Å; Y348-V352 PolarHBondContact O-N 2.96Å
349	A	95.5	Very high	95.5	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62	-36	173.4	0	0	0	0	0	111.2	V80 L266 T345 S346 F351 V352 I353	V80-A349 HydrophobicContact CB-CB 4.47Å; V80-A349 HydrophobicContact CG2-CB 4.17Å; L266-A349 HydrophobicContact CD2-CB 4.1Å; T345-A349 VanDerWaalsContact O-CB 3.29Å; T345-A349 WeakPolarHBondContact O-CB 3.42Å; T345-A349 PolarHBondContact O-N 3.03Å; S346-A349 PolarHBondContact O-N 3.28Å; A349-F351 VanDerWaalsContact C-N 3.28Å; A349-F351 PolarHBondContact O-N 2.95Å; A349-V352 WeakPolarHBondContact O-CA 3.06Å; A349-V352 WeakPolarHBondContact O-CB 3.21Å; A349-V352 PolarHBondContact O-N 3.15Å; A349-I353 WeakPolarHBondContact O-CB 3.48Å; A349-I353 VanDerWaalsContact O-CG1 3.25Å; A349-I353 WeakPolarHBondContact O-CG1 3.2Å; A349-I353 PolarHBondContact O-N 3.46Å
350	G	94.7	Very high	95.1	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-52.3	-42.5	170.3	0	0	0	0	0	113.5	S346 V347 Y348 I353 F354	S346-G350 PolarHBondContact O-N 3.44Å; V347-G350 WeakPolarHBondContact O-CA 3.34Å; V347-G350 PolarHBondContact O-N 3.35Å; Y348-G350 VanDerWaalsContact C-N 3.26Å; Y348-G350 PolarHBondContact O-N 3.15Å; G350-I353 PolarHBondContact O-N 3.39Å; G350-F354 WeakPolarHBondContact O-CB 3.31Å; G350-F354 WeakPolarHBondContact O-CD2 3.35Å; G350-F354 PolarHBondContact O-N 3.44Å
351	F	96.3	Very high	94.8	Very high	56 Å²	56	15.5 Å²	15.5	25%	0.246	9%	0.086	C	C	.	.	H	α-helix	trans	-65	-42.1	174.2	-73.1	-84	0	0	0	112.9	L270 V283 Y286 L287 V347 Y348 A349 I353 S355	L270-F351 HydrophobicContact CD1-CB 3.72Å; V283-F351 HydrophobicContact CG1-CD1 3.91Å; V283-F351 HydrophobicContact CG1-CE1 3.82Å; V283-F351 HydrophobicContact CG2-CD1 4.4Å; Y286-F351 HydrophobicContact CD1-CD1 4.44Å; Y286-F351 HydrophobicContact CD1-CE1 4.48Å; Y286-F351 HydrophobicContact CE1-CD1 4.49Å; Y286-F351 HydrophobicContact CE1-CD2 4.01Å; Y286-F351 HydrophobicContact CE1-CE2 4.03Å; Y286-F351 HydrophobicContact CE1-CG 4.25Å; Y286-F351 HydrophobicContact CE1-CZ 4.3Å; L287-F351 HydrophobicContact CD1-CE1 4.02Å; L287-F351 HydrophobicContact CD1-CZ 4.26Å; L287-F351 HydrophobicContact CD2-CE1 4.34Å; L287-F351 HydrophobicContact CD2-CZ 3.96Å; L287-F351 HydrophobicContact CG-CE1 4.4Å; V347-F351 HydrophobicContact CG1-CD2 4.49Å; V347-F351 HydrophobicContact CG1-CE2 3.97Å; V347-F351 VanDerWaalsContact O-CD2 3.25Å; V347-F351 WeakPolarHBondContact O-CD2 3.33Å; V347-F351 PolarHBondContact O-N 2.97Å; Y348-F351 WeakPolarHBondContact O-CB 3.5Å; Y348-F351 PolarHBondContact O-N 3.49Å; Y348-F351 VanDerWaalsContact O-N 3.1Å; A349-F351 VanDerWaalsContact C-N 3.28Å; A349-F351 PolarHBondContact O-N 2.95Å; F351-I353 VanDerWaalsContact C-N 3.3Å; F351-I353 PolarHBondContact O-N 3.19Å; F351-S355 VanDerWaalsContact O-CB 3.24Å; F351-S355 WeakPolarHBondContact O-CB 3.42Å; F351-S355 PolarHBondContact O-N 3.49Å; F351-S355 PolarHBondContact O-OG 3.1Å
352	V	94.1	Very high	94.5	Very high	3 Å²	3	20.3 Å²	20.3	2%	0.018	10%	0.103	C	C	.	.	H	α-helix	trans	-58.1	-48.4	175.2	178	0	0	0	0	109.6	L266 L269 L270 Y348 A349 S355 N356	L266-V352 HydrophobicContact CB-CG2 4.41Å; L266-V352 HydrophobicContact CD2-CB 4.48Å; L266-V352 HydrophobicContact CD2-CG2 3.97Å; L266-V352 WeakPolarHBondContact O-CG2 3.47Å; L269-V352 HydrophobicContact CB-CG1 3.67Å; L269-V352 HydrophobicContact CD1-CG1 4.49Å; L270-V352 HydrophobicContact CB-CG2 3.79Å; L270-V352 HydrophobicContact CD1-CG2 4.37Å; Y348-V352 PolarHBondContact O-N 2.96Å; A349-V352 WeakPolarHBondContact O-CA 3.06Å; A349-V352 WeakPolarHBondContact O-CB 3.21Å; A349-V352 PolarHBondContact O-N 3.15Å; V352-S355 PolarHBondContact O-OG 2.99Å; V352-N356 PolarHBondContact O-N 2.89Å; V352-N356 PolarHBondContact O-ND2 3.02Å
353	I	92.1	Very high	94.1	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-62.8	-57.6	-178.3	-70.5	-20.6	0	0	0	111.5	V80 P84 A349 G350 F351 S355 N356 L357 Y383	V80-I353 HydrophobicContact CG1-CD1 4.05Å; V80-I353 VanDerWaalsContact O-CG1 3.22Å; V80-I353 WeakPolarHBondContact O-CG1 3.46Å; P84-I353 HydrophobicContact CB-CB 4.08Å; P84-I353 HydrophobicContact CB-CG1 4.14Å; P84-I353 HydrophobicContact CB-CG2 3.69Å; P84-I353 HydrophobicContact CG-CB 4.23Å; P84-I353 HydrophobicContact CG-CG1 3.84Å; P84-I353 HydrophobicContact CG-CG2 4.37Å; A349-I353 WeakPolarHBondContact O-CB 3.48Å; A349-I353 VanDerWaalsContact O-CG1 3.25Å; A349-I353 WeakPolarHBondContact O-CG1 3.2Å; A349-I353 PolarHBondContact O-N 3.46Å; G350-I353 PolarHBondContact O-N 3.39Å; F351-I353 VanDerWaalsContact C-N 3.3Å; F351-I353 PolarHBondContact O-N 3.19Å; I353-S355 VanDerWaalsContact C-N 3.34Å; I353-S355 PolarHBondContact O-N 3.39Å; I353-N356 PolarHBondContact O-N 3.43Å; I353-N356 VanDerWaalsContact O-N 3.14Å; I353-L357 HydrophobicContact CG2-CD1 3.87Å; I353-L357 HydrophobicContact CG2-CG 4.37Å; I353-L357 WeakPolarHBondContact O-CG 3.4Å; I353-L357 PolarHBondContact O-N 2.69Å; I353-Y383 HydrophobicContact CB-CE1 4.03Å; I353-Y383 WeakPolarHBondContact CB-OH 3.46Å; I353-Y383 HydrophobicContact CD1-CD1 4.29Å; I353-Y383 HydrophobicContact CD1-CD2 4.35Å; I353-Y383 HydrophobicContact CD1-CE1 3.58Å; I353-Y383 HydrophobicContact CD1-CE2 3.7Å; I353-Y383 WeakPolarHBondContact CD1-OH 3.46Å; I353-Y383 HydrophobicContact CG1-CE1 3.99Å; I353-Y383 HydrophobicContact CG1-CE2 4.27Å; I353-Y383 WeakPolarHBondContact CG1-OH 3.46Å; I353-Y383 HydrophobicContact CG2-CE1 3.73Å; I353-Y383 WeakPolarHBondContact CG2-OH 3.46Å
354	F	93	Very high	93.5	Very high	1 Å²	1	28.6 Å²	28.6	0%	0.004	14%	0.139	C	C	.	.	H	α-helix	trans	-72.3	-28.1	-170.9	-85.7	-90	0	0	0	112.9	P84 F88 G282 Y285 Y286 G350 N356 L357 G358 I368	P84-F354 HydrophobicContact CB-CD2 4.41Å; P84-F354 HydrophobicContact CB-CE2 4.04Å; F88-F354 HydrophobicContact CB-CZ 3.88Å; F88-F354 HydrophobicContact CD2-CE1 4.45Å; G282-F354 VanDerWaalsContact CA-O 3.28Å; G282-F354 WeakPolarHBondContact CA-O 3.05Å; Y285-F354 HydrophobicContact CD1-CD1 4.4Å; Y285-F354 AromaticContact CD1-CE1 3.73Å; Y285-F354 HydrophobicContact CD1-CE1 3.73Å; Y285-F354 HydrophobicContact CE1-CE1 4.27Å; Y286-F354 HydrophobicContact CD1-CD2 4.5Å; Y286-F354 AromaticContact CD2-CD2 3.55Å; Y286-F354 HydrophobicContact CD2-CD2 3.55Å; Y286-F354 AromaticContact CD2-CE2 3.45Å; Y286-F354 HydrophobicContact CD2-CE2 3.45Å; Y286-F354 VanDerWaalsContact CD2-CE2 3.45Å; Y286-F354 HydrophobicContact CD2-CG 4.28Å; Y286-F354 HydrophobicContact CD2-CZ 4.11Å; Y286-F354 HydrophobicContact CE2-CD2 4.3Å; Y286-F354 HydrophobicContact CE2-CE2 4.16Å; Y286-F354 HydrophobicContact CG-CB 4.34Å; Y286-F354 AromaticContact CG-CD2 3.68Å; Y286-F354 HydrophobicContact CG-CD2 3.68Å; Y286-F354 HydrophobicContact CG-CE2 4.03Å; Y286-F354 HydrophobicContact CG-CG 4.01Å; G350-F354 WeakPolarHBondContact O-CB 3.31Å; G350-F354 WeakPolarHBondContact O-CD2 3.35Å; G350-F354 PolarHBondContact O-N 3.44Å; F354-N356 VanDerWaalsContact C-N 3.31Å; F354-N356 PolarHBondContact O-N 3.38Å; F354-L357 HydrophobicContact CD1-CD1 4.34Å; F354-L357 PolarHBondContact O-N 3.05Å; F354-G358 PolarHBondContact O-N 3.06Å; F354-I368 HydrophobicContact CD1-CG2 4.38Å; F354-I368 HydrophobicContact CE1-CG2 4.33Å
355	S	94.9	Very high	93.1	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.007	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-40.2	170.8	59.2	0	0	0	0	111.9	S279 F351 V352 I353 F359	S279-S355 WeakPolarHBondContact CA-O 2.98Å; S279-S355 WeakPolarHBondContact CB-O 3.45Å; F351-S355 VanDerWaalsContact O-CB 3.24Å; F351-S355 WeakPolarHBondContact O-CB 3.42Å; F351-S355 PolarHBondContact O-N 3.49Å; F351-S355 PolarHBondContact O-OG 3.1Å; V352-S355 PolarHBondContact O-OG 2.99Å; I353-S355 VanDerWaalsContact C-N 3.34Å; I353-S355 PolarHBondContact O-N 3.39Å; S355-F359 PolarHBondContact O-N 2.89Å
356	N	91.7	Very high	92.6	Very high	16 Å²	16	34.9 Å²	34.9	9%	0.086	17%	0.166	C	C	.	.	H	α-helix	trans	-72.5	-38	176	-71	-60.6	0	0	0	112.6	V352 I353 F354 F359 M360 A386 M390	V352-N356 PolarHBondContact O-N 2.89Å; V352-N356 PolarHBondContact O-ND2 3.02Å; I353-N356 PolarHBondContact O-N 3.43Å; I353-N356 VanDerWaalsContact O-N 3.14Å; F354-N356 VanDerWaalsContact C-N 3.31Å; F354-N356 PolarHBondContact O-N 3.38Å; N356-F359 PolarHBondContact O-N 2.91Å; N356-M360 PolarHBondContact O-N 3.16Å; N356-A386 HydrophobicContact CB-CB 4.36Å; N356-M390 HydrophobicContact CB-CE 4.32Å; N356-M390 WeakPolarHBondContact OD1-CE 3.38Å
357	L	90.8	Very high	92.3	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-38.9	173.7	-65.2	178.9	0	0	0	112.3	I353 F354 F359 M360 A361 V371 A372 V382 Y383	I353-L357 HydrophobicContact CG2-CD1 3.87Å; I353-L357 HydrophobicContact CG2-CG 4.37Å; I353-L357 WeakPolarHBondContact O-CG 3.4Å; I353-L357 PolarHBondContact O-N 2.69Å; F354-L357 HydrophobicContact CD1-CD1 4.34Å; F354-L357 PolarHBondContact O-N 3.05Å; L357-F359 VanDerWaalsContact C-N 3.32Å; L357-F359 PolarHBondContact O-N 3.23Å; L357-M360 PolarHBondContact O-N 3.11Å; L357-A361 WeakPolarHBondContact O-CB 3.26Å; L357-A361 PolarHBondContact O-N 2.94Å; L357-V371 HydrophobicContact CB-CG2 4.47Å; L357-A372 HydrophobicContact CD1-CB 4.11Å; L357-V382 HydrophobicContact CD2-CG1 3.29Å; L357-Y383 HydrophobicContact CD2-CE1 4.38Å; L357-Y383 HydrophobicContact CG-CE1 4.49Å
358	G	93.8	Very high	91.8	Very high	2 Å²	2	37.1 Å²	37.1	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-40	175.1	0	0	0	0	0	112.5	G278 F354 Y362	G278-G358 CarbonylContact O-C 3.45Å; F354-G358 PolarHBondContact O-N 3.06Å; G358-Y362 WeakPolarHBondContact O-CB 3.11Å; G358-Y362 PolarHBondContact O-N 2.87Å
359	F	93.4	Very high	91.3	Very high	7 Å²	7	37.3 Å²	37.3	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-64.8	-43.9	172.8	168.4	-111.5	0	0	0	113	L276 P277 S355 N356 L357 Y362 Q363 N389 M390	L276-F359 HydrophobicContact CB-CB 3.89Å; L276-F359 HydrophobicContact CB-CD2 3.64Å; L276-F359 HydrophobicContact CB-CE2 4.15Å; L276-F359 HydrophobicContact CB-CG 3.81Å; L276-F359 HydrophobicContact CD1-CB 4.12Å; L276-F359 HydrophobicContact CD1-CD1 3.71Å; L276-F359 HydrophobicContact CD1-CD2 4.21Å; L276-F359 HydrophobicContact CD1-CE1 3.97Å; L276-F359 HydrophobicContact CD1-CE2 4.43Å; L276-F359 HydrophobicContact CD1-CG 3.76Å; L276-F359 HydrophobicContact CD1-CZ 4.24Å; L276-F359 HydrophobicContact CD2-CD2 4.13Å; L276-F359 HydrophobicContact CD2-CE1 4.36Å; L276-F359 HydrophobicContact CD2-CE2 3.76Å; L276-F359 HydrophobicContact CD2-CG 4.49Å; L276-F359 HydrophobicContact CD2-CZ 3.81Å; L276-F359 HydrophobicContact CG-CD2 4.2Å; L276-F359 HydrophobicContact CG-CE2 4.33Å; L276-F359 HydrophobicContact CG-CG 4.22Å; L276-F359 HydrophobicContact CG-CZ 4.49Å; P277-F359 HydrophobicContact CG-CD2 3.91Å; P277-F359 HydrophobicContact CG-CE2 3.93Å; P277-F359 WeakPolarHBondContact O-CA 3.45Å; P277-F359 WeakPolarHBondContact O-CD2 3.48Å; S355-F359 PolarHBondContact O-N 2.89Å; N356-F359 PolarHBondContact O-N 2.91Å; L357-F359 VanDerWaalsContact C-N 3.32Å; L357-F359 PolarHBondContact O-N 3.23Å; F359-Y362 WeakPolarHBondContact O-CB 3.32Å; F359-Y362 PolarHBondContact O-N 3.29Å; F359-Q363 HydrophobicContact CD2-CG 4.23Å; F359-Q363 HydrophobicContact CE1-CG 4.49Å; F359-Q363 HydrophobicContact CE2-CG 3.93Å; F359-Q363 HydrophobicContact CZ-CG 4.15Å; F359-Q363 PolarHBondContact O-N 3.36Å; F359-N389 HydrophobicContact CE1-CB 3.94Å; F359-N389 WeakPolarHBondContact CZ-O 3.3Å; F359-M390 HydrophobicContact CD1-CE 4.22Å; F359-M390 HydrophobicContact CD1-CG 4.33Å; F359-M390 HydrophobicContact CE1-CE 4.33Å; F359-M390 HydrophobicContact CE1-CG 3.56Å; F359-M390 HydrophobicContact CZ-CG 4.16Å
360	M	90	Very high	90.6	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-44	177	-177.9	178.5	170.3	0	0	111.6	N356 L357 Y362 Q363 K364 V371 V382 E385 A386	N356-M360 PolarHBondContact O-N 3.16Å; L357-M360 PolarHBondContact O-N 3.11Å; M360-Y362 VanDerWaalsContact C-N 3.33Å; M360-Y362 PolarHBondContact O-N 2.91Å; M360-Q363 PolarHBondContact O-N 3.44Å; M360-K364 HydrophobicContact CE-CD 4.17Å; M360-K364 HydrophobicContact CG-CD 4.46Å; M360-K364 WeakPolarHBondContact O-CB 3.41Å; M360-K364 PolarHBondContact O-N 2.66Å; M360-V371 HydrophobicContact CE-CB 4.25Å; M360-V371 HydrophobicContact CE-CG1 4.07Å; M360-V371 HydrophobicContact CG-CG1 4.24Å; M360-V371 HydrophobicContact SD-CB 4.25Å; M360-V371 HydrophobicContact SD-CG1 4.38Å; M360-V382 HydrophobicContact SD-CG1 4.17Å; M360-E385 HydrophobicContact CE-CB 3.94Å; M360-E385 HydrophobicContact CE-CG 3.62Å; M360-E385 WeakPolarHBondContact CE-OE1 3.34Å; M360-E385 WeakPolarHBondContact CE-OE2 3.36Å; M360-E385 HydrophobicContact SD-CB 4.32Å; M360-E385 HydrophobicContact SD-CG 4.46Å; M360-A386 HydrophobicContact CB-CB 4.36Å; M360-A386 HydrophobicContact SD-CB 4.19Å
361	A	90.7	Very high	89.8	Confident	5 Å²	5	44 Å²	44	4%	0.041	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-42.5	175.1	0	0	0	0	0	111.7	L357 K364 N365 T366 I368 V371	L357-A361 WeakPolarHBondContact O-CB 3.26Å; L357-A361 PolarHBondContact O-N 2.94Å; A361-K364 PolarHBondContact O-N 2.89Å; A361-N365 PolarHBondContact O-N 3.32Å; A361-T366 HydrophobicContact CB-CG2 4.49Å; A361-T366 PolarHBondContact O-N 3.27Å; A361-I368 HydrophobicContact CB-CG1 4.09Å; A361-V371 HydrophobicContact CB-CG2 4.3Å
362	Y	92.8	Very high	88.9	Confident	148 Å²	148	41.5 Å²	41.5	58%	0.58	21%	0.208	S	C	*	.	H	α-helix	trans	-62	-45.2	175.1	175	-92.8	0	0	0	112.6	P277 G358 F359 M360 N365	P277-Y362 HydrophobicContact CB-CD1 3.98Å; P277-Y362 HydrophobicContact CB-CE1 3.74Å; P277-Y362 HydrophobicContact CG-CD1 4Å; P277-Y362 HydrophobicContact CG-CE1 3.86Å; G358-Y362 WeakPolarHBondContact O-CB 3.11Å; G358-Y362 PolarHBondContact O-N 2.87Å; F359-Y362 WeakPolarHBondContact O-CB 3.32Å; F359-Y362 PolarHBondContact O-N 3.29Å; M360-Y362 VanDerWaalsContact C-N 3.33Å; M360-Y362 PolarHBondContact O-N 2.91Å; Y362-N365 PolarHBondContact O-N 2.76Å
363	Q	88.3	Confident	87.5	Confident	86 Å²	86	44.9 Å²	44.9	40%	0.402	23%	0.232	S	C	.	.	H	α-helix	trans	-66.3	-39.8	179.1	-76.1	-151.1	5.3	0	0	113.4	F359 M360 N365 N389	F359-Q363 HydrophobicContact CD2-CG 4.23Å; F359-Q363 HydrophobicContact CE1-CG 4.49Å; F359-Q363 HydrophobicContact CE2-CG 3.93Å; F359-Q363 HydrophobicContact CZ-CG 4.15Å; F359-Q363 PolarHBondContact O-N 3.36Å; M360-Q363 PolarHBondContact O-N 3.44Å; Q363-N365 PolarHBondContact O-N 3.25Å; Q363-N389 PolarHBondContact NE2-O 3.06Å; Q363-N389 VanDerWaalsContact OE1-CG 3.27Å; Q363-N389 PolarHBondContact OE1-OD1 3.38Å
364	K	85.6	Confident	85.9	Confident	100 Å²	100	46.8 Å²	46.8	44%	0.435	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-1.6	178.6	-73.9	-171.6	169.5	-161.7	0	113.7	M360 A361 T366 E385	M360-K364 HydrophobicContact CE-CD 4.17Å; M360-K364 HydrophobicContact CG-CD 4.46Å; M360-K364 WeakPolarHBondContact O-CB 3.41Å; M360-K364 PolarHBondContact O-N 2.66Å; A361-K364 PolarHBondContact O-N 2.89Å; K364-T366 HydrophobicContact CB-CG2 3.68Å; K364-T366 PolarHBondContact O-N 3.02Å; K364-E385 WeakPolarHBondContact CE-OE1 3.48Å; K364-E385 IonicContact NZ-OE1 2.85Å; K364-E385 PolarHBondContact NZ-OE1 2.88Å
365	N	87.8	Confident	84.4	Confident	156 Å²	156	47.1 Å²	47.1	83%	0.834	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.2	44.5	-173.7	-166.4	42.2	0	0	0	112.6	A361 Y362 Q363	A361-N365 PolarHBondContact O-N 3.32Å; Y362-N365 PolarHBondContact O-N 2.76Å; Q363-N365 PolarHBondContact O-N 3.25Å
366	T	88.1	Confident	82.2	Confident	36 Å²	36	51.1 Å²	51.1	22%	0.221	28%	0.275	C	S	.	.			trans	-127.3	179.2	-179.2	-177.7	0	0	0	0	110.8	A361 K364 E370 V371	A361-T366 HydrophobicContact CB-CG2 4.49Å; A361-T366 PolarHBondContact O-N 3.27Å; K364-T366 HydrophobicContact CB-CG2 3.68Å; K364-T366 PolarHBondContact O-N 3.02Å; T366-E370 WeakPolarHBondContact OG1-CB 3.46Å; T366-E370 PolarHBondContact OG1-OE2 2.94Å; T366-V371 HydrophobicContact CG2-CG1 3.72Å
367	T	89.7	Confident	81	Confident	73 Å²	73	50.7 Å²	50.7	45%	0.448	27%	0.274	S	S	.	.			trans	-87.4	158.3	175.1	72.7	0	0	0	0	112	V369 E370	T367-V369 PolarHBondContact O-N 3.15Å; T367-E370 PolarHBondContact O-N 2.78Å
368	I	87.2	Confident	80	Confident	17 Å²	17	50.8 Å²	50.8	9%	0.087	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-29.3	175.8	-65.7	150.9	0	0	0	111.5	A281 Y285 F354 A361 E370 V371 A372	A281-I368 VanDerWaalsContact C-CD1 3.45Å; A281-I368 HydrophobicContact CB-CD1 4.24Å; A281-I368 VanDerWaalsContact O-CD1 3.23Å; A281-I368 WeakPolarHBondContact O-CD1 3.07Å; Y285-I368 HydrophobicContact CD1-CG2 4.06Å; Y285-I368 HydrophobicContact CD2-CB 4.45Å; Y285-I368 HydrophobicContact CD2-CD1 4.45Å; Y285-I368 HydrophobicContact CG-CB 4.4Å; Y285-I368 HydrophobicContact CG-CD1 4.19Å; Y285-I368 HydrophobicContact CG-CG2 4.07Å; F354-I368 HydrophobicContact CD1-CG2 4.38Å; F354-I368 HydrophobicContact CE1-CG2 4.33Å; A361-I368 HydrophobicContact CB-CG1 4.09Å; I368-E370 VanDerWaalsContact C-N 3.35Å; I368-E370 PolarHBondContact O-N 3.41Å; I368-V371 VanDerWaalsContact O-CG2 3.28Å; I368-V371 WeakPolarHBondContact O-CG2 3.22Å; I368-V371 PolarHBondContact O-N 2.94Å; I368-A372 VanDerWaalsContact O-CB 3.26Å; I368-A372 WeakPolarHBondContact O-CB 3.1Å; I368-A372 PolarHBondContact O-N 3Å; I368-A372 VanDerWaalsContact O-N 3.09Å
369	V	86	Confident	79.5	Confident	71 Å²	71	50.7 Å²	50.7	43%	0.43	27%	0.274	S	S	.	.	H	α-helix	trans	-63.9	-41.4	-179.4	180	0	0	0	0	111.3	F88 Y285 T367 V371	F88-V369 HydrophobicContact CE2-CB 4.48Å; F88-V369 HydrophobicContact CE2-CG2 4.37Å; F88-V369 HydrophobicContact CZ-CB 4.42Å; F88-V369 HydrophobicContact CZ-CG1 4.12Å; Y285-V369 HydrophobicContact CE2-CG2 3.84Å; T367-V369 PolarHBondContact O-N 3.15Å; V369-V371 PolarHBondContact O-N 3.41Å
370	E	81.2	Confident	79.4	Confident	131 Å²	131	50.5 Å²	50.5	61%	0.612	27%	0.273	S	S	*	.	H	α-helix	trans	-70	-30.3	-179.5	-73	177.3	-150	0	0	113	T366 T367 I368 S373	T366-E370 WeakPolarHBondContact OG1-CB 3.46Å; T366-E370 PolarHBondContact OG1-OE2 2.94Å; T367-E370 PolarHBondContact O-N 2.78Å; I368-E370 VanDerWaalsContact C-N 3.35Å; I368-E370 PolarHBondContact O-N 3.41Å; E370-S373 PolarHBondContact O-OG 3.12Å
371	V	79.4	Confident	79.5	Confident	10 Å²	10	50.6 Å²	50.6	6%	0.061	27%	0.273	C	S	.	.	H	α-helix	trans	-89.5	-22.1	-179	-61	0	0	0	0	113.5	L357 M360 A361 T366 I368 V369 V382	L357-V371 HydrophobicContact CB-CG2 4.47Å; M360-V371 HydrophobicContact CE-CB 4.25Å; M360-V371 HydrophobicContact CE-CG1 4.07Å; M360-V371 HydrophobicContact CG-CG1 4.24Å; M360-V371 HydrophobicContact SD-CB 4.25Å; M360-V371 HydrophobicContact SD-CG1 4.38Å; A361-V371 HydrophobicContact CB-CG2 4.3Å; T366-V371 HydrophobicContact CG2-CG1 3.72Å; I368-V371 VanDerWaalsContact O-CG2 3.28Å; I368-V371 WeakPolarHBondContact O-CG2 3.22Å; I368-V371 PolarHBondContact O-N 2.94Å; V369-V371 PolarHBondContact O-N 3.41Å; V371-V382 VanDerWaalsContact O-CG1 3.27Å; V371-V382 WeakPolarHBondContact O-CG1 3.25Å
372	A	75.9	Confident	79.3	Confident	2 Å²	2	50.4 Å²	50.4	2%	0.017	27%	0.272	C	S	.	.	H	α-helix	trans	-94.1	-3	-175.5	0	0	0	0	0	114.2	F88 L357 I368 S374	F88-A372 HydrophobicContact CD1-CB 4.21Å; F88-A372 HydrophobicContact CD2-CB 3.64Å; F88-A372 HydrophobicContact CE1-CB 4.12Å; F88-A372 HydrophobicContact CE2-CB 3.58Å; F88-A372 HydrophobicContact CG-CB 3.98Å; F88-A372 HydrophobicContact CZ-CB 3.82Å; L357-A372 HydrophobicContact CD1-CB 4.11Å; I368-A372 VanDerWaalsContact O-CB 3.26Å; I368-A372 WeakPolarHBondContact O-CB 3.1Å; I368-A372 PolarHBondContact O-N 3Å; I368-A372 VanDerWaalsContact O-N 3.09Å; A372-S374 VanDerWaalsContact C-N 3.28Å; A372-S374 PolarHBondContact O-N 3.17Å
373	S	64.8	Low	79.1	Confident	75 Å²	75	43.6 Å²	43.6	52%	0.524	25%	0.245	S	C	.	.			trans	-71.1	-12.3	-170.2	51.5	0	0	0	0	115.5	E370 G375	E370-S373 PolarHBondContact O-OG 3.12Å; S373-G375 PolarHBondContact O-N 3.47Å
374	S	58.6	Low	79.2	Confident	42 Å²	42	39.5 Å²	39.5	29%	0.294	23%	0.226	S	C	.	.			trans	-74.8	21.3	-166.8	-44.6	0	0	0	0	117	A372 G377 V382	A372-S374 VanDerWaalsContact C-N 3.28Å; A372-S374 PolarHBondContact O-N 3.17Å; S374-G377 PolarHBondContact O-N 3.34Å; S374-V382 WeakPolarHBondContact OG-CG2 3.35Å
375	G	62.4	Low	79.4	Confident	8 Å²	8	35.7 Å²	35.7	8%	0.082	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	58.4	-146.3	169.2	0	0	0	0	0	114.8	S373 G377 L378	S373-G375 PolarHBondContact O-N 3.47Å; G375-G377 PolarHBondContact O-N 2.9Å; G375-L378 VanDerWaalsContact O-CB 3.3Å; G375-L378 WeakPolarHBondContact O-CB 3.25Å; G375-L378 PolarHBondContact O-N 3.07Å; G375-L378 VanDerWaalsContact O-N 3.13Å
376	P	49.1	Very low	79.5	Confident	85 Å²	85	28.3 Å²	28.3	55%	0.552	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	-60.3	-21.6	176.7	-20.6	31.8	0	0	0	114.3	L378	P376-L378 PolarHBondContact O-N 2.79Å; P376-L378 VanDerWaalsContact O-N 3.14Å
377	G	66.6	Low	79.6	Confident	6 Å²	6	27 Å²	27	6%	0.062	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-65.2	-9.4	174.5	0	0	0	0	0	114.1	S374 G375 A379 F380 I381	S374-G377 PolarHBondContact O-N 3.34Å; G375-G377 PolarHBondContact O-N 2.9Å; G377-A379 PolarHBondContact O-N 2.62Å; G377-F380 PolarHBondContact O-N 3.25Å; G377-I381 VanDerWaalsContact O-CB 3.29Å; G377-I381 WeakPolarHBondContact O-CB 3.47Å; G377-I381 PolarHBondContact O-N 3.16Å
378	L	67.8	Low	79.7	Confident	4 Å²	4	24.9 Å²	24.9	2%	0.021	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-45	-39.8	-178.2	-166.1	72.5	0	0	0	113.5	G375 P376 V382 Y383	G375-L378 VanDerWaalsContact O-CB 3.3Å; G375-L378 WeakPolarHBondContact O-CB 3.25Å; G375-L378 PolarHBondContact O-N 3.07Å; G375-L378 VanDerWaalsContact O-N 3.13Å; P376-L378 PolarHBondContact O-N 2.79Å; P376-L378 VanDerWaalsContact O-N 3.14Å; L378-V382 HydrophobicContact CD1-CB 3.69Å; L378-V382 HydrophobicContact CD1-CG1 3.91Å; L378-V382 HydrophobicContact CD1-CG2 3.79Å; L378-V382 HydrophobicContact CG-CB 4.4Å; L378-V382 PolarHBondContact O-N 3.27Å; L378-Y383 HydrophobicContact CD2-CE2 4.34Å; L378-Y383 WeakPolarHBondContact CD2-OH 3.31Å; L378-Y383 HydrophobicContact CG-CE2 3.99Å; L378-Y383 WeakPolarHBondContact CG-OH 3.21Å; L378-Y383 WeakPolarHBondContact O-CD2 3.04Å; L378-Y383 PolarHBondContact O-N 2.71Å; L378-Y383 VanDerWaalsContact O-N 3.08Å
379	A	85.2	Confident	79.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-78.6	-27.1	-178.8	0	0	0	0	0	116.7	W81 G377 Y383 P384 F400 M404	W81-A379 HydrophobicContact CB-CB 3.97Å; W81-A379 HydrophobicContact CD2-CB 4.03Å; W81-A379 HydrophobicContact CE3-CB 3.22Å; W81-A379 HydrophobicContact CG-CB 4.4Å; W81-A379 HydrophobicContact CZ3-CB 3.93Å; G377-A379 PolarHBondContact O-N 2.62Å; A379-Y383 HydrophobicContact CB-CD2 4.2Å; A379-Y383 HydrophobicContact CB-CE2 4.37Å; A379-P384 VanDerWaalsContact O-CD 3.24Å; A379-P384 WeakPolarHBondContact O-CD 3.39Å; A379-F400 HydrophobicContact CB-CZ 4.36Å; A379-M404 HydrophobicContact CB-CE 3.76Å
380	F	91.1	Very high	79.9	Confident	3 Å²	3	23.5 Å²	23.5	1%	0.013	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-9.2	-177	-60.5	-65.6	0	0	0	112.9	W81 V156 H159 Y163 Y208 G377 P384 F401	W81-F380 HydrophobicContact CE3-CE2 4.47Å; W81-F380 AromaticContact CH2-CE2 3.86Å; W81-F380 HydrophobicContact CH2-CE2 3.86Å; W81-F380 AromaticContact CZ3-CD2 3.82Å; W81-F380 HydrophobicContact CZ3-CD2 3.82Å; W81-F380 AromaticContact CZ3-CE2 3.41Å; W81-F380 HydrophobicContact CZ3-CE2 3.41Å; W81-F380 VanDerWaalsContact CZ3-CE2 3.41Å; W81-F380 HydrophobicContact CZ3-CZ 4.31Å; V156-F380 HydrophobicContact CG1-CE2 4.19Å; V156-F380 HydrophobicContact CG1-CZ 4.27Å; H159-F380 HydrophobicContact CB-CD1 4.43Å; H159-F380 HydrophobicContact CB-CE1 3.78Å; H159-F380 HydrophobicContact CB-CE2 4.12Å; H159-F380 HydrophobicContact CB-CZ 3.61Å; Y163-F380 AromaticContact CD2-CD1 3.68Å; Y163-F380 HydrophobicContact CD2-CD1 3.68Å; Y163-F380 HydrophobicContact CD2-CE1 4.22Å; Y163-F380 HydrophobicContact CE2-CB 4.08Å; Y163-F380 AromaticContact CE2-CD1 3.75Å; Y163-F380 HydrophobicContact CE2-CD1 3.75Å; Y163-F380 HydrophobicContact CE2-CG 4.25Å; Y163-F380 HydrophobicContact CG-CD1 4.29Å; Y163-F380 PolarHBondContact OH-O 3.01Å; Y208-F380 HydrophobicContact CD2-CB 3.69Å; Y208-F380 HydrophobicContact CD2-CG 4.43Å; Y208-F380 HydrophobicContact CE2-CB 3.66Å; Y208-F380 HydrophobicContact CE2-CD2 4.11Å; Y208-F380 AromaticContact CE2-CG 3.96Å; Y208-F380 HydrophobicContact CE2-CG 3.96Å; Y208-F380 HydrophobicContact CG-CB 4.26Å; G377-F380 PolarHBondContact O-N 3.25Å; F380-P384 WeakPolarHBondContact O-CG 3.14Å; F380-F401 AromaticContact CD1-CE1 3.85Å; F380-F401 HydrophobicContact CD1-CE1 3.85Å; F380-F401 HydrophobicContact CD1-CZ 4.4Å; F380-F401 AromaticContact CE1-CE1 3.91Å; F380-F401 HydrophobicContact CE1-CE1 3.91Å
381	I	90.5	Very high	80.4	Confident	4 Å²	4	21.3 Å²	21.3	2%	0.021	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-64.6	-179.3	-60.7	174.6	0	0	0	109.6	S204 E205 Y208 F209 G377 E385	S204-I381 VanDerWaalsContact CB-O 3.27Å; S204-I381 WeakPolarHBondContact CB-O 3.26Å; S204-I381 PolarHBondContact OG-O 2.87Å; E205-I381 HydrophobicContact CB-CG2 3.63Å; E205-I381 HydrophobicContact CG-CD1 4.24Å; E205-I381 HydrophobicContact CG-CG2 4.25Å; Y208-I381 HydrophobicContact CD1-CD1 3.92Å; Y208-I381 HydrophobicContact CD1-CG1 3.97Å; Y208-I381 HydrophobicContact CG-CG1 4.17Å; F209-I381 HydrophobicContact CE2-CD1 3.72Å; F209-I381 HydrophobicContact CZ-CD1 4.04Å; G377-I381 VanDerWaalsContact O-CB 3.29Å; G377-I381 WeakPolarHBondContact O-CB 3.47Å; G377-I381 PolarHBondContact O-N 3.16Å; I381-E385 WeakPolarHBondContact O-CB 3.27Å; I381-E385 PolarHBondContact O-N 3.32Å; I381-E385 VanDerWaalsContact O-N 3.17Å
382	V	88	Confident	81	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-76.4	-41.6	-167.7	-177.5	0	0	0	0	112.6	L357 M360 V371 S374 L378 E385 A386	L357-V382 HydrophobicContact CD2-CG1 3.29Å; M360-V382 HydrophobicContact SD-CG1 4.17Å; V371-V382 VanDerWaalsContact O-CG1 3.27Å; V371-V382 WeakPolarHBondContact O-CG1 3.25Å; S374-V382 WeakPolarHBondContact OG-CG2 3.35Å; L378-V382 HydrophobicContact CD1-CB 3.69Å; L378-V382 HydrophobicContact CD1-CG1 3.91Å; L378-V382 HydrophobicContact CD1-CG2 3.79Å; L378-V382 HydrophobicContact CG-CB 4.4Å; L378-V382 PolarHBondContact O-N 3.27Å; V382-E385 VanDerWaalsContact O-CB 3.32Å; V382-E385 WeakPolarHBondContact O-CB 3.38Å; V382-E385 PolarHBondContact O-N 3.35Å; V382-A386 PolarHBondContact O-N 3.39Å
383	Y	87	Confident	81.9	Confident	6 Å²	6	27.9 Å²	27.9	2%	0.024	17%	0.171	C	C	.	.	H	α-helix	trans	-70.8	-42.7	175.7	-57.6	-50.6	0	0	0	114.1	I353 L357 L378 A379 E385 A386 M387 F400	I353-Y383 HydrophobicContact CB-CE1 4.03Å; I353-Y383 WeakPolarHBondContact CB-OH 3.46Å; I353-Y383 HydrophobicContact CD1-CD1 4.29Å; I353-Y383 HydrophobicContact CD1-CD2 4.35Å; I353-Y383 HydrophobicContact CD1-CE1 3.58Å; I353-Y383 HydrophobicContact CD1-CE2 3.7Å; I353-Y383 WeakPolarHBondContact CD1-OH 3.46Å; I353-Y383 HydrophobicContact CG1-CE1 3.99Å; I353-Y383 HydrophobicContact CG1-CE2 4.27Å; I353-Y383 WeakPolarHBondContact CG1-OH 3.46Å; I353-Y383 HydrophobicContact CG2-CE1 3.73Å; I353-Y383 WeakPolarHBondContact CG2-OH 3.46Å; L357-Y383 HydrophobicContact CD2-CE1 4.38Å; L357-Y383 HydrophobicContact CG-CE1 4.49Å; L378-Y383 HydrophobicContact CD2-CE2 4.34Å; L378-Y383 WeakPolarHBondContact CD2-OH 3.31Å; L378-Y383 HydrophobicContact CG-CE2 3.99Å; L378-Y383 WeakPolarHBondContact CG-OH 3.21Å; L378-Y383 WeakPolarHBondContact O-CD2 3.04Å; L378-Y383 PolarHBondContact O-N 2.71Å; L378-Y383 VanDerWaalsContact O-N 3.08Å; A379-Y383 HydrophobicContact CB-CD2 4.2Å; A379-Y383 HydrophobicContact CB-CE2 4.37Å; Y383-E385 PolarHBondContact O-N 3.01Å; Y383-A386 PolarHBondContact O-N 3.06Å; Y383-M387 WeakPolarHBondContact O-CG 3.5Å; Y383-M387 PolarHBondContact O-N 2.89Å; Y383-F400 HydrophobicContact CD2-CE1 4.37Å; Y383-F400 AromaticContact CD2-CE2 3.94Å; Y383-F400 HydrophobicContact CD2-CE2 3.94Å; Y383-F400 AromaticContact CD2-CZ 3.54Å; Y383-F400 HydrophobicContact CD2-CZ 3.54Å; Y383-F400 HydrophobicContact CE2-CZ 4.4Å; Y383-F400 HydrophobicContact CG-CE2 4.34Å; Y383-F400 HydrophobicContact CG-CZ 4.16Å
384	P	91.8	Very high	83.4	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-52.4	-38.7	171.4	-33.9	43.9	0	0	0	111.5	Y163 W174 A379 F380 M387 T388 F401	Y163-P384 HydrophobicContact CD1-CG 4.48Å; Y163-P384 HydrophobicContact CE1-CB 4.43Å; Y163-P384 HydrophobicContact CE1-CG 4.15Å; W174-P384 HydrophobicContact CD2-CB 4.28Å; W174-P384 HydrophobicContact CG-CB 4.37Å; W174-P384 HydrophobicContact CZ2-CB 4.11Å; W174-P384 PolarHBondContact NE1-O 3.06Å; A379-P384 VanDerWaalsContact O-CD 3.24Å; A379-P384 WeakPolarHBondContact O-CD 3.39Å; F380-P384 WeakPolarHBondContact O-CG 3.14Å; P384-M387 HydrophobicContact CG-CE 4.41Å; P384-M387 PolarHBondContact O-N 2.96Å; P384-T388 PolarHBondContact O-N 2.9Å; P384-T388 PolarHBondContact O-OG1 3.43Å; P384-F401 HydrophobicContact CG-CE2 4.21Å; P384-F401 HydrophobicContact CG-CZ 3.76Å
385	E	90.1	Very high	85.2	Confident	19 Å²	19	27.3 Å²	27.3	9%	0.089	16%	0.16	C	C	.	.	H	α-helix	trans	-66.3	-46.2	173.1	-154.6	172.4	165	0	0	114	S202 S204 M360 K364 I381 V382 Y383 M387 T388 N389	S202-E385 WeakPolarHBondContact CB-OE1 3.42Å; S202-E385 WeakPolarHBondContact CB-OE2 3.38Å; S202-E385 PolarHBondContact OG-OE2 3.37Å; S204-E385 WeakPolarHBondContact OG-CB 3.44Å; S204-E385 PolarHBondContact OG-OE2 3.29Å; M360-E385 HydrophobicContact CE-CB 3.94Å; M360-E385 HydrophobicContact CE-CG 3.62Å; M360-E385 WeakPolarHBondContact CE-OE1 3.34Å; M360-E385 WeakPolarHBondContact CE-OE2 3.36Å; M360-E385 HydrophobicContact SD-CB 4.32Å; M360-E385 HydrophobicContact SD-CG 4.46Å; K364-E385 WeakPolarHBondContact CE-OE1 3.48Å; K364-E385 IonicContact NZ-OE1 2.85Å; K364-E385 PolarHBondContact NZ-OE1 2.88Å; I381-E385 WeakPolarHBondContact O-CB 3.27Å; I381-E385 PolarHBondContact O-N 3.32Å; I381-E385 VanDerWaalsContact O-N 3.17Å; V382-E385 VanDerWaalsContact O-CB 3.32Å; V382-E385 WeakPolarHBondContact O-CB 3.38Å; V382-E385 PolarHBondContact O-N 3.35Å; Y383-E385 PolarHBondContact O-N 3.01Å; E385-M387 PolarHBondContact O-N 2.92Å; E385-T388 WeakPolarHBondContact O-CB 3.38Å; E385-T388 PolarHBondContact O-N 3.42Å; E385-N389 PolarHBondContact O-N 3.39Å; E385-N389 PolarHBondContact O-ND2 2.94Å
386	A	89.2	Confident	86.7	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-38.4	176.8	0	0	0	0	0	111.5	N356 M360 V382 Y383 N389 M390	N356-A386 HydrophobicContact CB-CB 4.36Å; M360-A386 HydrophobicContact CB-CB 4.36Å; M360-A386 HydrophobicContact SD-CB 4.19Å; V382-A386 PolarHBondContact O-N 3.39Å; Y383-A386 PolarHBondContact O-N 3.06Å; A386-N389 WeakPolarHBondContact O-CB 3.28Å; A386-N389 PolarHBondContact O-N 3.46Å; A386-M390 WeakPolarHBondContact O-CE 3.38Å
387	M	91.2	Very high	89	Confident	9 Å²	9	24.5 Å²	24.5	4%	0.044	14%	0.136	C	C	.	.	H	α-helix	trans	-72.8	-34.4	179	-67.7	-176.7	-64.8	0	0	113	Y383 P384 E385 N389 M390 S393 W396 S397 F400 F401	Y383-M387 WeakPolarHBondContact O-CG 3.5Å; Y383-M387 PolarHBondContact O-N 2.89Å; P384-M387 HydrophobicContact CG-CE 4.41Å; P384-M387 PolarHBondContact O-N 2.96Å; E385-M387 PolarHBondContact O-N 2.92Å; M387-N389 PolarHBondContact O-N 3.45Å; M387-M390 PolarHBondContact O-N 2.93Å; M387-S393 WeakPolarHBondContact O-CA 3.32Å; M387-S393 WeakPolarHBondContact O-CB 3.22Å; M387-W396 HydrophobicContact CB-CB 4.49Å; M387-W396 HydrophobicContact CG-CB 4.21Å; M387-W396 VanDerWaalsContact SD-C 3.54Å; M387-W396 HydrophobicContact SD-CB 4.18Å; M387-S397 VanDerWaalsContact SD-CA 3.58Å; M387-F400 HydrophobicContact CE-CB 4.08Å; M387-F400 HydrophobicContact CE-CD1 3.8Å; M387-F400 HydrophobicContact CE-CG 4.06Å; M387-F400 HydrophobicContact SD-CB 3.61Å; M387-F400 HydrophobicContact SD-CD1 4.4Å; M387-F400 HydrophobicContact SD-CG 4.05Å; M387-F401 HydrophobicContact CE-CE2 4.1Å
388	T	91.6	Very high	90.4	Very high	28 Å²	28	25.5 Å²	25.5	17%	0.172	14%	0.141	C	C	.	.	H	α-helix	trans	-53.4	-35	172.7	-67.2	0	0	0	0	111.9	W174 T175 P384 E385 M390	W174-T388 PolarHBondContact NE1-OG1 3.32Å; T175-T388 HydrophobicContact CG2-CG2 3.64Å; P384-T388 PolarHBondContact O-N 2.9Å; P384-T388 PolarHBondContact O-OG1 3.43Å; E385-T388 WeakPolarHBondContact O-CB 3.38Å; E385-T388 PolarHBondContact O-N 3.42Å; T388-M390 VanDerWaalsContact C-N 3.26Å; T388-M390 PolarHBondContact O-N 2.98Å
389	N	86.9	Confident	91.7	Very high	47 Å²	47	26.9 Å²	26.9	25%	0.251	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-2.1	-178	-74.6	-47.2	0	0	0	114.2	F359 Q363 E385 A386 M387	F359-N389 HydrophobicContact CE1-CB 3.94Å; F359-N389 WeakPolarHBondContact CZ-O 3.3Å; Q363-N389 PolarHBondContact NE2-O 3.06Å; Q363-N389 VanDerWaalsContact OE1-CG 3.27Å; Q363-N389 PolarHBondContact OE1-OD1 3.38Å; E385-N389 PolarHBondContact O-N 3.39Å; E385-N389 PolarHBondContact O-ND2 2.94Å; A386-N389 WeakPolarHBondContact O-CB 3.28Å; A386-N389 PolarHBondContact O-N 3.46Å; M387-N389 PolarHBondContact O-N 3.45Å
390	M	90.5	Very high	92.2	Very high	12 Å²	12	27.2 Å²	27.2	6%	0.059	15%	0.15	C	C	.	.	S	Bend	trans	-100.1	146.1	178.6	-61.5	178.6	-157.4	0	0	111.8	R272 L276 N356 F359 A386 M387 T388 S393 W396	R272-M390 HydrophobicContact CG-SD 4.49Å; L276-M390 HydrophobicContact CD1-CE 3.62Å; L276-M390 HydrophobicContact CD1-CG 4.06Å; L276-M390 HydrophobicContact CD1-SD 3.83Å; N356-M390 HydrophobicContact CB-CE 4.32Å; N356-M390 WeakPolarHBondContact OD1-CE 3.38Å; F359-M390 HydrophobicContact CD1-CE 4.22Å; F359-M390 HydrophobicContact CD1-CG 4.33Å; F359-M390 HydrophobicContact CE1-CE 4.33Å; F359-M390 HydrophobicContact CE1-CG 3.56Å; F359-M390 HydrophobicContact CZ-CG 4.16Å; A386-M390 WeakPolarHBondContact O-CE 3.38Å; M387-M390 PolarHBondContact O-N 2.93Å; T388-M390 VanDerWaalsContact C-N 3.26Å; T388-M390 PolarHBondContact O-N 2.98Å; M390-S393 PolarHBondContact O-N 3.15Å; M390-W396 HydrophobicContact SD-CG 4.18Å
391	P	90.1	Very high	92.5	Very high	86 Å²	86	27.1 Å²	27.1	56%	0.558	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	141.4	166.7	27.8	-35.1	0	0	0	109.9	R272 W396	R272-P391 VanDerWaalsContact NH2-CG 3.27Å; P391-W396 PolarHBondContact O-NE1 2.91Å
392	L	93.2	Very high	92.7	Very high	132 Å²	132	28.3 Å²	28.3	69%	0.691	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	42.7	-171.6	-52.5	171.5	0	0	0	112.5	S394 L395 W396	L392-S394 PolarHBondContact O-N 3.48Å; L392-S394 VanDerWaalsContact O-N 3.09Å; L392-L395 HydrophobicContact CB-CB 4.16Å; L392-L395 HydrophobicContact CD1-CD2 4.43Å; L392-L395 WeakPolarHBondContact O-CB 3.47Å; L392-L395 PolarHBondContact O-N 3.4Å; L392-W396 PolarHBondContact O-N 3.4Å
393	S	94.6	Very high	93.1	Very high	18 Å²	18	28.3 Å²	28.3	13%	0.126	16%	0.157	C	C	.	.	H	α-helix	trans	-47.2	-40.7	-177.9	57.4	0	0	0	0	113.5	M387 M390 L395 W396 S397	M387-S393 WeakPolarHBondContact O-CA 3.32Å; M387-S393 WeakPolarHBondContact O-CB 3.22Å; M390-S393 PolarHBondContact O-N 3.15Å; S393-L395 PolarHBondContact O-N 2.95Å; S393-W396 PolarHBondContact O-N 3.45Å; S393-S397 WeakPolarHBondContact O-CB 3.43Å; S393-S397 PolarHBondContact O-N 3.06Å
394	S	96.4	Very high	93.5	Very high	20 Å²	20	28 Å²	28	14%	0.14	16%	0.156	C	C	.	.	H	α-helix	trans	-61.7	-37.7	177.1	-50.3	0	0	0	0	114.4	T169 H170 L392 S397 V398	T169-S394 WeakPolarHBondContact O-CB 3.46Å; T169-S394 PolarHBondContact O-OG 3.49Å; H170-S394 PolarHBondContact O-OG 3.2Å; L392-S394 PolarHBondContact O-N 3.48Å; L392-S394 VanDerWaalsContact O-N 3.09Å; S394-S397 PolarHBondContact O-N 3.23Å; S394-V398 VanDerWaalsContact O-CG2 3.3Å; S394-V398 WeakPolarHBondContact O-CG2 3.18Å; S394-V398 PolarHBondContact O-N 2.79Å
395	L	95.8	Very high	93.8	Very high	85 Å²	85	28.7 Å²	28.7	45%	0.445	16%	0.159	S	C	.	.	H	α-helix	trans	-60.7	-49.1	175.1	173.3	64.9	0	0	0	110.3	L392 S393 S397 V398 L399	L392-L395 HydrophobicContact CB-CB 4.16Å; L392-L395 HydrophobicContact CD1-CD2 4.43Å; L392-L395 WeakPolarHBondContact O-CB 3.47Å; L392-L395 PolarHBondContact O-N 3.4Å; S393-L395 PolarHBondContact O-N 2.95Å; L395-S397 VanDerWaalsContact C-N 3.34Å; L395-S397 PolarHBondContact O-N 3.16Å; L395-V398 PolarHBondContact O-N 3.34Å; L395-L399 HydrophobicContact CD1-CD1 4.16Å; L395-L399 HydrophobicContact CD1-CG 4.34Å; L395-L399 HydrophobicContact CG-CD1 4.16Å; L395-L399 VanDerWaalsContact O-CG 3.3Å; L395-L399 WeakPolarHBondContact O-CG 3.18Å; L395-L399 PolarHBondContact O-N 3.38Å
396	W	95	Very high	94.1	Very high	34 Å²	34	28.2 Å²	28.2	13%	0.129	16%	0.157	C	C	.	.	H	α-helix	trans	-65.5	-39.8	-178.5	-53.3	114.4	0	0	0	111.6	I268 L269 R272 M387 M390 P391 L392 S393 L399 F400	I268-W396 HydrophobicContact CG2-CZ3 4.12Å; L269-W396 HydrophobicContact CD2-CE3 4.19Å; R272-W396 HydrophobicContact CB-CE3 4.31Å; R272-W396 HydrophobicContact CB-CH2 3.8Å; R272-W396 HydrophobicContact CB-CZ2 4.44Å; R272-W396 HydrophobicContact CB-CZ3 3.72Å; R272-W396 VanDerWaalsContact CD-CZ2 3.49Å; R272-W396 HydrophobicContact CG-CD2 4.14Å; R272-W396 HydrophobicContact CG-CE3 4.01Å; R272-W396 HydrophobicContact CG-CH2 3.52Å; R272-W396 HydrophobicContact CG-CZ2 3.65Å; R272-W396 HydrophobicContact CG-CZ3 3.7Å; M387-W396 HydrophobicContact CB-CB 4.49Å; M387-W396 HydrophobicContact CG-CB 4.21Å; M387-W396 VanDerWaalsContact SD-C 3.54Å; M387-W396 HydrophobicContact SD-CB 4.18Å; M390-W396 HydrophobicContact SD-CG 4.18Å; P391-W396 PolarHBondContact O-NE1 2.91Å; L392-W396 PolarHBondContact O-N 3.4Å; S393-W396 PolarHBondContact O-N 3.45Å; W396-L399 HydrophobicContact CE3-CD1 4.08Å; W396-L399 HydrophobicContact CZ3-CD1 4.23Å; W396-L399 PolarHBondContact O-N 3.42Å; W396-F400 WeakPolarHBondContact O-CB 3.31Å; W396-F400 PolarHBondContact O-N 3.35Å
397	S	96	Very high	94.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.4	-47.2	175.2	-167.2	0	0	0	0	112.1	S167 W174 M387 S393 S394 L395 L399 F400 F401	S167-S397 WeakPolarHBondContact OG-CB 3.31Å; S167-S397 PolarHBondContact OG-OG 3.34Å; W174-S397 WeakPolarHBondContact CZ2-OG 3.4Å; M387-S397 VanDerWaalsContact SD-CA 3.58Å; S393-S397 WeakPolarHBondContact O-CB 3.43Å; S393-S397 PolarHBondContact O-N 3.06Å; S394-S397 PolarHBondContact O-N 3.23Å; L395-S397 VanDerWaalsContact C-N 3.34Å; L395-S397 PolarHBondContact O-N 3.16Å; S397-L399 PolarHBondContact O-N 2.92Å; S397-F400 PolarHBondContact O-N 3.35Å; S397-F401 VanDerWaalsContact O-CD2 3.27Å; S397-F401 WeakPolarHBondContact O-CD2 3.45Å; S397-F401 PolarHBondContact O-N 3.24Å; S397-F401 WeakPolarHBondContact OG-CD2 3.26Å
398	V	96.7	Very high	94.8	Very high	26 Å²	26	28 Å²	28	16%	0.158	16%	0.156	C	C	.	.	H	α-helix	trans	-59.2	-46.7	175.8	171.1	0	0	0	0	110.8	F164 F168 S394 L395 T402	F164-V398 HydrophobicContact CE2-CG1 4.17Å; F168-V398 HydrophobicContact CD1-CG2 4.23Å; F168-V398 HydrophobicContact CD2-CG2 4.41Å; F168-V398 HydrophobicContact CE1-CG1 4.16Å; F168-V398 HydrophobicContact CE1-CG2 4.03Å; F168-V398 HydrophobicContact CE2-CG2 4.21Å; F168-V398 HydrophobicContact CG-CG2 4.42Å; F168-V398 HydrophobicContact CZ-CG1 3.83Å; F168-V398 HydrophobicContact CZ-CG2 4.02Å; S394-V398 VanDerWaalsContact O-CG2 3.3Å; S394-V398 WeakPolarHBondContact O-CG2 3.18Å; S394-V398 PolarHBondContact O-N 2.79Å; L395-V398 PolarHBondContact O-N 3.34Å; V398-T402 VanDerWaalsContact O-CB 3.27Å; V398-T402 WeakPolarHBondContact O-CB 3.42Å; V398-T402 PolarHBondContact O-N 3.18Å; V398-T402 PolarHBondContact O-OG1 3.17Å
399	L	95.6	Very high	95.1	Very high	34 Å²	34	27.5 Å²	27.5	18%	0.178	15%	0.152	C	C	.	.	H	α-helix	trans	-62.8	-45	179.3	-66.2	173.2	0	0	0	112	M265 I268 L395 W396 S397 M403	M265-L399 HydrophobicContact CE-CD2 4.36Å; M265-L399 HydrophobicContact SD-CB 4.22Å; M265-L399 HydrophobicContact SD-CD2 3.61Å; M265-L399 HydrophobicContact SD-CG 4.49Å; I268-L399 HydrophobicContact CG2-CD1 4.08Å; L395-L399 HydrophobicContact CD1-CD1 4.16Å; L395-L399 HydrophobicContact CD1-CG 4.34Å; L395-L399 HydrophobicContact CG-CD1 4.16Å; L395-L399 VanDerWaalsContact O-CG 3.3Å; L395-L399 WeakPolarHBondContact O-CG 3.18Å; L395-L399 PolarHBondContact O-N 3.38Å; W396-L399 HydrophobicContact CE3-CD1 4.08Å; W396-L399 HydrophobicContact CZ3-CD1 4.23Å; W396-L399 PolarHBondContact O-N 3.42Å; S397-L399 PolarHBondContact O-N 2.92Å; L399-M403 WeakPolarHBondContact O-CB 3.47Å; L399-M403 PolarHBondContact O-N 3.46Å
400	F	95.1	Very high	95.6	Very high	7 Å²	7	25.5 Å²	25.5	3%	0.031	14%	0.142	C	C	.	.	H	α-helix	trans	-62.8	-49.8	178.4	177.3	-99.7	0	0	0	112.1	V80 L269 A379 Y383 M387 W396 S397 T402 M403 M404	V80-F400 HydrophobicContact CG1-CE2 4.35Å; L269-F400 HydrophobicContact CD1-CB 4.29Å; L269-F400 HydrophobicContact CD1-CD2 4.12Å; A379-F400 HydrophobicContact CB-CZ 4.36Å; Y383-F400 HydrophobicContact CD2-CE1 4.37Å; Y383-F400 AromaticContact CD2-CE2 3.94Å; Y383-F400 HydrophobicContact CD2-CE2 3.94Å; Y383-F400 AromaticContact CD2-CZ 3.54Å; Y383-F400 HydrophobicContact CD2-CZ 3.54Å; Y383-F400 HydrophobicContact CE2-CZ 4.4Å; Y383-F400 HydrophobicContact CG-CE2 4.34Å; Y383-F400 HydrophobicContact CG-CZ 4.16Å; M387-F400 HydrophobicContact CE-CB 4.08Å; M387-F400 HydrophobicContact CE-CD1 3.8Å; M387-F400 HydrophobicContact CE-CG 4.06Å; M387-F400 HydrophobicContact SD-CB 3.61Å; M387-F400 HydrophobicContact SD-CD1 4.4Å; M387-F400 HydrophobicContact SD-CG 4.05Å; W396-F400 WeakPolarHBondContact O-CB 3.31Å; W396-F400 PolarHBondContact O-N 3.35Å; S397-F400 PolarHBondContact O-N 3.35Å; F400-T402 PolarHBondContact O-N 3.22Å; F400-M403 HydrophobicContact CD2-CE 3.75Å; F400-M403 HydrophobicContact CE2-CE 3.81Å; F400-M403 WeakPolarHBondContact O-CB 3.37Å; F400-M403 PolarHBondContact O-N 3.43Å; F400-M404 HydrophobicContact CD1-CG 4.22Å; F400-M404 HydrophobicContact CE1-CG 3.75Å; F400-M404 HydrophobicContact CE2-CG 4.08Å; F400-M404 HydrophobicContact CE2-SD 4.38Å; F400-M404 HydrophobicContact CZ-CE 4.3Å; F400-M404 HydrophobicContact CZ-CG 3.65Å; F400-M404 HydrophobicContact CZ-SD 4.05Å; F400-M404 WeakPolarHBondContact O-CG 3.41Å; F400-M404 PolarHBondContact O-N 3.38Å
401	F	96.5	Very high	96	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-73.7	-26.7	-179.2	-73.4	-66.8	0	0	0	113.1	Y163 F164 W174 F380 P384 M387 S397 M404 L405	Y163-F401 VanDerWaalsContact CB-CZ 3.4Å; Y163-F401 HydrophobicContact CD1-CE1 4.09Å; Y163-F401 AromaticContact CD1-CE2 3.62Å; Y163-F401 HydrophobicContact CD1-CE2 3.62Å; Y163-F401 AromaticContact CD1-CZ 3.33Å; Y163-F401 HydrophobicContact CD1-CZ 3.33Å; Y163-F401 HydrophobicContact CD2-CE1 4.41Å; Y163-F401 HydrophobicContact CD2-CZ 4.41Å; Y163-F401 HydrophobicContact CE1-CZ 4.18Å; Y163-F401 HydrophobicContact CG-CD1 4.38Å; Y163-F401 AromaticContact CG-CE1 3.73Å; Y163-F401 HydrophobicContact CG-CE1 3.73Å; Y163-F401 AromaticContact CG-CE2 3.94Å; Y163-F401 HydrophobicContact CG-CE2 3.94Å; Y163-F401 AromaticContact CG-CZ 3.47Å; Y163-F401 HydrophobicContact CG-CZ 3.47Å; Y163-F401 VanDerWaalsContact CG-CZ 3.47Å; F164-F401 HydrophobicContact CB-CB 3.93Å; W174-F401 HydrophobicContact CH2-CE2 4.33Å; W174-F401 HydrophobicContact CZ2-CE2 4.38Å; F380-F401 AromaticContact CD1-CE1 3.85Å; F380-F401 HydrophobicContact CD1-CE1 3.85Å; F380-F401 HydrophobicContact CD1-CZ 4.4Å; F380-F401 AromaticContact CE1-CE1 3.91Å; F380-F401 HydrophobicContact CE1-CE1 3.91Å; P384-F401 HydrophobicContact CG-CE2 4.21Å; P384-F401 HydrophobicContact CG-CZ 3.76Å; M387-F401 HydrophobicContact CE-CE2 4.1Å; S397-F401 VanDerWaalsContact O-CD2 3.27Å; S397-F401 WeakPolarHBondContact O-CD2 3.45Å; S397-F401 PolarHBondContact O-N 3.24Å; S397-F401 WeakPolarHBondContact OG-CD2 3.26Å; F401-M404 PolarHBondContact O-N 3.05Å; F401-L405 VanDerWaalsContact O-CB 3.24Å; F401-L405 WeakPolarHBondContact O-CB 3.36Å; F401-L405 VanDerWaalsContact O-CG 3.26Å; F401-L405 WeakPolarHBondContact O-CG 3.48Å; F401-L405 PolarHBondContact O-N 2.99Å
402	T	96.4	Very high	96.3	Very high	30 Å²	30	21.1 Å²	21.1	18%	0.184	11%	0.114	C	C	.	.	H	α-helix	trans	-64.1	-44	168.6	-53	0	0	0	0	110.7	F164 F261 V398 F400 T406	F164-T402 VanDerWaalsContact CE2-OG1 3.28Å; F164-T402 WeakPolarHBondContact CE2-OG1 3.27Å; F261-T402 HydrophobicContact CD1-CG2 4.48Å; F261-T402 HydrophobicContact CE1-CG2 3.54Å; F261-T402 HydrophobicContact CZ-CG2 4.16Å; V398-T402 VanDerWaalsContact O-CB 3.27Å; V398-T402 WeakPolarHBondContact O-CB 3.42Å; V398-T402 PolarHBondContact O-N 3.18Å; V398-T402 PolarHBondContact O-OG1 3.17Å; F400-T402 PolarHBondContact O-N 3.22Å; T402-T406 VanDerWaalsContact O-CB 3.31Å; T402-T406 WeakPolarHBondContact O-CB 3.38Å; T402-T406 PolarHBondContact O-N 2.76Å; T402-T406 PolarHBondContact O-OG1 3.3Å
403	M	95.6	Very high	96.6	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-60	-51	174.2	179	-165.2	72.4	0	0	111.5	V80 P262 M265 L266 L269 L399 F400 L405 T406 L407	V80-M403 HydrophobicContact CG1-CE 3.83Å; V80-M403 HydrophobicContact CG2-CE 4.35Å; P262-M403 HydrophobicContact CB-CG 4.2Å; M265-M403 HydrophobicContact CB-CB 3.65Å; M265-M403 HydrophobicContact CB-CG 3.87Å; M265-M403 HydrophobicContact CB-SD 4.16Å; M265-M403 HydrophobicContact CG-CB 3.99Å; L266-M403 HydrophobicContact CD2-CE 4.27Å; L266-M403 HydrophobicContact CD2-SD 3.46Å; L266-M403 WeakPolarHBondContact CD2-SD 3.48Å; L266-M403 HydrophobicContact CG-SD 3.58Å; L266-M403 VanDerWaalsContact CG-SD 3.58Å; L269-M403 HydrophobicContact CD1-CE 4.35Å; L269-M403 HydrophobicContact CD1-SD 4.14Å; L399-M403 WeakPolarHBondContact O-CB 3.47Å; L399-M403 PolarHBondContact O-N 3.46Å; F400-M403 HydrophobicContact CD2-CE 3.75Å; F400-M403 HydrophobicContact CE2-CE 3.81Å; F400-M403 WeakPolarHBondContact O-CB 3.37Å; F400-M403 PolarHBondContact O-N 3.43Å; M403-L405 PolarHBondContact O-N 3.44Å; M403-T406 PolarHBondContact O-N 2.96Å; M403-T406 VanDerWaalsContact O-N 3.14Å; M403-L407 HydrophobicContact CG-CD1 4.1Å; M403-L407 WeakPolarHBondContact O-CG 3.26Å; M403-L407 PolarHBondContact O-N 3.21Å
404	M	95.8	Very high	96.7	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-60.2	-44.4	179.5	-69.2	-65.8	-84	0	0	111.6	L77 V80 C160 A379 F400 F401 T406 L407 G408	L77-M404 HydrophobicContact CD2-CB 4.02Å; L77-M404 HydrophobicContact CD2-CE 3.58Å; L77-M404 WeakPolarHBondContact CD2-O 3.49Å; L77-M404 HydrophobicContact CD2-SD 3.83Å; V80-M404 HydrophobicContact CB-SD 4.01Å; V80-M404 HydrophobicContact CG1-SD 3.8Å; V80-M404 HydrophobicContact CG2-SD 4.46Å; C160-M404 HydrophobicContact CB-CB 4.39Å; A379-M404 HydrophobicContact CB-CE 3.76Å; F400-M404 HydrophobicContact CD1-CG 4.22Å; F400-M404 HydrophobicContact CE1-CG 3.75Å; F400-M404 HydrophobicContact CE2-CG 4.08Å; F400-M404 HydrophobicContact CE2-SD 4.38Å; F400-M404 HydrophobicContact CZ-CE 4.3Å; F400-M404 HydrophobicContact CZ-CG 3.65Å; F400-M404 HydrophobicContact CZ-SD 4.05Å; F400-M404 WeakPolarHBondContact O-CG 3.41Å; F400-M404 PolarHBondContact O-N 3.38Å; F401-M404 PolarHBondContact O-N 3.05Å; M404-T406 VanDerWaalsContact C-N 3.32Å; M404-T406 PolarHBondContact O-N 2.85Å; M404-L407 PolarHBondContact O-N 3.31Å; M404-G408 PolarHBondContact O-N 3.47Å
405	L	97.3	Very high	96.8	Very high	14 Å²	14	13.7 Å²	13.7	7%	0.073	7%	0.072	C	C	.	.	H	α-helix	trans	-56.1	-46.8	172.9	-84.4	173.3	0	0	0	112.3	V157 C160 L161 F164 F401 M403 G408 F409	V157-L405 HydrophobicContact CG1-CD2 4.08Å; C160-L405 HydrophobicContact CB-CD2 3.73Å; C160-L405 HydrophobicContact CB-CG 3.84Å; L161-L405 HydrophobicContact CB-CD2 3.82Å; L161-L405 HydrophobicContact CD1-CD1 3.97Å; L161-L405 HydrophobicContact CD1-CD2 4.27Å; F164-L405 HydrophobicContact CB-CD1 3.54Å; F164-L405 HydrophobicContact CD1-CD1 3.96Å; F164-L405 HydrophobicContact CD2-CD1 4.14Å; F164-L405 HydrophobicContact CG-CD1 3.61Å; F401-L405 VanDerWaalsContact O-CB 3.24Å; F401-L405 WeakPolarHBondContact O-CB 3.36Å; F401-L405 VanDerWaalsContact O-CG 3.26Å; F401-L405 WeakPolarHBondContact O-CG 3.48Å; F401-L405 PolarHBondContact O-N 2.99Å; M403-L405 PolarHBondContact O-N 3.44Å; L405-G408 PolarHBondContact O-N 3.2Å; L405-F409 HydrophobicContact CB-CD2 4.48Å; L405-F409 HydrophobicContact CD2-CE2 3.92Å; L405-F409 WeakPolarHBondContact O-CB 3.23Å; L405-F409 WeakPolarHBondContact O-CD2 3.34Å; L405-F409 WeakPolarHBondContact O-CG 3.41Å; L405-F409 PolarHBondContact O-N 2.77Å
406	T	97.3	Very high	96.9	Very high	8 Å²	8	9.7 Å²	9.7	5%	0.049	5%	0.051	C	C	.	.	H	α-helix	trans	-65.4	-43	-176.5	-58.7	0	0	0	0	111.6	F257 T258 F261 P262 T402 M403 M404 G410	F257-T406 HydrophobicContact CD1-CG2 4.35Å; F257-T406 HydrophobicContact CE1-CG2 4.04Å; T258-T406 VanDerWaalsContact CA-CG2 3.42Å; T258-T406 HydrophobicContact CG2-CG2 4.04Å; T258-T406 WeakPolarHBondContact O-CG2 3.46Å; F261-T406 HydrophobicContact CB-CG2 4.32Å; F261-T406 HydrophobicContact CD1-CG2 4.31Å; P262-T406 HydrophobicContact CG-CG2 3.78Å; T402-T406 VanDerWaalsContact O-CB 3.31Å; T402-T406 WeakPolarHBondContact O-CB 3.38Å; T402-T406 PolarHBondContact O-N 2.76Å; T402-T406 PolarHBondContact O-OG1 3.3Å; M403-T406 PolarHBondContact O-N 2.96Å; M403-T406 VanDerWaalsContact O-N 3.14Å; M404-T406 VanDerWaalsContact C-N 3.32Å; M404-T406 PolarHBondContact O-N 2.85Å; T406-G410 PolarHBondContact O-N 2.98Å
407	L	97.5	Very high	97	Very high	5 Å²	5	8.1 Å²	8.1	3%	0.026	5%	0.045	C	C	.	.	H	α-helix	trans	-64.1	-46.3	173.8	-71.8	173.9	0	0	0	112	V75 L77 V80 P262 M403 M404 F409 G410 S411	V75-L407 HydrophobicContact CB-CD2 4.48Å; V75-L407 HydrophobicContact CG1-CD2 3.72Å; V75-L407 WeakPolarHBondContact O-CD2 3.39Å; L77-L407 HydrophobicContact CD2-CB 4.43Å; V80-L407 HydrophobicContact CG2-CD1 3.47Å; V80-L407 VanDerWaalsContact CG2-CD1 3.47Å; P262-L407 HydrophobicContact CB-CD1 4.34Å; P262-L407 HydrophobicContact CB-CD2 3.53Å; P262-L407 HydrophobicContact CB-CG 3.79Å; P262-L407 HydrophobicContact CG-CD2 3.55Å; P262-L407 HydrophobicContact CG-CG 3.81Å; M403-L407 HydrophobicContact CG-CD1 4.1Å; M403-L407 WeakPolarHBondContact O-CG 3.26Å; M403-L407 PolarHBondContact O-N 3.21Å; M404-L407 PolarHBondContact O-N 3.31Å; L407-F409 PolarHBondContact O-N 3.15Å; L407-G410 PolarHBondContact O-N 3.28Å; L407-S411 PolarHBondContact O-N 3.02Å; L407-S411 PolarHBondContact O-OG 3.2Å
408	G	97.4	Very high	97	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-57.3	-49.1	176.2	0	0	0	0	0	111.9	Y153 M404 L405 G410 S411 Q412	Y153-G408 VanDerWaalsContact CE1-O 3.3Å; Y153-G408 WeakPolarHBondContact CE1-O 3.42Å; M404-G408 PolarHBondContact O-N 3.47Å; L405-G408 PolarHBondContact O-N 3.2Å; G408-G410 PolarHBondContact O-N 2.92Å; G408-S411 PolarHBondContact O-N 2.82Å; G408-Q412 WeakPolarHBondContact O-CB 3.47Å; G408-Q412 PolarHBondContact O-N 3.26Å
409	F	98.4	Very high	97.1	Very high	19 Å²	19	7 Å²	7	8%	0.083	4%	0.038	C	C	.	.	H	α-helix	trans	-63.8	-40.5	177.1	-80.8	-50.2	0	0	0	113.2	V157 C236 L239 L405 L407 S411 Q412 F413	V157-F409 HydrophobicContact CG1-CD1 4.11Å; V157-F409 HydrophobicContact CG1-CD2 4.42Å; V157-F409 HydrophobicContact CG1-CE1 3.92Å; V157-F409 HydrophobicContact CG1-CE2 4.25Å; V157-F409 HydrophobicContact CG1-CG 4.35Å; V157-F409 HydrophobicContact CG1-CZ 3.98Å; C236-F409 HydrophobicContact CB-CE1 4.28Å; C236-F409 HydrophobicContact CB-CZ 4.36Å; L239-F409 HydrophobicContact CB-CE1 4.17Å; L239-F409 HydrophobicContact CB-CZ 4.11Å; L239-F409 HydrophobicContact CD1-CE2 4.05Å; L239-F409 HydrophobicContact CD1-CZ 3.71Å; L405-F409 HydrophobicContact CB-CD2 4.48Å; L405-F409 HydrophobicContact CD2-CE2 3.92Å; L405-F409 WeakPolarHBondContact O-CB 3.23Å; L405-F409 WeakPolarHBondContact O-CD2 3.34Å; L405-F409 WeakPolarHBondContact O-CG 3.41Å; L405-F409 PolarHBondContact O-N 2.77Å; L407-F409 PolarHBondContact O-N 3.15Å; F409-S411 PolarHBondContact O-N 3.25Å; F409-Q412 PolarHBondContact O-N 3.36Å; F409-F413 HydrophobicContact CB-CE1 3.95Å; F409-F413 HydrophobicContact CB-CE2 3.87Å; F409-F413 HydrophobicContact CB-CZ 3.51Å; F409-F413 AromaticContact CD1-CE1 3.65Å; F409-F413 HydrophobicContact CD1-CE1 3.65Å; F409-F413 AromaticContact CD1-CZ 3.9Å; F409-F413 HydrophobicContact CD1-CZ 3.9Å; F409-F413 HydrophobicContact CG-CE1 4.1Å; F409-F413 AromaticContact CG-CZ 3.88Å; F409-F413 HydrophobicContact CG-CZ 3.88Å; F409-F413 WeakPolarHBondContact O-CD1 3.48Å; F409-F413 WeakPolarHBondContact O-CD2 3.45Å; F409-F413 WeakPolarHBondContact O-CG 3.29Å; F409-F413 PolarHBondContact O-N 2.82Å
410	G	97.5	Very high	97.1	Very high	4 Å²	4	5.3 Å²	5.3	4%	0.041	3%	0.03	C	C	.	.	H	α-helix	trans	-52.1	-51.2	176.8	0	0	0	0	0	112.6	G72 T406 L407 G408	G72-G410 CarbonylContact O-C 3.59Å; T406-G410 PolarHBondContact O-N 2.98Å; L407-G410 PolarHBondContact O-N 3.28Å; G408-G410 PolarHBondContact O-N 2.92Å
411	S	97.1	Very high	97	Very high	6 Å²	6	5 Å²	5	4%	0.042	3%	0.029	C	C	.	.	H	α-helix	trans	-68	-47	177.9	-44	0	0	0	0	111.4	G72 Y73 G76 Y153 L407 G408 F409 F413 S414 I415	G72-S411 WeakPolarHBondContact O-CA 3.41Å; G72-S411 PolarHBondContact O-N 3.07Å; G72-S411 PolarHBondContact O-OG 3.41Å; Y73-S411 PolarHBondContact O-OG 2.86Å; G76-S411 WeakPolarHBondContact CA-OG 3.23Å; Y153-S411 PolarHBondContact OH-OG 2.99Å; L407-S411 PolarHBondContact O-N 3.02Å; L407-S411 PolarHBondContact O-OG 3.2Å; G408-S411 PolarHBondContact O-N 2.82Å; F409-S411 PolarHBondContact O-N 3.25Å; S411-F413 VanDerWaalsContact C-N 3.3Å; S411-F413 PolarHBondContact O-N 2.95Å; S411-S414 PolarHBondContact O-N 3.31Å; S411-I415 WeakPolarHBondContact O-CD1 3.3Å; S411-I415 VanDerWaalsContact O-CG1 3.27Å; S411-I415 WeakPolarHBondContact O-CG1 3.42Å; S411-I415 PolarHBondContact O-N 3.05Å; S411-I415 VanDerWaalsContact O-N 3.12Å
412	Q	97.9	Very high	96.9	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-59.2	-37.9	-174.3	-176.2	64	8	0	0	113.1	N150 Y153 Q154 G408 F409 S414 I415 L416	N150-Q412 PolarHBondContact O-NE2 3.33Å; N150-Q412 PolarHBondContact OD1-NE2 3.45Å; Y153-Q412 HydrophobicContact CD1-CB 4.16Å; Y153-Q412 HydrophobicContact CE1-CB 4.31Å; Q154-Q412 VanDerWaalsContact OE1-CD 3.27Å; G408-Q412 WeakPolarHBondContact O-CB 3.47Å; G408-Q412 PolarHBondContact O-N 3.26Å; F409-Q412 PolarHBondContact O-N 3.36Å; Q412-S414 VanDerWaalsContact C-N 3.35Å; Q412-S414 PolarHBondContact O-N 2.78Å; Q412-I415 PolarHBondContact O-N 2.83Å; Q412-L416 WeakPolarHBondContact O-CB 3.04Å; Q412-L416 PolarHBondContact O-N 3.49Å
413	F	97.9	Very high	96.7	Very high	9 Å²	9	6.2 Å²	6.2	4%	0.039	3%	0.033	C	C	.	.	H	α-helix	trans	-63.9	-39.9	179.5	-57	-30.9	0	0	0	112.7	C240 A243 V244 L251 V254 T258 F409 S411 L416 E417	C240-F413 HydrophobicContact CB-CD1 4.17Å; C240-F413 HydrophobicContact CB-CE1 4.12Å; C240-F413 VanDerWaalsContact SG-CE1 3.51Å; A243-F413 HydrophobicContact CB-CD1 3.73Å; A243-F413 HydrophobicContact CB-CD2 4.02Å; A243-F413 HydrophobicContact CB-CE1 3.54Å; A243-F413 HydrophobicContact CB-CE2 3.82Å; A243-F413 HydrophobicContact CB-CG 3.97Å; A243-F413 HydrophobicContact CB-CZ 3.55Å; V244-F413 HydrophobicContact CG1-CB 4.1Å; L251-F413 HydrophobicContact CD1-CB 3.41Å; L251-F413 VanDerWaalsContact CD1-CB 3.41Å; L251-F413 HydrophobicContact CD1-CD2 4.13Å; L251-F413 HydrophobicContact CD1-CG 4.2Å; V254-F413 HydrophobicContact CB-CE2 4.5Å; V254-F413 HydrophobicContact CG1-CD2 4.16Å; V254-F413 HydrophobicContact CG1-CE2 3.47Å; V254-F413 VanDerWaalsContact CG1-CE2 3.47Å; V254-F413 HydrophobicContact CG1-CZ 4.25Å; T258-F413 HydrophobicContact CG2-CE2 4.01Å; F409-F413 HydrophobicContact CB-CE1 3.95Å; F409-F413 HydrophobicContact CB-CE2 3.87Å; F409-F413 HydrophobicContact CB-CZ 3.51Å; F409-F413 AromaticContact CD1-CE1 3.65Å; F409-F413 HydrophobicContact CD1-CE1 3.65Å; F409-F413 AromaticContact CD1-CZ 3.9Å; F409-F413 HydrophobicContact CD1-CZ 3.9Å; F409-F413 HydrophobicContact CG-CE1 4.1Å; F409-F413 AromaticContact CG-CZ 3.88Å; F409-F413 HydrophobicContact CG-CZ 3.88Å; F409-F413 WeakPolarHBondContact O-CD1 3.48Å; F409-F413 WeakPolarHBondContact O-CD2 3.45Å; F409-F413 WeakPolarHBondContact O-CG 3.29Å; F409-F413 PolarHBondContact O-N 2.82Å; S411-F413 VanDerWaalsContact C-N 3.3Å; S411-F413 PolarHBondContact O-N 2.95Å; F413-L416 PolarHBondContact O-N 3.18Å; F413-E417 PolarHBondContact O-N 3.46Å
414	S	97.4	Very high	96.5	Very high	1 Å²	1	6.7 Å²	6.7	1%	0.007	4%	0.035	C	C	.	.	H	α-helix	trans	-71.9	-37.8	178.4	-65	0	0	0	0	112	T69 Y73 S411 Q412 L416 E417 T418	T69-S414 WeakPolarHBondContact CG2-OG 3.3Å; Y73-S414 VanDerWaalsContact CD2-CB 3.43Å; S411-S414 PolarHBondContact O-N 3.31Å; Q412-S414 VanDerWaalsContact C-N 3.35Å; Q412-S414 PolarHBondContact O-N 2.78Å; S414-L416 VanDerWaalsContact C-N 3.3Å; S414-L416 PolarHBondContact O-N 3.03Å; S414-E417 PolarHBondContact O-N 3.35Å; S414-T418 WeakPolarHBondContact O-CB 3.3Å; S414-T418 PolarHBondContact O-N 3.26Å; S414-T418 PolarHBondContact O-OG1 2.98Å
415	I	97.8	Very high	96.1	Very high	5 Å²	5	7.2 Å²	7.2	3%	0.026	4%	0.038	C	C	.	.	H	α-helix	trans	-62.8	-40.5	174.5	-59.2	159.4	0	0	0	110.3	Y73 S146 L149 N150 Y153 S411 Q412 T418 T419	Y73-I415 HydrophobicContact CD2-CG1 4.35Å; Y73-I415 HydrophobicContact CE2-CG1 3.7Å; S146-I415 WeakPolarHBondContact O-CG2 3.41Å; L149-I415 HydrophobicContact CB-CG2 4.03Å; L149-I415 HydrophobicContact CD2-CD1 3.61Å; L149-I415 HydrophobicContact CD2-CG1 3.83Å; L149-I415 HydrophobicContact CD2-CG2 3.83Å; L149-I415 HydrophobicContact CG-CD1 3.81Å; L149-I415 HydrophobicContact CG-CG1 4.36Å; L149-I415 HydrophobicContact CG-CG2 3.88Å; N150-I415 HydrophobicContact CB-CG2 4.39Å; N150-I415 PolarHBondContact ND2-O 2.87Å; N150-I415 WeakPolarHBondContact OD1-CG2 3.37Å; Y153-I415 HydrophobicContact CD1-CD1 4.39Å; S411-I415 WeakPolarHBondContact O-CD1 3.3Å; S411-I415 VanDerWaalsContact O-CG1 3.27Å; S411-I415 WeakPolarHBondContact O-CG1 3.42Å; S411-I415 PolarHBondContact O-N 3.05Å; S411-I415 VanDerWaalsContact O-N 3.12Å; Q412-I415 PolarHBondContact O-N 2.83Å; I415-T418 WeakPolarHBondContact O-CB 3.2Å; I415-T418 PolarHBondContact O-N 3.5Å; I415-T419 PolarHBondContact O-N 2.89Å; I415-T419 PolarHBondContact O-OG1 3.05Å
416	L	98.2	Very high	95.6	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-67.3	-47	176.4	-178.8	57.2	0	0	0	111.9	N150 W237 C240 V244 Q412 F413 S414 T418 T419 L420 V446	N150-L416 WeakPolarHBondContact OD1-CA 3.46Å; N150-L416 WeakPolarHBondContact OD1-CB 3.32Å; N150-L416 PolarHBondContact OD1-N 2.64Å; W237-L416 HydrophobicContact CZ3-CD1 4.03Å; W237-L416 HydrophobicContact CZ3-CD2 4.06Å; C240-L416 HydrophobicContact CB-CD2 4.09Å; V244-L416 HydrophobicContact CG1-CD2 4.36Å; V244-L416 HydrophobicContact CG2-CD2 3.62Å; V244-L416 HydrophobicContact CG2-CG 4.14Å; Q412-L416 WeakPolarHBondContact O-CB 3.04Å; Q412-L416 PolarHBondContact O-N 3.49Å; F413-L416 PolarHBondContact O-N 3.18Å; S414-L416 VanDerWaalsContact C-N 3.3Å; S414-L416 PolarHBondContact O-N 3.03Å; L416-T418 PolarHBondContact O-N 3.29Å; L416-T419 PolarHBondContact O-N 3.37Å; L416-T419 VanDerWaalsContact O-N 3.16Å; L416-L420 HydrophobicContact CD1-CD1 3.98Å; L416-L420 HydrophobicContact CD1-CG 4.12Å; L416-L420 HydrophobicContact CD2-CD1 4.44Å; L416-L420 HydrophobicContact CG-CD1 3.72Å; L416-L420 HydrophobicContact CG-CG 4.35Å; L416-L420 VanDerWaalsContact O-CG 3.31Å; L416-L420 WeakPolarHBondContact O-CG 3.44Å; L416-L420 PolarHBondContact O-N 3.45Å; L416-V446 HydrophobicContact CD1-CG1 4.34Å
417	E	97.3	Very high	95.2	Very high	1 Å²	1	10.3 Å²	10.3	1%	0.005	5%	0.051	C	C	.	.	H	α-helix	trans	-60.1	-34.6	177.1	-173.2	60.4	-157	0	0	112	V248 L251 T320 F413 S414 L420 S421 R443	V248-E417 HydrophobicContact CG1-CG 4.29Å; L251-E417 HydrophobicContact CD2-CB 4.14Å; L251-E417 HydrophobicContact CD2-CG 4.42Å; T320-E417 HydrophobicContact CG2-CG 4.34Å; F413-E417 PolarHBondContact O-N 3.46Å; S414-E417 PolarHBondContact O-N 3.35Å; E417-L420 PolarHBondContact O-N 3.29Å; E417-S421 WeakPolarHBondContact O-CB 3.35Å; E417-S421 PolarHBondContact O-N 2.81Å; E417-S421 PolarHBondContact O-OG 3.44Å; E417-R443 IonicContact OE1-CZ 2.87Å; E417-R443 IonicContact OE1-NH1 3.11Å; E417-R443 IonicContact OE1-NH2 2.75Å; E417-R443 PolarHBondContact OE1-NH2 3.07Å; E417-R443 IonicContact OE2-CZ 3.9Å; E417-R443 IonicContact OE2-NH1 3.93Å; E417-R443 PolarHBondContact OE2-NH1 3.34Å; E417-R443 IonicContact OE2-NH2 3.59Å; E417-R443 PolarHBondContact OE2-NH2 2.97Å
418	T	97.5	Very high	94.6	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-60.4	-46.8	175.5	-58.7	0	0	0	0	111.8	P125 S146 G317 T320 S414 I415 L416 S421 G422	P125-T418 HydrophobicContact CG-CG2 4.22Å; S146-T418 WeakPolarHBondContact OG-CG2 3.46Å; G317-T418 VanDerWaalsContact CA-OG1 3.27Å; G317-T418 WeakPolarHBondContact CA-OG1 3.29Å; T320-T418 WeakPolarHBondContact OG1-CG2 3.47Å; S414-T418 WeakPolarHBondContact O-CB 3.3Å; S414-T418 PolarHBondContact O-N 3.26Å; S414-T418 PolarHBondContact O-OG1 2.98Å; I415-T418 WeakPolarHBondContact O-CB 3.2Å; I415-T418 PolarHBondContact O-N 3.5Å; L416-T418 PolarHBondContact O-N 3.29Å; T418-S421 PolarHBondContact O-OG 2.95Å; T418-G422 PolarHBondContact O-N 3.16Å
419	T	97.5	Very high	93.8	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.012	8%	0.083	C	C	.	.	H	α-helix	trans	-67	-46.3	178.2	-58.4	0	0	0	0	111	V143 W147 N150 I415 L416 I423	V143-T419 HydrophobicContact CG1-CG2 4.47Å; W147-T419 HydrophobicContact CB-CG2 3.98Å; W147-T419 HydrophobicContact CG-CG2 4.3Å; W147-T419 PolarHBondContact N-OG1 3.25Å; N150-T419 PolarHBondContact ND2-OG1 2.92Å; I415-T419 PolarHBondContact O-N 2.89Å; I415-T419 PolarHBondContact O-OG1 3.05Å; L416-T419 PolarHBondContact O-N 3.37Å; L416-T419 VanDerWaalsContact O-N 3.16Å; T419-I423 HydrophobicContact CG2-CD1 4.01Å; T419-I423 VanDerWaalsContact O-CG1 3.32Å; T419-I423 WeakPolarHBondContact O-CG1 3.25Å; T419-I423 PolarHBondContact O-N 3.28Å; T419-I423 VanDerWaalsContact O-N 3.15Å
420	L	96.4	Very high	93.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.1	-50.1	-179.7	-70.3	167.4	0	0	0	112.1	V244 L416 E417 I423 Q424 F442 R443 V446	V244-L420 HydrophobicContact CG2-CD1 3.82Å; L416-L420 HydrophobicContact CD1-CD1 3.98Å; L416-L420 HydrophobicContact CD1-CG 4.12Å; L416-L420 HydrophobicContact CD2-CD1 4.44Å; L416-L420 HydrophobicContact CG-CD1 3.72Å; L416-L420 HydrophobicContact CG-CG 4.35Å; L416-L420 VanDerWaalsContact O-CG 3.31Å; L416-L420 WeakPolarHBondContact O-CG 3.44Å; L416-L420 PolarHBondContact O-N 3.45Å; E417-L420 PolarHBondContact O-N 3.29Å; L420-I423 PolarHBondContact O-N 2.69Å; L420-Q424 WeakPolarHBondContact O-CB 3.34Å; L420-Q424 WeakPolarHBondContact O-CG 3.43Å; L420-Q424 PolarHBondContact O-N 3.4Å; L420-F442 HydrophobicContact CB-CE1 4.48Å; L420-F442 HydrophobicContact CD2-CD1 4.19Å; L420-F442 HydrophobicContact CD2-CE1 3.62Å; L420-F442 HydrophobicContact CD2-CZ 4.21Å; L420-R443 HydrophobicContact CD1-CB 4.43Å; L420-R443 HydrophobicContact CD1-CG 4.01Å; L420-R443 HydrophobicContact CD2-CB 4.36Å; L420-R443 HydrophobicContact CD2-CG 4.01Å; L420-V446 HydrophobicContact CD2-CB 3.72Å; L420-V446 HydrophobicContact CD2-CG1 3.8Å; L420-V446 HydrophobicContact CD2-CG2 3.86Å
421	S	93.2	Very high	92.5	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.007	13%	0.134	C	C	.	.	H	α-helix	trans	-67.8	-38.3	-178.3	65.3	0	0	0	0	112	T320 Y324 E417 T418 I423 Q424 D425	T320-S421 VanDerWaalsContact CG2-OG 3.27Å; T320-S421 WeakPolarHBondContact CG2-OG 3.38Å; Y324-S421 WeakPolarHBondContact OH-CB 3.25Å; E417-S421 WeakPolarHBondContact O-CB 3.35Å; E417-S421 PolarHBondContact O-N 2.81Å; E417-S421 PolarHBondContact O-OG 3.44Å; T418-S421 PolarHBondContact O-OG 2.95Å; S421-I423 PolarHBondContact O-N 2.72Å; S421-Q424 PolarHBondContact O-N 3.12Å; S421-D425 WeakPolarHBondContact O-CB 3.43Å; S421-D425 VanDerWaalsContact O-CG 3.28Å; S421-D425 PolarHBondContact O-N 3.47Å
422	G	93.3	Very high	92.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.7	-48	174.2	0	0	0	0	0	112.3	T418 D425 E426	T418-G422 PolarHBondContact O-N 3.16Å; G422-D425 PolarHBondContact O-N 3Å; G422-E426 PolarHBondContact O-N 2.87Å
423	I	93.5	Very high	91.5	Very high	55 Å²	55	35 Å²	35	28%	0.282	18%	0.178	S	C	.	.	H	α-helix	trans	-66.6	-43.2	177.1	-63.3	166.3	0	0	0	111.1	T419 L420 S421 D425 E426 F427 F442	T419-I423 HydrophobicContact CG2-CD1 4.01Å; T419-I423 VanDerWaalsContact O-CG1 3.32Å; T419-I423 WeakPolarHBondContact O-CG1 3.25Å; T419-I423 PolarHBondContact O-N 3.28Å; T419-I423 VanDerWaalsContact O-N 3.15Å; L420-I423 PolarHBondContact O-N 2.69Å; S421-I423 PolarHBondContact O-N 2.72Å; I423-D425 VanDerWaalsContact C-N 3.3Å; I423-D425 PolarHBondContact O-N 3.41Å; I423-E426 PolarHBondContact O-N 3.33Å; I423-F427 HydrophobicContact CG2-CD2 4.34Å; I423-F427 HydrophobicContact CG2-CE1 4.1Å; I423-F427 HydrophobicContact CG2-CE2 3.8Å; I423-F427 HydrophobicContact CG2-CZ 3.67Å; I423-F427 PolarHBondContact O-N 2.91Å; I423-F442 HydrophobicContact CB-CZ 3.98Å; I423-F442 HydrophobicContact CD1-CZ 4.4Å; I423-F442 HydrophobicContact CG2-CE2 3.99Å; I423-F442 HydrophobicContact CG2-CZ 3.65Å
424	Q	91.5	Very high	91	Very high	11 Å²	11	36.4 Å²	36.4	5%	0.051	19%	0.186	C	C	.	.	H	α-helix	trans	-63.1	-34.7	179.5	-75.6	-179.5	-35.8	0	0	113	L420 S421 E426 F427 R428 L434 F442 R443	L420-Q424 WeakPolarHBondContact O-CB 3.34Å; L420-Q424 WeakPolarHBondContact O-CG 3.43Å; L420-Q424 PolarHBondContact O-N 3.4Å; S421-Q424 PolarHBondContact O-N 3.12Å; Q424-E426 VanDerWaalsContact C-N 3.34Å; Q424-F427 PolarHBondContact O-N 3Å; Q424-R428 WeakPolarHBondContact O-CG 3.4Å; Q424-R428 PolarHBondContact O-N 3.46Å; Q424-R428 VanDerWaalsContact O-N 3.1Å; Q424-L434 HydrophobicContact CG-CD1 4.46Å; Q424-F442 HydrophobicContact CG-CD1 3.99Å; Q424-F442 HydrophobicContact CG-CE1 3.58Å; Q424-F442 HydrophobicContact CG-CZ 4.36Å; Q424-R443 VanDerWaalsContact OE1-NH2 3.09Å
425	D	85.6	Confident	90.7	Very high	10 Å²	10	40.1 Å²	40.1	5%	0.053	21%	0.208	C	C	.	.	H	α-helix	trans	-67.3	-35.8	176.3	-75.3	-9.9	0	0	0	111.5	R57 G124 S421 G422 I423 R428 R429	R57-D425 IonicContact CZ-OD2 3.72Å; R57-D425 IonicContact NE-OD1 2.65Å; R57-D425 PolarHBondContact NE-OD1 2.59Å; R57-D425 IonicContact NE-OD2 2.92Å; R57-D425 PolarHBondContact NE-OD2 2.88Å; R57-D425 IonicContact NH2-OD2 3.5Å; R57-D425 PolarHBondContact NH2-OD2 3.21Å; G124-D425 WeakPolarHBondContact CA-OD2 3.33Å; G124-D425 PolarHBondContact N-OD2 3.06Å; G124-D425 VanDerWaalsContact N-OD2 3.15Å; S421-D425 WeakPolarHBondContact O-CB 3.43Å; S421-D425 VanDerWaalsContact O-CG 3.28Å; S421-D425 PolarHBondContact O-N 3.47Å; G422-D425 PolarHBondContact O-N 3Å; I423-D425 VanDerWaalsContact C-N 3.3Å; I423-D425 PolarHBondContact O-N 3.41Å; D425-R428 PolarHBondContact O-N 2.97Å; D425-R428 IonicContact OD1-NH1 3.57Å; D425-R428 PolarHBondContact OD1-NH1 3.31Å; D425-R429 PolarHBondContact O-N 3.16Å
426	E	87.4	Confident	90.2	Very high	23 Å²	23	46 Å²	46	11%	0.107	24%	0.236	C	C	.	.	H	α-helix	trans	-72.1	-35	173.2	-73.7	-64	118.6	0	0	112.8	I126 K136 Y140 G422 I423 Q424 R428 R429 L430	I126-E426 HydrophobicContact CB-CG 4.42Å; I126-E426 HydrophobicContact CD1-CG 4.06Å; I126-E426 HydrophobicContact CG2-CG 3.79Å; I126-E426 WeakPolarHBondContact CG2-OE1 3.3Å; K136-E426 WeakPolarHBondContact CE-OE1 3.46Å; K136-E426 IonicContact NZ-OE1 2.57Å; K136-E426 PolarHBondContact NZ-OE1 3.21Å; K136-E426 IonicContact NZ-OE2 2.9Å; Y140-E426 HydrophobicContact CE1-CG 4.11Å; Y140-E426 VanDerWaalsContact OH-CD 3.28Å; Y140-E426 PolarHBondContact OH-OE2 3.46Å; G422-E426 PolarHBondContact O-N 2.87Å; I423-E426 PolarHBondContact O-N 3.33Å; Q424-E426 VanDerWaalsContact C-N 3.34Å; E426-R428 VanDerWaalsContact C-N 3.32Å; E426-R428 PolarHBondContact O-N 3.33Å; E426-R429 WeakPolarHBondContact O-CB 3.39Å; E426-R429 PolarHBondContact O-N 3.37Å; E426-R429 WeakPolarHBondContact OE1-CD 3.43Å; E426-R429 IonicContact OE1-NH1 2.81Å; E426-R429 IonicContact OE2-CZ 2.76Å; E426-R429 IonicContact OE2-NH1 3.87Å; E426-R429 PolarHBondContact OE2-NH1 3.21Å; E426-L430 WeakPolarHBondContact O-CG 3.44Å; E426-L430 PolarHBondContact O-N 2.88Å
427	F	89.1	Confident	90	Very high	64 Å²	64	56.2 Å²	56.2	28%	0.281	27%	0.274	S	S	.	.	H	α-helix	trans	-57.6	-46	170	-70.5	-21.3	0	0	0	111.8	I423 Q424 R429 L430 G431 V432 L434 F442	I423-F427 HydrophobicContact CG2-CD2 4.34Å; I423-F427 HydrophobicContact CG2-CE1 4.1Å; I423-F427 HydrophobicContact CG2-CE2 3.8Å; I423-F427 HydrophobicContact CG2-CZ 3.67Å; I423-F427 PolarHBondContact O-N 2.91Å; Q424-F427 PolarHBondContact O-N 3Å; F427-R429 VanDerWaalsContact C-N 3.31Å; F427-R429 PolarHBondContact O-N 3.13Å; F427-L430 CarbonylContact O-C 3.55Å; F427-L430 PolarHBondContact O-N 3.32Å; F427-G431 PolarHBondContact O-N 3.22Å; F427-V432 CarbonylContact C-O 3.58Å; F427-V432 VanDerWaalsContact C-O 3.29Å; F427-V432 HydrophobicContact CB-CB 4.13Å; F427-V432 HydrophobicContact CB-CG1 4.44Å; F427-V432 WeakPolarHBondContact O-CA 3.4Å; F427-V432 WeakPolarHBondContact O-CB 3.48Å; F427-V432 PolarHBondContact O-N 2.8Å; F427-L434 HydrophobicContact CD2-CD1 3.85Å; F427-L434 HydrophobicContact CD2-CG 4.38Å; F427-L434 HydrophobicContact CE2-CD1 4.27Å; F427-F442 AromaticContact CE2-CD2 3.97Å; F427-F442 HydrophobicContact CE2-CD2 3.97Å; F427-F442 AromaticContact CE2-CE2 3.68Å; F427-F442 HydrophobicContact CE2-CE2 3.68Å; F427-F442 HydrophobicContact CE2-CZ 4.16Å; F427-F442 HydrophobicContact CZ-CE2 4.16Å
428	R	85.8	Confident	89.9	Confident	63 Å²	63	63.8 Å²	63.8	24%	0.238	30%	0.303	C	S	.	.	H	α-helix	trans	-60.2	-42	175.6	-70.6	173	178.2	132.5	-5.2	111.9	Q424 D425 E426 L430 G431	Q424-R428 WeakPolarHBondContact O-CG 3.4Å; Q424-R428 PolarHBondContact O-N 3.46Å; Q424-R428 VanDerWaalsContact O-N 3.1Å; D425-R428 PolarHBondContact O-N 2.97Å; D425-R428 IonicContact OD1-NH1 3.57Å; D425-R428 PolarHBondContact OD1-NH1 3.31Å; E426-R428 VanDerWaalsContact C-N 3.32Å; E426-R428 PolarHBondContact O-N 3.33Å; R428-L430 VanDerWaalsContact C-N 3.3Å; R428-L430 PolarHBondContact O-N 2.81Å; R428-G431 PolarHBondContact O-N 2.79Å
429	R	79.7	Confident	89.7	Confident	123 Å²	123	65.7 Å²	65.7	46%	0.464	31%	0.311	S	S	.	.	H	α-helix	trans	-61.3	-37.9	177	-177.9	-174.4	170.9	-146.9	-5.1	112.4	Y140 D425 E426 F427 G431	Y140-R429 PolarHBondContact OH-NH1 2.97Å; D425-R429 PolarHBondContact O-N 3.16Å; E426-R429 WeakPolarHBondContact O-CB 3.39Å; E426-R429 PolarHBondContact O-N 3.37Å; E426-R429 WeakPolarHBondContact OE1-CD 3.43Å; E426-R429 IonicContact OE1-NH1 2.81Å; E426-R429 IonicContact OE2-CZ 2.76Å; E426-R429 IonicContact OE2-NH1 3.87Å; E426-R429 PolarHBondContact OE2-NH1 3.21Å; F427-R429 VanDerWaalsContact C-N 3.31Å; F427-R429 PolarHBondContact O-N 3.13Å; R429-G431 PolarHBondContact O-N 3.14Å
430	L	84	Confident	89.6	Confident	133 Å²	133	68.6 Å²	68.6	70%	0.696	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	6	174.8	-65.9	173	0	0	0	113.2	E426 F427 R428 V432	E426-L430 WeakPolarHBondContact O-CG 3.44Å; E426-L430 PolarHBondContact O-N 2.88Å; F427-L430 CarbonylContact O-C 3.55Å; F427-L430 PolarHBondContact O-N 3.32Å; R428-L430 VanDerWaalsContact C-N 3.3Å; R428-L430 PolarHBondContact O-N 2.81Å; L430-V432 VanDerWaalsContact C-N 3.29Å; L430-V432 PolarHBondContact O-N 3.18Å
431	G	84.6	Confident	89.6	Confident	49 Å²	49	72.8 Å²	72.8	51%	0.505	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	-0.6	-178.6	0	0	0	0	0	114.6	F427 R428 R429 H433	F427-G431 PolarHBondContact O-N 3.22Å; R428-G431 PolarHBondContact O-N 2.79Å; R429-G431 PolarHBondContact O-N 3.14Å; G431-H433 PolarHBondContact O-N 3.22Å; G431-H433 PolarHBondContact O-ND1 2.92Å
432	V	88.2	Confident	89.8	Confident	72 Å²	72	74.3 Å²	74.3	44%	0.436	36%	0.358	S	S	.	.			trans	-83.1	99.7	179.8	-177.2	0	0	0	0	110.3	F427 L430 L434	F427-V432 CarbonylContact C-O 3.58Å; F427-V432 VanDerWaalsContact C-O 3.29Å; F427-V432 HydrophobicContact CB-CB 4.13Å; F427-V432 HydrophobicContact CB-CG1 4.44Å; F427-V432 WeakPolarHBondContact O-CA 3.4Å; F427-V432 WeakPolarHBondContact O-CB 3.48Å; F427-V432 PolarHBondContact O-N 2.8Å; L430-V432 VanDerWaalsContact C-N 3.29Å; L430-V432 PolarHBondContact O-N 3.18Å; V432-L434 HydrophobicContact CG1-CD2 4.19Å
433	H	86.4	Confident	90	Very high	114 Å²	114	75 Å²	75	53%	0.528	36%	0.36	S	S	.	.			trans	-94.2	108.9	176.9	-66.2	74.9	0	0	0	110.6	G431	G431-H433 PolarHBondContact O-N 3.22Å; G431-H433 PolarHBondContact O-ND1 2.92Å
434	L	87.3	Confident	90.2	Very high	38 Å²	38	76.2 Å²	76.2	20%	0.199	37%	0.366	C	S	.	.			trans	-76.5	128.2	177.5	-60.4	-179.4	0	0	0	110.9	Q424 F427 V432 R438 K439 F442	Q424-L434 HydrophobicContact CG-CD1 4.46Å; F427-L434 HydrophobicContact CD2-CD1 3.85Å; F427-L434 HydrophobicContact CD2-CG 4.38Å; F427-L434 HydrophobicContact CE2-CD1 4.27Å; V432-L434 HydrophobicContact CG1-CD2 4.19Å; L434-R438 HydrophobicContact CB-CB 4.25Å; L434-R438 HydrophobicContact CD2-CB 4.21Å; L434-K439 HydrophobicContact CB-CG 3.73Å; L434-K439 HydrophobicContact CD1-CG 4.45Å; L434-K439 VanDerWaalsContact O-CE 3.28Å; L434-K439 WeakPolarHBondContact O-CE 3.46Å; L434-F442 HydrophobicContact CD1-CB 4.32Å; L434-F442 HydrophobicContact CD1-CG 4.35Å
435	T	90.6	Very high	90.5	Very high	78 Å²	78	78.8 Å²	78.8	48%	0.479	39%	0.386	S	S	.	.			trans	-65.7	160.2	167.1	63.9	0	0	0	0	110.8	R437 R438 K439	T435-R437 VanDerWaalsContact C-N 3.27Å; T435-R437 PolarHBondContact O-N 3.38Å; T435-R438 CarbonylContact O-C 3.6Å; T435-R438 WeakPolarHBondContact O-CA 3.48Å; T435-R438 PolarHBondContact O-N 2.97Å; T435-R438 WeakPolarHBondContact OG1-CG 3.43Å; T435-R438 PolarHBondContact OG1-N 3.34Å; T435-K439 WeakPolarHBondContact O-CG 3.19Å; T435-K439 PolarHBondContact O-N 3.34Å
436	E	88.5	Confident	91	Very high	129 Å²	129	79 Å²	79	60%	0.603	39%	0.387	S	S	*	.	H	α-helix	trans	-54.6	-41	-179.9	-63.2	-51	121.3	0	0	113.3	K439 I440	E436-K439 PolarHBondContact O-N 2.85Å; E436-K439 IonicContact OE1-NZ 3.77Å; E436-K439 PolarHBondContact OE1-NZ 2.94Å; E436-K439 IonicContact OE2-NZ 3.46Å; E436-I440 WeakPolarHBondContact O-CG1 3.31Å; E436-I440 PolarHBondContact O-N 2.88Å; E436-I440 VanDerWaalsContact O-N 3.09Å
437	R	93.2	Very high	91.6	Very high	215 Å²	215	78.3 Å²	78.3	81%	0.811	39%	0.385	S	S	*	.	H	α-helix	trans	-63	-43.8	174.4	-69.1	-174.2	-179.5	177.5	0.4	111.9	T435 K439 I440 V441	T435-R437 VanDerWaalsContact C-N 3.27Å; T435-R437 PolarHBondContact O-N 3.38Å; R437-K439 VanDerWaalsContact C-N 3.33Å; R437-K439 PolarHBondContact O-N 3.13Å; R437-I440 PolarHBondContact O-N 3.25Å; R437-V441 WeakPolarHBondContact O-CG2 3.47Å; R437-V441 PolarHBondContact O-N 3.26Å
438	R	94.6	Very high	92	Very high	160 Å²	160	78.1 Å²	78.1	60%	0.604	39%	0.391	S	S	*	.	H	α-helix	trans	-67.2	-33	177.5	-72.9	-179.6	176.3	-179	-1.3	112.2	L434 T435 F442	L434-R438 HydrophobicContact CB-CB 4.25Å; L434-R438 HydrophobicContact CD2-CB 4.21Å; T435-R438 CarbonylContact O-C 3.6Å; T435-R438 WeakPolarHBondContact O-CA 3.48Å; T435-R438 PolarHBondContact O-N 2.97Å; T435-R438 WeakPolarHBondContact OG1-CG 3.43Å; T435-R438 PolarHBondContact OG1-N 3.34Å; R438-F442 WeakPolarHBondContact O-CB 3.47Å; R438-F442 PolarHBondContact O-N 3.18Å
439	K	93.6	Very high	92.6	Very high	40 Å²	40	79.1 Å²	79.1	17%	0.174	40%	0.4	C	S	.	.	H	α-helix	trans	-62.5	-45.4	172.3	-69.5	177.2	-174.7	166.4	0	111.3	L434 T435 E436 R437 F442 R443	L434-K439 HydrophobicContact CB-CG 3.73Å; L434-K439 HydrophobicContact CD1-CG 4.45Å; L434-K439 VanDerWaalsContact O-CE 3.28Å; L434-K439 WeakPolarHBondContact O-CE 3.46Å; T435-K439 WeakPolarHBondContact O-CG 3.19Å; T435-K439 PolarHBondContact O-N 3.34Å; E436-K439 PolarHBondContact O-N 2.85Å; E436-K439 IonicContact OE1-NZ 3.77Å; E436-K439 PolarHBondContact OE1-NZ 2.94Å; E436-K439 IonicContact OE2-NZ 3.46Å; R437-K439 VanDerWaalsContact C-N 3.33Å; R437-K439 PolarHBondContact O-N 3.13Å; K439-F442 PolarHBondContact O-N 2.93Å; K439-R443 WeakPolarHBondContact O-CG 3.22Å; K439-R443 PolarHBondContact O-N 3.29Å
440	I	95.5	Very high	93.5	Very high	62 Å²	62	73.2 Å²	73.2	32%	0.318	38%	0.378	S	S	.	.	H	α-helix	trans	-62.3	-49	177.3	-67.5	168.6	0	0	0	110.5	I245 E436 R437 F442 R443 I444	I245-I440 HydrophobicContact CD1-CG2 4.02Å; I245-I440 HydrophobicContact CG1-CG1 4.33Å; I245-I440 HydrophobicContact CG1-CG2 3.88Å; E436-I440 WeakPolarHBondContact O-CG1 3.31Å; E436-I440 PolarHBondContact O-N 2.88Å; E436-I440 VanDerWaalsContact O-N 3.09Å; R437-I440 PolarHBondContact O-N 3.25Å; I440-F442 PolarHBondContact O-N 3.43Å; I440-R443 PolarHBondContact O-N 3.28Å; I440-I444 HydrophobicContact CG2-CD1 3.87Å; I440-I444 WeakPolarHBondContact O-CG1 3.37Å; I440-I444 PolarHBondContact O-N 3.44Å
441	V	96.4	Very high	94.2	Very high	89 Å²	89	68.2 Å²	68.2	54%	0.539	35%	0.351	S	S	.	.	H	α-helix	trans	-58.3	-47.5	177.5	173	0	0	0	0	110.8	R437 R443 I444 S445	R437-V441 WeakPolarHBondContact O-CG2 3.47Å; R437-V441 PolarHBondContact O-N 3.26Å; V441-R443 VanDerWaalsContact C-N 3.35Å; V441-R443 PolarHBondContact O-N 2.92Å; V441-I444 PolarHBondContact O-N 3.49Å; V441-S445 PolarHBondContact O-N 3.3Å; V441-S445 PolarHBondContact O-OG 3.43Å
442	F	96.6	Very high	94.9	Very high	33 Å²	33	72.3 Å²	72.3	15%	0.145	36%	0.355	C	S	.	.	H	α-helix	trans	-55.6	-46.5	176.4	167	-102.9	0	0	0	112.6	L420 I423 Q424 F427 L434 R438 K439 I440 I444 S445 V446	L420-F442 HydrophobicContact CB-CE1 4.48Å; L420-F442 HydrophobicContact CD2-CD1 4.19Å; L420-F442 HydrophobicContact CD2-CE1 3.62Å; L420-F442 HydrophobicContact CD2-CZ 4.21Å; I423-F442 HydrophobicContact CB-CZ 3.98Å; I423-F442 HydrophobicContact CD1-CZ 4.4Å; I423-F442 HydrophobicContact CG2-CE2 3.99Å; I423-F442 HydrophobicContact CG2-CZ 3.65Å; Q424-F442 HydrophobicContact CG-CD1 3.99Å; Q424-F442 HydrophobicContact CG-CE1 3.58Å; Q424-F442 HydrophobicContact CG-CZ 4.36Å; F427-F442 AromaticContact CE2-CD2 3.97Å; F427-F442 HydrophobicContact CE2-CD2 3.97Å; F427-F442 AromaticContact CE2-CE2 3.68Å; F427-F442 HydrophobicContact CE2-CE2 3.68Å; F427-F442 HydrophobicContact CE2-CZ 4.16Å; F427-F442 HydrophobicContact CZ-CE2 4.16Å; L434-F442 HydrophobicContact CD1-CB 4.32Å; L434-F442 HydrophobicContact CD1-CG 4.35Å; R438-F442 WeakPolarHBondContact O-CB 3.47Å; R438-F442 PolarHBondContact O-N 3.18Å; K439-F442 PolarHBondContact O-N 2.93Å; I440-F442 PolarHBondContact O-N 3.43Å; F442-I444 PolarHBondContact O-N 3.34Å; F442-S445 WeakPolarHBondContact O-CB 3.35Å; F442-S445 PolarHBondContact O-N 2.68Å; F442-V446 HydrophobicContact CD2-CG2 4.24Å; F442-V446 HydrophobicContact CE1-CG2 4.33Å; F442-V446 HydrophobicContact CE2-CG2 3.73Å; F442-V446 HydrophobicContact CZ-CG2 3.79Å; F442-V446 WeakPolarHBondContact O-CG2 3.42Å; F442-V446 PolarHBondContact O-N 3.31Å
443	R	97.1	Very high	95.3	Very high	14 Å²	14	72.3 Å²	72.3	5%	0.053	35%	0.351	C	S	.	.	H	α-helix	trans	-61.7	-43.9	179	-70.1	169.4	174	-85.4	-10.9	111.7	V244 E417 L420 Q424 K439 I440 V441 V446 C447	V244-R443 PolarHBondContact O-NH1 3.47Å; E417-R443 IonicContact OE1-CZ 2.87Å; E417-R443 IonicContact OE1-NH1 3.11Å; E417-R443 IonicContact OE1-NH2 2.75Å; E417-R443 PolarHBondContact OE1-NH2 3.07Å; E417-R443 IonicContact OE2-CZ 3.9Å; E417-R443 IonicContact OE2-NH1 3.93Å; E417-R443 PolarHBondContact OE2-NH1 3.34Å; E417-R443 IonicContact OE2-NH2 3.59Å; E417-R443 PolarHBondContact OE2-NH2 2.97Å; L420-R443 HydrophobicContact CD1-CB 4.43Å; L420-R443 HydrophobicContact CD1-CG 4.01Å; L420-R443 HydrophobicContact CD2-CB 4.36Å; L420-R443 HydrophobicContact CD2-CG 4.01Å; Q424-R443 VanDerWaalsContact OE1-NH2 3.09Å; K439-R443 WeakPolarHBondContact O-CG 3.22Å; K439-R443 PolarHBondContact O-N 3.29Å; I440-R443 PolarHBondContact O-N 3.28Å; V441-R443 VanDerWaalsContact C-N 3.35Å; V441-R443 PolarHBondContact O-N 2.92Å; R443-V446 PolarHBondContact O-N 2.66Å; R443-C447 PolarHBondContact O-N 2.84Å; R443-C447 VanDerWaalsContact O-N 3.1Å; R443-C447 PolarHBondContact O-SG 3.36Å
444	I	97.7	Very high	95.9	Very high	80 Å²	80	66.9 Å²	66.9	41%	0.41	33%	0.326	S	S	.	.	H	α-helix	trans	-62.6	-45.5	175.1	-66	168.8	0	0	0	110.3	I440 V441 F442 V446 C447 C448	I440-I444 HydrophobicContact CG2-CD1 3.87Å; I440-I444 WeakPolarHBondContact O-CG1 3.37Å; I440-I444 PolarHBondContact O-N 3.44Å; V441-I444 PolarHBondContact O-N 3.49Å; F442-I444 PolarHBondContact O-N 3.34Å; I444-V446 VanDerWaalsContact C-N 3.33Å; I444-V446 PolarHBondContact O-N 3.03Å; I444-C447 WeakPolarHBondContact O-CB 3.33Å; I444-C447 PolarHBondContact O-N 3.45Å; I444-C447 VanDerWaalsContact O-N 3.14Å; I444-C448 PolarHBondContact O-N 2.87Å; I444-C448 PolarHBondContact O-SG 3.14Å; I444-C448 VanDerWaalsContact O-SG 3.32Å
445	S	97.9	Very high	96.4	Very high	66 Å²	66	66.6 Å²	66.6	46%	0.462	33%	0.325	S	S	.	.	H	α-helix	trans	-59.1	-41.2	178.3	-60.5	0	0	0	0	112.7	V441 F442 C448 L449	V441-S445 PolarHBondContact O-N 3.3Å; V441-S445 PolarHBondContact O-OG 3.43Å; F442-S445 WeakPolarHBondContact O-CB 3.35Å; F442-S445 PolarHBondContact O-N 2.68Å; S445-C448 PolarHBondContact O-N 3.04Å; S445-L449 WeakPolarHBondContact O-CB 3.44Å; S445-L449 PolarHBondContact O-N 3.33Å
446	V	98	Very high	96.7	Very high	14 Å²	14	65.1 Å²	65.1	9%	0.085	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-39.8	175.8	171.5	0	0	0	0	111.4	L416 L420 F442 R443 I444 L449 N450	L416-V446 HydrophobicContact CD1-CG1 4.34Å; L420-V446 HydrophobicContact CD2-CB 3.72Å; L420-V446 HydrophobicContact CD2-CG1 3.8Å; L420-V446 HydrophobicContact CD2-CG2 3.86Å; F442-V446 HydrophobicContact CD2-CG2 4.24Å; F442-V446 HydrophobicContact CE1-CG2 4.33Å; F442-V446 HydrophobicContact CE2-CG2 3.73Å; F442-V446 HydrophobicContact CZ-CG2 3.79Å; F442-V446 WeakPolarHBondContact O-CG2 3.42Å; F442-V446 PolarHBondContact O-N 3.31Å; R443-V446 PolarHBondContact O-N 2.66Å; I444-V446 VanDerWaalsContact C-N 3.33Å; I444-V446 PolarHBondContact O-N 3.03Å; V446-L449 PolarHBondContact O-N 3.11Å; V446-N450 VanDerWaalsContact O-CG 3.3Å; V446-N450 PolarHBondContact O-N 3.39Å; V446-N450 PolarHBondContact O-ND2 3.35Å
447	C	98.6	Very high	97.1	Very high	8 Å²	8	59.2 Å²	59.2	5%	0.054	29%	0.289	C	S	.	.	H	α-helix	trans	-62.3	-43.3	173.8	-62.7	0	0	0	0	111.6	W237 R443 I444 N450 F451	W237-C447 HydrophobicContact CE3-CB 3.86Å; R443-C447 PolarHBondContact O-N 2.84Å; R443-C447 VanDerWaalsContact O-N 3.1Å; R443-C447 PolarHBondContact O-SG 3.36Å; I444-C447 WeakPolarHBondContact O-CB 3.33Å; I444-C447 PolarHBondContact O-N 3.45Å; I444-C447 VanDerWaalsContact O-N 3.14Å; C447-N450 PolarHBondContact O-N 2.98Å; C447-F451 WeakPolarHBondContact O-CB 3.36Å; C447-F451 PolarHBondContact O-N 3.46Å
448	C	98.4	Very high	97.3	Very high	60 Å²	60	49.2 Å²	49.2	41%	0.405	25%	0.252	S	S	.	.	H	α-helix	trans	-62.2	-43.4	175.3	-66.6	0	0	0	0	111.8	I444 S445 F451 F452	I444-C448 PolarHBondContact O-N 2.87Å; I444-C448 PolarHBondContact O-SG 3.14Å; I444-C448 VanDerWaalsContact O-SG 3.32Å; S445-C448 PolarHBondContact O-N 3.04Å; C448-F451 WeakPolarHBondContact O-CB 3.09Å; C448-F451 PolarHBondContact O-N 3.18Å; C448-F452 WeakPolarHBondContact O-CD2 3.21Å; C448-F452 PolarHBondContact O-N 3.44Å; C448-F452 VanDerWaalsContact O-N 3.14Å
449	L	98.3	Very high	97.5	Very high	84 Å²	84	42 Å²	42	44%	0.44	23%	0.226	S	C	.	.	H	α-helix	trans	-59.4	-48.3	176.2	179.4	65.4	0	0	0	111.3	S445 V446 F451 F452 M453	S445-L449 WeakPolarHBondContact O-CB 3.44Å; S445-L449 PolarHBondContact O-N 3.33Å; V446-L449 PolarHBondContact O-N 3.11Å; L449-F451 VanDerWaalsContact C-N 3.31Å; L449-F451 PolarHBondContact O-N 3.29Å; L449-F452 PolarHBondContact O-N 2.84Å; L449-M453 HydrophobicContact CD1-CE 3.83Å; L449-M453 HydrophobicContact CD1-SD 4.3Å; L449-M453 HydrophobicContact CD2-CE 4.48Å; L449-M453 HydrophobicContact CG-CE 4.14Å; L449-M453 HydrophobicContact CG-SD 4.09Å; L449-M453 WeakPolarHBondContact O-CG 3.45Å; L449-M453 PolarHBondContact O-N 2.65Å
450	N	98.4	Very high	97.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.2	-31.8	179.4	-67.1	-34.2	0	0	0	112.6	W147 I151 W237 V446 C447 M453 G454	W147-N450 PolarHBondContact NE1-OD1 3.21Å; I151-N450 HydrophobicContact CG1-CB 4.47Å; W237-N450 HydrophobicContact CD2-CB 4.27Å; W237-N450 HydrophobicContact CE3-CB 4.33Å; W237-N450 HydrophobicContact CH2-CB 3.35Å; W237-N450 HydrophobicContact CZ2-CB 3.23Å; W237-N450 HydrophobicContact CZ3-CB 3.9Å; V446-N450 VanDerWaalsContact O-CG 3.3Å; V446-N450 PolarHBondContact O-N 3.39Å; V446-N450 PolarHBondContact O-ND2 3.35Å; C447-N450 PolarHBondContact O-N 2.98Å; N450-M453 PolarHBondContact O-N 2.89Å; N450-G454 PolarHBondContact O-N 2.88Å
451	F	98.6	Very high	97.6	Very high	27 Å²	27	38.2 Å²	38.2	12%	0.118	21%	0.211	C	C	.	.	H	α-helix	trans	-58.1	-52.9	170.5	165.9	-104.6	0	0	0	111.1	L233 L234 W237 C447 C448 L449 M453 G454 L455	L233-F451 HydrophobicContact CB-CE2 4.48Å; L233-F451 HydrophobicContact CD2-CD2 4.18Å; L233-F451 HydrophobicContact CD2-CE2 4.41Å; L233-F451 HydrophobicContact CG-CD2 4.02Å; L233-F451 HydrophobicContact CG-CE2 4.38Å; L234-F451 HydrophobicContact CB-CD2 4.09Å; L234-F451 HydrophobicContact CB-CE2 3.6Å; L234-F451 HydrophobicContact CB-CZ 4.14Å; L234-F451 HydrophobicContact CD1-CD1 4.36Å; L234-F451 HydrophobicContact CD1-CD2 4.13Å; L234-F451 HydrophobicContact CD1-CE1 4.3Å; L234-F451 HydrophobicContact CD1-CE2 4.09Å; L234-F451 HydrophobicContact CD1-CG 4.27Å; L234-F451 HydrophobicContact CD1-CZ 4.17Å; L234-F451 HydrophobicContact CG-CE2 4.4Å; W237-F451 HydrophobicContact CB-CB 4.44Å; W237-F451 HydrophobicContact CG-CB 4.01Å; C447-F451 WeakPolarHBondContact O-CB 3.36Å; C447-F451 PolarHBondContact O-N 3.46Å; C448-F451 WeakPolarHBondContact O-CB 3.09Å; C448-F451 PolarHBondContact O-N 3.18Å; L449-F451 VanDerWaalsContact C-N 3.31Å; L449-F451 PolarHBondContact O-N 3.29Å; F451-M453 VanDerWaalsContact C-N 3.3Å; F451-M453 PolarHBondContact O-N 2.74Å; F451-G454 PolarHBondContact O-N 3.37Å; F451-G454 VanDerWaalsContact O-N 3.1Å; F451-L455 HydrophobicContact CE1-CD1 4.18Å; F451-L455 HydrophobicContact CE1-CD2 4.49Å; F451-L455 HydrophobicContact CE1-CG 4.46Å; F451-L455 HydrophobicContact CE2-CD2 3.89Å; F451-L455 HydrophobicContact CE2-CG 4.45Å; F451-L455 HydrophobicContact CZ-CD1 4.25Å; F451-L455 HydrophobicContact CZ-CD2 3.79Å; F451-L455 HydrophobicContact CZ-CG 4.23Å; F451-L455 PolarHBondContact O-N 3.36Å
452	F	98.4	Very high	97.5	Very high	135 Å²	135	34 Å²	34	59%	0.592	19%	0.185	S	C	*	.	H	α-helix	trans	-63.6	-35.8	179.3	-70.5	-64.6	0	0	0	112.6	C448 L449 G454 L455	C448-F452 WeakPolarHBondContact O-CD2 3.21Å; C448-F452 PolarHBondContact O-N 3.44Å; C448-F452 VanDerWaalsContact O-N 3.14Å; L449-F452 PolarHBondContact O-N 2.84Å; F452-G454 VanDerWaalsContact C-N 3.31Å; F452-G454 PolarHBondContact O-N 3.05Å; F452-L455 HydrophobicContact CD1-CD1 3.89Å; F452-L455 PolarHBondContact O-N 3.33Å
453	M	97.7	Very high	97.3	Very high	72 Å²	72	33.5 Å²	33.5	36%	0.355	18%	0.183	S	C	.	.	H	α-helix	trans	-71.9	-22.7	175.2	-72.1	179	166.7	0	0	113.9	W147 I151 L449 N450 F451 P456	W147-M453 HydrophobicContact CH2-CE 3.86Å; W147-M453 HydrophobicContact CH2-SD 3.83Å; W147-M453 HydrophobicContact CZ2-CE 3.59Å; W147-M453 HydrophobicContact CZ2-SD 3.21Å; W147-M453 WeakPolarHBondContact CZ2-SD 3.49Å; I151-M453 HydrophobicContact CD1-CB 3.95Å; I151-M453 HydrophobicContact CD1-SD 4.06Å; I151-M453 HydrophobicContact CG1-CB 4.28Å; I151-M453 HydrophobicContact CG2-CB 4.33Å; L449-M453 HydrophobicContact CD1-CE 3.83Å; L449-M453 HydrophobicContact CD1-SD 4.3Å; L449-M453 HydrophobicContact CD2-CE 4.48Å; L449-M453 HydrophobicContact CG-CE 4.14Å; L449-M453 HydrophobicContact CG-SD 4.09Å; L449-M453 WeakPolarHBondContact O-CG 3.45Å; L449-M453 PolarHBondContact O-N 2.65Å; N450-M453 PolarHBondContact O-N 2.89Å; F451-M453 VanDerWaalsContact C-N 3.3Å; F451-M453 PolarHBondContact O-N 2.74Å; M453-P456 WeakPolarHBondContact O-CD 3.49Å
454	G	98.3	Very high	97.2	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-83.6	-18.4	173.8	0	0	0	0	0	114	N450 F451 F452 P456 M457	N450-G454 PolarHBondContact O-N 2.88Å; F451-G454 PolarHBondContact O-N 3.37Å; F451-G454 VanDerWaalsContact O-N 3.1Å; F452-G454 VanDerWaalsContact C-N 3.31Å; F452-G454 PolarHBondContact O-N 3.05Å; G454-P456 VanDerWaalsContact C-CD 3.47Å; G454-M457 WeakPolarHBondContact O-CB 3.3Å; G454-M457 PolarHBondContact O-N 3.39Å
455	L	98.2	Very high	97	Very high	33 Å²	33	30.1 Å²	30.1	17%	0.173	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-56.4	-40.3	-179.9	-74	178.7	0	0	0	114.5	P225 L233 F451 F452 M457 V458	P225-L455 HydrophobicContact CB-CD2 4.46Å; P225-L455 HydrophobicContact CG-CB 4.43Å; L233-L455 HydrophobicContact CD2-CD2 4.45Å; F451-L455 HydrophobicContact CE1-CD1 4.18Å; F451-L455 HydrophobicContact CE1-CD2 4.49Å; F451-L455 HydrophobicContact CE1-CG 4.46Å; F451-L455 HydrophobicContact CE2-CD2 3.89Å; F451-L455 HydrophobicContact CE2-CG 4.45Å; F451-L455 HydrophobicContact CZ-CD1 4.25Å; F451-L455 HydrophobicContact CZ-CD2 3.79Å; F451-L455 HydrophobicContact CZ-CG 4.23Å; F451-L455 PolarHBondContact O-N 3.36Å; F452-L455 HydrophobicContact CD1-CD1 3.89Å; F452-L455 PolarHBondContact O-N 3.33Å; L455-M457 PolarHBondContact O-N 3.34Å; L455-V458 HydrophobicContact CD2-CG2 4.17Å; L455-V458 WeakPolarHBondContact O-CG2 3.42Å; L455-V458 PolarHBondContact O-N 3.05Å; L455-V458 VanDerWaalsContact O-N 3.08Å
456	P	97.7	Very high	96.8	Very high	47 Å²	47	28.1 Å²	28.1	31%	0.305	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-57.6	-32.4	175.8	-26.3	35.8	0	0	0	113.3	F222 M453 G454 V458 C459 G462 L465	F222-P456 HydrophobicContact CE1-CB 3.79Å; F222-P456 WeakPolarHBondContact CE1-O 3.44Å; F222-P456 HydrophobicContact CZ-CB 3.56Å; F222-P456 WeakPolarHBondContact CZ-O 3.2Å; M453-P456 WeakPolarHBondContact O-CD 3.49Å; G454-P456 VanDerWaalsContact C-CD 3.47Å; P456-V458 VanDerWaalsContact C-N 3.27Å; P456-V458 PolarHBondContact O-N 3.36Å; P456-C459 WeakPolarHBondContact O-CB 3.3Å; P456-C459 PolarHBondContact O-N 3.39Å; P456-G462 VanDerWaalsContact O-CA 3.24Å; P456-G462 WeakPolarHBondContact O-CA 3.48Å; P456-L465 HydrophobicContact CB-CD2 4.03Å
457	M	96.8	Very high	96.6	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.025	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-77.3	-9	-179.7	-68.1	174.9	179.4	0	0	113.9	I151 V155 G454 L455 G462 L465 V466 Y469	I151-M457 HydrophobicContact CG2-CE 4.21Å; I151-M457 HydrophobicContact CG2-SD 4.12Å; V155-M457 HydrophobicContact CB-CB 4.48Å; V155-M457 HydrophobicContact CG1-CB 4.2Å; V155-M457 HydrophobicContact CG2-CB 3.74Å; V155-M457 HydrophobicContact CG2-SD 4.01Å; G454-M457 WeakPolarHBondContact O-CB 3.3Å; G454-M457 PolarHBondContact O-N 3.39Å; L455-M457 PolarHBondContact O-N 3.34Å; M457-G462 CarbonylContact O-C 3.32Å; M457-L465 HydrophobicContact CE-CD2 4.34Å; M457-L465 HydrophobicContact CE-CG 4.09Å; M457-L465 HydrophobicContact CG-CB 4.32Å; M457-L465 HydrophobicContact CG-CD2 3.79Å; M457-L465 HydrophobicContact CG-CG 4.01Å; M457-V466 HydrophobicContact CB-CG2 3.75Å; M457-V466 HydrophobicContact CG-CG2 3.94Å; M457-V466 HydrophobicContact SD-CG2 4.14Å; M457-Y469 HydrophobicContact CE-CD1 3.53Å; M457-Y469 HydrophobicContact CE-CD2 3.26Å; M457-Y469 HydrophobicContact CE-CE1 3.57Å; M457-Y469 HydrophobicContact CE-CE2 3.31Å; M457-Y469 HydrophobicContact CE-CG 3.36Å; M457-Y469 VanDerWaalsContact CE-CZ 3.46Å
458	V	97.2	Very high	96.3	Very high	5 Å²	5	28.1 Å²	28.1	3%	0.03	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-105.1	9.3	172.7	-56.6	0	0	0	0	112.7	V155 P225 G226 L229 L233 L455 P456	V155-V458 HydrophobicContact CG1-CG1 4.09Å; P225-V458 HydrophobicContact CB-CG2 4.12Å; G226-V458 PolarHBondContact N-O 2.98Å; L229-V458 HydrophobicContact CB-CB 3.96Å; L229-V458 HydrophobicContact CB-CG1 4.08Å; L233-V458 HydrophobicContact CD2-CG1 4.21Å; L455-V458 HydrophobicContact CD2-CG2 4.17Å; L455-V458 WeakPolarHBondContact O-CG2 3.42Å; L455-V458 PolarHBondContact O-N 3.05Å; L455-V458 VanDerWaalsContact O-N 3.08Å; P456-V458 VanDerWaalsContact C-N 3.27Å; P456-V458 PolarHBondContact O-N 3.36Å
459	C	97.8	Very high	96.1	Very high	9 Å²	9	26.9 Å²	26.9	6%	0.061	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-76.2	167.7	166.9	-60.3	0	0	0	0	111.2	F222 A224 P225 P456 G461 G462	F222-C459 HydrophobicContact CD1-CB 3.84Å; F222-C459 HydrophobicContact CE1-CB 3.69Å; F222-C459 VanDerWaalsContact CE1-SG 3.53Å; F222-C459 HydrophobicContact CZ-CB 4.35Å; F222-C459 WeakPolarHBondContact O-CB 3.46Å; A224-C459 VanDerWaalsContact C-SG 3.59Å; P225-C459 VanDerWaalsContact CD-SG 3.59Å; P456-C459 WeakPolarHBondContact O-CB 3.3Å; P456-C459 PolarHBondContact O-N 3.39Å; C459-G461 VanDerWaalsContact C-N 3.31Å; C459-G461 PolarHBondContact O-N 3.17Å; C459-G462 WeakPolarHBondContact O-CA 3.45Å; C459-G462 PolarHBondContact O-N 2.95Å
460	A	96.1	Very high	95.7	Very high	21 Å²	21	25.6 Å²	25.6	17%	0.174	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-42.1	176.9	0	0	0	0	0	113.2	K214 S216 F222 G462	K214-A460 WeakPolarHBondContact O-CA 3.49Å; K214-A460 WeakPolarHBondContact O-CB 3.4Å; S216-A460 PolarHBondContact N-O 3.1Å; S216-A460 VanDerWaalsContact N-O 3.09Å; S216-A460 PolarHBondContact OG-O 2.9Å; F222-A460 PolarHBondContact O-N 3.01Å; A460-G462 VanDerWaalsContact C-N 3.33Å
461	G	94.7	Very high	95.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	0.8	172.8	0	0	0	0	0	114.3	S216 F219 F222 C459 Y463 Y464	S216-G461 VanDerWaalsContact OG-CA 3.23Å; S216-G461 WeakPolarHBondContact OG-CA 3.4Å; S216-G461 PolarHBondContact OG-N 3.34Å; F219-G461 WeakPolarHBondContact CD2-O 2.99Å; F222-G461 PolarHBondContact O-N 3.48Å; C459-G461 VanDerWaalsContact C-N 3.31Å; C459-G461 PolarHBondContact O-N 3.17Å; G461-Y463 VanDerWaalsContact C-N 3.28Å; G461-Y463 PolarHBondContact O-N 3.37Å; G461-Y464 PolarHBondContact O-N 3.42Å
462	G	95.2	Very high	94.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.7	-27.9	-176.2	0	0	0	0	0	113.7	P456 M457 C459 A460 Y464 L465 V466	P456-G462 VanDerWaalsContact O-CA 3.24Å; P456-G462 WeakPolarHBondContact O-CA 3.48Å; M457-G462 CarbonylContact O-C 3.32Å; C459-G462 WeakPolarHBondContact O-CA 3.45Å; C459-G462 PolarHBondContact O-N 2.95Å; A460-G462 VanDerWaalsContact C-N 3.33Å; G462-Y464 VanDerWaalsContact C-N 3.33Å; G462-Y464 PolarHBondContact O-N 2.97Å; G462-L465 WeakPolarHBondContact O-CA 3.07Å; G462-L465 VanDerWaalsContact O-CB 3.31Å; G462-L465 WeakPolarHBondContact O-CB 3.04Å; G462-L465 PolarHBondContact O-N 3.23Å; G462-V466 PolarHBondContact O-N 3.44Å
463	Y	92.6	Very high	94.5	Very high	24 Å²	24	19.6 Å²	19.6	9%	0.094	11%	0.109	C	C	.	.	H	α-helix	trans	-56.7	-45.1	176.4	-176.7	-87.2	0	0	0	112.2	Y208 F209 L213 L215 G461 L465 V466 T467 E542	Y208-Y463 HydrophobicContact CE1-CE2 4.14Å; F209-Y463 HydrophobicContact CE1-CE2 4.49Å; L213-Y463 HydrophobicContact CD1-CD2 3.37Å; L213-Y463 HydrophobicContact CD1-CE2 3.87Å; L213-Y463 HydrophobicContact CD1-CG 4.06Å; L213-Y463 HydrophobicContact CD2-CD2 4.06Å; L213-Y463 HydrophobicContact CG-CD2 4.38Å; L215-Y463 HydrophobicContact CD1-CD1 4.27Å; L215-Y463 HydrophobicContact CD1-CG 4.07Å; G461-Y463 VanDerWaalsContact C-N 3.28Å; G461-Y463 PolarHBondContact O-N 3.37Å; Y463-L465 VanDerWaalsContact C-N 3.27Å; Y463-L465 PolarHBondContact O-N 3.48Å; Y463-V466 WeakPolarHBondContact O-CB 3.17Å; Y463-V466 PolarHBondContact O-N 3.44Å; Y463-V466 VanDerWaalsContact O-N 3.1Å; Y463-T467 PolarHBondContact O-N 2.87Å; Y463-T467 PolarHBondContact O-OG1 3.32Å; Y463-E542 HydrophobicContact CD1-CG 4.28Å; Y463-E542 HydrophobicContact CE1-CG 3.49Å; Y463-E542 VanDerWaalsContact CE1-CG 3.49Å; Y463-E542 VanDerWaalsContact OH-CD 3.3Å; Y463-E542 PolarHBondContact OH-OE1 2.83Å; Y463-E542 PolarHBondContact OH-OE2 3.23Å
464	Y	93.9	Very high	94	Very high	4 Å²	4	17.2 Å²	17.2	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-63.1	-34.2	176.5	-56.5	-71	0	0	0	112.3	L215 S216 P217 G218 F219 G461 G462 T467 I468 Y545 F547	L215-Y464 HydrophobicContact CD1-CE2 3.93Å; S216-Y464 PolarHBondContact O-OH 3.38Å; S216-Y464 VanDerWaalsContact O-OH 3.07Å; P217-Y464 PolarHBondContact O-OH 3.18Å; G218-Y464 VanDerWaalsContact C-CE2 3.46Å; F219-Y464 HydrophobicContact CB-CD2 3.96Å; F219-Y464 HydrophobicContact CB-CG 4.06Å; F219-Y464 HydrophobicContact CD2-CD2 4.22Å; F219-Y464 HydrophobicContact CD2-CG 4.28Å; G461-Y464 PolarHBondContact O-N 3.42Å; G462-Y464 VanDerWaalsContact C-N 3.33Å; G462-Y464 PolarHBondContact O-N 2.97Å; Y464-T467 PolarHBondContact O-N 2.99Å; Y464-I468 WeakPolarHBondContact O-CG1 3.22Å; Y464-I468 PolarHBondContact O-N 2.83Å; Y464-I468 VanDerWaalsContact O-N 3.07Å; Y464-Y545 AromaticContact CD1-CD1 3.69Å; Y464-Y545 HydrophobicContact CD1-CD1 3.69Å; Y464-Y545 AromaticContact CD1-CE1 3.79Å; Y464-Y545 HydrophobicContact CD1-CE1 3.79Å; Y464-Y545 AromaticContact CE1-CD1 3.31Å; Y464-Y545 HydrophobicContact CE1-CD1 3.31Å; Y464-Y545 HydrophobicContact CE1-CD2 4.45Å; Y464-Y545 AromaticContact CE1-CE1 3.72Å; Y464-Y545 HydrophobicContact CE1-CE1 3.72Å; Y464-Y545 AromaticContact CE1-CG 3.71Å; Y464-Y545 HydrophobicContact CE1-CG 3.71Å; Y464-Y545 HydrophobicContact CG-CE1 4.39Å; Y464-F547 HydrophobicContact CD1-CE1 4.11Å; Y464-F547 HydrophobicContact CD1-CE2 4.31Å; Y464-F547 AromaticContact CD1-CZ 3.73Å; Y464-F547 HydrophobicContact CD1-CZ 3.73Å; Y464-F547 HydrophobicContact CG-CE1 4.42Å; Y464-F547 HydrophobicContact CG-CZ 4.43Å
465	L	94.9	Very high	93.5	Very high	19 Å²	19	17.4 Å²	17.4	10%	0.099	10%	0.101	C	C	.	.	H	α-helix	trans	-66.4	-40.7	173.8	-172.2	58.1	0	0	0	111.3	F219 F222 P456 M457 G462 Y463 T467 I468 Y469 L554	F219-L465 HydrophobicContact CE2-CB 3.93Å; F219-L465 HydrophobicContact CZ-CB 4.36Å; F219-L465 HydrophobicContact CZ-CD1 4.2Å; F222-L465 HydrophobicContact CZ-CD2 4.32Å; P456-L465 HydrophobicContact CB-CD2 4.03Å; M457-L465 HydrophobicContact CE-CD2 4.34Å; M457-L465 HydrophobicContact CE-CG 4.09Å; M457-L465 HydrophobicContact CG-CB 4.32Å; M457-L465 HydrophobicContact CG-CD2 3.79Å; M457-L465 HydrophobicContact CG-CG 4.01Å; G462-L465 WeakPolarHBondContact O-CA 3.07Å; G462-L465 VanDerWaalsContact O-CB 3.31Å; G462-L465 WeakPolarHBondContact O-CB 3.04Å; G462-L465 PolarHBondContact O-N 3.23Å; Y463-L465 VanDerWaalsContact C-N 3.27Å; Y463-L465 PolarHBondContact O-N 3.48Å; L465-T467 VanDerWaalsContact C-N 3.32Å; L465-T467 PolarHBondContact O-N 3.24Å; L465-I468 PolarHBondContact O-N 3.41Å; L465-Y469 HydrophobicContact CD1-CD2 4Å; L465-Y469 HydrophobicContact CD1-CE2 3.78Å; L465-Y469 HydrophobicContact CG-CD2 4.15Å; L465-Y469 HydrophobicContact CG-CE2 4.07Å; L465-Y469 WeakPolarHBondContact O-CD2 3.46Å; L465-Y469 PolarHBondContact O-N 2.97Å; L465-L554 HydrophobicContact CD1-CD2 4Å
466	V	94	Very high	93.1	Very high	24 Å²	24	17 Å²	17	15%	0.145	10%	0.098	C	C	.	.	H	α-helix	trans	-59.4	-44	173.5	175.2	0	0	0	0	110.5	V155 M457 G462 Y463 I468 Y469 D470	V155-V466 HydrophobicContact CG1-CG2 4.18Å; M457-V466 HydrophobicContact CB-CG2 3.75Å; M457-V466 HydrophobicContact CG-CG2 3.94Å; M457-V466 HydrophobicContact SD-CG2 4.14Å; G462-V466 PolarHBondContact O-N 3.44Å; Y463-V466 WeakPolarHBondContact O-CB 3.17Å; Y463-V466 PolarHBondContact O-N 3.44Å; Y463-V466 VanDerWaalsContact O-N 3.1Å; V466-I468 VanDerWaalsContact C-N 3.33Å; V466-I468 PolarHBondContact O-N 3.22Å; V466-Y469 PolarHBondContact O-N 2.88Å; V466-D470 PolarHBondContact O-N 3.13Å
467	T	92.1	Very high	92.9	Very high	22 Å²	22	14.7 Å²	14.7	14%	0.135	8%	0.083	C	C	.	.	H	α-helix	trans	-59.8	-41	176.2	-54.8	0	0	0	0	112.3	Y463 Y464 L465 S471 F547	Y463-T467 PolarHBondContact O-N 2.87Å; Y463-T467 PolarHBondContact O-OG1 3.32Å; Y464-T467 PolarHBondContact O-N 2.99Å; L465-T467 VanDerWaalsContact C-N 3.32Å; L465-T467 PolarHBondContact O-N 3.24Å; T467-S471 WeakPolarHBondContact O-CB 3.35Å; T467-S471 PolarHBondContact O-N 3.49Å; T467-S471 PolarHBondContact O-OG 3.12Å; T467-F547 HydrophobicContact CG2-CZ 4.14Å
468	I	93.5	Very high	92.7	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63	-47.5	175.2	-67.1	166	0	0	0	110.3	F219 Y464 L465 V466 S471 V472 L540 F547 T551 L554 L558	F219-I468 HydrophobicContact CE1-CD1 4.14Å; F219-I468 HydrophobicContact CZ-CD1 4.21Å; Y464-I468 WeakPolarHBondContact O-CG1 3.22Å; Y464-I468 PolarHBondContact O-N 2.83Å; Y464-I468 VanDerWaalsContact O-N 3.07Å; L465-I468 PolarHBondContact O-N 3.41Å; V466-I468 VanDerWaalsContact C-N 3.33Å; V466-I468 PolarHBondContact O-N 3.22Å; I468-S471 WeakPolarHBondContact O-CB 3.29Å; I468-S471 PolarHBondContact O-N 3Å; I468-V472 HydrophobicContact CG2-CG2 4.41Å; I468-V472 VanDerWaalsContact O-CG2 3.31Å; I468-V472 WeakPolarHBondContact O-CG2 3.35Å; I468-V472 PolarHBondContact O-N 3.38Å; I468-L540 HydrophobicContact CG1-CD1 4.15Å; I468-F547 HydrophobicContact CD1-CE1 4.36Å; I468-F547 HydrophobicContact CG1-CE1 4.19Å; I468-T551 HydrophobicContact CD1-CG2 4.46Å; I468-L554 HydrophobicContact CD1-CD2 4.23Å; I468-L558 HydrophobicContact CG2-CD1 4.15Å
469	Y	93.5	Very high	92.5	Very high	33 Å²	33	14.5 Å²	14.5	13%	0.129	8%	0.082	C	C	.	.	H	α-helix	trans	-62.2	-45.5	179.1	-91.1	-112.5	0	0	0	112.4	L148 Y152 M457 L465 V466 S471 V472 M473 L558	L148-Y469 HydrophobicContact CB-CD1 4.47Å; L148-Y469 HydrophobicContact CB-CE1 4.27Å; L148-Y469 HydrophobicContact CD2-CE1 3.81Å; Y152-Y469 HydrophobicContact CD1-CD1 4.35Å; Y152-Y469 HydrophobicContact CG-CD1 4.48Å; M457-Y469 HydrophobicContact CE-CD1 3.53Å; M457-Y469 HydrophobicContact CE-CD2 3.26Å; M457-Y469 HydrophobicContact CE-CE1 3.57Å; M457-Y469 HydrophobicContact CE-CE2 3.31Å; M457-Y469 HydrophobicContact CE-CG 3.36Å; M457-Y469 VanDerWaalsContact CE-CZ 3.46Å; L465-Y469 HydrophobicContact CD1-CD2 4Å; L465-Y469 HydrophobicContact CD1-CE2 3.78Å; L465-Y469 HydrophobicContact CG-CD2 4.15Å; L465-Y469 HydrophobicContact CG-CE2 4.07Å; L465-Y469 WeakPolarHBondContact O-CD2 3.46Å; L465-Y469 PolarHBondContact O-N 2.97Å; V466-Y469 PolarHBondContact O-N 2.88Å; Y469-S471 PolarHBondContact O-N 2.99Å; Y469-V472 PolarHBondContact O-N 3.37Å; Y469-V472 VanDerWaalsContact O-N 3.16Å; Y469-M473 WeakPolarHBondContact O-CG 3.37Å; Y469-M473 PolarHBondContact O-N 2.93Å; Y469-L558 HydrophobicContact CD2-CD1 4Å; Y469-L558 HydrophobicContact CE2-CD1 3.69Å
470	D	90.1	Very high	92.4	Very high	57 Å²	57	15.8 Å²	15.8	31%	0.305	9%	0.088	S	C	.	.	H	α-helix	trans	-61.2	-36.7	177.2	-172.9	69.2	0	0	0	111.7	Y152 V466 S474	Y152-D470 HydrophobicContact CE2-CB 4.34Å; V466-D470 PolarHBondContact O-N 3.13Å; D470-S474 VanDerWaalsContact O-CB 3.3Å; D470-S474 WeakPolarHBondContact O-CB 3.17Å; D470-S474 PolarHBondContact O-N 3.44Å; D470-S474 PolarHBondContact O-OG 3.23Å; D470-S474 VanDerWaalsContact O-OG 3.05Å
471	S	89.9	Confident	92.5	Very high	33 Å²	33	14.8 Å²	14.8	23%	0.231	8%	0.08	C	C	.	.	H	α-helix	trans	-69.2	-37.3	175	-59.3	0	0	0	0	112.8	T467 I468 Y469 G475	T467-S471 WeakPolarHBondContact O-CB 3.35Å; T467-S471 PolarHBondContact O-N 3.49Å; T467-S471 PolarHBondContact O-OG 3.12Å; I468-S471 WeakPolarHBondContact O-CB 3.29Å; I468-S471 PolarHBondContact O-N 3Å; Y469-S471 PolarHBondContact O-N 2.99Å; S471-G475 PolarHBondContact O-N 3.04Å; S471-G475 VanDerWaalsContact O-N 3.11Å
472	V	91.1	Very high	92.5	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-65.7	-46.5	175.4	169.9	0	0	0	0	109.5	I468 Y469 G475 Y555 L558	I468-V472 HydrophobicContact CG2-CG2 4.41Å; I468-V472 VanDerWaalsContact O-CG2 3.31Å; I468-V472 WeakPolarHBondContact O-CG2 3.35Å; I468-V472 PolarHBondContact O-N 3.38Å; Y469-V472 PolarHBondContact O-N 3.37Å; Y469-V472 VanDerWaalsContact O-N 3.16Å; V472-G475 PolarHBondContact O-N 3.5Å; V472-Y555 HydrophobicContact CB-CE2 4.45Å; V472-Y555 HydrophobicContact CG2-CD2 3.54Å; V472-Y555 HydrophobicContact CG2-CE2 3.81Å; V472-Y555 HydrophobicContact CG2-CG 4.23Å; V472-L558 HydrophobicContact CG1-CB 4.09Å; V472-L558 HydrophobicContact CG2-CB 3.84Å; V472-L558 HydrophobicContact CG2-CD1 4.25Å
473	M	89.4	Confident	92.6	Very high	3 Å²	3	16.6 Å²	16.6	2%	0.015	9%	0.089	C	C	.	.	H	α-helix	trans	-61.5	-49.4	176.9	-67	-55.6	110.9	0	0	109.6	L145 L148 L149 Y152 F309 Y469 G475 P478	L145-M473 HydrophobicContact CD2-CE 4.1Å; L145-M473 HydrophobicContact CD2-SD 4.32Å; L148-M473 HydrophobicContact CB-CE 3.54Å; L148-M473 HydrophobicContact CB-SD 4.44Å; L148-M473 HydrophobicContact CD1-CE 3.67Å; L148-M473 HydrophobicContact CG-CE 4.27Å; L149-M473 HydrophobicContact CB-SD 4.26Å; Y152-M473 HydrophobicContact CD1-CG 4.21Å; Y152-M473 HydrophobicContact CE1-CB 4.38Å; Y152-M473 HydrophobicContact CE1-CG 3.39Å; Y152-M473 HydrophobicContact CE1-SD 4.33Å; F309-M473 VanDerWaalsContact CE1-C 3.45Å; F309-M473 HydrophobicContact CE1-CB 4.33Å; F309-M473 WeakPolarHBondContact CE1-O 3.46Å; F309-M473 VanDerWaalsContact CZ-C 3.48Å; F309-M473 WeakPolarHBondContact CZ-O 3.45Å; Y469-M473 WeakPolarHBondContact O-CG 3.37Å; Y469-M473 PolarHBondContact O-N 2.93Å; M473-G475 PolarHBondContact O-N 2.92Å; M473-P478 WeakPolarHBondContact O-CG 3.28Å
474	S	86.3	Confident	92.9	Very high	23 Å²	23	16.7 Å²	16.7	16%	0.161	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	4.3	179.5	-57.1	0	0	0	0	115.2	R82 F309 D470	R82-S474 PolarHBondContact NH1-OG 3.47Å; R82-S474 VanDerWaalsContact NH1-OG 3.12Å; R82-S474 PolarHBondContact NH2-OG 3.27Å; F309-S474 VanDerWaalsContact CE2-CA 3.45Å; D470-S474 VanDerWaalsContact O-CB 3.3Å; D470-S474 WeakPolarHBondContact O-CB 3.17Å; D470-S474 PolarHBondContact O-N 3.44Å; D470-S474 PolarHBondContact O-OG 3.23Å; D470-S474 VanDerWaalsContact O-OG 3.05Å
475	G	88.8	Confident	93	Very high	3 Å²	3	16.5 Å²	16.5	3%	0.031	9%	0.093	C	C	.	.	S	Bend	trans	-98.9	-158.5	-169.6	0	0	0	0	0	115.3	S471 V472 M473 A477 P478	S471-G475 PolarHBondContact O-N 3.04Å; S471-G475 VanDerWaalsContact O-N 3.11Å; V472-G475 PolarHBondContact O-N 3.5Å; M473-G475 PolarHBondContact O-N 2.92Å; G475-A477 VanDerWaalsContact C-N 3.31Å; G475-A477 PolarHBondContact O-N 2.87Å; G475-P478 WeakPolarHBondContact O-CD 3.26Å
476	Y	90.5	Very high	93.1	Very high	24 Å²	24	15.6 Å²	15.6	9%	0.094	9%	0.088	C	C	.	.	H	α-helix	trans	-71.5	-21.9	-176	62.4	-98	0	0	0	113.9	L479 I480 V533 L534 Y555 S559 V563	Y476-L479 PolarHBondContact O-N 2.65Å; Y476-I480 HydrophobicContact CD2-CD1 3.75Å; Y476-I480 HydrophobicContact CE2-CD1 4.46Å; Y476-I480 WeakPolarHBondContact O-CG1 3.38Å; Y476-I480 PolarHBondContact O-N 2.96Å; Y476-V533 HydrophobicContact CD1-CG1 4.25Å; Y476-L534 HydrophobicContact CD1-CD2 3.78Å; Y476-L534 HydrophobicContact CE1-CD2 4.19Å; Y476-L534 HydrophobicContact CG-CD2 4Å; Y476-Y555 HydrophobicContact CE1-CE1 4.06Å; Y476-S559 VanDerWaalsContact CZ-CB 3.43Å; Y476-S559 WeakPolarHBondContact OH-CB 3.34Å; Y476-V563 HydrophobicContact CD2-CG2 4.49Å; Y476-V563 HydrophobicContact CE2-CG2 4.15Å
477	A	91.9	Very high	93.3	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59.8	-54.9	-173.4	0	0	0	0	0	113.3	L145 G475 L479 I480 V481 T562	L145-A477 HydrophobicContact CD2-CB 4.42Å; G475-A477 VanDerWaalsContact C-N 3.31Å; G475-A477 PolarHBondContact O-N 2.87Å; A477-L479 VanDerWaalsContact C-N 3.32Å; A477-L479 PolarHBondContact O-N 3.2Å; A477-I480 PolarHBondContact O-N 3.48Å; A477-V481 PolarHBondContact O-N 2.96Å; A477-T562 HydrophobicContact CB-CG2 4.25Å
478	P	93.3	Very high	93.5	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.006	9%	0.091	C	C	.	.	H	α-helix	trans	-71.1	-26.2	176.1	29.4	-37	0	0	0	113.4	L145 F308 F309 M473 G475 I480 V481 A482	L145-P478 HydrophobicContact CD1-CB 3.93Å; F308-P478 HydrophobicContact CE1-CB 3.71Å; F308-P478 HydrophobicContact CE1-CG 4.12Å; F308-P478 HydrophobicContact CZ-CB 4.02Å; F309-P478 HydrophobicContact CE1-CG 4.06Å; F309-P478 HydrophobicContact CZ-CG 3.69Å; M473-P478 WeakPolarHBondContact O-CG 3.28Å; G475-P478 WeakPolarHBondContact O-CD 3.26Å; P478-I480 VanDerWaalsContact C-N 3.31Å; P478-I480 PolarHBondContact O-N 3.44Å; P478-V481 WeakPolarHBondContact O-CB 3.45Å; P478-V481 PolarHBondContact O-N 3.25Å; P478-A482 WeakPolarHBondContact O-CB 3.29Å; P478-A482 PolarHBondContact O-N 3.05Å
479	L	94.1	Very high	93.7	Very high	4 Å²	4	16.1 Å²	16.1	2%	0.021	9%	0.091	C	C	.	.	H	α-helix	trans	-64.2	-36.9	173.2	-65.2	173.2	0	0	0	111.8	F308 Y476 A477 A482 L483 L529 I530 V533	F308-L479 HydrophobicContact CD2-CD2 4.39Å; F308-L479 HydrophobicContact CE2-CD2 4.45Å; Y476-L479 PolarHBondContact O-N 2.65Å; A477-L479 VanDerWaalsContact C-N 3.32Å; A477-L479 PolarHBondContact O-N 3.2Å; L479-A482 PolarHBondContact O-N 3.05Å; L479-L483 WeakPolarHBondContact O-CB 3.13Å; L479-L483 PolarHBondContact O-N 3.11Å; L479-L529 HydrophobicContact CD1-CB 3.66Å; L479-L529 HydrophobicContact CD2-CB 4.24Å; L479-L529 HydrophobicContact CD2-CD1 3.94Å; L479-I530 HydrophobicContact CB-CD1 4.14Å; L479-I530 HydrophobicContact CB-CG1 3.57Å; L479-I530 HydrophobicContact CD1-CG1 4.34Å; L479-V533 HydrophobicContact CD1-CG2 4.34Å
480	I	95.3	Very high	93.8	Very high	37 Å²	37	14.8 Å²	14.8	19%	0.19	9%	0.086	C	C	.	.	H	α-helix	trans	-65.4	-40.8	173.3	-71.9	171.6	0	0	0	110.8	Y476 A477 P478 A482 L483 S484 I530 V563 I566	Y476-I480 HydrophobicContact CD2-CD1 3.75Å; Y476-I480 HydrophobicContact CE2-CD1 4.46Å; Y476-I480 WeakPolarHBondContact O-CG1 3.38Å; Y476-I480 PolarHBondContact O-N 2.96Å; A477-I480 PolarHBondContact O-N 3.48Å; P478-I480 VanDerWaalsContact C-N 3.31Å; P478-I480 PolarHBondContact O-N 3.44Å; I480-A482 VanDerWaalsContact C-N 3.33Å; I480-L483 PolarHBondContact O-N 3.17Å; I480-S484 VanDerWaalsContact O-CB 3.24Å; I480-S484 WeakPolarHBondContact O-CB 3.49Å; I480-S484 PolarHBondContact O-N 3.27Å; I480-S484 PolarHBondContact O-OG 2.88Å; I480-I530 HydrophobicContact CG1-CD1 3.88Å; I480-I530 HydrophobicContact CG1-CG1 4.31Å; I480-V563 HydrophobicContact CD1-CG1 4.5Å; I480-V563 HydrophobicContact CD1-CG2 3.63Å; I480-I566 HydrophobicContact CG2-CD1 4.07Å
481	V	96.7	Very high	94	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59.3	-47.3	173.9	176.6	0	0	0	0	109.9	I138 A141 M142 L145 C314 A477 P478 L483 S484 E485 T562 I566	I138-V481 HydrophobicContact CG2-CG1 3.92Å; A141-V481 HydrophobicContact CB-CG2 4.04Å; M142-V481 HydrophobicContact CE-CG1 3.81Å; M142-V481 HydrophobicContact CG-CG1 3.66Å; L145-V481 HydrophobicContact CD1-CG2 3.87Å; C314-V481 HydrophobicContact CB-CG1 4.08Å; C314-V481 VanDerWaalsContact O-CG1 3.29Å; C314-V481 WeakPolarHBondContact O-CG1 3.48Å; A477-V481 PolarHBondContact O-N 2.96Å; P478-V481 WeakPolarHBondContact O-CB 3.45Å; P478-V481 PolarHBondContact O-N 3.25Å; V481-L483 PolarHBondContact O-N 3.09Å; V481-S484 PolarHBondContact O-N 3.17Å; V481-E485 WeakPolarHBondContact O-CB 3.25Å; V481-E485 PolarHBondContact O-N 3.17Å; V481-T562 HydrophobicContact CG2-CG2 4.02Å; V481-I566 HydrophobicContact CG2-CD1 4.05Å
482	A	96.5	Very high	94.1	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-62.3	-44.3	179.6	0	0	0	0	0	113.6	L110 F308 C314 P478 L479 I480 T486	L110-A482 HydrophobicContact CD1-CB 4.36Å; F308-A482 HydrophobicContact CE2-CB 3.51Å; F308-A482 HydrophobicContact CZ-CB 3.91Å; C314-A482 HydrophobicContact CB-CB 3.93Å; C314-A482 WeakPolarHBondContact SG-CA 3.37Å; C314-A482 WeakPolarHBondContact SG-CB 3.5Å; P478-A482 WeakPolarHBondContact O-CB 3.29Å; P478-A482 PolarHBondContact O-N 3.05Å; L479-A482 PolarHBondContact O-N 3.05Å; I480-A482 VanDerWaalsContact C-N 3.33Å; A482-T486 WeakPolarHBondContact O-CB 3.04Å; A482-T486 PolarHBondContact O-N 3.24Å; A482-T486 PolarHBondContact O-OG1 3.15Å
483	L	97.2	Very high	94.2	Very high	37 Å²	37	19.9 Å²	19.9	19%	0.194	10%	0.102	C	C	.	.	H	α-helix	trans	-62.2	-48.8	175.1	179.6	62.5	0	0	0	110.4	L479 I480 V481 E485 T486 V487 P523 C526 L527 I530	L479-L483 WeakPolarHBondContact O-CB 3.13Å; L479-L483 PolarHBondContact O-N 3.11Å; I480-L483 PolarHBondContact O-N 3.17Å; V481-L483 PolarHBondContact O-N 3.09Å; L483-E485 PolarHBondContact O-N 2.91Å; L483-T486 PolarHBondContact O-N 3.19Å; L483-V487 HydrophobicContact CD1-CG2 3.94Å; L483-V487 HydrophobicContact CG-CG2 4.37Å; L483-V487 VanDerWaalsContact O-CB 3.31Å; L483-V487 WeakPolarHBondContact O-CB 3.44Å; L483-V487 WeakPolarHBondContact O-CG2 3.25Å; L483-V487 PolarHBondContact O-N 3.14Å; L483-P523 HydrophobicContact CD1-CB 3.89Å; L483-P523 WeakPolarHBondContact CD1-O 3.23Å; L483-C526 HydrophobicContact CB-CB 4.09Å; L483-C526 HydrophobicContact CD1-CB 4.35Å; L483-L527 HydrophobicContact CD2-CD1 4.23Å; L483-I530 HydrophobicContact CB-CD1 4.15Å; L483-I530 HydrophobicContact CD2-CD1 3.8Å
484	S	97.4	Very high	94.4	Very high	27 Å²	27	20.8 Å²	20.8	19%	0.189	11%	0.112	C	C	.	.	H	α-helix	trans	-61.3	-46	-178.7	-56.8	0	0	0	0	111.2	I480 V481 V487 V488	I480-S484 VanDerWaalsContact O-CB 3.24Å; I480-S484 WeakPolarHBondContact O-CB 3.49Å; I480-S484 PolarHBondContact O-N 3.27Å; I480-S484 PolarHBondContact O-OG 2.88Å; V481-S484 PolarHBondContact O-N 3.17Å; S484-V487 PolarHBondContact O-N 3.13Å; S484-V488 WeakPolarHBondContact O-CB 3.23Å; S484-V488 WeakPolarHBondContact O-CG2 3.04Å; S484-V488 PolarHBondContact O-N 3.06Å
485	E	97.1	Very high	94.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.6	-49.5	179.5	169.8	176.6	-149.1	0	0	111.9	L113 E114 W129 M142 C314 V481 L483 V487 V488 I489	L113-E485 HydrophobicContact CD2-CG 3.86Å; E114-E485 WeakPolarHBondContact CG-OE1 3.28Å; W129-E485 HydrophobicContact CH2-CB 3.85Å; W129-E485 HydrophobicContact CH2-CG 3.87Å; W129-E485 HydrophobicContact CZ2-CB 4.12Å; W129-E485 HydrophobicContact CZ2-CG 4.12Å; M142-E485 HydrophobicContact CE-CB 4.38Å; M142-E485 HydrophobicContact CE-CG 4.4Å; M142-E485 VanDerWaalsContact CE-OE2 3.24Å; M142-E485 WeakPolarHBondContact CE-OE2 3.49Å; C314-E485 PolarHBondContact SG-OE2 3.26Å; V481-E485 WeakPolarHBondContact O-CB 3.25Å; V481-E485 PolarHBondContact O-N 3.17Å; L483-E485 PolarHBondContact O-N 2.91Å; E485-V487 VanDerWaalsContact C-N 3.31Å; E485-V487 PolarHBondContact O-N 3.35Å; E485-V488 PolarHBondContact O-N 3.29Å; E485-I489 HydrophobicContact CG-CD1 3.72Å; E485-I489 WeakPolarHBondContact O-CB 3.02Å; E485-I489 WeakPolarHBondContact O-CG1 3.37Å; E485-I489 PolarHBondContact O-N 3.38Å
486	T	97.5	Very high	95.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.8	-44.2	179.4	-54.1	0	0	0	0	110.5	L110 A482 L483 T490 W518 T522 P523	L110-T486 VanDerWaalsContact CD2-OG1 3.31Å; L110-T486 WeakPolarHBondContact CD2-OG1 3.45Å; A482-T486 WeakPolarHBondContact O-CB 3.04Å; A482-T486 PolarHBondContact O-N 3.24Å; A482-T486 PolarHBondContact O-OG1 3.15Å; L483-T486 PolarHBondContact O-N 3.19Å; T486-T490 HydrophobicContact CG2-CG2 4.36Å; T486-T490 VanDerWaalsContact O-CB 3.31Å; T486-T490 WeakPolarHBondContact O-CB 3.43Å; T486-T490 WeakPolarHBondContact O-CG2 3.11Å; T486-T490 PolarHBondContact O-N 3.48Å; T486-T490 PolarHBondContact O-OG1 3.47Å; T486-W518 WeakPolarHBondContact CG2-O 3.41Å; T486-T522 HydrophobicContact CG2-CG2 4.07Å; T486-P523 HydrophobicContact CG2-CB 4.35Å; T486-P523 HydrophobicContact CG2-CG 4.35Å
487	V	97.2	Very high	95.3	Very high	53 Å²	53	27.4 Å²	27.4	32%	0.321	14%	0.139	S	C	.	.	H	α-helix	trans	-65.5	-46.6	-179.7	168.9	0	0	0	0	111.6	L483 S484 E485 T490 Y491 P523	L483-V487 HydrophobicContact CD1-CG2 3.94Å; L483-V487 HydrophobicContact CG-CG2 4.37Å; L483-V487 VanDerWaalsContact O-CB 3.31Å; L483-V487 WeakPolarHBondContact O-CB 3.44Å; L483-V487 WeakPolarHBondContact O-CG2 3.25Å; L483-V487 PolarHBondContact O-N 3.14Å; S484-V487 PolarHBondContact O-N 3.13Å; E485-V487 VanDerWaalsContact C-N 3.31Å; E485-V487 PolarHBondContact O-N 3.35Å; V487-T490 PolarHBondContact O-N 3.23Å; V487-Y491 HydrophobicContact CG1-CD2 4.31Å; V487-Y491 WeakPolarHBondContact O-CB 3.06Å; V487-Y491 PolarHBondContact O-N 3.29Å; V487-P523 HydrophobicContact CG2-CB 4.41Å
488	V	96.4	Very high	95.5	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.018	14%	0.14	C	C	.	.	I	π-helix	trans	-64.8	-45.9	-178.4	173.6	0	0	0	0	110.8	W129 F135 I138 S484 E485 T490 V492 Y493	W129-V488 HydrophobicContact CE3-CG1 4.45Å; W129-V488 HydrophobicContact CZ3-CB 4.06Å; W129-V488 HydrophobicContact CZ3-CG1 3.8Å; F135-V488 HydrophobicContact CB-CG1 4.22Å; F135-V488 HydrophobicContact CB-CG2 4.09Å; F135-V488 HydrophobicContact CD1-CG2 3.58Å; F135-V488 HydrophobicContact CD2-CB 4.48Å; F135-V488 HydrophobicContact CD2-CG1 3.84Å; F135-V488 HydrophobicContact CD2-CG2 3.7Å; F135-V488 HydrophobicContact CE1-CG2 3.83Å; F135-V488 HydrophobicContact CE2-CG1 4.45Å; F135-V488 HydrophobicContact CE2-CG2 3.93Å; F135-V488 HydrophobicContact CG-CB 4.48Å; F135-V488 HydrophobicContact CG-CG1 4.11Å; F135-V488 HydrophobicContact CG-CG2 3.5Å; F135-V488 HydrophobicContact CZ-CG2 3.99Å; I138-V488 HydrophobicContact CD1-CG2 4.1Å; S484-V488 WeakPolarHBondContact O-CB 3.23Å; S484-V488 WeakPolarHBondContact O-CG2 3.04Å; S484-V488 PolarHBondContact O-N 3.06Å; E485-V488 PolarHBondContact O-N 3.29Å; V488-T490 PolarHBondContact O-N 3.45Å; V488-V492 HydrophobicContact CG1-CB 4.22Å; V488-V492 WeakPolarHBondContact O-CA 3.43Å; V488-V492 VanDerWaalsContact O-CB 3.27Å; V488-V492 WeakPolarHBondContact O-CB 3.49Å; V488-V492 PolarHBondContact O-N 3.39Å; V488-V492 VanDerWaalsContact O-N 3.11Å; V488-Y493 PolarHBondContact O-N 3.44Å
489	I	97.1	Very high	95.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.146	C	C	.	.	I	π-helix	trans	-66.2	-39.1	-179.2	-67.9	170.7	0	0	0	111.4	L113 F117 E485 G494 F498	L113-I489 HydrophobicContact CD1-CD1 4.38Å; L113-I489 HydrophobicContact CD1-CG2 4.31Å; L113-I489 HydrophobicContact CD2-CD1 3.5Å; L113-I489 VanDerWaalsContact CD2-CD1 3.5Å; L113-I489 HydrophobicContact CG-CD1 4.11Å; F117-I489 HydrophobicContact CD1-CD1 3.81Å; F117-I489 HydrophobicContact CD2-CD1 4.33Å; F117-I489 HydrophobicContact CE1-CD1 3.98Å; F117-I489 HydrophobicContact CE2-CD1 4.48Å; F117-I489 HydrophobicContact CG-CD1 4.01Å; F117-I489 HydrophobicContact CZ-CD1 4.33Å; E485-I489 HydrophobicContact CG-CD1 3.72Å; E485-I489 WeakPolarHBondContact O-CB 3.02Å; E485-I489 WeakPolarHBondContact O-CG1 3.37Å; E485-I489 PolarHBondContact O-N 3.38Å; I489-G494 PolarHBondContact O-N 2.86Å; I489-F498 HydrophobicContact CG2-CB 4.28Å; I489-F498 HydrophobicContact CG2-CD1 3.73Å; I489-F498 HydrophobicContact CG2-CD2 3.79Å; I489-F498 HydrophobicContact CG2-CE1 3.9Å; I489-F498 HydrophobicContact CG2-CE2 3.98Å; I489-F498 HydrophobicContact CG2-CG 3.66Å; I489-F498 HydrophobicContact CG2-CZ 4.03Å
490	T	96.7	Very high	95.9	Very high	6 Å²	6	29.6 Å²	29.6	4%	0.037	15%	0.148	C	C	.	.	I	π-helix	trans	-87.7	-39.8	-172.4	58.7	0	0	0	0	114	T486 V487 V488 G494 L495 W518	T486-T490 HydrophobicContact CG2-CG2 4.36Å; T486-T490 VanDerWaalsContact O-CB 3.31Å; T486-T490 WeakPolarHBondContact O-CB 3.43Å; T486-T490 WeakPolarHBondContact O-CG2 3.11Å; T486-T490 PolarHBondContact O-N 3.48Å; T486-T490 PolarHBondContact O-OG1 3.47Å; V487-T490 PolarHBondContact O-N 3.23Å; V488-T490 PolarHBondContact O-N 3.45Å; T490-G494 CarbonylContact O-C 3.6Å; T490-G494 WeakPolarHBondContact O-CA 3.24Å; T490-L495 PolarHBondContact O-N 3.5Å; T490-W518 HydrophobicContact CG2-CB 3.7Å
491	Y	94.3	Very high	95.9	Very high	132 Å²	132	27.9 Å²	27.9	52%	0.518	14%	0.139	S	C	.	.	I	π-helix	trans	-103.5	-33.3	-174.2	-66.5	-85.2	0	0	0	113.6	V487 L519	V487-Y491 HydrophobicContact CG1-CD2 4.31Å; V487-Y491 WeakPolarHBondContact O-CB 3.06Å; V487-Y491 PolarHBondContact O-N 3.29Å; Y491-L519 HydrophobicContact CE1-CD1 3.75Å; Y491-L519 HydrophobicContact CE2-CD1 4.29Å; Y491-L519 WeakPolarHBondContact OH-CD1 3.41Å; Y491-L519 PolarHBondContact OH-O 3.26Å
492	V	92	Very high	96	Very high	48 Å²	48	27.9 Å²	27.9	29%	0.291	14%	0.139	S	C	.	.	I	π-helix	trans	-87.8	-58.6	-179.8	178.9	0	0	0	0	110.9	F135 V488 G494 L587	F135-V492 HydrophobicContact CE2-CG1 4.37Å; F135-V492 HydrophobicContact CE2-CG2 4.23Å; V488-V492 HydrophobicContact CG1-CB 4.22Å; V488-V492 WeakPolarHBondContact O-CA 3.43Å; V488-V492 VanDerWaalsContact O-CB 3.27Å; V488-V492 WeakPolarHBondContact O-CB 3.49Å; V488-V492 PolarHBondContact O-N 3.39Å; V488-V492 VanDerWaalsContact O-N 3.11Å; V492-G494 VanDerWaalsContact C-N 3.34Å; V492-L587 HydrophobicContact CG1-CB 3.87Å; V492-L587 HydrophobicContact CG1-CD2 3.58Å; V492-L587 HydrophobicContact CG1-CG 4.23Å; V492-L587 HydrophobicContact CG2-CD2 4.47Å
493	Y	93.2	Very high	96.1	Very high	16 Å²	16	31.4 Å²	31.4	6%	0.063	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-34.9	176	179.3	-109.6	0	0	0	112.1	I131 V488 Q497 F498 D501 P589 W593 F663	I131-Y493 HydrophobicContact CD1-CD1 3.6Å; I131-Y493 HydrophobicContact CD1-CD2 3.6Å; I131-Y493 HydrophobicContact CD1-CE1 3.84Å; I131-Y493 HydrophobicContact CD1-CE2 3.82Å; I131-Y493 HydrophobicContact CD1-CG 3.45Å; I131-Y493 VanDerWaalsContact CD1-CG 3.45Å; I131-Y493 HydrophobicContact CG1-CD1 4.23Å; I131-Y493 HydrophobicContact CG1-CD2 3.24Å; I131-Y493 HydrophobicContact CG1-CE1 4.44Å; I131-Y493 HydrophobicContact CG1-CE2 3.49Å; I131-Y493 VanDerWaalsContact CG1-CE2 3.49Å; I131-Y493 HydrophobicContact CG1-CG 3.61Å; V488-Y493 PolarHBondContact O-N 3.44Å; Y493-Q497 HydrophobicContact CE1-CB 4.06Å; Y493-Q497 HydrophobicContact CE1-CG 3.68Å; Y493-Q497 HydrophobicContact CE2-CG 4.33Å; Y493-F498 HydrophobicContact CD1-CB 4.06Å; Y493-F498 HydrophobicContact CD1-CD2 4.49Å; Y493-F498 HydrophobicContact CE1-CB 4.05Å; Y493-F498 HydrophobicContact CE1-CD2 4.27Å; Y493-D501 WeakPolarHBondContact CE1-OD2 3.4Å; Y493-D501 VanDerWaalsContact CZ-OD2 3.24Å; Y493-D501 PolarHBondContact OH-OD2 2.99Å; Y493-P589 HydrophobicContact CD2-CG 3.68Å; Y493-P589 HydrophobicContact CE2-CG 3.45Å; Y493-P589 VanDerWaalsContact CE2-CG 3.45Å; Y493-W593 AromaticContact CE2-NE1 3.69Å; Y493-W593 AromaticContact CZ-NE1 3.76Å; Y493-W593 PolarHBondContact OH-NE1 3.38Å; Y493-F663 HydrophobicContact CE2-CE2 4.14Å; Y493-F663 AromaticContact CE2-CZ 3.62Å; Y493-F663 HydrophobicContact CE2-CZ 3.62Å; Y493-F663 AromaticContact CZ-CZ 3.98Å
494	G	93.2	Very high	96	Very high	22 Å²	22	30.8 Å²	30.8	23%	0.227	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.4	117.5	174.6	0	0	0	0	0	112.9	I489 T490 V492 K496 Q497 F498	I489-G494 PolarHBondContact O-N 2.86Å; T490-G494 CarbonylContact O-C 3.6Å; T490-G494 WeakPolarHBondContact O-CA 3.24Å; V492-G494 VanDerWaalsContact C-N 3.34Å; G494-K496 PolarHBondContact O-N 2.93Å; G494-K496 VanDerWaalsContact O-N 3.12Å; G494-Q497 PolarHBondContact O-N 3.05Å; G494-F498 PolarHBondContact O-N 3.5Å; G494-F498 VanDerWaalsContact O-N 3.07Å
495	L	96.2	Very high	96	Very high	15 Å²	15	29.5 Å²	29.5	8%	0.079	14%	0.144	C	C	.	.	H	α-helix	trans	-57.5	-30.6	-179.4	177.1	57.1	0	0	0	113.9	T490 R499 R515 W518 L519	T490-L495 PolarHBondContact O-N 3.5Å; L495-R499 HydrophobicContact CD1-CG 3.94Å; L495-R499 HydrophobicContact CG-CG 4.5Å; L495-R499 WeakPolarHBondContact O-CB 3.48Å; L495-R499 VanDerWaalsContact O-CG 3.26Å; L495-R499 WeakPolarHBondContact O-CG 3.39Å; L495-R499 PolarHBondContact O-N 3.2Å; L495-R515 HydrophobicContact CD2-CB 4.46Å; L495-R515 HydrophobicContact CD2-CG 3.69Å; L495-W518 HydrophobicContact CD1-CE3 3.62Å; L495-W518 HydrophobicContact CD1-CZ3 4.23Å; L495-L519 HydrophobicContact CD2-CB 4.13Å; L495-L519 HydrophobicContact CD2-CD1 4.36Å
496	K	94.4	Very high	96	Very high	150 Å²	150	30.3 Å²	30.3	65%	0.652	15%	0.148	S	C	*	.	H	α-helix	trans	-63.5	-44.4	177	-175.5	-177.4	175	-171.7	0	110.9	G494 C500 R509	G494-K496 PolarHBondContact O-N 2.93Å; G494-K496 VanDerWaalsContact O-N 3.12Å; K496-C500 PolarHBondContact O-N 3.26Å; K496-C500 PolarHBondContact O-SG 2.83Å; K496-R509 PolarHBondContact O-NH2 2.81Å; K496-R509 VanDerWaalsContact O-NH2 3.14Å
497	Q	93.9	Very high	95.9	Very high	24 Å²	24	36.1 Å²	36.1	11%	0.112	18%	0.179	C	C	.	.	H	α-helix	trans	-68.8	-49.1	178.6	-178.8	58.8	40.9	0	0	110.6	Y493 G494 R499 C500 D501 I608 F663	Y493-Q497 HydrophobicContact CE1-CB 4.06Å; Y493-Q497 HydrophobicContact CE1-CG 3.68Å; Y493-Q497 HydrophobicContact CE2-CG 4.33Å; G494-Q497 PolarHBondContact O-N 3.05Å; Q497-R499 PolarHBondContact O-N 3.09Å; Q497-C500 CarbonylContact O-C 3.53Å; Q497-C500 WeakPolarHBondContact O-CA 3.39Å; Q497-C500 VanDerWaalsContact O-CB 3.26Å; Q497-C500 WeakPolarHBondContact O-CB 3.44Å; Q497-C500 PolarHBondContact O-N 2.91Å; Q497-D501 PolarHBondContact NE2-OD1 3.31Å; Q497-D501 PolarHBondContact O-N 3.45Å; Q497-I608 VanDerWaalsContact CD-CD1 3.49Å; Q497-I608 VanDerWaalsContact NE2-CD1 3.29Å; Q497-F663 HydrophobicContact CG-CE2 3.76Å; Q497-F663 HydrophobicContact CG-CZ 3.92Å
498	F	97.1	Very high	95.8	Very high	3 Å²	3	39.3 Å²	39.3	1%	0.013	19%	0.19	C	C	.	.	H	α-helix	trans	-56.5	-37.6	178.8	-169.4	-116.6	0	0	0	112.9	L113 A116 F117 I489 Y493 G494 D501 I502 W518	L113-F498 HydrophobicContact CG-CE1 4.2Å; L113-F498 HydrophobicContact CG-CZ 4.35Å; A116-F498 HydrophobicContact CB-CE1 4.47Å; A116-F498 HydrophobicContact CB-CZ 3.88Å; F117-F498 HydrophobicContact CB-CZ 4.48Å; I489-F498 HydrophobicContact CG2-CB 4.28Å; I489-F498 HydrophobicContact CG2-CD1 3.73Å; I489-F498 HydrophobicContact CG2-CD2 3.79Å; I489-F498 HydrophobicContact CG2-CE1 3.9Å; I489-F498 HydrophobicContact CG2-CE2 3.98Å; I489-F498 HydrophobicContact CG2-CG 3.66Å; I489-F498 HydrophobicContact CG2-CZ 4.03Å; Y493-F498 HydrophobicContact CD1-CB 4.06Å; Y493-F498 HydrophobicContact CD1-CD2 4.49Å; Y493-F498 HydrophobicContact CE1-CB 4.05Å; Y493-F498 HydrophobicContact CE1-CD2 4.27Å; G494-F498 PolarHBondContact O-N 3.5Å; G494-F498 VanDerWaalsContact O-N 3.07Å; F498-D501 WeakPolarHBondContact O-CB 3.29Å; F498-D501 PolarHBondContact O-N 3.46Å; F498-I502 HydrophobicContact CD1-CD1 3.89Å; F498-I502 HydrophobicContact CE1-CD1 3.63Å; F498-I502 HydrophobicContact CZ-CD1 4.14Å; F498-I502 WeakPolarHBondContact O-CG1 3.41Å; F498-I502 PolarHBondContact O-N 2.99Å; F498-W518 HydrophobicContact CD1-CZ3 4.3Å; F498-W518 HydrophobicContact CE1-CH2 4.26Å; F498-W518 HydrophobicContact CE1-CZ3 4.37Å
499	R	97.7	Very high	95.7	Very high	40 Å²	40	43.3 Å²	43.3	15%	0.151	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-34.9	173.2	-73.4	175	67.1	-142.6	-0.6	113.2	L495 Q497 D501 E503 R509 P510 W518	L495-R499 HydrophobicContact CD1-CG 3.94Å; L495-R499 HydrophobicContact CG-CG 4.5Å; L495-R499 WeakPolarHBondContact O-CB 3.48Å; L495-R499 VanDerWaalsContact O-CG 3.26Å; L495-R499 WeakPolarHBondContact O-CG 3.39Å; L495-R499 PolarHBondContact O-N 3.2Å; Q497-R499 PolarHBondContact O-N 3.09Å; R499-D501 VanDerWaalsContact C-N 3.35Å; R499-E503 WeakPolarHBondContact O-CB 3.46Å; R499-E503 PolarHBondContact O-N 2.93Å; R499-R509 HydrophobicContact CB-CG 4.22Å; R499-P510 HydrophobicContact CB-CG 4.5Å; R499-P510 HydrophobicContact CG-CB 4.17Å; R499-P510 HydrophobicContact CG-CG 4.11Å; R499-P510 PolarHBondContact NE-O 3.29Å; R499-P510 PolarHBondContact NH2-O 3.45Å; R499-W518 HydrophobicContact CG-CZ3 4.48Å
500	C	96.4	Very high	95.8	Very high	9 Å²	9	43.6 Å²	43.6	6%	0.061	21%	0.207	C	C	.	.	H	α-helix	trans	-67.1	-38.2	172.5	-64.2	0	0	0	0	111.1	K496 Q497 I502 E503 L504 R509 M607	K496-C500 PolarHBondContact O-N 3.26Å; K496-C500 PolarHBondContact O-SG 2.83Å; Q497-C500 CarbonylContact O-C 3.53Å; Q497-C500 WeakPolarHBondContact O-CA 3.39Å; Q497-C500 VanDerWaalsContact O-CB 3.26Å; Q497-C500 WeakPolarHBondContact O-CB 3.44Å; Q497-C500 PolarHBondContact O-N 2.91Å; C500-I502 VanDerWaalsContact C-N 3.33Å; C500-I502 PolarHBondContact O-N 2.76Å; C500-E503 WeakPolarHBondContact O-CB 3.45Å; C500-E503 PolarHBondContact O-N 2.77Å; C500-L504 WeakPolarHBondContact O-CB 3.34Å; C500-L504 PolarHBondContact O-N 2.72Å; C500-R509 VanDerWaalsContact SG-CZ 3.6Å; C500-R509 PolarHBondContact SG-NH1 2.8Å; C500-R509 PolarHBondContact SG-NH2 3.33Å; C500-M607 HydrophobicContact CB-CE 4.07Å; C500-M607 HydrophobicContact CB-SD 3.65Å
501	D	97.1	Very high	95.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.9	-41	177.3	-60.5	-22.6	0	0	0	111.5	F120 Y493 Q497 F498 R499 L504 M505 F604	F120-D501 HydrophobicContact CD2-CB 3.83Å; F120-D501 HydrophobicContact CE1-CB 4.38Å; F120-D501 HydrophobicContact CE2-CB 3.51Å; F120-D501 HydrophobicContact CG-CB 4.39Å; F120-D501 HydrophobicContact CZ-CB 3.81Å; Y493-D501 WeakPolarHBondContact CE1-OD2 3.4Å; Y493-D501 VanDerWaalsContact CZ-OD2 3.24Å; Y493-D501 PolarHBondContact OH-OD2 2.99Å; Q497-D501 PolarHBondContact NE2-OD1 3.31Å; Q497-D501 PolarHBondContact O-N 3.45Å; F498-D501 WeakPolarHBondContact O-CB 3.29Å; F498-D501 PolarHBondContact O-N 3.46Å; R499-D501 VanDerWaalsContact C-N 3.35Å; D501-L504 WeakPolarHBondContact O-CB 3.38Å; D501-L504 PolarHBondContact O-N 2.92Å; D501-M505 PolarHBondContact O-N 3.47Å; D501-F604 WeakPolarHBondContact OD1-CE2 3.33Å
502	I	98.1	Very high	95.9	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-45.5	172.8	-67.5	167.9	0	0	0	111.2	F112 A116 F498 C500 L504 M505 I506 P510 W518	F112-I502 HydrophobicContact CE1-CD1 4.4Å; F112-I502 HydrophobicContact CZ-CD1 4.14Å; F112-I502 HydrophobicContact CZ-CG2 3.8Å; A116-I502 HydrophobicContact CB-CD1 3.76Å; A116-I502 HydrophobicContact CB-CG1 3.69Å; F498-I502 HydrophobicContact CD1-CD1 3.89Å; F498-I502 HydrophobicContact CE1-CD1 3.63Å; F498-I502 HydrophobicContact CZ-CD1 4.14Å; F498-I502 WeakPolarHBondContact O-CG1 3.41Å; F498-I502 PolarHBondContact O-N 2.99Å; C500-I502 VanDerWaalsContact C-N 3.33Å; C500-I502 PolarHBondContact O-N 2.76Å; I502-L504 PolarHBondContact O-N 3.29Å; I502-M505 HydrophobicContact CB-CE 4.31Å; I502-M505 HydrophobicContact CG1-CE 3.86Å; I502-M505 WeakPolarHBondContact O-CA 3.44Å; I502-M505 WeakPolarHBondContact O-CB 3.44Å; I502-M505 PolarHBondContact O-N 3.19Å; I502-I506 HydrophobicContact CG2-CD1 3.77Å; I502-I506 HydrophobicContact CG2-CG1 3.88Å; I502-I506 WeakPolarHBondContact O-CG1 3.41Å; I502-I506 PolarHBondContact O-N 3.5Å; I502-P510 HydrophobicContact CB-CG 3.9Å; I502-P510 HydrophobicContact CD1-CG 3.71Å; I502-P510 HydrophobicContact CG1-CG 4.41Å; I502-P510 HydrophobicContact CG2-CG 3.62Å; I502-W518 HydrophobicContact CD1-CH2 3.72Å; I502-W518 HydrophobicContact CD1-CZ3 4.16Å
503	E	97.6	Very high	96.2	Very high	75 Å²	75	50 Å²	50	35%	0.35	23%	0.231	S	C	.	.	H	α-helix	trans	-57.3	-38.1	175.2	-174.9	174.2	-171.2	0	0	111.1	R499 C500 M505 N507 R509	R499-E503 WeakPolarHBondContact O-CB 3.46Å; R499-E503 PolarHBondContact O-N 2.93Å; C500-E503 WeakPolarHBondContact O-CB 3.45Å; C500-E503 PolarHBondContact O-N 2.77Å; E503-M505 PolarHBondContact O-N 2.85Å; E503-N507 WeakPolarHBondContact O-CA 3.29Å; E503-N507 PolarHBondContact O-N 3.34Å; E503-R509 HydrophobicContact CB-CB 4.16Å; E503-R509 HydrophobicContact CB-CG 4.31Å; E503-R509 HydrophobicContact CG-CB 4.12Å; E503-R509 VanDerWaalsContact OE2-CD 3.32Å; E503-R509 WeakPolarHBondContact OE2-CD 3.49Å; E503-R509 WeakPolarHBondContact OE2-CG 3.14Å; E503-R509 IonicContact OE2-CZ 3.3Å; E503-R509 IonicContact OE2-NE 3.51Å; E503-R509 IonicContact OE2-NH1 2.83Å; E503-R509 PolarHBondContact OE2-NH1 3.3Å
504	L	96.4	Very high	96.4	Very high	24 Å²	24	50 Å²	50	13%	0.126	23%	0.231	C	C	.	.	H	α-helix	trans	-65.8	-34.2	173.4	-177.9	64.9	0	0	0	112.5	F120 F327 K328 C500 D501 I502 E603 F604	F120-L504 HydrophobicContact CE2-CD2 4.47Å; F327-L504 HydrophobicContact CE1-CG 4.11Å; F327-L504 HydrophobicContact CZ-CD2 4.18Å; F327-L504 HydrophobicContact CZ-CG 4.11Å; K328-L504 PolarHBondContact NZ-O 3.4Å; C500-L504 WeakPolarHBondContact O-CB 3.34Å; C500-L504 PolarHBondContact O-N 2.72Å; D501-L504 WeakPolarHBondContact O-CB 3.38Å; D501-L504 PolarHBondContact O-N 2.92Å; I502-L504 PolarHBondContact O-N 3.29Å; L504-E603 HydrophobicContact CD1-CB 3.82Å; L504-F604 HydrophobicContact CD2-CB 3.72Å; L504-F604 HydrophobicContact CD2-CD2 4.32Å
505	M	96.3	Very high	96.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-74.5	-55.3	175.9	-72.8	-174.3	-71.4	0	0	112.6	A116 Q119 F120 F327 K328 D501 I502 E503	A116-M505 HydrophobicContact CB-CE 3.95Å; A116-M505 WeakPolarHBondContact O-CE 3.47Å; Q119-M505 HydrophobicContact CB-SD 4.13Å; Q119-M505 HydrophobicContact CG-SD 4.09Å; F120-M505 WeakPolarHBondContact CA-SD 3.25Å; F120-M505 HydrophobicContact CB-CE 3.88Å; F120-M505 HydrophobicContact CB-SD 3.62Å; F120-M505 HydrophobicContact CD2-CE 4.24Å; F120-M505 HydrophobicContact CD2-CG 3.99Å; F120-M505 HydrophobicContact CD2-SD 4.06Å; F120-M505 HydrophobicContact CG-SD 4.36Å; F120-M505 PolarHBondContact N-SD 3.32Å; F120-M505 VanDerWaalsContact N-SD 3.43Å; F327-M505 HydrophobicContact CD1-CG 4.47Å; F327-M505 HydrophobicContact CD2-CG 4.17Å; F327-M505 HydrophobicContact CE1-CG 4.02Å; F327-M505 HydrophobicContact CE2-CG 3.68Å; F327-M505 HydrophobicContact CE2-SD 4.45Å; F327-M505 HydrophobicContact CZ-CG 3.6Å; K328-M505 VanDerWaalsContact CA-O 3.29Å; K328-M505 WeakPolarHBondContact CA-O 3.24Å; K328-M505 WeakPolarHBondContact CD-O 3.17Å; D501-M505 PolarHBondContact O-N 3.47Å; I502-M505 HydrophobicContact CB-CE 4.31Å; I502-M505 HydrophobicContact CG1-CE 3.86Å; I502-M505 WeakPolarHBondContact O-CA 3.44Å; I502-M505 WeakPolarHBondContact O-CB 3.44Å; I502-M505 PolarHBondContact O-N 3.19Å; E503-M505 PolarHBondContact O-N 2.85Å
506	I	96.6	Very high	96.8	Very high	16 Å²	16	57.9 Å²	57.9	8%	0.082	26%	0.257	C	S	.	.	H	α-helix	trans	-107	3.1	-166.1	69.6	173.9	0	0	0	113.7	F112 N329 C332 I502 E508	F112-I506 HydrophobicContact CZ-CD1 4.35Å; N329-I506 VanDerWaalsContact O-CG2 3.3Å; N329-I506 WeakPolarHBondContact O-CG2 3.36Å; C332-I506 HydrophobicContact CB-CD1 3.67Å; I502-I506 HydrophobicContact CG2-CD1 3.77Å; I502-I506 HydrophobicContact CG2-CG1 3.88Å; I502-I506 WeakPolarHBondContact O-CG1 3.41Å; I502-I506 PolarHBondContact O-N 3.5Å; I506-E508 HydrophobicContact CD1-CB 4.34Å; I506-E508 HydrophobicContact CG1-CB 4.17Å; I506-E508 WeakPolarHBondContact CG1-O 3.17Å; I506-E508 PolarHBondContact O-N 3.05Å
507	N	95.7	Very high	97	Very high	123 Å²	123	50.8 Å²	50.8	66%	0.658	23%	0.226	S	C	*	.	S	Bend	trans	59	16.9	-175.2	-51.8	-50.3	0	0	0	114.2	E503	E503-N507 WeakPolarHBondContact O-CA 3.29Å; E503-N507 PolarHBondContact O-N 3.34Å
508	E	95.1	Very high	97.2	Very high	120 Å²	120	49.7 Å²	49.7	56%	0.561	22%	0.221	S	C	*	.	S	Bend	trans	-133.5	127.5	176.7	-68.9	-176.1	-177.6	0	0	109.4	I506	I506-E508 HydrophobicContact CD1-CB 4.34Å; I506-E508 HydrophobicContact CG1-CB 4.17Å; I506-E508 WeakPolarHBondContact CG1-O 3.17Å; I506-E508 PolarHBondContact O-N 3.05Å
509	R	95.8	Very high	97.2	Very high	86 Å²	86	52.1 Å²	52.1	33%	0.325	23%	0.234	S	C	.	.			trans	-80.7	128.8	177.1	-159.6	-178.5	-175.3	102.3	4.7	109.6	K496 R499 C500 E503 N511	K496-R509 PolarHBondContact O-NH2 2.81Å; K496-R509 VanDerWaalsContact O-NH2 3.14Å; R499-R509 HydrophobicContact CB-CG 4.22Å; C500-R509 VanDerWaalsContact SG-CZ 3.6Å; C500-R509 PolarHBondContact SG-NH1 2.8Å; C500-R509 PolarHBondContact SG-NH2 3.33Å; E503-R509 HydrophobicContact CB-CB 4.16Å; E503-R509 HydrophobicContact CB-CG 4.31Å; E503-R509 HydrophobicContact CG-CB 4.12Å; E503-R509 VanDerWaalsContact OE2-CD 3.32Å; E503-R509 WeakPolarHBondContact OE2-CD 3.49Å; E503-R509 WeakPolarHBondContact OE2-CG 3.14Å; E503-R509 IonicContact OE2-CZ 3.3Å; E503-R509 IonicContact OE2-NE 3.51Å; E503-R509 IonicContact OE2-NH1 2.83Å; E503-R509 PolarHBondContact OE2-NH1 3.3Å; R509-N511 PolarHBondContact O-N 2.89Å
510	P	97.7	Very high	97.2	Very high	6 Å²	6	53.5 Å²	53.5	4%	0.039	25%	0.247	C	C	.	.			trans	-51.9	127.3	176.2	-27.7	34.4	0	0	0	111	F112 R499 I502 W514 W518	F112-P510 HydrophobicContact CE1-CB 4.43Å; F112-P510 HydrophobicContact CE1-CG 4.17Å; F112-P510 HydrophobicContact CZ-CG 4.42Å; R499-P510 HydrophobicContact CB-CG 4.5Å; R499-P510 HydrophobicContact CG-CB 4.17Å; R499-P510 HydrophobicContact CG-CG 4.11Å; R499-P510 PolarHBondContact NE-O 3.29Å; R499-P510 PolarHBondContact NH2-O 3.45Å; I502-P510 HydrophobicContact CB-CG 3.9Å; I502-P510 HydrophobicContact CD1-CG 3.71Å; I502-P510 HydrophobicContact CG1-CG 4.41Å; I502-P510 HydrophobicContact CG2-CG 3.62Å; P510-W514 HydrophobicContact CB-CB 3.87Å; P510-W514 HydrophobicContact CB-CG 4.07Å; P510-W518 HydrophobicContact CB-CH2 4.28Å; P510-W518 HydrophobicContact CB-CZ3 4.06Å; P510-W518 HydrophobicContact CG-CH2 4.26Å; P510-W518 HydrophobicContact CG-CZ3 4.23Å
511	N	96.7	Very high	97.3	Very high	80 Å²	80	57.3 Å²	57.3	43%	0.428	26%	0.263	S	S	.	.			trans	-69.1	-170.5	-176.6	68.7	21.2	0	0	0	113	R509 Y513 W514 R515	R509-N511 PolarHBondContact O-N 2.89Å; N511-Y513 VanDerWaalsContact C-N 3.32Å; N511-Y513 PolarHBondContact O-N 3.28Å; N511-Y513 WeakPolarHBondContact OD1-CB 3.48Å; N511-Y513 PolarHBondContact OD1-N 2.93Å; N511-W514 PolarHBondContact OD1-N 2.86Å; N511-R515 PolarHBondContact O-N 3.48Å
512	W	97	Very high	97.3	Very high	187 Å²	187	57.3 Å²	57.3	71%	0.708	26%	0.263	S	S	*	.	H	α-helix	trans	-65.7	-30.7	-178.2	68.2	-94.6	0	0	0	113.5	R515 I516	W512-R515 WeakPolarHBondContact O-CB 3.37Å; W512-R515 PolarHBondContact O-N 3.1Å; W512-I516 HydrophobicContact CE3-CD1 3.69Å; W512-I516 HydrophobicContact CE3-CG1 4.46Å; W512-I516 HydrophobicContact CZ3-CD1 4.06Å; W512-I516 WeakPolarHBondContact O-CG1 3.5Å; W512-I516 PolarHBondContact O-N 3.32Å
513	Y	98.3	Very high	97.3	Very high	54 Å²	54	57.9 Å²	57.9	21%	0.212	27%	0.266	C	S	.	.	H	α-helix	trans	-63.5	-51.8	-179.7	154.4	-98.2	0	0	0	110.8	A104 N511 R515 I516 C517	A104-Y513 WeakPolarHBondContact O-CE2 3.49Å; A104-Y513 PolarHBondContact O-OH 3.39Å; N511-Y513 VanDerWaalsContact C-N 3.32Å; N511-Y513 PolarHBondContact O-N 3.28Å; N511-Y513 WeakPolarHBondContact OD1-CB 3.48Å; N511-Y513 PolarHBondContact OD1-N 2.93Å; Y513-R515 VanDerWaalsContact C-N 3.25Å; Y513-R515 PolarHBondContact O-N 3.02Å; Y513-I516 PolarHBondContact O-N 3.18Å; Y513-C517 WeakPolarHBondContact CE2-SG 3.47Å; Y513-C517 PolarHBondContact O-N 2.71Å; Y513-C517 PolarHBondContact O-SG 3.45Å
514	W	98.2	Very high	97.3	Very high	17 Å²	17	57.5 Å²	57.5	6%	0.064	27%	0.269	C	S	.	.	H	α-helix	trans	-58.6	-41.2	176.3	-58.9	111.8	0	0	0	111.6	L108 F112 V336 P510 N511 C517 W518	L108-W514 HydrophobicContact CD1-CH2 3.93Å; L108-W514 HydrophobicContact CD1-CZ3 4.46Å; L108-W514 HydrophobicContact CD2-CH2 3.96Å; L108-W514 HydrophobicContact CD2-CZ3 4.48Å; L108-W514 HydrophobicContact CG-CH2 3.6Å; L108-W514 HydrophobicContact CG-CZ3 3.85Å; F112-W514 HydrophobicContact CB-CE3 4.37Å; F112-W514 HydrophobicContact CB-CH2 3.92Å; F112-W514 HydrophobicContact CB-CZ3 3.72Å; F112-W514 AromaticContact CD1-CD2 3.67Å; F112-W514 HydrophobicContact CD1-CD2 3.67Å; F112-W514 AromaticContact CD1-CE2 3.83Å; F112-W514 AromaticContact CD1-CE3 3.61Å; F112-W514 HydrophobicContact CD1-CE3 3.61Å; F112-W514 HydrophobicContact CD1-CG 4.34Å; F112-W514 AromaticContact CD1-CH2 3.84Å; F112-W514 HydrophobicContact CD1-CH2 3.84Å; F112-W514 AromaticContact CD1-CZ2 3.94Å; F112-W514 HydrophobicContact CD1-CZ2 3.94Å; F112-W514 AromaticContact CD1-CZ3 3.69Å; F112-W514 HydrophobicContact CD1-CZ3 3.69Å; F112-W514 HydrophobicContact CE1-CD2 4.06Å; F112-W514 HydrophobicContact CE1-CE3 4.44Å; F112-W514 HydrophobicContact CE1-CG 4.33Å; F112-W514 HydrophobicContact CE1-CZ2 4.44Å; F112-W514 HydrophobicContact CG-CE3 4.47Å; F112-W514 HydrophobicContact CG-CH2 4.17Å; F112-W514 HydrophobicContact CG-CZ3 4.14Å; V336-W514 HydrophobicContact CG2-CH2 4.27Å; V336-W514 HydrophobicContact CG2-CZ2 4.23Å; P510-W514 HydrophobicContact CB-CB 3.87Å; P510-W514 HydrophobicContact CB-CG 4.07Å; N511-W514 PolarHBondContact OD1-N 2.86Å; W514-C517 PolarHBondContact O-N 3.1Å; W514-W518 HydrophobicContact CB-CD2 4.44Å; W514-W518 HydrophobicContact CB-CE3 4.12Å; W514-W518 HydrophobicContact CB-CH2 4.1Å; W514-W518 HydrophobicContact CB-CZ2 4.38Å; W514-W518 HydrophobicContact CB-CZ3 3.96Å; W514-W518 HydrophobicContact CE3-CZ2 4.21Å; W514-W518 WeakPolarHBondContact O-CB 3.27Å; W514-W518 PolarHBondContact O-N 3.38Å
515	R	98.1	Very high	97.3	Very high	132 Å²	132	57.4 Å²	57.4	50%	0.498	27%	0.268	S	S	.	.	H	α-helix	trans	-59.6	-49	178.6	-175.2	-170.4	176.6	-178.5	-2.5	111.9	L495 N511 W512 Y513 L519	L495-R515 HydrophobicContact CD2-CB 4.46Å; L495-R515 HydrophobicContact CD2-CG 3.69Å; N511-R515 PolarHBondContact O-N 3.48Å; W512-R515 WeakPolarHBondContact O-CB 3.37Å; W512-R515 PolarHBondContact O-N 3.1Å; Y513-R515 VanDerWaalsContact C-N 3.25Å; Y513-R515 PolarHBondContact O-N 3.02Å; R515-L519 WeakPolarHBondContact O-CB 3.42Å; R515-L519 PolarHBondContact O-N 2.89Å; R515-L519 VanDerWaalsContact O-N 3.09Å
516	I	98.2	Very high	97.2	Very high	69 Å²	69	57.4 Å²	57.4	35%	0.354	27%	0.268	S	S	.	.	H	α-helix	trans	-70.6	-37.9	-178.3	-64.3	179.6	0	0	0	110.7	W512 Y513 V520 F521	W512-I516 HydrophobicContact CE3-CD1 3.69Å; W512-I516 HydrophobicContact CE3-CG1 4.46Å; W512-I516 HydrophobicContact CZ3-CD1 4.06Å; W512-I516 WeakPolarHBondContact O-CG1 3.5Å; W512-I516 PolarHBondContact O-N 3.32Å; Y513-I516 PolarHBondContact O-N 3.18Å; I516-V520 WeakPolarHBondContact O-CB 3.07Å; I516-V520 PolarHBondContact O-N 3.23Å; I516-F521 HydrophobicContact CG2-CD2 3.69Å; I516-F521 HydrophobicContact CG2-CE2 3.49Å; I516-F521 VanDerWaalsContact CG2-CE2 3.49Å; I516-F521 PolarHBondContact O-N 3.33Å
517	C	98.5	Very high	97.2	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.014	29%	0.285	C	S	.	.	I	π-helix	trans	-61.4	-54.8	177.9	-66.7	0	0	0	0	111.6	P109 Y513 W514 L519 F521 T522	P109-C517 HydrophobicContact CB-CB 3.74Å; P109-C517 HydrophobicContact CG-CB 3.45Å; P109-C517 VanDerWaalsContact CG-CB 3.45Å; Y513-C517 WeakPolarHBondContact CE2-SG 3.47Å; Y513-C517 PolarHBondContact O-N 2.71Å; Y513-C517 PolarHBondContact O-SG 3.45Å; W514-C517 PolarHBondContact O-N 3.1Å; C517-L519 VanDerWaalsContact C-N 3.34Å; C517-L519 PolarHBondContact O-N 3.32Å; C517-F521 PolarHBondContact O-N 3.38Å; C517-T522 VanDerWaalsContact O-CB 3.28Å; C517-T522 WeakPolarHBondContact O-CB 3.41Å; C517-T522 PolarHBondContact O-N 3.08Å; C517-T522 PolarHBondContact O-OG1 3.38Å; C517-T522 VanDerWaalsContact O-OG1 3.09Å
518	W	98.5	Very high	97.2	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.281	C	S	.	.	I	π-helix	trans	-65	-36.5	-179	-63.8	-33	0	0	0	113.2	P109 F112 L113 T486 T490 L495 F498 R499 I502 P510 W514 P523	P109-W518 PolarHBondContact O-NE1 3.15Å; F112-W518 HydrophobicContact CB-CZ2 4.46Å; F112-W518 AromaticContact CD1-CH2 3.67Å; F112-W518 HydrophobicContact CD1-CH2 3.67Å; F112-W518 AromaticContact CD1-CZ2 3.46Å; F112-W518 HydrophobicContact CD1-CZ2 3.46Å; F112-W518 VanDerWaalsContact CD1-CZ2 3.46Å; F112-W518 AromaticContact CE1-CH2 3.64Å; F112-W518 HydrophobicContact CE1-CH2 3.64Å; F112-W518 AromaticContact CE1-CZ2 3.97Å; F112-W518 HydrophobicContact CE1-CZ2 3.97Å; F112-W518 HydrophobicContact CG-CZ2 4.17Å; L113-W518 HydrophobicContact CB-CZ2 4.07Å; L113-W518 HydrophobicContact CD1-CD2 4.45Å; L113-W518 HydrophobicContact CD1-CG 4.22Å; T486-W518 WeakPolarHBondContact CG2-O 3.41Å; T490-W518 HydrophobicContact CG2-CB 3.7Å; L495-W518 HydrophobicContact CD1-CE3 3.62Å; L495-W518 HydrophobicContact CD1-CZ3 4.23Å; F498-W518 HydrophobicContact CD1-CZ3 4.3Å; F498-W518 HydrophobicContact CE1-CH2 4.26Å; F498-W518 HydrophobicContact CE1-CZ3 4.37Å; R499-W518 HydrophobicContact CG-CZ3 4.48Å; I502-W518 HydrophobicContact CD1-CH2 3.72Å; I502-W518 HydrophobicContact CD1-CZ3 4.16Å; P510-W518 HydrophobicContact CB-CH2 4.28Å; P510-W518 HydrophobicContact CB-CZ3 4.06Å; P510-W518 HydrophobicContact CG-CH2 4.26Å; P510-W518 HydrophobicContact CG-CZ3 4.23Å; W514-W518 HydrophobicContact CB-CD2 4.44Å; W514-W518 HydrophobicContact CB-CE3 4.12Å; W514-W518 HydrophobicContact CB-CH2 4.1Å; W514-W518 HydrophobicContact CB-CZ2 4.38Å; W514-W518 HydrophobicContact CB-CZ3 3.96Å; W514-W518 HydrophobicContact CE3-CZ2 4.21Å; W514-W518 WeakPolarHBondContact O-CB 3.27Å; W514-W518 PolarHBondContact O-N 3.38Å; W518-P523 WeakPolarHBondContact O-CD 2.85Å
519	L	97.9	Very high	97	Very high	55 Å²	55	54.8 Å²	54.8	29%	0.288	26%	0.257	S	S	.	.	I	π-helix	trans	-76	-41.2	-179.2	-169	71.2	0	0	0	112.2	Y491 L495 R515 C517 P523	Y491-L519 HydrophobicContact CE1-CD1 3.75Å; Y491-L519 HydrophobicContact CE2-CD1 4.29Å; Y491-L519 WeakPolarHBondContact OH-CD1 3.41Å; Y491-L519 PolarHBondContact OH-O 3.26Å; L495-L519 HydrophobicContact CD2-CB 4.13Å; L495-L519 HydrophobicContact CD2-CD1 4.36Å; R515-L519 WeakPolarHBondContact O-CB 3.42Å; R515-L519 PolarHBondContact O-N 2.89Å; R515-L519 VanDerWaalsContact O-N 3.09Å; C517-L519 VanDerWaalsContact C-N 3.34Å; C517-L519 PolarHBondContact O-N 3.32Å; L519-P523 WeakPolarHBondContact O-CG 3.42Å
520	V	97.7	Very high	96.9	Very high	69 Å²	69	51.3 Å²	51.3	42%	0.418	25%	0.245	S	C	.	.	I	π-helix	trans	-121.2	-65.2	-167.1	-175.1	0	0	0	0	112	I516 P523 T524	I516-V520 WeakPolarHBondContact O-CB 3.07Å; I516-V520 PolarHBondContact O-N 3.23Å; V520-P523 WeakPolarHBondContact O-CD 3.47Å; V520-P523 WeakPolarHBondContact O-CG 3.31Å; V520-T524 WeakPolarHBondContact O-CB 3.14Å; V520-T524 PolarHBondContact O-N 3.43Å; V520-T524 VanDerWaalsContact O-N 3.12Å; V520-T524 PolarHBondContact O-OG1 3.39Å
521	F	97.8	Very high	96.7	Very high	89 Å²	89	55.1 Å²	55.1	39%	0.39	26%	0.264	S	S	.	.	I	π-helix	trans	-66.3	-52.5	-167.2	-70.6	-66.1	0	0	0	113.2	L105 I516 C517 T524 I525	L105-F521 HydrophobicContact CB-CB 4.34Å; L105-F521 HydrophobicContact CD1-CD1 4.49Å; L105-F521 HydrophobicContact CD2-CB 4.44Å; L105-F521 HydrophobicContact CD2-CD1 4.49Å; L105-F521 HydrophobicContact CD2-CD2 3.96Å; L105-F521 HydrophobicContact CD2-CE2 4.31Å; L105-F521 HydrophobicContact CD2-CG 4.07Å; I516-F521 HydrophobicContact CG2-CD2 3.69Å; I516-F521 HydrophobicContact CG2-CE2 3.49Å; I516-F521 VanDerWaalsContact CG2-CE2 3.49Å; I516-F521 PolarHBondContact O-N 3.33Å; C517-F521 PolarHBondContact O-N 3.38Å; F521-T524 PolarHBondContact O-N 2.99Å; F521-I525 HydrophobicContact CB-CD1 4.39Å; F521-I525 WeakPolarHBondContact O-CB 3.16Å; F521-I525 VanDerWaalsContact O-CG1 3.24Å; F521-I525 WeakPolarHBondContact O-CG1 3.46Å; F521-I525 PolarHBondContact O-N 3.26Å
522	T	97.6	Very high	96.3	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-56.5	-55.2	-178	-55.8	0	0	0	0	112.4	L105 L106 P109 L110 T486 C517 T524 I525 C526	L105-T522 PolarHBondContact O-OG1 2.9Å; L106-T522 HydrophobicContact CD1-CG2 4.2Å; P109-T522 WeakPolarHBondContact CB-OG1 3.36Å; L110-T522 HydrophobicContact CD1-CG2 4.21Å; L110-T522 HydrophobicContact CD2-CG2 3.57Å; L110-T522 HydrophobicContact CG-CG2 3.62Å; T486-T522 HydrophobicContact CG2-CG2 4.07Å; C517-T522 VanDerWaalsContact O-CB 3.28Å; C517-T522 WeakPolarHBondContact O-CB 3.41Å; C517-T522 PolarHBondContact O-N 3.08Å; C517-T522 PolarHBondContact O-OG1 3.38Å; C517-T522 VanDerWaalsContact O-OG1 3.09Å; T522-T524 VanDerWaalsContact C-N 3.33Å; T522-T524 PolarHBondContact O-N 3.49Å; T522-I525 PolarHBondContact O-N 3.14Å; T522-C526 PolarHBondContact O-N 3.44Å; T522-C526 PolarHBondContact O-SG 3.21Å; T522-C526 VanDerWaalsContact O-SG 3.32Å
523	P	97.3	Very high	95.8	Very high	12 Å²	12	45.7 Å²	45.7	8%	0.078	23%	0.232	C	C	.	.	H	α-helix	trans	-66.1	-34.7	179.6	26.1	-33.5	0	0	0	112.4	L483 T486 V487 W518 L519 V520 L527	L483-P523 HydrophobicContact CD1-CB 3.89Å; L483-P523 WeakPolarHBondContact CD1-O 3.23Å; T486-P523 HydrophobicContact CG2-CB 4.35Å; T486-P523 HydrophobicContact CG2-CG 4.35Å; V487-P523 HydrophobicContact CG2-CB 4.41Å; W518-P523 WeakPolarHBondContact O-CD 2.85Å; L519-P523 WeakPolarHBondContact O-CG 3.42Å; V520-P523 WeakPolarHBondContact O-CD 3.47Å; V520-P523 WeakPolarHBondContact O-CG 3.31Å; P523-L527 WeakPolarHBondContact O-CB 3.38Å; P523-L527 PolarHBondContact O-N 3.33Å
524	T	97.5	Very high	95.2	Very high	67 Å²	67	48.3 Å²	48.3	41%	0.411	25%	0.249	S	C	.	.	H	α-helix	trans	-66.1	-45.6	177.9	-56.7	0	0	0	0	111.4	V520 F521 T522 L527 L528	V520-T524 WeakPolarHBondContact O-CB 3.14Å; V520-T524 PolarHBondContact O-N 3.43Å; V520-T524 VanDerWaalsContact O-N 3.12Å; V520-T524 PolarHBondContact O-OG1 3.39Å; F521-T524 PolarHBondContact O-N 2.99Å; T522-T524 VanDerWaalsContact C-N 3.33Å; T522-T524 PolarHBondContact O-N 3.49Å; T524-L527 PolarHBondContact O-N 2.88Å; T524-L528 HydrophobicContact CG2-CD1 4.17Å; T524-L528 HydrophobicContact CG2-CG 4.45Å; T524-L528 VanDerWaalsContact O-CG 3.31Å; T524-L528 WeakPolarHBondContact O-CG 3.29Å; T524-L528 PolarHBondContact O-N 3.32Å
525	I	96.2	Very high	94.7	Very high	21 Å²	21	52.5 Å²	52.5	11%	0.108	28%	0.276	C	S	.	.	H	α-helix	trans	-63.5	-46	177.8	-67.5	165.8	0	0	0	110	M102 L105 L106 F521 T522 L527 L528 L529	M102-I525 HydrophobicContact SD-CD1 4.3Å; M102-I525 HydrophobicContact SD-CG2 4.02Å; L105-I525 HydrophobicContact CB-CD1 3.73Å; L105-I525 HydrophobicContact CD1-CD1 4.5Å; L106-I525 HydrophobicContact CB-CG2 4.42Å; L106-I525 HydrophobicContact CD1-CG2 4.23Å; L106-I525 HydrophobicContact CD2-CG2 4.01Å; L106-I525 HydrophobicContact CG-CG2 4.46Å; F521-I525 HydrophobicContact CB-CD1 4.39Å; F521-I525 WeakPolarHBondContact O-CB 3.16Å; F521-I525 VanDerWaalsContact O-CG1 3.24Å; F521-I525 WeakPolarHBondContact O-CG1 3.46Å; F521-I525 PolarHBondContact O-N 3.26Å; T522-I525 PolarHBondContact O-N 3.14Å; I525-L527 VanDerWaalsContact C-N 3.31Å; I525-L527 PolarHBondContact O-N 3.31Å; I525-L528 PolarHBondContact O-N 3.07Å; I525-L529 HydrophobicContact CG2-CD1 3.95Å; I525-L529 HydrophobicContact CG2-CG 4.31Å; I525-L529 VanDerWaalsContact O-CG 3.3Å; I525-L529 WeakPolarHBondContact O-CG 3.45Å; I525-L529 PolarHBondContact O-N 2.84Å
526	C	95.9	Very high	94	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-56.4	-45.1	175	-70.3	0	0	0	0	111.7	L106 L483 T522 L529 I530	L106-C526 VanDerWaalsContact CD1-SG 3.56Å; L483-C526 HydrophobicContact CB-CB 4.09Å; L483-C526 HydrophobicContact CD1-CB 4.35Å; T522-C526 PolarHBondContact O-N 3.44Å; T522-C526 PolarHBondContact O-SG 3.21Å; T522-C526 VanDerWaalsContact O-SG 3.32Å; C526-L529 PolarHBondContact O-N 3.09Å; C526-I530 WeakPolarHBondContact O-CD1 3.3Å; C526-I530 VanDerWaalsContact O-CG1 3.25Å; C526-I530 WeakPolarHBondContact O-CG1 3.22Å; C526-I530 PolarHBondContact O-N 3.05Å
527	L	96.1	Very high	92.6	Very high	84 Å²	84	57.9 Å²	57.9	44%	0.44	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-44.9	177.6	-179	63.5	0	0	0	112.2	L483 P523 T524 I525 L529 I530 I531	L483-L527 HydrophobicContact CD2-CD1 4.23Å; P523-L527 WeakPolarHBondContact O-CB 3.38Å; P523-L527 PolarHBondContact O-N 3.33Å; T524-L527 PolarHBondContact O-N 2.88Å; I525-L527 VanDerWaalsContact C-N 3.31Å; I525-L527 PolarHBondContact O-N 3.31Å; L527-L529 VanDerWaalsContact C-N 3.34Å; L527-L529 PolarHBondContact O-N 3.36Å; L527-I530 PolarHBondContact O-N 3Å; L527-I531 HydrophobicContact CD1-CD1 4.29Å; L527-I531 HydrophobicContact CG-CD1 4.06Å; L527-I531 WeakPolarHBondContact O-CG1 3.41Å; L527-I531 PolarHBondContact O-N 2.91Å
528	L	94.4	Very high	91.5	Very high	107 Å²	107	60 Å²	60	56%	0.56	31%	0.309	S	S	*	.	H	α-helix	trans	-63.4	-39.3	177.5	-70	174.9	0	0	0	112.1	T524 I525 I531 S532	T524-L528 HydrophobicContact CG2-CD1 4.17Å; T524-L528 HydrophobicContact CG2-CG 4.45Å; T524-L528 VanDerWaalsContact O-CG 3.31Å; T524-L528 WeakPolarHBondContact O-CG 3.29Å; T524-L528 PolarHBondContact O-N 3.32Å; I525-L528 PolarHBondContact O-N 3.07Å; L528-I531 PolarHBondContact O-N 2.91Å; L528-S532 WeakPolarHBondContact O-CB 3.43Å; L528-S532 PolarHBondContact O-N 3.34Å
529	L	92.5	Very high	90.3	Very high	13 Å²	13	66 Å²	66	7%	0.068	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-41.4	175.2	-67.6	171.5	0	0	0	111.7	L106 A301 A304 L479 I525 C526 L527 I531 S532 V533	L106-L529 HydrophobicContact CD2-CD1 4.18Å; A301-L529 HydrophobicContact CB-CD2 4.04Å; A304-L529 HydrophobicContact CB-CD1 3.65Å; A304-L529 HydrophobicContact CB-CD2 3.9Å; A304-L529 HydrophobicContact CB-CG 4.35Å; L479-L529 HydrophobicContact CD1-CB 3.66Å; L479-L529 HydrophobicContact CD2-CB 4.24Å; L479-L529 HydrophobicContact CD2-CD1 3.94Å; I525-L529 HydrophobicContact CG2-CD1 3.95Å; I525-L529 HydrophobicContact CG2-CG 4.31Å; I525-L529 VanDerWaalsContact O-CG 3.3Å; I525-L529 WeakPolarHBondContact O-CG 3.45Å; I525-L529 PolarHBondContact O-N 2.84Å; C526-L529 PolarHBondContact O-N 3.09Å; L527-L529 VanDerWaalsContact C-N 3.34Å; L527-L529 PolarHBondContact O-N 3.36Å; L529-I531 PolarHBondContact O-N 3.39Å; L529-S532 PolarHBondContact O-N 2.89Å; L529-V533 WeakPolarHBondContact O-CB 3.39Å; L529-V533 VanDerWaalsContact O-CG2 3.29Å; L529-V533 WeakPolarHBondContact O-CG2 3.14Å; L529-V533 PolarHBondContact O-N 3.14Å
530	I	92.8	Very high	89.5	Confident	14 Å²	14	63.6 Å²	63.6	7%	0.072	33%	0.325	C	S	.	.	H	α-helix	trans	-59.6	-48.1	174.4	-69	162	0	0	0	110.1	L479 I480 L483 C526 L527 S532 V533 L534	L479-I530 HydrophobicContact CB-CD1 4.14Å; L479-I530 HydrophobicContact CB-CG1 3.57Å; L479-I530 HydrophobicContact CD1-CG1 4.34Å; I480-I530 HydrophobicContact CG1-CD1 3.88Å; I480-I530 HydrophobicContact CG1-CG1 4.31Å; L483-I530 HydrophobicContact CB-CD1 4.15Å; L483-I530 HydrophobicContact CD2-CD1 3.8Å; C526-I530 WeakPolarHBondContact O-CD1 3.3Å; C526-I530 VanDerWaalsContact O-CG1 3.25Å; C526-I530 WeakPolarHBondContact O-CG1 3.22Å; C526-I530 PolarHBondContact O-N 3.05Å; L527-I530 PolarHBondContact O-N 3Å; I530-S532 VanDerWaalsContact C-N 3.33Å; I530-S532 PolarHBondContact O-N 3.17Å; I530-V533 PolarHBondContact O-N 3.1Å; I530-L534 HydrophobicContact CG2-CD1 3.63Å; I530-L534 HydrophobicContact CG2-CG 4.24Å; I530-L534 WeakPolarHBondContact O-CB 3.37Å; I530-L534 VanDerWaalsContact O-CG 3.23Å; I530-L534 WeakPolarHBondContact O-CG 3.24Å; I530-L534 PolarHBondContact O-N 3.1Å
531	I	92.6	Very high	88.2	Confident	85 Å²	85	66.6 Å²	66.6	44%	0.436	33%	0.332	S	S	.	.	H	α-helix	trans	-60.7	-44.5	178.1	-67.2	165.8	0	0	0	110.6	L527 L528 L529 L534 T535	L527-I531 HydrophobicContact CD1-CD1 4.29Å; L527-I531 HydrophobicContact CG-CD1 4.06Å; L527-I531 WeakPolarHBondContact O-CG1 3.41Å; L527-I531 PolarHBondContact O-N 2.91Å; L528-I531 PolarHBondContact O-N 2.91Å; L529-I531 PolarHBondContact O-N 3.39Å; I531-L534 PolarHBondContact O-N 2.86Å; I531-T535 VanDerWaalsContact O-CB 3.26Å; I531-T535 WeakPolarHBondContact O-CB 3.37Å; I531-T535 PolarHBondContact O-N 3.2Å; I531-T535 PolarHBondContact O-OG1 3.02Å
532	S	89.3	Confident	87	Confident	34 Å²	34	63.7 Å²	63.7	24%	0.238	32%	0.319	C	S	.	.	H	α-helix	trans	-59.1	-50.7	177.5	-177.5	0	0	0	0	111.7	L528 L529 I530 L534 T535 N536	L528-S532 WeakPolarHBondContact O-CB 3.43Å; L528-S532 PolarHBondContact O-N 3.34Å; L529-S532 PolarHBondContact O-N 2.89Å; I530-S532 VanDerWaalsContact C-N 3.33Å; I530-S532 PolarHBondContact O-N 3.17Å; S532-L534 VanDerWaalsContact C-N 3.34Å; S532-L534 PolarHBondContact O-N 3.32Å; S532-T535 PolarHBondContact O-N 3.23Å; S532-N536 WeakPolarHBondContact O-CB 3.3Å; S532-N536 VanDerWaalsContact O-CG 3.31Å; S532-N536 PolarHBondContact O-N 3.01Å; S532-N536 PolarHBondContact O-ND2 3.31Å; S532-N536 VanDerWaalsContact O-ND2 3.09Å; S532-N536 PolarHBondContact OG-ND2 3.09Å
533	V	86.1	Confident	85.9	Confident	36 Å²	36	68.1 Å²	68.1	22%	0.218	34%	0.341	C	S	.	.	H	α-helix	trans	-64.8	-36.1	-179.9	172.6	0	0	0	0	112.1	Y476 L479 L529 I530	Y476-V533 HydrophobicContact CD1-CG1 4.25Å; L479-V533 HydrophobicContact CD1-CG2 4.34Å; L529-V533 WeakPolarHBondContact O-CB 3.39Å; L529-V533 VanDerWaalsContact O-CG2 3.29Å; L529-V533 WeakPolarHBondContact O-CG2 3.14Å; L529-V533 PolarHBondContact O-N 3.14Å; I530-V533 PolarHBondContact O-N 3.1Å
534	L	86.7	Confident	84.9	Confident	108 Å²	108	74.4 Å²	74.4	57%	0.565	37%	0.374	S	S	*	.	H	α-helix	trans	-78	-26.9	178.7	-68.4	176.5	0	0	0	113.5	Y476 I530 I531 S532	Y476-L534 HydrophobicContact CD1-CD2 3.78Å; Y476-L534 HydrophobicContact CE1-CD2 4.19Å; Y476-L534 HydrophobicContact CG-CD2 4Å; I530-L534 HydrophobicContact CG2-CD1 3.63Å; I530-L534 HydrophobicContact CG2-CG 4.24Å; I530-L534 WeakPolarHBondContact O-CB 3.37Å; I530-L534 VanDerWaalsContact O-CG 3.23Å; I530-L534 WeakPolarHBondContact O-CG 3.24Å; I530-L534 PolarHBondContact O-N 3.1Å; I531-L534 PolarHBondContact O-N 2.86Å; S532-L534 VanDerWaalsContact C-N 3.34Å; S532-L534 PolarHBondContact O-N 3.32Å
535	T	87.6	Confident	84.3	Confident	106 Å²	106	72.9 Å²	72.9	65%	0.65	36%	0.361	S	S	*	.	H	α-helix	trans	-85.7	-38.3	-179.6	-53.8	0	0	0	0	111.5	I531 S532	I531-T535 VanDerWaalsContact O-CB 3.26Å; I531-T535 WeakPolarHBondContact O-CB 3.37Å; I531-T535 PolarHBondContact O-N 3.2Å; I531-T535 PolarHBondContact O-OG1 3.02Å; S532-T535 PolarHBondContact O-N 3.23Å
536	N	83	Confident	83.9	Confident	82 Å²	82	76.8 Å²	76.8	44%	0.439	39%	0.391	S	S	.	.	S	Bend	trans	-70.8	134.3	175.1	-69.1	-36.4	0	0	0	109.6	S532 I538	S532-N536 WeakPolarHBondContact O-CB 3.3Å; S532-N536 VanDerWaalsContact O-CG 3.31Å; S532-N536 PolarHBondContact O-N 3.01Å; S532-N536 PolarHBondContact O-ND2 3.31Å; S532-N536 VanDerWaalsContact O-ND2 3.09Å; S532-N536 PolarHBondContact OG-ND2 3.09Å; N536-I538 PolarHBondContact O-N 3.09Å
537	R	68.5	Low	83.7	Confident	232 Å²	232	77.3 Å²	77.3	88%	0.875	39%	0.393	S	S	*	.			trans	-61.8	130.7	174.4	-70.3	-167.1	-176.8	-144	2.4	108.6	E539	R537-E539 PolarHBondContact O-N 2.75Å
538	I	75.1	Confident	83.5	Confident	46 Å²	46	74.4 Å²	74.4	24%	0.236	38%	0.379	C	S	.	.			trans	-62.2	110.9	171.2	-60.8	153.1	0	0	0	107	N536 L540 Y552 Y555	N536-I538 PolarHBondContact O-N 3.09Å; I538-L540 HydrophobicContact CG2-CD2 4.29Å; I538-L540 HydrophobicContact CG2-CG 4.17Å; I538-Y552 HydrophobicContact CG2-CE1 4.5Å; I538-Y552 WeakPolarHBondContact O-CE1 3.2Å; I538-Y555 HydrophobicContact CD1-CD1 3.82Å; I538-Y555 HydrophobicContact CD1-CE1 3.33Å; I538-Y555 HydrophobicContact CG1-CE1 4.18Å; I538-Y555 HydrophobicContact CG2-CE2 4.48Å
539	E	73.2	Confident	83.3	Confident	126 Å²	126	74.6 Å²	74.6	59%	0.589	39%	0.387	S	S	*	.			trans	-99.5	87.9	175.4	-64.5	-162	145.3	0	0	108.9	R537 K541	R537-E539 PolarHBondContact O-N 2.75Å; E539-K541 VanDerWaalsContact C-N 3.33Å; E539-K541 HydrophobicContact CB-CD 4.18Å; E539-K541 HydrophobicContact CB-CG 4.21Å; E539-K541 PolarHBondContact O-N 3.11Å; E539-K541 IonicContact OE1-NZ 3.88Å; E539-K541 PolarHBondContact OE1-NZ 3.46Å; E539-K541 VanDerWaalsContact OE2-CE 3.32Å; E539-K541 WeakPolarHBondContact OE2-CE 3.35Å; E539-K541 IonicContact OE2-NZ 3.23Å; E539-K541 PolarHBondContact OE2-NZ 3.31Å
540	L	81.8	Confident	83.2	Confident	5 Å²	5	80.1 Å²	80.1	3%	0.026	41%	0.407	C	S	.	.			trans	-69.8	97.5	161.1	-60.4	177.2	0	0	0	106.6	I468 I538 F547 Y552	I468-L540 HydrophobicContact CG1-CD1 4.15Å; I538-L540 HydrophobicContact CG2-CD2 4.29Å; I538-L540 HydrophobicContact CG2-CG 4.17Å; L540-F547 HydrophobicContact CB-CB 4.11Å; L540-F547 HydrophobicContact CB-CD1 4.08Å; L540-F547 HydrophobicContact CB-CD2 3.56Å; L540-F547 HydrophobicContact CB-CE1 4.38Å; L540-F547 HydrophobicContact CB-CE2 3.89Å; L540-F547 HydrophobicContact CB-CG 3.65Å; L540-F547 HydrophobicContact CB-CZ 4.28Å; L540-F547 HydrophobicContact CD1-CB 4.39Å; L540-F547 HydrophobicContact CD1-CD1 4Å; L540-F547 HydrophobicContact CD1-CE1 4.49Å; L540-F547 HydrophobicContact CD1-CG 4.2Å; L540-F547 WeakPolarHBondContact O-CD2 3.26Å; L540-Y552 HydrophobicContact CB-CE1 4.49Å; L540-Y552 HydrophobicContact CD1-CD1 4.2Å; L540-Y552 HydrophobicContact CD1-CE1 4.08Å; L540-Y552 HydrophobicContact CG-CE1 4.14Å
541	K	70.7	Confident	83.2	Confident	131 Å²	131	79.5 Å²	79.5	57%	0.57	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.8	178	-75.8	179.3	-179.7	165.6	0	108.7	E539	E539-K541 VanDerWaalsContact C-N 3.33Å; E539-K541 HydrophobicContact CB-CD 4.18Å; E539-K541 HydrophobicContact CB-CG 4.21Å; E539-K541 PolarHBondContact O-N 3.11Å; E539-K541 IonicContact OE1-NZ 3.88Å; E539-K541 PolarHBondContact OE1-NZ 3.46Å; E539-K541 VanDerWaalsContact OE2-CE 3.32Å; E539-K541 WeakPolarHBondContact OE2-CE 3.35Å; E539-K541 IonicContact OE2-NZ 3.23Å; E539-K541 PolarHBondContact OE2-NZ 3.31Å
542	E	72.8	Confident	83.2	Confident	28 Å²	28	79 Å²	79	13%	0.131	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	120.3	166.8	-166.6	66.7	-131.7	0	0	108.9	Y463 N544 Y545 F547	Y463-E542 HydrophobicContact CD1-CG 4.28Å; Y463-E542 HydrophobicContact CE1-CG 3.49Å; Y463-E542 VanDerWaalsContact CE1-CG 3.49Å; Y463-E542 VanDerWaalsContact OH-CD 3.3Å; Y463-E542 PolarHBondContact OH-OE1 2.83Å; Y463-E542 PolarHBondContact OH-OE2 3.23Å; E542-N544 PolarHBondContact O-N 3.14Å; E542-N544 VanDerWaalsContact O-N 3.13Å; E542-Y545 WeakPolarHBondContact O-CB 3.3Å; E542-Y545 PolarHBondContact O-N 3.5Å; E542-F547 HydrophobicContact CB-CE2 4.24Å
543	M	74.3	Confident	83.3	Confident	93 Å²	93	81.6 Å²	81.6	46%	0.458	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	-120.1	-177.4	-58.3	177.8	-78.8	0	0	111.4	F209 L215	F209-M543 HydrophobicContact CD1-CE 4.35Å; F209-M543 HydrophobicContact CE1-CE 3.99Å; F209-M543 HydrophobicContact CE1-SD 4.29Å; F209-M543 HydrophobicContact CE2-SD 4.08Å; F209-M543 HydrophobicContact CZ-CE 4.21Å; F209-M543 HydrophobicContact CZ-SD 3.92Å; L215-M543 HydrophobicContact CD2-CE 3.57Å
544	N	76.2	Confident	83.6	Confident	144 Å²	144	82.3 Å²	82.3	77%	0.77	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	11.3	176.5	-73.1	-16.7	0	0	0	113.7	E542	E542-N544 PolarHBondContact O-N 3.14Å; E542-N544 VanDerWaalsContact O-N 3.13Å
545	Y	85.5	Confident	83.9	Confident	35 Å²	35	77.4 Å²	77.4	14%	0.137	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	132.4	-178.3	179.5	-107.5	0	0	0	111.8	P217 F219 E220 Y464 E542 F547 P548	P217-Y545 WeakPolarHBondContact O-CD2 3.38Å; F219-Y545 HydrophobicContact CB-CE1 4.39Å; F219-Y545 WeakPolarHBondContact CB-OH 3.07Å; F219-Y545 PolarHBondContact N-OH 3Å; E220-Y545 PolarHBondContact OE2-OH 3.32Å; Y464-Y545 AromaticContact CD1-CD1 3.69Å; Y464-Y545 HydrophobicContact CD1-CD1 3.69Å; Y464-Y545 AromaticContact CD1-CE1 3.79Å; Y464-Y545 HydrophobicContact CD1-CE1 3.79Å; Y464-Y545 AromaticContact CE1-CD1 3.31Å; Y464-Y545 HydrophobicContact CE1-CD1 3.31Å; Y464-Y545 HydrophobicContact CE1-CD2 4.45Å; Y464-Y545 AromaticContact CE1-CE1 3.72Å; Y464-Y545 HydrophobicContact CE1-CE1 3.72Å; Y464-Y545 AromaticContact CE1-CG 3.71Å; Y464-Y545 HydrophobicContact CE1-CG 3.71Å; Y464-Y545 HydrophobicContact CG-CE1 4.39Å; E542-Y545 WeakPolarHBondContact O-CB 3.3Å; E542-Y545 PolarHBondContact O-N 3.5Å; Y545-F547 AromaticContact CD1-CD2 3.79Å; Y545-F547 HydrophobicContact CD1-CD2 3.79Å; Y545-F547 AromaticContact CD1-CE2 3.94Å; Y545-F547 HydrophobicContact CD1-CE2 3.94Å; Y545-F547 HydrophobicContact CD1-CG 4.22Å; Y545-F547 HydrophobicContact CD1-CZ 4.47Å; Y545-F547 HydrophobicContact CE1-CB 4.44Å; Y545-F547 HydrophobicContact CE1-CD1 4.19Å; Y545-F547 HydrophobicContact CE1-CD2 4.01Å; Y545-F547 HydrophobicContact CE1-CE2 4.34Å; Y545-F547 AromaticContact CE1-CG 3.95Å; Y545-F547 HydrophobicContact CE1-CG 3.95Å; Y545-P548 WeakPolarHBondContact OH-CD 3.44Å; Y545-P548 WeakPolarHBondContact OH-CG 3.22Å
546	S	87.3	Confident	84.2	Confident	104 Å²	104	76.3 Å²	76.3	73%	0.727	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	117	172.3	-66.2	0	0	0	0	109.8
547	F	90.9	Very high	84.6	Confident	11 Å²	11	78.1 Å²	78.1	5%	0.048	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-64.7	134.3	-179.3	-81.7	-105.3	0	0	0	111.8	Y464 T467 I468 L540 E542 Y545 T551 Y552	Y464-F547 HydrophobicContact CD1-CE1 4.11Å; Y464-F547 HydrophobicContact CD1-CE2 4.31Å; Y464-F547 AromaticContact CD1-CZ 3.73Å; Y464-F547 HydrophobicContact CD1-CZ 3.73Å; Y464-F547 HydrophobicContact CG-CE1 4.42Å; Y464-F547 HydrophobicContact CG-CZ 4.43Å; T467-F547 HydrophobicContact CG2-CZ 4.14Å; I468-F547 HydrophobicContact CD1-CE1 4.36Å; I468-F547 HydrophobicContact CG1-CE1 4.19Å; L540-F547 HydrophobicContact CB-CB 4.11Å; L540-F547 HydrophobicContact CB-CD1 4.08Å; L540-F547 HydrophobicContact CB-CD2 3.56Å; L540-F547 HydrophobicContact CB-CE1 4.38Å; L540-F547 HydrophobicContact CB-CE2 3.89Å; L540-F547 HydrophobicContact CB-CG 3.65Å; L540-F547 HydrophobicContact CB-CZ 4.28Å; L540-F547 HydrophobicContact CD1-CB 4.39Å; L540-F547 HydrophobicContact CD1-CD1 4Å; L540-F547 HydrophobicContact CD1-CE1 4.49Å; L540-F547 HydrophobicContact CD1-CG 4.2Å; L540-F547 WeakPolarHBondContact O-CD2 3.26Å; E542-F547 HydrophobicContact CB-CE2 4.24Å; Y545-F547 AromaticContact CD1-CD2 3.79Å; Y545-F547 HydrophobicContact CD1-CD2 3.79Å; Y545-F547 AromaticContact CD1-CE2 3.94Å; Y545-F547 HydrophobicContact CD1-CE2 3.94Å; Y545-F547 HydrophobicContact CD1-CG 4.22Å; Y545-F547 HydrophobicContact CD1-CZ 4.47Å; Y545-F547 HydrophobicContact CE1-CB 4.44Å; Y545-F547 HydrophobicContact CE1-CD1 4.19Å; Y545-F547 HydrophobicContact CE1-CD2 4.01Å; Y545-F547 HydrophobicContact CE1-CE2 4.34Å; Y545-F547 AromaticContact CE1-CG 3.95Å; Y545-F547 HydrophobicContact CE1-CG 3.95Å; F547-T551 WeakPolarHBondContact CB-OG1 3.39Å; F547-T551 HydrophobicContact CD1-CG2 4.22Å; F547-Y552 HydrophobicContact CB-CE2 4.3Å
548	P	91.1	Very high	85.7	Confident	23 Å²	23	68.2 Å²	68.2	15%	0.149	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-59.8	147.4	176	-26.6	32.2	0	0	0	111.8	E220 Y545 W550 T551	E220-P548 WeakPolarHBondContact OE2-CG 3.15Å; Y545-P548 WeakPolarHBondContact OH-CD 3.44Å; Y545-P548 WeakPolarHBondContact OH-CG 3.22Å; P548-W550 VanDerWaalsContact CB-CD1 3.48Å; P548-W550 HydrophobicContact CB-CG 4.34Å; P548-W550 VanDerWaalsContact CB-NE1 3.28Å; P548-W550 PolarHBondContact O-N 3.37Å; P548-T551 HydrophobicContact CB-CG2 4.23Å; P548-T551 HydrophobicContact CG-CG2 4.34Å; P548-T551 WeakPolarHBondContact O-CB 3.23Å; P548-T551 WeakPolarHBondContact O-CG2 3.44Å; P548-T551 PolarHBondContact O-N 2.84Å; P548-T551 PolarHBondContact O-OG1 2.88Å
549	P	90.5	Very high	86.6	Confident	110 Å²	110	66 Å²	66	71%	0.714	34%	0.336	S	S	*	.	H	α-helix	trans	-55.5	-30.9	-176.9	-29.4	36.1	0	0	0	115.3	T551 Y552	P549-T551 VanDerWaalsContact C-N 3.26Å; P549-T551 PolarHBondContact O-N 3.16Å; P549-Y552 PolarHBondContact O-N 3.15Å
550	W	91.7	Very high	87.3	Confident	130 Å²	130	61.6 Å²	61.6	49%	0.492	32%	0.322	S	S	.	.	H	α-helix	trans	-70.3	-20.6	179.9	66.1	-98.6	0	0	0	113.2	F219 P548 Y552 V553 L554	F219-W550 AromaticContact CD1-CH2 3.18Å; F219-W550 HydrophobicContact CD1-CH2 3.18Å; F219-W550 AromaticContact CD1-CZ2 3.37Å; F219-W550 HydrophobicContact CD1-CZ2 3.37Å; F219-W550 AromaticContact CD1-CZ3 3.97Å; F219-W550 HydrophobicContact CD1-CZ3 3.97Å; F219-W550 HydrophobicContact CE1-CE3 4.41Å; F219-W550 AromaticContact CE1-CH2 2.94Å; F219-W550 HydrophobicContact CE1-CH2 2.94Å; F219-W550 AromaticContact CE1-CZ2 3.69Å; F219-W550 HydrophobicContact CE1-CZ2 3.69Å; F219-W550 AromaticContact CE1-CZ3 3.37Å; F219-W550 HydrophobicContact CE1-CZ3 3.37Å; F219-W550 HydrophobicContact CG-CH2 4.32Å; F219-W550 HydrophobicContact CG-CZ2 4.4Å; F219-W550 AromaticContact CZ-CH2 3.92Å; F219-W550 HydrophobicContact CZ-CH2 3.92Å; F219-W550 HydrophobicContact CZ-CZ3 4.32Å; P548-W550 VanDerWaalsContact CB-CD1 3.48Å; P548-W550 HydrophobicContact CB-CG 4.34Å; P548-W550 VanDerWaalsContact CB-NE1 3.28Å; P548-W550 PolarHBondContact O-N 3.37Å; W550-Y552 VanDerWaalsContact C-N 3.28Å; W550-Y552 PolarHBondContact O-N 3.06Å; W550-V553 WeakPolarHBondContact O-CB 3.47Å; W550-V553 PolarHBondContact O-N 2.97Å; W550-V553 VanDerWaalsContact O-N 3.12Å; W550-L554 HydrophobicContact CZ3-CD2 4.46Å; W550-L554 PolarHBondContact O-N 3.38Å; W550-L554 VanDerWaalsContact O-N 3.08Å
551	T	93.1	Very high	87.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-69	-30.3	176.7	67.8	0	0	0	0	111.8	F219 I468 F547 P548 P549 V553 L554 Y555	F219-T551 HydrophobicContact CD1-CG2 3.36Å; F219-T551 HydrophobicContact CE1-CG2 3.67Å; F219-T551 HydrophobicContact CG-CG2 4.45Å; I468-T551 HydrophobicContact CD1-CG2 4.46Å; F547-T551 WeakPolarHBondContact CB-OG1 3.39Å; F547-T551 HydrophobicContact CD1-CG2 4.22Å; P548-T551 HydrophobicContact CB-CG2 4.23Å; P548-T551 HydrophobicContact CG-CG2 4.34Å; P548-T551 WeakPolarHBondContact O-CB 3.23Å; P548-T551 WeakPolarHBondContact O-CG2 3.44Å; P548-T551 PolarHBondContact O-N 2.84Å; P548-T551 PolarHBondContact O-OG1 2.88Å; P549-T551 VanDerWaalsContact C-N 3.26Å; P549-T551 PolarHBondContact O-N 3.16Å; T551-V553 VanDerWaalsContact C-N 3.31Å; T551-L554 WeakPolarHBondContact O-CB 3.49Å; T551-L554 PolarHBondContact O-N 3.1Å; T551-Y555 PolarHBondContact O-N 3.41Å
552	Y	91.7	Very high	88.7	Confident	76 Å²	76	56.1 Å²	56.1	30%	0.298	30%	0.304	S	S	.	.	H	α-helix	trans	-66.3	-34.5	171.1	-63.3	-86.9	0	0	0	111.7	I538 L540 F547 P549 W550 Y555 H556	I538-Y552 HydrophobicContact CG2-CE1 4.5Å; I538-Y552 WeakPolarHBondContact O-CE1 3.2Å; L540-Y552 HydrophobicContact CB-CE1 4.49Å; L540-Y552 HydrophobicContact CD1-CD1 4.2Å; L540-Y552 HydrophobicContact CD1-CE1 4.08Å; L540-Y552 HydrophobicContact CG-CE1 4.14Å; F547-Y552 HydrophobicContact CB-CE2 4.3Å; P549-Y552 PolarHBondContact O-N 3.15Å; W550-Y552 VanDerWaalsContact C-N 3.28Å; W550-Y552 PolarHBondContact O-N 3.06Å; Y552-Y555 PolarHBondContact O-N 3.46Å; Y552-H556 WeakPolarHBondContact O-CB 3.38Å; Y552-H556 PolarHBondContact O-CD2 3.17Å; Y552-H556 PolarHBondContact O-N 3.15Å
553	V	92.5	Very high	89.7	Confident	88 Å²	88	56.4 Å²	56.4	53%	0.533	31%	0.307	S	S	.	.	H	α-helix	trans	-64.5	-43.8	171.8	-177.7	0	0	0	0	110	W550 T551 H556 L557	W550-V553 WeakPolarHBondContact O-CB 3.47Å; W550-V553 PolarHBondContact O-N 2.97Å; W550-V553 VanDerWaalsContact O-N 3.12Å; T551-V553 VanDerWaalsContact C-N 3.31Å; V553-H556 PolarHBondContact O-N 3.49Å; V553-L557 HydrophobicContact CG1-CD1 4.07Å; V553-L557 HydrophobicContact CG1-CG 4.34Å; V553-L557 WeakPolarHBondContact O-CB 3.39Å; V553-L557 VanDerWaalsContact O-CG 3.29Å; V553-L557 WeakPolarHBondContact O-CG 3.33Å; V553-L557 PolarHBondContact O-N 2.99Å
554	L	92.4	Very high	90.7	Very high	50 Å²	50	57.4 Å²	57.4	26%	0.262	31%	0.314	S	S	.	.	H	α-helix	trans	-60.6	-46.3	175.5	178.5	61.1	0	0	0	112.2	F219 L465 I468 W550 T551 H556 L557 L558	F219-L554 HydrophobicContact CE1-CD2 4.44Å; F219-L554 HydrophobicContact CZ-CD2 4.34Å; L465-L554 HydrophobicContact CD1-CD2 4Å; I468-L554 HydrophobicContact CD1-CD2 4.23Å; W550-L554 HydrophobicContact CZ3-CD2 4.46Å; W550-L554 PolarHBondContact O-N 3.38Å; W550-L554 VanDerWaalsContact O-N 3.08Å; T551-L554 WeakPolarHBondContact O-CB 3.49Å; T551-L554 PolarHBondContact O-N 3.1Å; L554-H556 PolarHBondContact O-N 2.66Å; L554-L557 PolarHBondContact O-N 2.99Å; L554-L558 HydrophobicContact CD1-CD1 4.35Å; L554-L558 HydrophobicContact CD1-CG 4.41Å; L554-L558 HydrophobicContact CG-CD1 4.32Å; L554-L558 WeakPolarHBondContact O-CG 3.5Å; L554-L558 PolarHBondContact O-N 3.43Å
555	Y	92.8	Very high	91.6	Very high	5 Å²	5	53.5 Å²	53.5	2%	0.02	29%	0.292	C	S	.	.	H	α-helix	trans	-53.3	-52.5	172.7	171.2	-87.5	0	0	0	111	V472 Y476 I538 T551 Y552 L557 L558 S559	V472-Y555 HydrophobicContact CB-CE2 4.45Å; V472-Y555 HydrophobicContact CG2-CD2 3.54Å; V472-Y555 HydrophobicContact CG2-CE2 3.81Å; V472-Y555 HydrophobicContact CG2-CG 4.23Å; Y476-Y555 HydrophobicContact CE1-CE1 4.06Å; I538-Y555 HydrophobicContact CD1-CD1 3.82Å; I538-Y555 HydrophobicContact CD1-CE1 3.33Å; I538-Y555 HydrophobicContact CG1-CE1 4.18Å; I538-Y555 HydrophobicContact CG2-CE2 4.48Å; T551-Y555 PolarHBondContact O-N 3.41Å; Y552-Y555 PolarHBondContact O-N 3.46Å; Y555-L557 VanDerWaalsContact C-N 3.34Å; Y555-L557 PolarHBondContact O-N 2.86Å; Y555-L558 PolarHBondContact O-N 3.41Å; Y555-S559 PolarHBondContact O-N 2.86Å; Y555-S559 PolarHBondContact O-OG 2.85Å
556	H	92.1	Very high	92.1	Very high	84 Å²	84	52.5 Å²	52.5	39%	0.389	29%	0.289	S	S	.	.	H	α-helix	trans	-65.5	-34.6	-179.5	-76.2	-55.7	0	0	0	112.7	Y552 V553 L554 A560	Y552-H556 WeakPolarHBondContact O-CB 3.38Å; Y552-H556 PolarHBondContact O-CD2 3.17Å; Y552-H556 PolarHBondContact O-N 3.15Å; V553-H556 PolarHBondContact O-N 3.49Å; L554-H556 PolarHBondContact O-N 2.66Å; H556-A560 WeakPolarHBondContact O-CA 3.35Å; H556-A560 WeakPolarHBondContact O-CB 3.34Å; H556-A560 PolarHBondContact O-N 3.45Å
557	L	92.2	Very high	92.5	Very high	119 Å²	119	51 Å²	51	62%	0.623	28%	0.275	S	S	*	.	H	α-helix	trans	-64	-44.4	175.1	-76.3	170.3	0	0	0	111.6	V553 L554 Y555 G561	V553-L557 HydrophobicContact CG1-CD1 4.07Å; V553-L557 HydrophobicContact CG1-CG 4.34Å; V553-L557 WeakPolarHBondContact O-CB 3.39Å; V553-L557 VanDerWaalsContact O-CG 3.29Å; V553-L557 WeakPolarHBondContact O-CG 3.33Å; V553-L557 PolarHBondContact O-N 2.99Å; L554-L557 PolarHBondContact O-N 2.99Å; Y555-L557 VanDerWaalsContact C-N 3.34Å; Y555-L557 PolarHBondContact O-N 2.86Å; L557-G561 PolarHBondContact O-N 3.15Å
558	L	92.6	Very high	92.7	Very high	24 Å²	24	52 Å²	52	13%	0.126	29%	0.29	C	S	.	.	H	α-helix	trans	-64.4	-47.1	177	-70.1	169.9	0	0	0	111.5	L148 I468 Y469 V472 L554 Y555	L148-L558 HydrophobicContact CD2-CD2 4.27Å; I468-L558 HydrophobicContact CG2-CD1 4.15Å; Y469-L558 HydrophobicContact CD2-CD1 4Å; Y469-L558 HydrophobicContact CE2-CD1 3.69Å; V472-L558 HydrophobicContact CG1-CB 4.09Å; V472-L558 HydrophobicContact CG2-CB 3.84Å; V472-L558 HydrophobicContact CG2-CD1 4.25Å; L554-L558 HydrophobicContact CD1-CD1 4.35Å; L554-L558 HydrophobicContact CD1-CG 4.41Å; L554-L558 HydrophobicContact CG-CD1 4.32Å; L554-L558 WeakPolarHBondContact O-CG 3.5Å; L554-L558 PolarHBondContact O-N 3.43Å; Y555-L558 PolarHBondContact O-N 3.41Å
559	S	92.4	Very high	92.8	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-69.1	-42.9	178.3	-62.5	0	0	0	0	113	Y476 Y555 G561 T562	Y476-S559 VanDerWaalsContact CZ-CB 3.43Å; Y476-S559 WeakPolarHBondContact OH-CB 3.34Å; Y555-S559 PolarHBondContact O-N 2.86Å; Y555-S559 PolarHBondContact O-OG 2.85Å; S559-G561 VanDerWaalsContact C-N 3.32Å; S559-G561 PolarHBondContact O-N 3.19Å; S559-T562 WeakPolarHBondContact O-CB 3.34Å; S559-T562 PolarHBondContact O-N 3.09Å
560	A	89	Confident	93	Very high	34 Å²	34	50.7 Å²	50.7	28%	0.281	27%	0.269	S	S	.	.	H	α-helix	trans	-69	-30.6	179.8	0	0	0	0	0	111.5	H556 T562 V563 L564	H556-A560 WeakPolarHBondContact O-CA 3.35Å; H556-A560 WeakPolarHBondContact O-CB 3.34Å; H556-A560 PolarHBondContact O-N 3.45Å; A560-T562 VanDerWaalsContact C-N 3.26Å; A560-T562 PolarHBondContact O-N 3.36Å; A560-V563 PolarHBondContact O-N 2.97Å; A560-V563 VanDerWaalsContact O-N 3.08Å; A560-L564 HydrophobicContact CB-CD1 4.49Å; A560-L564 VanDerWaalsContact O-CB 3.27Å; A560-L564 WeakPolarHBondContact O-CB 3.25Å; A560-L564 WeakPolarHBondContact O-CG 3.35Å; A560-L564 PolarHBondContact O-N 3.39Å
561	G	89.6	Confident	93	Very high	21 Å²	21	48.8 Å²	48.8	22%	0.216	27%	0.268	C	S	.	.	H	α-helix	trans	-51.7	-45.6	172.6	0	0	0	0	0	112.3	L557 S559 L564 L565	L557-G561 PolarHBondContact O-N 3.15Å; S559-G561 VanDerWaalsContact C-N 3.32Å; S559-G561 PolarHBondContact O-N 3.19Å; G561-L564 PolarHBondContact O-N 3.08Å; G561-L565 WeakPolarHBondContact O-CG 3.42Å; G561-L565 PolarHBondContact O-N 3.49Å; G561-L565 VanDerWaalsContact O-N 3.1Å
562	T	91.9	Very high	93	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-46.2	175.2	-54.1	0	0	0	0	112.4	A141 F144 L145 A477 V481 S559 A560 L565	A141-T562 HydrophobicContact CB-CG2 3.77Å; F144-T562 WeakPolarHBondContact CD1-OG1 3.28Å; L145-T562 HydrophobicContact CD1-CG2 3.79Å; L145-T562 HydrophobicContact CD2-CG2 3.95Å; L145-T562 HydrophobicContact CG-CG2 3.7Å; A477-T562 HydrophobicContact CB-CG2 4.25Å; V481-T562 HydrophobicContact CG2-CG2 4.02Å; S559-T562 WeakPolarHBondContact O-CB 3.34Å; S559-T562 PolarHBondContact O-N 3.09Å; A560-T562 VanDerWaalsContact C-N 3.26Å; A560-T562 PolarHBondContact O-N 3.36Å; T562-L565 PolarHBondContact O-N 2.91Å
563	V	93.4	Very high	92.8	Very high	34 Å²	34	53 Å²	53	21%	0.206	29%	0.285	C	S	.	.	H	α-helix	trans	-69.1	-38.1	-179	-178.4	0	0	0	0	111.4	Y476 I480 A560 L565 I566 V567	Y476-V563 HydrophobicContact CD2-CG2 4.49Å; Y476-V563 HydrophobicContact CE2-CG2 4.15Å; I480-V563 HydrophobicContact CD1-CG1 4.5Å; I480-V563 HydrophobicContact CD1-CG2 3.63Å; A560-V563 PolarHBondContact O-N 2.97Å; A560-V563 VanDerWaalsContact O-N 3.08Å; V563-L565 VanDerWaalsContact C-N 3.29Å; V563-L565 PolarHBondContact O-N 2.93Å; V563-I566 WeakPolarHBondContact O-CB 3.39Å; V563-I566 PolarHBondContact O-N 3.14Å; V563-I566 VanDerWaalsContact O-N 3.11Å; V563-V567 HydrophobicContact CG1-CG2 4.18Å; V563-V567 PolarHBondContact O-N 2.97Å
564	L	95	Very high	92.5	Very high	113 Å²	113	52.2 Å²	52.2	59%	0.592	27%	0.273	S	S	*	.	H	α-helix	trans	-64.6	-32.2	177.1	-74.2	170.9	0	0	0	111.8	A560 G561 I566 G568	A560-L564 HydrophobicContact CB-CD1 4.49Å; A560-L564 VanDerWaalsContact O-CB 3.27Å; A560-L564 WeakPolarHBondContact O-CB 3.25Å; A560-L564 WeakPolarHBondContact O-CG 3.35Å; A560-L564 PolarHBondContact O-N 3.39Å; G561-L564 PolarHBondContact O-N 3.08Å; L564-I566 VanDerWaalsContact C-N 3.29Å; L564-I566 PolarHBondContact O-N 3.19Å; L564-G568 WeakPolarHBondContact O-CA 3.49Å; L564-G568 PolarHBondContact O-N 3.03Å
565	L	96.2	Very high	92.3	Very high	62 Å²	62	54.2 Å²	54.2	33%	0.325	29%	0.29	S	S	.	.	H	α-helix	trans	-64	-35.4	172.6	-72	169.1	0	0	0	112	G137 A141 F144 G561 T562 V563 W569	G137-L565 VanDerWaalsContact CA-O 3.23Å; G137-L565 WeakPolarHBondContact CA-O 3.48Å; A141-L565 HydrophobicContact CB-CB 4.3Å; F144-L565 HydrophobicContact CB-CD1 3.64Å; F144-L565 HydrophobicContact CD1-CD1 4.15Å; F144-L565 HydrophobicContact CG-CD1 3.86Å; G561-L565 WeakPolarHBondContact O-CG 3.42Å; G561-L565 PolarHBondContact O-N 3.49Å; G561-L565 VanDerWaalsContact O-N 3.1Å; T562-L565 PolarHBondContact O-N 2.91Å; V563-L565 VanDerWaalsContact C-N 3.29Å; V563-L565 PolarHBondContact O-N 2.93Å; L565-W569 WeakPolarHBondContact O-CB 3.34Å; L565-W569 PolarHBondContact O-N 3.16Å
566	I	96.1	Very high	91.8	Very high	14 Å²	14	57 Å²	57	7%	0.072	31%	0.31	C	S	.	.	H	α-helix	trans	-73.4	-58.5	177	-55.4	176.4	0	0	0	110.3	I138 A141 I480 V481 V563 L564 F570	I138-I566 HydrophobicContact CG1-CD1 4.46Å; I138-I566 HydrophobicContact CG1-CG1 4.36Å; I138-I566 HydrophobicContact CG1-CG2 3.99Å; A141-I566 HydrophobicContact CB-CD1 4.1Å; A141-I566 HydrophobicContact CB-CG1 3.73Å; I480-I566 HydrophobicContact CG2-CD1 4.07Å; V481-I566 HydrophobicContact CG2-CD1 4.05Å; V563-I566 WeakPolarHBondContact O-CB 3.39Å; V563-I566 PolarHBondContact O-N 3.14Å; V563-I566 VanDerWaalsContact O-N 3.11Å; L564-I566 VanDerWaalsContact C-N 3.29Å; L564-I566 PolarHBondContact O-N 3.19Å; I566-F570 WeakPolarHBondContact O-CB 3.14Å; I566-F570 PolarHBondContact O-N 3.47Å
567	V	95.2	Very high	91.1	Very high	72 Å²	72	56.2 Å²	56.2	44%	0.436	31%	0.306	S	S	.	.	H	α-helix	trans	-69.8	-43.5	-174.1	177.6	0	0	0	0	111.2	V563 F570 I571	V563-V567 HydrophobicContact CG1-CG2 4.18Å; V563-V567 PolarHBondContact O-N 2.97Å; V567-F570 WeakPolarHBondContact O-CB 3.47Å; V567-F570 PolarHBondContact O-N 3.2Å; V567-I571 HydrophobicContact CG1-CD1 3.71Å; V567-I571 HydrophobicContact CG1-CG1 4.33Å; V567-I571 VanDerWaalsContact O-CG1 3.3Å; V567-I571 WeakPolarHBondContact O-CG1 3.27Å; V567-I571 PolarHBondContact O-N 3.12Å
568	G	94.9	Very high	90.1	Very high	34 Å²	34	51.5 Å²	51.5	35%	0.351	29%	0.287	S	S	.	.	H	α-helix	trans	-64.1	-40.5	178.9	0	0	0	0	0	112.4	L564 Y572	L564-G568 WeakPolarHBondContact O-CA 3.49Å; L564-G568 PolarHBondContact O-N 3.03Å; G568-Y572 WeakPolarHBondContact O-CB 3.39Å; G568-Y572 PolarHBondContact O-N 3.39Å
569	W	94.5	Very high	89.4	Confident	45 Å²	45	50.9 Å²	50.9	17%	0.17	29%	0.287	C	S	.	.	H	α-helix	trans	-64.9	-44.6	173	-178.2	-85.8	0	0	0	112	P133 K136 G137 Y140 L565 I571 Y572 K573	P133-W569 PolarHBondContact O-NE1 3.45Å; P133-W569 VanDerWaalsContact O-NE1 3.08Å; K136-W569 HydrophobicContact CB-CZ2 4.11Å; K136-W569 HydrophobicContact CD-CZ2 4.04Å; K136-W569 HydrophobicContact CG-CZ2 4.21Å; G137-W569 VanDerWaalsContact N-CD1 3.28Å; Y140-W569 HydrophobicContact CD2-CD2 4.45Å; Y140-W569 HydrophobicContact CD2-CE3 4.13Å; Y140-W569 HydrophobicContact CD2-CZ3 4.39Å; Y140-W569 HydrophobicContact CE2-CD2 4.17Å; Y140-W569 AromaticContact CE2-CE3 3.71Å; Y140-W569 HydrophobicContact CE2-CE3 3.71Å; Y140-W569 AromaticContact CE2-CH2 3.85Å; Y140-W569 HydrophobicContact CE2-CH2 3.85Å; Y140-W569 HydrophobicContact CE2-CZ2 4.3Å; Y140-W569 AromaticContact CE2-CZ3 3.54Å; Y140-W569 HydrophobicContact CE2-CZ3 3.54Å; L565-W569 WeakPolarHBondContact O-CB 3.34Å; L565-W569 PolarHBondContact O-N 3.16Å; W569-I571 PolarHBondContact O-N 3.39Å; W569-Y572 PolarHBondContact O-N 3.46Å; W569-K573 HydrophobicContact CD2-CG 4.42Å; W569-K573 HydrophobicContact CZ2-CD 4.4Å; W569-K573 HydrophobicContact CZ2-CG 4.06Å; W569-K573 WeakPolarHBondContact O-CB 3.13Å; W569-K573 PolarHBondContact O-N 3.27Å
570	F	93.8	Very high	88.5	Confident	60 Å²	60	58.8 Å²	58.8	26%	0.263	32%	0.321	S	S	.	.	H	α-helix	trans	-56.9	-50.7	176.8	-178.1	-82.7	0	0	0	110.8	L134 F135 I566 V567 K573 Y574 L583	L134-F570 HydrophobicContact CB-CD2 4.05Å; L134-F570 HydrophobicContact CB-CE2 4.13Å; L134-F570 HydrophobicContact CD1-CE2 4.19Å; L134-F570 HydrophobicContact CD2-CD2 4.18Å; L134-F570 HydrophobicContact CD2-CE2 4.19Å; L134-F570 HydrophobicContact CG-CE2 4.39Å; F135-F570 HydrophobicContact CD1-CD2 4.33Å; F135-F570 AromaticContact CE1-CD2 3.95Å; F135-F570 HydrophobicContact CE1-CD2 3.95Å; F135-F570 HydrophobicContact CE1-CE2 4.05Å; F135-F570 HydrophobicContact CZ-CD2 4.24Å; F135-F570 AromaticContact CZ-CE2 3.9Å; F135-F570 HydrophobicContact CZ-CE2 3.9Å; I566-F570 WeakPolarHBondContact O-CB 3.14Å; I566-F570 PolarHBondContact O-N 3.47Å; V567-F570 WeakPolarHBondContact O-CB 3.47Å; V567-F570 PolarHBondContact O-N 3.2Å; F570-K573 PolarHBondContact O-N 2.56Å; F570-Y574 WeakPolarHBondContact O-CB 3.43Å; F570-Y574 PolarHBondContact O-N 3.37Å; F570-L583 HydrophobicContact CZ-CD1 4.49Å
571	I	92.7	Very high	87.6	Confident	90 Å²	90	62.1 Å²	62.1	46%	0.462	33%	0.334	S	S	.	.	H	α-helix	trans	-63	-45.9	178.4	-67	170.3	0	0	0	110.7	V567 W569 K573 Y574 C575	V567-I571 HydrophobicContact CG1-CD1 3.71Å; V567-I571 HydrophobicContact CG1-CG1 4.33Å; V567-I571 VanDerWaalsContact O-CG1 3.3Å; V567-I571 WeakPolarHBondContact O-CG1 3.27Å; V567-I571 PolarHBondContact O-N 3.12Å; W569-I571 PolarHBondContact O-N 3.39Å; I571-K573 PolarHBondContact O-N 2.97Å; I571-Y574 PolarHBondContact O-N 3.14Å; I571-C575 VanDerWaalsContact O-CB 3.25Å; I571-C575 WeakPolarHBondContact O-CB 3.24Å; I571-C575 PolarHBondContact O-N 3.12Å; I571-C575 PolarHBondContact O-SG 2.79Å
572	Y	91.9	Very high	86.8	Confident	137 Å²	137	61.1 Å²	61.1	54%	0.537	32%	0.323	S	S	.	.	H	α-helix	trans	-57.2	-52.1	178.3	166.5	-104.9	0	0	0	111.2	G568 W569 C575 S576	G568-Y572 WeakPolarHBondContact O-CB 3.39Å; G568-Y572 PolarHBondContact O-N 3.39Å; W569-Y572 PolarHBondContact O-N 3.46Å; Y572-C575 PolarHBondContact O-N 3.29Å; Y572-S576 VanDerWaalsContact O-CB 3.24Å; Y572-S576 WeakPolarHBondContact O-CB 3.27Å; Y572-S576 PolarHBondContact O-N 3.14Å; Y572-S576 PolarHBondContact O-OG 3.12Å
573	K	87.5	Confident	86.3	Confident	27 Å²	27	63.2 Å²	63.2	12%	0.117	33%	0.334	C	S	.	.	H	α-helix	trans	-65.3	-42.9	179.5	-83.2	-61.9	-160.1	164.4	0	112.4	L134 W569 F570 I571 E577	L134-K573 HydrophobicContact CD2-CB 3.99Å; W569-K573 HydrophobicContact CD2-CG 4.42Å; W569-K573 HydrophobicContact CZ2-CD 4.4Å; W569-K573 HydrophobicContact CZ2-CG 4.06Å; W569-K573 WeakPolarHBondContact O-CB 3.13Å; W569-K573 PolarHBondContact O-N 3.27Å; F570-K573 PolarHBondContact O-N 2.56Å; I571-K573 PolarHBondContact O-N 2.97Å; K573-E577 HydrophobicContact CD-CG 4.31Å; K573-E577 WeakPolarHBondContact CD-OE2 3.38Å; K573-E577 IonicContact NZ-OE1 2.89Å; K573-E577 PolarHBondContact NZ-OE1 3.33Å; K573-E577 IonicContact NZ-OE2 3.38Å; K573-E577 PolarHBondContact NZ-OE2 3.32Å; K573-E577 PolarHBondContact O-N 2.95Å; K573-E577 VanDerWaalsContact O-N 3.15Å
574	Y	87.1	Confident	85.6	Confident	71 Å²	71	64.6 Å²	64.6	28%	0.278	34%	0.337	S	S	.	.	H	α-helix	trans	-58.5	-49.8	175.1	-178	-94.2	0	0	0	110.9	F570 I571 G579 F580 L583	F570-Y574 WeakPolarHBondContact O-CB 3.43Å; F570-Y574 PolarHBondContact O-N 3.37Å; I571-Y574 PolarHBondContact O-N 3.14Å; Y574-G579 WeakPolarHBondContact O-CA 3.16Å; Y574-G579 PolarHBondContact O-N 3.27Å; Y574-F580 PolarHBondContact OH-N 3.24Å; Y574-L583 HydrophobicContact CD2-CD1 4.21Å; Y574-L583 HydrophobicContact CE2-CB 4.38Å; Y574-L583 HydrophobicContact CE2-CD1 4.19Å; Y574-L583 HydrophobicContact CE2-CD2 4.49Å
575	C	87.9	Confident	84.9	Confident	92 Å²	92	59.5 Å²	59.5	62%	0.622	31%	0.311	S	S	*	.	H	α-helix	trans	-74.5	-38.3	-176.6	-67.3	0	0	0	0	113.8	I571 Y572	I571-C575 VanDerWaalsContact O-CB 3.25Å; I571-C575 WeakPolarHBondContact O-CB 3.24Å; I571-C575 PolarHBondContact O-N 3.12Å; I571-C575 PolarHBondContact O-SG 2.79Å; Y572-C575 PolarHBondContact O-N 3.29Å
576	S	81.8	Confident	84.2	Confident	63 Å²	63	56.9 Å²	56.9	44%	0.441	30%	0.297	S	S	.	.	H	α-helix	trans	-79.8	-29.9	-174.8	57.7	0	0	0	0	114	Y572	Y572-S576 VanDerWaalsContact O-CB 3.24Å; Y572-S576 WeakPolarHBondContact O-CB 3.27Å; Y572-S576 PolarHBondContact O-N 3.14Å; Y572-S576 PolarHBondContact O-OG 3.12Å
577	E	77.4	Confident	83.7	Confident	68 Å²	68	58.8 Å²	58.8	32%	0.318	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	13.4	-170.3	-55.2	-172.2	168	0	0	114.1	K573 L582 F586	K573-E577 HydrophobicContact CD-CG 4.31Å; K573-E577 WeakPolarHBondContact CD-OE2 3.38Å; K573-E577 IonicContact NZ-OE1 2.89Å; K573-E577 PolarHBondContact NZ-OE1 3.33Å; K573-E577 IonicContact NZ-OE2 3.38Å; K573-E577 PolarHBondContact NZ-OE2 3.32Å; K573-E577 PolarHBondContact O-N 2.95Å; K573-E577 VanDerWaalsContact O-N 3.15Å; E577-L582 WeakPolarHBondContact O-CD1 3.26Å; E577-F586 HydrophobicContact CB-CE1 4.39Å; E577-F586 HydrophobicContact CB-CE2 3.81Å; E577-F586 HydrophobicContact CB-CZ 3.4Å; E577-F586 VanDerWaalsContact O-CZ 3.28Å; E577-F586 WeakPolarHBondContact O-CZ 3.24Å
578	G	71.3	Confident	83.2	Confident	21 Å²	21	56.7 Å²	56.7	22%	0.216	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	124.9	3.4	165.5	0	0	0	0	0	117.3	L581	G578-L581 WeakPolarHBondContact O-CB 3.32Å; G578-L581 PolarHBondContact O-N 2.87Å
579	G	77.4	Confident	82.7	Confident	11 Å²	11	55.3 Å²	55.3	11%	0.113	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	59	-134.9	168.1	0	0	0	0	0	114.2	Y574 L581 L582 L583	Y574-G579 WeakPolarHBondContact O-CA 3.16Å; Y574-G579 PolarHBondContact O-N 3.27Å; G579-L581 PolarHBondContact O-N 3.09Å; G579-L582 PolarHBondContact O-N 3.46Å; G579-L583 PolarHBondContact O-N 3.23Å
580	F	74.5	Confident	82.2	Confident	165 Å²	165	54.2 Å²	54.2	72%	0.724	28%	0.275	S	S	*	.	H	α-helix	trans	-58.2	-31.3	-178.6	-171.6	-98.5	0	0	0	113.5	Y574 L582 L583	Y574-F580 PolarHBondContact OH-N 3.24Å; F580-L582 PolarHBondContact O-N 3.47Å; F580-L583 HydrophobicContact CD2-CD2 4.29Å; F580-L583 PolarHBondContact O-N 3.47Å
581	L	69.5	Low	81.7	Confident	104 Å²	104	56.4 Å²	56.4	55%	0.545	29%	0.286	S	S	.	.	H	α-helix	trans	-64	-32.9	-178.6	-69.6	136.6	0	0	0	112.3	G578 G579 A677	G578-L581 WeakPolarHBondContact O-CB 3.32Å; G578-L581 PolarHBondContact O-N 2.87Å; G579-L581 PolarHBondContact O-N 3.09Å; L581-A677 HydrophobicContact CB-CB 4.36Å; L581-A677 HydrophobicContact CD1-CB 3.58Å; L581-A677 HydrophobicContact CD2-CB 3.65Å; L581-A677 HydrophobicContact CG-CB 4.03Å
582	L	73.5	Confident	81.2	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-113.3	0.8	-178.5	-73.3	179.1	0	0	0	113.9	E577 G579 F580 K584 E585 F586 V670 K673 L674	E577-L582 WeakPolarHBondContact O-CD1 3.26Å; G579-L582 PolarHBondContact O-N 3.46Å; F580-L582 PolarHBondContact O-N 3.47Å; L582-K584 PolarHBondContact O-N 2.83Å; L582-E585 HydrophobicContact CD2-CB 4.16Å; L582-E585 HydrophobicContact CD2-CG 4.08Å; L582-E585 PolarHBondContact O-N 2.95Å; L582-F586 HydrophobicContact CB-CD2 3.91Å; L582-F586 HydrophobicContact CB-CE1 4.43Å; L582-F586 HydrophobicContact CB-CE2 3.49Å; L582-F586 VanDerWaalsContact CB-CE2 3.49Å; L582-F586 HydrophobicContact CB-CZ 3.78Å; L582-F586 HydrophobicContact CD1-CE1 4.45Å; L582-F586 HydrophobicContact CD1-CE2 4.23Å; L582-F586 HydrophobicContact CD1-CZ 3.77Å; L582-F586 HydrophobicContact CG-CZ 4.42Å; L582-F586 WeakPolarHBondContact O-CD2 3.33Å; L582-F586 PolarHBondContact O-N 2.79Å; L582-V670 HydrophobicContact CD1-CG1 3.82Å; L582-V670 HydrophobicContact CD2-CG1 4.36Å; L582-K673 HydrophobicContact CD2-CB 3.59Å; L582-K673 HydrophobicContact CD2-CD 3.97Å; L582-K673 HydrophobicContact CD2-CG 4.41Å; L582-L674 HydrophobicContact CD1-CD1 4.07Å; L582-L674 HydrophobicContact CD1-CD2 3.58Å; L582-L674 HydrophobicContact CD1-CG 3.54Å
583	L	80.4	Confident	81.1	Confident	45 Å²	45	50.6 Å²	50.6	24%	0.236	26%	0.262	C	S	.	.	H	α-helix	trans	-49.1	-48.6	177.3	179.9	61.7	0	0	0	111	L134 F570 Y574 G579 F580 E585 F586 L587	L134-L583 HydrophobicContact CD1-CD1 3.69Å; F570-L583 HydrophobicContact CZ-CD1 4.49Å; Y574-L583 HydrophobicContact CD2-CD1 4.21Å; Y574-L583 HydrophobicContact CE2-CB 4.38Å; Y574-L583 HydrophobicContact CE2-CD1 4.19Å; Y574-L583 HydrophobicContact CE2-CD2 4.49Å; G579-L583 PolarHBondContact O-N 3.23Å; F580-L583 HydrophobicContact CD2-CD2 4.29Å; F580-L583 PolarHBondContact O-N 3.47Å; L583-E585 VanDerWaalsContact C-N 3.34Å; L583-E585 PolarHBondContact O-N 3.05Å; L583-F586 PolarHBondContact O-N 2.72Å; L583-L587 VanDerWaalsContact O-CG 3.26Å; L583-L587 WeakPolarHBondContact O-CG 3.38Å; L583-L587 PolarHBondContact O-N 3.32Å; L583-L587 VanDerWaalsContact O-N 3.15Å
584	K	78.6	Confident	81.4	Confident	62 Å²	62	49.5 Å²	49.5	27%	0.27	26%	0.258	S	S	.	.	H	α-helix	trans	-62.8	-36.3	178.7	-167.1	-175.2	-179	-165.4	0	113.1	L582 I658 D660	L582-K584 PolarHBondContact O-N 2.83Å; K584-I658 WeakPolarHBondContact CE-O 3.49Å; K584-I658 PolarHBondContact NZ-O 2.92Å; K584-D660 IonicContact NZ-OD2 3.52Å; K584-D660 PolarHBondContact NZ-OD2 3.01Å
585	E	79.8	Confident	81.7	Confident	6 Å²	6	46.2 Å²	46.2	3%	0.028	25%	0.245	C	C	.	.	H	α-helix	trans	-74.3	-37.9	178.5	-70.9	-56.8	148.9	0	0	112	L582 L583 L587 K588 K673	L582-E585 HydrophobicContact CD2-CB 4.16Å; L582-E585 HydrophobicContact CD2-CG 4.08Å; L582-E585 PolarHBondContact O-N 2.95Å; L583-E585 VanDerWaalsContact C-N 3.34Å; L583-E585 PolarHBondContact O-N 3.05Å; E585-L587 VanDerWaalsContact C-N 3.27Å; E585-L587 PolarHBondContact O-N 3.48Å; E585-K588 WeakPolarHBondContact O-CB 3.32Å; E585-K588 PolarHBondContact O-N 3.3Å; E585-K588 IonicContact OE1-NZ 3.9Å; E585-K588 PolarHBondContact OE1-NZ 3.41Å; E585-K588 IonicContact OE2-NZ 2.78Å; E585-K673 HydrophobicContact CG-CD 3.84Å; E585-K673 IonicContact OE1-NZ 2.65Å; E585-K673 PolarHBondContact OE1-NZ 2.96Å
586	F	82.2	Confident	81.7	Confident	7 Å²	7	45 Å²	45	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-75.6	-14.8	179.3	-61.6	-39.2	0	0	0	114.6	S132 P133 L134 E577 L582 L583 V670	S132-F586 PolarHBondContact OG-O 2.96Å; P133-F586 WeakPolarHBondContact CD-O 3.34Å; L134-F586 HydrophobicContact CD1-CB 3.44Å; L134-F586 VanDerWaalsContact CD1-CB 3.44Å; L134-F586 HydrophobicContact CD1-CD2 4.41Å; L134-F586 HydrophobicContact CD1-CG 4.42Å; L134-F586 HydrophobicContact CD2-CB 4.49Å; L134-F586 HydrophobicContact CD2-CD2 4.45Å; L134-F586 HydrophobicContact CG-CB 3.52Å; L134-F586 HydrophobicContact CG-CD2 4.33Å; L134-F586 HydrophobicContact CG-CG 4.3Å; E577-F586 HydrophobicContact CB-CE1 4.39Å; E577-F586 HydrophobicContact CB-CE2 3.81Å; E577-F586 HydrophobicContact CB-CZ 3.4Å; E577-F586 VanDerWaalsContact O-CZ 3.28Å; E577-F586 WeakPolarHBondContact O-CZ 3.24Å; L582-F586 HydrophobicContact CB-CD2 3.91Å; L582-F586 HydrophobicContact CB-CE1 4.43Å; L582-F586 HydrophobicContact CB-CE2 3.49Å; L582-F586 VanDerWaalsContact CB-CE2 3.49Å; L582-F586 HydrophobicContact CB-CZ 3.78Å; L582-F586 HydrophobicContact CD1-CE1 4.45Å; L582-F586 HydrophobicContact CD1-CE2 4.23Å; L582-F586 HydrophobicContact CD1-CZ 3.77Å; L582-F586 HydrophobicContact CG-CZ 4.42Å; L582-F586 WeakPolarHBondContact O-CD2 3.33Å; L582-F586 PolarHBondContact O-N 2.79Å; L583-F586 PolarHBondContact O-N 2.72Å; F586-V670 HydrophobicContact CE1-CG1 4.48Å
587	L	84.7	Confident	81.9	Confident	54 Å²	54	46.2 Å²	46.2	28%	0.283	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-20.7	167.4	-67.8	173	0	0	0	111.7	S132 L134 F135 V492 L583 E585	S132-L587 PolarHBondContact OG-O 2.69Å; L134-L587 HydrophobicContact CD1-CD2 4.29Å; F135-L587 HydrophobicContact CE2-CD2 3.71Å; F135-L587 HydrophobicContact CZ-CD2 4.43Å; V492-L587 HydrophobicContact CG1-CB 3.87Å; V492-L587 HydrophobicContact CG1-CD2 3.58Å; V492-L587 HydrophobicContact CG1-CG 4.23Å; V492-L587 HydrophobicContact CG2-CD2 4.47Å; L583-L587 VanDerWaalsContact O-CG 3.26Å; L583-L587 WeakPolarHBondContact O-CG 3.38Å; L583-L587 PolarHBondContact O-N 3.32Å; L583-L587 VanDerWaalsContact O-N 3.15Å; E585-L587 VanDerWaalsContact C-N 3.27Å; E585-L587 PolarHBondContact O-N 3.48Å
588	K	85	Confident	82.4	Confident	28 Å²	28	49.5 Å²	49.5	12%	0.122	26%	0.257	C	S	.	.	S	Bend	trans	-84.5	154.2	178.8	-60.5	178.3	-172.8	174.6	0	112.4	E585 K662 Q665	E585-K588 WeakPolarHBondContact O-CB 3.32Å; E585-K588 PolarHBondContact O-N 3.3Å; E585-K588 IonicContact OE1-NZ 3.9Å; E585-K588 PolarHBondContact OE1-NZ 3.41Å; E585-K588 IonicContact OE2-NZ 2.78Å; K588-K662 PolarHBondContact NZ-O 3.26Å; K588-Q665 PolarHBondContact O-NE2 3.26Å
589	P	84.2	Confident	83.4	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.032	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-63.2	145.2	172.2	-18.2	30.5	0	0	0	112.9	I131 Y493 W593 F663 Q665	I131-P589 VanDerWaalsContact O-CA 3.3Å; I131-P589 WeakPolarHBondContact O-CA 3.35Å; Y493-P589 HydrophobicContact CD2-CG 3.68Å; Y493-P589 HydrophobicContact CE2-CG 3.45Å; Y493-P589 VanDerWaalsContact CE2-CG 3.45Å; P589-W593 HydrophobicContact CB-CB 3.77Å; P589-W593 VanDerWaalsContact CB-CD1 3.49Å; P589-W593 HydrophobicContact CB-CG 3.76Å; P589-F663 HydrophobicContact CB-CE1 4.45Å; P589-F663 HydrophobicContact CG-CE1 3.97Å; P589-F663 HydrophobicContact CG-CE2 4.33Å; P589-F663 HydrophobicContact CG-CZ 3.79Å; P589-Q665 WeakPolarHBondContact O-CG 3.32Å; P589-Q665 PolarHBondContact O-N 2.81Å
590	V	85.1	Confident	84.1	Confident	23 Å²	23	55.6 Å²	55.6	14%	0.139	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-68	154.6	169.8	-63.1	0	0	0	0	111.1	N130 P133 E592 W593 F664 Q665	N130-V590 HydrophobicContact CB-CG2 3.74Å; N130-V590 PolarHBondContact O-N 3.49Å; P133-V590 HydrophobicContact CG-CG1 3.49Å; P133-V590 VanDerWaalsContact CG-CG1 3.49Å; V590-E592 WeakPolarHBondContact CB-OE2 3.47Å; V590-E592 HydrophobicContact CG2-CB 4.18Å; V590-E592 PolarHBondContact O-N 2.97Å; V590-E592 VanDerWaalsContact O-N 3.1Å; V590-W593 HydrophobicContact CG2-CB 4.27Å; V590-W593 WeakPolarHBondContact O-CB 3.27Å; V590-W593 PolarHBondContact O-N 3.39Å; V590-F664 WeakPolarHBondContact O-CD1 3.44Å; V590-Q665 HydrophobicContact CG1-CG 4.32Å
591	H	83.2	Confident	85	Confident	106 Å²	106	50.3 Å²	50.3	49%	0.491	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.1	178.6	-174.2	-91.6	0	0	0	112.2	W593 R601	H591-W593 VanDerWaalsContact C-N 3.29Å; H591-W593 PolarHBondContact O-N 3.23Å; H591-R601 PolarHBondContact O-NH2 3.32Å
592	E	82.5	Confident	86.1	Confident	102 Å²	102	48.2 Å²	48.2	48%	0.477	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.3	176.5	-60.6	83.7	174.4	0	0	113.6	V590 R601 K667	V590-E592 WeakPolarHBondContact CB-OE2 3.47Å; V590-E592 HydrophobicContact CG2-CB 4.18Å; V590-E592 PolarHBondContact O-N 2.97Å; V590-E592 VanDerWaalsContact O-N 3.1Å; E592-R601 PolarHBondContact O-NH1 3.16Å; E592-R601 PolarHBondContact O-NH2 3.14Å; E592-K667 IonicContact OE1-NZ 3.64Å
593	W	90.6	Very high	87.1	Confident	3 Å²	3	51.4 Å²	51.4	1%	0.011	26%	0.263	C	S	.	.			trans	-61.9	144.5	177.2	176.7	-109.8	0	0	0	111.8	F117 F120 A121 V128 N130 I131 Y493 P589 V590 H591 R601	F117-W593 AromaticContact CD2-CH2 3.92Å; F117-W593 HydrophobicContact CD2-CH2 3.92Å; F117-W593 AromaticContact CE2-CH2 3.56Å; F117-W593 HydrophobicContact CE2-CH2 3.56Å; F117-W593 HydrophobicContact CE2-CZ2 4.2Å; F117-W593 HydrophobicContact CE2-CZ3 4.33Å; F120-W593 HydrophobicContact CD1-CH2 4.19Å; F120-W593 AromaticContact CD1-CZ2 3.68Å; F120-W593 HydrophobicContact CD1-CZ2 3.68Å; F120-W593 AromaticContact CE1-CE2 3.99Å; F120-W593 AromaticContact CE1-CZ2 3.91Å; F120-W593 HydrophobicContact CE1-CZ2 3.91Å; F120-W593 AromaticContact CE1-NE1 3.94Å; A121-W593 HydrophobicContact CB-CE3 4.22Å; A121-W593 HydrophobicContact CB-CH2 3.82Å; A121-W593 HydrophobicContact CB-CZ3 3.52Å; V128-W593 HydrophobicContact CG2-CH2 3.93Å; V128-W593 HydrophobicContact CG2-CZ3 3.96Å; V128-W593 WeakPolarHBondContact O-CZ3 3.19Å; N130-W593 HydrophobicContact CB-CE3 4.12Å; I131-W593 HydrophobicContact CB-CD2 3.92Å; I131-W593 HydrophobicContact CB-CE3 4.05Å; I131-W593 HydrophobicContact CB-CH2 3.9Å; I131-W593 HydrophobicContact CB-CZ2 3.74Å; I131-W593 HydrophobicContact CB-CZ3 4.05Å; I131-W593 HydrophobicContact CD1-CH2 4.18Å; I131-W593 HydrophobicContact CD1-CZ2 3.53Å; I131-W593 HydrophobicContact CG1-CD2 4.23Å; I131-W593 HydrophobicContact CG1-CH2 4.3Å; I131-W593 HydrophobicContact CG1-CZ2 3.65Å; Y493-W593 AromaticContact CE2-NE1 3.69Å; Y493-W593 AromaticContact CZ-NE1 3.76Å; Y493-W593 PolarHBondContact OH-NE1 3.38Å; P589-W593 HydrophobicContact CB-CB 3.77Å; P589-W593 VanDerWaalsContact CB-CD1 3.49Å; P589-W593 HydrophobicContact CB-CG 3.76Å; V590-W593 HydrophobicContact CG2-CB 4.27Å; V590-W593 WeakPolarHBondContact O-CB 3.27Å; V590-W593 PolarHBondContact O-N 3.39Å; H591-W593 VanDerWaalsContact C-N 3.29Å; H591-W593 PolarHBondContact O-N 3.23Å; W593-R601 PolarHBondContact O-NH1 2.76Å
594	G	92.1	Very high	87.7	Confident	4 Å²	4	49.3 Å²	49.3	4%	0.041	25%	0.252	C	S	.	.	S	Bend	trans	126.6	-171.7	-179.6	0	0	0	0	0	112.3
595	P	93.1	Very high	88.4	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.006	25%	0.25	C	S	.	.			trans	-58.8	142.3	179.7	-23.6	34.3	0	0	0	112.4	F120 F327 H600 R601 F604	F120-P595 HydrophobicContact CE2-CG 4.01Å; F120-P595 HydrophobicContact CZ-CG 4.12Å; F120-P595 WeakPolarHBondContact O-CA 3.46Å; F327-P595 HydrophobicContact CD2-CB 4.09Å; F327-P595 HydrophobicContact CD2-CG 4.46Å; F327-P595 HydrophobicContact CE2-CB 3.63Å; F327-P595 HydrophobicContact CE2-CG 3.53Å; F327-P595 HydrophobicContact CZ-CB 4.12Å; F327-P595 HydrophobicContact CZ-CG 3.67Å; P595-H600 HydrophobicContact CB-CB 3.71Å; P595-H600 HydrophobicContact CG-CB 4.13Å; P595-R601 HydrophobicContact CB-CB 4.49Å; P595-F604 HydrophobicContact CG-CB 4.04Å; P595-F604 HydrophobicContact CG-CG 4.47Å
596	A	87.9	Confident	89	Confident	68 Å²	68	52 Å²	52	56%	0.562	27%	0.274	S	S	*	.	S	Bend	trans	-71	-39.7	177.5	0	0	0	0	0	112.4
597	D	87.1	Confident	89.6	Confident	87 Å²	87	53.2 Å²	53.2	47%	0.465	28%	0.281	S	S	.	.	S	Bend	trans	-71.8	129.5	177.9	-171.4	-47.1	0	0	0	110.8	K599 H600 R601	D597-K599 PolarHBondContact O-N 2.81Å; D597-K599 WeakPolarHBondContact OD1-CB 3.34Å; D597-K599 PolarHBondContact OD1-N 3.32Å; D597-H600 PolarHBondContact O-N 3.33Å; D597-R601 VanDerWaalsContact O-CB 3.27Å; D597-R601 WeakPolarHBondContact O-CB 3.43Å; D597-R601 PolarHBondContact O-N 3.44Å
598	K	88.6	Confident	89.9	Confident	137 Å²	137	50.9 Å²	50.9	60%	0.596	27%	0.268	S	S	*	.	H	α-helix	trans	-53.9	-37.3	-179.9	-65.9	-179.2	-175.8	172.2	0	112.8	A602	K598-A602 PolarHBondContact O-N 3.37Å
599	K	90.6	Very high	90.1	Very high	139 Å²	139	56.1 Å²	56.1	60%	0.604	29%	0.291	S	S	*	.	H	α-helix	trans	-63.4	-54.6	179.6	180	-176.6	175.2	-179.8	0	110.9	D597 R601 A602 E603	D597-K599 PolarHBondContact O-N 2.81Å; D597-K599 WeakPolarHBondContact OD1-CB 3.34Å; D597-K599 PolarHBondContact OD1-N 3.32Å; K599-R601 VanDerWaalsContact C-N 3.27Å; K599-R601 PolarHBondContact O-N 2.87Å; K599-A602 WeakPolarHBondContact O-CB 3.37Å; K599-A602 PolarHBondContact O-N 3.03Å; K599-E603 PolarHBondContact O-N 2.92Å
600	H	92.8	Very high	90.3	Very high	22 Å²	22	58.3 Å²	58.3	10%	0.102	31%	0.307	C	S	.	.	H	α-helix	trans	-69.2	-30	-179.2	-63.7	-45.8	0	0	0	112.1	F327 K328 P595 D597 E603 F604	F327-H600 HydrophobicContact CD1-CB 3.74Å; F327-H600 AromaticContact CD1-CD2 3.32Å; F327-H600 WeakPolarHBondContact CD1-CD2 3.42Å; F327-H600 AromaticContact CD1-CE1 3.89Å; F327-H600 AromaticContact CD1-CG 3.27Å; F327-H600 AromaticContact CD1-ND1 3.64Å; F327-H600 AromaticContact CD1-NE2 3.71Å; F327-H600 HydrophobicContact CD2-CB 4.46Å; F327-H600 HydrophobicContact CE1-CB 3.68Å; F327-H600 AromaticContact CE1-CG 3.63Å; F327-H600 AromaticContact CE1-ND1 3.9Å; F327-H600 HydrophobicContact CE2-CB 4.42Å; F327-H600 HydrophobicContact CG-CB 4.14Å; F327-H600 AromaticContact CG-CD2 3.52Å; F327-H600 AromaticContact CG-CG 3.82Å; F327-H600 HydrophobicContact CZ-CB 4.04Å; K328-H600 VanDerWaalsContact CE-CE1 3.41Å; K328-H600 WeakPolarHBondContact CE-CE1 3.47Å; P595-H600 HydrophobicContact CB-CB 3.71Å; P595-H600 HydrophobicContact CG-CB 4.13Å; D597-H600 PolarHBondContact O-N 3.33Å; H600-E603 IonicContact ND1-OE1 3.25Å; H600-E603 IonicContact ND1-OE2 2.69Å; H600-E603 PolarHBondContact ND1-OE2 2.93Å; H600-E603 PolarHBondContact O-N 3.44Å; H600-F604 WeakPolarHBondContact O-CB 3.49Å; H600-F604 PolarHBondContact O-N 3.47Å
601	R	93.1	Very high	90.4	Very high	53 Å²	53	59.1 Å²	59.1	20%	0.2	31%	0.31	C	S	.	.	H	α-helix	trans	-63.4	-39.9	172.2	-169.1	176.7	-177.1	84.1	8.7	112.3	H591 E592 W593 P595 D597 K599 F604 I605	H591-R601 PolarHBondContact O-NH2 3.32Å; E592-R601 PolarHBondContact O-NH1 3.16Å; E592-R601 PolarHBondContact O-NH2 3.14Å; W593-R601 PolarHBondContact O-NH1 2.76Å; P595-R601 HydrophobicContact CB-CB 4.49Å; D597-R601 VanDerWaalsContact O-CB 3.27Å; D597-R601 WeakPolarHBondContact O-CB 3.43Å; D597-R601 PolarHBondContact O-N 3.44Å; K599-R601 VanDerWaalsContact C-N 3.27Å; K599-R601 PolarHBondContact O-N 2.87Å; R601-F604 PolarHBondContact O-N 3.29Å; R601-I605 HydrophobicContact CG-CD1 4.17Å; R601-I605 VanDerWaalsContact O-CG1 3.31Å; R601-I605 WeakPolarHBondContact O-CG1 3.43Å; R601-I605 PolarHBondContact O-N 3.39Å
602	A	92.9	Very high	90.4	Very high	61 Å²	61	56.3 Å²	56.3	50%	0.504	30%	0.297	S	S	.	.	H	α-helix	trans	-65.5	-42.5	174.2	0	0	0	0	0	111.9	K598 K599 F604 I605 S606	K598-A602 PolarHBondContact O-N 3.37Å; K599-A602 WeakPolarHBondContact O-CB 3.37Å; K599-A602 PolarHBondContact O-N 3.03Å; A602-F604 VanDerWaalsContact C-N 3.32Å; A602-F604 PolarHBondContact O-N 2.68Å; A602-I605 PolarHBondContact O-N 2.88Å; A602-S606 WeakPolarHBondContact O-CB 2.86Å; A602-S606 PolarHBondContact O-N 3.43Å
603	E	93.8	Very high	90.5	Very high	67 Å²	67	53.8 Å²	53.8	31%	0.313	29%	0.291	S	S	.	.	H	α-helix	trans	-57.7	-45.3	173.4	-65.9	170.2	-168.9	0	0	111	K328 L504 K599 H600 S606 M607	K328-E603 IonicContact NZ-OE2 3.38Å; K328-E603 PolarHBondContact NZ-OE2 3.09Å; L504-E603 HydrophobicContact CD1-CB 3.82Å; K599-E603 PolarHBondContact O-N 2.92Å; H600-E603 IonicContact ND1-OE1 3.25Å; H600-E603 IonicContact ND1-OE2 2.69Å; H600-E603 PolarHBondContact ND1-OE2 2.93Å; H600-E603 PolarHBondContact O-N 3.44Å; E603-S606 PolarHBondContact O-N 3.26Å; E603-M607 WeakPolarHBondContact O-CB 3.47Å; E603-M607 PolarHBondContact O-N 3Å
604	F	94.5	Very high	90	Very high	1 Å²	1	62 Å²	62	0%	0.004	32%	0.322	C	S	.	.	H	α-helix	trans	-61	-49.9	176.9	173.9	-120.6	0	0	0	112.6	F120 D501 L504 P595 H600 R601 A602 S606 M607 I608 F663 F664	F120-F604 HydrophobicContact CE1-CE2 4.49Å; F120-F604 HydrophobicContact CE2-CD2 4.43Å; F120-F604 AromaticContact CZ-CD2 3.76Å; F120-F604 HydrophobicContact CZ-CD2 3.76Å; F120-F604 AromaticContact CZ-CE2 3.75Å; F120-F604 HydrophobicContact CZ-CE2 3.75Å; F120-F604 HydrophobicContact CZ-CG 4.24Å; F120-F604 HydrophobicContact CZ-CZ 4.16Å; D501-F604 WeakPolarHBondContact OD1-CE2 3.33Å; L504-F604 HydrophobicContact CD2-CB 3.72Å; L504-F604 HydrophobicContact CD2-CD2 4.32Å; P595-F604 HydrophobicContact CG-CB 4.04Å; P595-F604 HydrophobicContact CG-CG 4.47Å; H600-F604 WeakPolarHBondContact O-CB 3.49Å; H600-F604 PolarHBondContact O-N 3.47Å; R601-F604 PolarHBondContact O-N 3.29Å; A602-F604 VanDerWaalsContact C-N 3.32Å; A602-F604 PolarHBondContact O-N 2.68Å; F604-S606 VanDerWaalsContact C-N 3.3Å; F604-S606 PolarHBondContact O-N 2.94Å; F604-M607 HydrophobicContact CD2-CE 3.6Å; F604-M607 HydrophobicContact CE2-CE 3.9Å; F604-M607 WeakPolarHBondContact O-CB 3.46Å; F604-M607 PolarHBondContact O-N 2.81Å; F604-I608 HydrophobicContact CD2-CG1 4.25Å; F604-I608 HydrophobicContact CE2-CD1 3.86Å; F604-I608 HydrophobicContact CE2-CG1 3.86Å; F604-I608 HydrophobicContact CZ-CD1 4.16Å; F604-I608 HydrophobicContact CZ-CG1 4.01Å; F604-I608 WeakPolarHBondContact O-CG1 3.2Å; F604-I608 PolarHBondContact O-N 3.3Å; F604-F663 AromaticContact CZ-CE1 3.81Å; F604-F663 HydrophobicContact CZ-CE1 3.81Å; F604-F663 HydrophobicContact CZ-CZ 4.27Å; F604-F664 HydrophobicContact CD1-CZ 4.29Å; F604-F664 HydrophobicContact CE1-CE1 4.04Å; F604-F664 AromaticContact CE1-CZ 3.54Å; F604-F664 HydrophobicContact CE1-CZ 3.54Å; F604-F664 HydrophobicContact CZ-CZ 4.18Å
605	I	92.7	Very high	89.3	Confident	47 Å²	47	65.9 Å²	65.9	24%	0.241	34%	0.341	C	S	.	.	H	α-helix	trans	-62	-40.1	179.1	-68.7	166.9	0	0	0	111	R601 A602 I608 K609	R601-I605 HydrophobicContact CG-CD1 4.17Å; R601-I605 VanDerWaalsContact O-CG1 3.31Å; R601-I605 WeakPolarHBondContact O-CG1 3.43Å; R601-I605 PolarHBondContact O-N 3.39Å; A602-I605 PolarHBondContact O-N 2.88Å; I605-I608 PolarHBondContact O-N 2.94Å; I605-K609 HydrophobicContact CG2-CD 4.2Å; I605-K609 HydrophobicContact CG2-CG 4.46Å; I605-K609 WeakPolarHBondContact O-CG 3.31Å; I605-K609 PolarHBondContact O-N 2.94Å
606	S	92.9	Very high	88.6	Confident	76 Å²	76	69.6 Å²	69.6	53%	0.531	36%	0.361	S	S	.	.	H	α-helix	trans	-60.6	-45.5	175	-177.6	0	0	0	0	111.7	A602 E603 F604 I608 K609 S610	A602-S606 WeakPolarHBondContact O-CB 2.86Å; A602-S606 PolarHBondContact O-N 3.43Å; E603-S606 PolarHBondContact O-N 3.26Å; F604-S606 VanDerWaalsContact C-N 3.3Å; F604-S606 PolarHBondContact O-N 2.94Å; S606-I608 PolarHBondContact O-N 3.46Å; S606-K609 PolarHBondContact O-N 2.94Å; S606-S610 WeakPolarHBondContact O-CB 3.44Å; S606-S610 PolarHBondContact O-N 3.46Å; S606-S610 PolarHBondContact O-OG 3.46Å
607	M	93.2	Very high	88.2	Confident	34 Å²	34	72.6 Å²	72.6	17%	0.167	36%	0.363	C	S	.	.	H	α-helix	trans	-60	-44.8	176.1	-179.1	-165.5	68.7	0	0	111.8	C500 E603 F604 S610 N611	C500-M607 HydrophobicContact CB-CE 4.07Å; C500-M607 HydrophobicContact CB-SD 3.65Å; E603-M607 WeakPolarHBondContact O-CB 3.47Å; E603-M607 PolarHBondContact O-N 3Å; F604-M607 HydrophobicContact CD2-CE 3.6Å; F604-M607 HydrophobicContact CE2-CE 3.9Å; F604-M607 WeakPolarHBondContact O-CB 3.46Å; F604-M607 PolarHBondContact O-N 2.81Å; M607-S610 PolarHBondContact O-N 3.1Å; M607-S610 PolarHBondContact O-OG 3.42Å; M607-N611 PolarHBondContact O-N 3.06Å; M607-N611 PolarHBondContact O-ND2 3.5Å
608	I	91.2	Very high	87.4	Confident	5 Å²	5	71.8 Å²	71.8	3%	0.026	37%	0.368	C	S	.	.	H	α-helix	trans	-60.3	-51.7	175.9	-64.7	-60.5	0	0	0	111.1	Q497 F604 I605 S606 S610 N611 E612 F663 F664	Q497-I608 VanDerWaalsContact CD-CD1 3.49Å; Q497-I608 VanDerWaalsContact NE2-CD1 3.29Å; F604-I608 HydrophobicContact CD2-CG1 4.25Å; F604-I608 HydrophobicContact CE2-CD1 3.86Å; F604-I608 HydrophobicContact CE2-CG1 3.86Å; F604-I608 HydrophobicContact CZ-CD1 4.16Å; F604-I608 HydrophobicContact CZ-CG1 4.01Å; F604-I608 WeakPolarHBondContact O-CG1 3.2Å; F604-I608 PolarHBondContact O-N 3.3Å; I605-I608 PolarHBondContact O-N 2.94Å; S606-I608 PolarHBondContact O-N 3.46Å; I608-S610 VanDerWaalsContact C-N 3.29Å; I608-S610 PolarHBondContact O-N 3.47Å; I608-N611 WeakPolarHBondContact O-CB 3.41Å; I608-N611 PolarHBondContact O-N 3.2Å; I608-E612 HydrophobicContact CG2-CG 4.34Å; I608-E612 PolarHBondContact O-N 2.99Å; I608-F663 HydrophobicContact CD1-CD1 3.88Å; I608-F663 HydrophobicContact CD1-CD2 4.17Å; I608-F663 HydrophobicContact CD1-CE1 3.79Å; I608-F663 HydrophobicContact CD1-CE2 4.09Å; I608-F663 HydrophobicContact CD1-CG 4.05Å; I608-F663 HydrophobicContact CD1-CZ 3.87Å; I608-F663 HydrophobicContact CG1-CD1 4.08Å; I608-F663 HydrophobicContact CG1-CE1 4.2Å; I608-F663 HydrophobicContact CG2-CB 3.63Å; I608-F663 HydrophobicContact CG2-CD1 3.96Å; I608-F663 HydrophobicContact CG2-CG 3.87Å; I608-F664 HydrophobicContact CG2-CE2 4.44Å
609	K	89.5	Confident	85.9	Confident	137 Å²	137	67.3 Å²	67.3	60%	0.596	36%	0.361	S	S	*	.	H	α-helix	trans	-57.5	-41.4	179.7	-73.8	-179.7	178	-175.1	0	112.3	I605 S606 N611 E612 S613	I605-K609 HydrophobicContact CG2-CD 4.2Å; I605-K609 HydrophobicContact CG2-CG 4.46Å; I605-K609 WeakPolarHBondContact O-CG 3.31Å; I605-K609 PolarHBondContact O-N 2.94Å; S606-K609 PolarHBondContact O-N 2.94Å; K609-N611 VanDerWaalsContact C-N 3.34Å; K609-E612 PolarHBondContact O-N 2.98Å; K609-S613 PolarHBondContact O-N 3.3Å
610	S	89.2	Confident	83.7	Confident	52 Å²	52	63.1 Å²	63.1	36%	0.364	36%	0.358	S	S	.	.	H	α-helix	trans	-68.1	-32	177	71.6	0	0	0	0	113.3	S606 M607 I608 S613 R614	S606-S610 WeakPolarHBondContact O-CB 3.44Å; S606-S610 PolarHBondContact O-N 3.46Å; S606-S610 PolarHBondContact O-OG 3.46Å; M607-S610 PolarHBondContact O-N 3.1Å; M607-S610 PolarHBondContact O-OG 3.42Å; I608-S610 VanDerWaalsContact C-N 3.29Å; I608-S610 PolarHBondContact O-N 3.47Å; S610-S613 PolarHBondContact O-OG 3.2Å; S610-R614 VanDerWaalsContact O-CG 3.25Å; S610-R614 WeakPolarHBondContact O-CG 3.23Å; S610-R614 PolarHBondContact O-N 2.96Å
611	N	86.7	Confident	81.1	Confident	39 Å²	39	68.3 Å²	68.3	21%	0.209	39%	0.386	C	S	.	.	H	α-helix	trans	-72.1	-41.8	173.9	-74.2	-28.6	0	0	0	111.2	M607 I608 K609 R614 I615	M607-N611 PolarHBondContact O-N 3.06Å; M607-N611 PolarHBondContact O-ND2 3.5Å; I608-N611 WeakPolarHBondContact O-CB 3.41Å; I608-N611 PolarHBondContact O-N 3.2Å; K609-N611 VanDerWaalsContact C-N 3.34Å; N611-R614 PolarHBondContact O-N 3.22Å; N611-I615 WeakPolarHBondContact O-CD1 3.26Å; N611-I615 VanDerWaalsContact O-CG1 3.29Å; N611-I615 WeakPolarHBondContact O-CG1 3.35Å; N611-I615 PolarHBondContact O-N 3.18Å; N611-I615 VanDerWaalsContact O-N 3.11Å
612	E	83.8	Confident	78.1	Confident	48 Å²	48	71 Å²	71	22%	0.224	41%	0.409	C	S	.	.	H	α-helix	trans	-62.4	-44	175.5	-71.4	176.2	167.7	0	0	111.4	I608 K609 R614 I615 N616 T661 F663	I608-E612 HydrophobicContact CG2-CG 4.34Å; I608-E612 PolarHBondContact O-N 2.99Å; K609-E612 PolarHBondContact O-N 2.98Å; E612-R614 PolarHBondContact O-N 3.22Å; E612-I615 PolarHBondContact O-N 3.48Å; E612-N616 PolarHBondContact O-N 3.41Å; E612-N616 PolarHBondContact O-ND2 3.35Å; E612-T661 WeakPolarHBondContact CG-O 3.37Å; E612-F663 WeakPolarHBondContact OE1-CB 3.42Å; E612-F663 PolarHBondContact OE1-N 3.34Å
613	S	83.7	Confident	75.1	Confident	49 Å²	49	78.5 Å²	78.5	34%	0.343	43%	0.426	S	S	.	.	H	α-helix	trans	-61.5	-43	177.4	71.4	0	0	0	0	112.1	K609 S610 I615 N616 E617	K609-S613 PolarHBondContact O-N 3.3Å; S610-S613 PolarHBondContact O-OG 3.2Å; S613-I615 VanDerWaalsContact C-N 3.29Å; S613-I615 PolarHBondContact O-N 2.9Å; S613-N616 PolarHBondContact O-N 2.77Å; S613-E617 WeakPolarHBondContact O-CG 3.46Å; S613-E617 PolarHBondContact O-N 3.09Å
614	R	81.3	Confident	71.8	Confident	174 Å²	174	80.9 Å²	80.9	66%	0.657	45%	0.445	S	S	*	.	H	α-helix	trans	-63.6	-33.7	176.3	-74.1	177.9	67.7	176.2	5.2	113.1	S610 N611 E612 A618	S610-R614 VanDerWaalsContact O-CG 3.25Å; S610-R614 WeakPolarHBondContact O-CG 3.23Å; S610-R614 PolarHBondContact O-N 2.96Å; N611-R614 PolarHBondContact O-N 3.22Å; E612-R614 PolarHBondContact O-N 3.22Å; R614-A618 VanDerWaalsContact O-CB 3.32Å; R614-A618 WeakPolarHBondContact O-CB 3.14Å; R614-A618 PolarHBondContact O-N 3.17Å; R614-A618 VanDerWaalsContact O-N 3.08Å
615	I	76.8	Confident	68.5	Low	86 Å²	86	86.1 Å²	86.1	44%	0.441	48%	0.482	S	S	.	.	H	α-helix	trans	-69	-44.8	175.2	-68.9	164.3	0	0	0	109.7	N611 E612 S613 E617 A618 G619	N611-I615 WeakPolarHBondContact O-CD1 3.26Å; N611-I615 VanDerWaalsContact O-CG1 3.29Å; N611-I615 WeakPolarHBondContact O-CG1 3.35Å; N611-I615 PolarHBondContact O-N 3.18Å; N611-I615 VanDerWaalsContact O-N 3.11Å; E612-I615 PolarHBondContact O-N 3.48Å; S613-I615 VanDerWaalsContact C-N 3.29Å; S613-I615 PolarHBondContact O-N 2.9Å; I615-E617 PolarHBondContact O-N 2.85Å; I615-A618 PolarHBondContact O-N 3.29Å; I615-G619 PolarHBondContact O-N 3.2Å
616	N	78	Confident	65.6	Low	80 Å²	80	90 Å²	90	43%	0.428	51%	0.51	S	S	.	.	H	α-helix	trans	-61.1	-43.7	177	-71.1	-27.4	0	0	0	112.7	E612 S613 G619 G620 T661	E612-N616 PolarHBondContact O-N 3.41Å; E612-N616 PolarHBondContact O-ND2 3.35Å; S613-N616 PolarHBondContact O-N 2.77Å; N616-G619 PolarHBondContact O-N 3.33Å; N616-G620 PolarHBondContact O-N 2.86Å; N616-T661 VanDerWaalsContact CG-CG2 3.46Å; N616-T661 VanDerWaalsContact ND2-CG2 3.28Å; N616-T661 WeakPolarHBondContact ND2-CG2 3.32Å; N616-T661 WeakPolarHBondContact OD1-CG2 3.49Å
617	E	78.7	Confident	62.5	Low	130 Å²	130	93.8 Å²	93.8	61%	0.607	52%	0.522	S	S	*	.	H	α-helix	trans	-63.7	-40.2	175.5	-73	171.4	-169.3	0	0	112	S613 I615	S613-E617 WeakPolarHBondContact O-CG 3.46Å; S613-E617 PolarHBondContact O-N 3.09Å; I615-E617 PolarHBondContact O-N 2.85Å
618	A	71.6	Confident	59.1	Low	70 Å²	70	96 Å²	96	58%	0.579	55%	0.554	S	S	*	*	H	α-helix	trans	-68.7	-35.7	176.7	0	0	0	0	0	112.6	R614 I615	R614-A618 VanDerWaalsContact O-CB 3.32Å; R614-A618 WeakPolarHBondContact O-CB 3.14Å; R614-A618 PolarHBondContact O-N 3.17Å; R614-A618 VanDerWaalsContact O-N 3.08Å; I615-A618 PolarHBondContact O-N 3.29Å
619	G	56.3	Low	55.8	Low	43 Å²	43	99 Å²	99	44%	0.443	59%	0.586	S	S	.	*	H	α-helix	trans	-72.2	-37.8	176.3	0	0	0	0	0	113.5	I615 N616 N621 T622	I615-G619 PolarHBondContact O-N 3.2Å; N616-G619 PolarHBondContact O-N 3.33Å; G619-N621 VanDerWaalsContact C-N 3.29Å; G619-N621 PolarHBondContact O-N 3.45Å; G619-T622 PolarHBondContact O-OG1 2.55Å
620	G	45.7	Very low	53.1	Low	52 Å²	52	98 Å²	98	54%	0.536	59%	0.594	S	S	.	*	H	α-helix	trans	-65.4	-24.8	-179.1	0	0	0	0	0	114.8	N616 T622	N616-G620 PolarHBondContact O-N 2.86Å; G620-T622 VanDerWaalsContact C-N 3.27Å; G620-T622 PolarHBondContact O-N 2.91Å
621	N	36.8	Very low	50	Low	131 Å²	131	102.6 Å²	102.6	70%	0.701	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	12.7	-177	-79.7	-19.7	0	0	0	115.3	G619	G619-N621 VanDerWaalsContact C-N 3.29Å; G619-N621 PolarHBondContact O-N 3.45Å
622	T	31.4	Very low	47	Very low	109 Å²	109	106.5 Å²	106.5	67%	0.669	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	5.6	178.4	-18.5	0	0	0	0	115	G619 G620	G619-T622 PolarHBondContact O-OG1 2.55Å; G620-T622 VanDerWaalsContact C-N 3.27Å; G620-T622 PolarHBondContact O-N 2.91Å
623	Y	30	Very low	44.1	Very low	219 Å²	219	112.1 Å²	112.1	86%	0.859	67%	0.67	S	S	*	*			trans	-132	63.8	172.3	-67.8	-79.7	0	0	0	112
624	T	24.2	Very low	41.1	Very low	117 Å²	117	118.6 Å²	118.6	72%	0.718	69%	0.694	S	S	*	*			trans	-127.4	68.3	160	51.6	0	0	0	0	109.6
625	S	24.6	Very low	38.3	Very low	111 Å²	111	113.4 Å²	113.4	78%	0.776	70%	0.695	S	S	*	*			trans	-87.4	122	148.5	-95.1	0	0	0	0	107.6	I627	S625-I627 PolarHBondContact O-N 2.88Å
626	P	32	Very low	35.6	Very low	128 Å²	128	114.8 Å²	114.8	83%	0.831	71%	0.712	S	S	*	*			trans	-79.3	105.6	-176.4	31	-30.4	0	0	0	109.4
627	I	27.1	Very low	33	Very low	156 Å²	156	118.8 Å²	118.8	80%	0.8	73%	0.728	S	S	*	*			trans	-135.1	101.2	159.5	-49.4	177.3	0	0	0	103.9	S625	S625-I627 PolarHBondContact O-N 2.88Å
628	G	22.8	Very low	30.2	Very low	80 Å²	80	120.5 Å²	120.5	83%	0.825	74%	0.741	S	S	*	*			cis	77.7	57.1	33.4	0	0	0	0	0	110.1
629	G	22.1	Very low	27.8	Very low	69 Å²	69	125.1 Å²	125.1	71%	0.711	75%	0.75	S	S	*	*			trans	167.8	112.9	170.2	0	0	0	0	0	113
630	P	31.9	Very low	26.2	Very low	115 Å²	115	129.7 Å²	129.7	75%	0.747	76%	0.764	S	S	*	*			trans	-79.5	133.7	169.9	33.3	-27.6	0	0	0	107.9
631	N	25.1	Very low	25	Very low	148 Å²	148	130.7 Å²	130.7	79%	0.791	77%	0.774	S	S	*	*			trans	167.6	122.7	138.2	-83.8	-16.3	0	0	0	112.4
632	T	23.7	Very low	24.3	Very low	121 Å²	121	134.5 Å²	134.5	74%	0.742	78%	0.78	S	S	*	*			trans	71.5	109.2	139.1	-27.9	0	0	0	0	119.5
633	I	22.4	Very low	23.9	Very low	167 Å²	167	131.8 Å²	131.8	86%	0.856	77%	0.774	S	S	*	*			trans	-62.4	118.6	159.5	-62.6	161.4	0	0	0	108.7
634	E	21.6	Very low	23.8	Very low	185 Å²	185	128.6 Å²	128.6	86%	0.864	77%	0.771	S	S	*	*			trans	-164.8	129.5	156.1	-112.8	173.5	-155.3	0	0	111.6
635	G	20.6	Very low	23.9	Very low	65 Å²	65	130.4 Å²	130.4	67%	0.67	78%	0.776	S	S	*	*			trans	74.8	95.5	144.8	0	0	0	0	0	120.3
636	S	21.9	Very low	24.1	Very low	115 Å²	115	129.2 Å²	129.2	80%	0.804	77%	0.768	S	S	*	*			trans	21.2	103	136.3	59	0	0	0	0	119.5
637	Q	21.7	Very low	23.8	Very low	163 Å²	163	126.2 Å²	126.2	76%	0.762	75%	0.75	S	S	*	*			trans	-146.2	109	149.7	-82.7	-69.2	-50.7	0	0	109.3	Q639	Q637-Q639 VanDerWaalsContact C-N 3.32Å; Q637-Q639 PolarHBondContact O-N 3.35Å
638	L	21.3	Very low	23.8	Very low	166 Å²	166	125.4 Å²	125.4	87%	0.869	75%	0.746	S	S	*	*			trans	-77.4	79.7	175.9	-145.1	140.7	0	0	0	107.6	L640	L638-L640 PolarHBondContact O-N 3.06Å
639	Q	21.4	Very low	24.1	Very low	168 Å²	168	130 Å²	130	79%	0.785	74%	0.744	S	S	*	*			trans	-88.6	103.6	179.6	-81.2	-168.6	-13.8	0	0	111.7	Q637 G641	Q637-Q639 VanDerWaalsContact C-N 3.32Å; Q637-Q639 PolarHBondContact O-N 3.35Å; Q639-G641 PolarHBondContact O-N 3.21Å; Q639-G641 VanDerWaalsContact O-N 3.1Å
640	L	21.2	Very low	24.4	Very low	138 Å²	138	130 Å²	130	72%	0.723	73%	0.733	S	S	*	*			trans	-62.6	93.9	161	-83.2	133.4	0	0	0	110.1	L638 Y642	L638-L640 PolarHBondContact O-N 3.06Å; L640-Y642 HydrophobicContact CD2-CD2 4.41Å; L640-Y642 HydrophobicContact CD2-CE2 3.71Å
641	G	21.6	Very low	24	Very low	73 Å²	73	126.8 Å²	126.8	75%	0.753	72%	0.721	S	S	*	*			trans	-109.1	88.4	170.4	0	0	0	0	0	111.3	Q639 G643	Q639-G641 PolarHBondContact O-N 3.21Å; Q639-G641 VanDerWaalsContact O-N 3.1Å; G641-G643 VanDerWaalsContact C-N 3.29Å; G641-G643 PolarHBondContact O-N 2.87Å
642	Y	22.3	Very low	24	Very low	211 Å²	211	126.7 Å²	126.7	83%	0.827	72%	0.719	S	S	*	*			trans	-69.3	83.2	169	-79.9	-88.2	0	0	0	110.1	L640	L640-Y642 HydrophobicContact CD2-CD2 4.41Å; L640-Y642 HydrophobicContact CD2-CE2 3.71Å
643	G	23.3	Very low	24.2	Very low	52 Å²	52	123.8 Å²	123.8	54%	0.536	71%	0.708	S	S	.	*			trans	-86.1	104.5	171.5	0	0	0	0	0	111.3	G641 N645	G641-G643 VanDerWaalsContact C-N 3.29Å; G641-G643 PolarHBondContact O-N 2.87Å; G643-N645 PolarHBondContact O-N 3.49Å
644	L	27.5	Very low	24.5	Very low	152 Å²	152	119.4 Å²	119.4	80%	0.796	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	7.7	-174	-132.3	94.1	0	0	0	116.5
645	N	25.4	Very low	24.9	Very low	155 Å²	155	115.2 Å²	115.2	83%	0.829	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	2.6	-178.1	-86.1	-10.8	0	0	0	114.8	G643	G643-N645 PolarHBondContact O-N 3.49Å
646	S	28.2	Very low	25.2	Very low	86 Å²	86	115 Å²	115	60%	0.601	69%	0.691	S	S	*	*	S	Bend	trans	-91.6	-16.7	172.3	60.4	0	0	0	0	113.8	L648 K649 S650	S646-L648 PolarHBondContact O-N 2.69Å; S646-K649 PolarHBondContact O-N 3.02Å; S646-S650 PolarHBondContact O-N 2.89Å; S646-S650 PolarHBondContact O-OG 3.49Å
647	S	27.7	Very low	25.9	Very low	65 Å²	65	114.6 Å²	114.6	46%	0.455	68%	0.684	S	S	.	*	H	α-helix	trans	-74.1	-27.6	-173.2	77.2	0	0	0	0	114.1	S650 G651	S647-S650 VanDerWaalsContact CA-OG 3.27Å; S647-S650 WeakPolarHBondContact CA-OG 3.24Å; S647-S650 PolarHBondContact O-N 2.9Å; S647-S650 PolarHBondContact O-OG 2.89Å; S647-G651 PolarHBondContact O-N 3.24Å
648	L	26.6	Very low	26.7	Very low	139 Å²	139	112.7 Å²	112.7	73%	0.728	68%	0.677	S	S	*	*	H	α-helix	trans	-77.9	-29.2	176	-94.6	154.7	0	0	0	112.6	S646 G651 L652	S646-L648 PolarHBondContact O-N 2.69Å; L648-G651 PolarHBondContact O-N 3.31Å; L648-L652 PolarHBondContact O-N 3.47Å
649	K	28.9	Very low	27.7	Very low	176 Å²	176	110.4 Å²	110.4	77%	0.765	67%	0.666	S	S	*	*	H	α-helix	trans	-74.8	-31.3	169.2	-78.3	-174.2	176.6	-177.7	0	111.7	S646 G651 A653	S646-K649 PolarHBondContact O-N 3.02Å; K649-G651 VanDerWaalsContact C-N 3.34Å; K649-A653 WeakPolarHBondContact O-CB 3.39Å; K649-A653 PolarHBondContact O-N 3.3Å
650	S	28.3	Very low	29.1	Very low	70 Å²	70	105.9 Å²	105.9	49%	0.49	65%	0.647	S	S	.	*	H	α-helix	trans	-72	-26.8	170	63.4	0	0	0	0	113.2	S646 S647 A654	S646-S650 PolarHBondContact O-N 2.89Å; S646-S650 PolarHBondContact O-OG 3.49Å; S647-S650 VanDerWaalsContact CA-OG 3.27Å; S647-S650 WeakPolarHBondContact CA-OG 3.24Å; S647-S650 PolarHBondContact O-N 2.9Å; S647-S650 PolarHBondContact O-OG 2.89Å; S650-A654 WeakPolarHBondContact O-CB 3.31Å; S650-A654 PolarHBondContact O-N 3Å
651	G	23.9	Very low	30.8	Very low	48 Å²	48	102.3 Å²	102.3	50%	0.495	63%	0.631	S	S	.	*	H	α-helix	trans	-68.1	-34.2	177.1	0	0	0	0	0	114.2	S647 L648 K649	S647-G651 PolarHBondContact O-N 3.24Å; L648-G651 PolarHBondContact O-N 3.31Å; K649-G651 VanDerWaalsContact C-N 3.34Å
652	L	25.2	Very low	33.3	Very low	145 Å²	145	104.4 Å²	104.4	76%	0.759	62%	0.62	S	S	*	*	H	α-helix	trans	-91	-24.4	172.7	-97.9	79.2	0	0	0	113.3	L648 A654 A655	L648-L652 PolarHBondContact O-N 3.47Å; L652-A654 PolarHBondContact O-N 2.97Å; L652-A655 PolarHBondContact O-N 3.44Å
653	A	26.6	Very low	36.2	Very low	60 Å²	60	96.1 Å²	96.1	50%	0.496	59%	0.588	S	S	.	*	H	α-helix	trans	-71.7	-19.3	169.2	0	0	0	0	0	112.8	K649 A655 G656	K649-A653 WeakPolarHBondContact O-CB 3.39Å; K649-A653 PolarHBondContact O-N 3.3Å; A653-A655 PolarHBondContact O-N 3.31Å; A653-A655 VanDerWaalsContact O-N 3.17Å; A653-G656 PolarHBondContact O-N 2.88Å
654	A	28.3	Very low	39.1	Very low	76 Å²	76	95.2 Å²	95.2	63%	0.628	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-13.4	171	0	0	0	0	0	113.7	S650 L652	S650-A654 WeakPolarHBondContact O-CB 3.31Å; S650-A654 PolarHBondContact O-N 3Å; L652-A654 PolarHBondContact O-N 2.97Å
655	A	30.2	Very low	41.5	Very low	97 Å²	97	89 Å²	89	80%	0.802	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	10.3	176.9	0	0	0	0	0	114.6	L652 A653	L652-A655 PolarHBondContact O-N 3.44Å; A653-A655 PolarHBondContact O-N 3.31Å; A653-A655 VanDerWaalsContact O-N 3.17Å
656	G	27.9	Very low	43.7	Very low	59 Å²	59	83.9 Å²	83.9	61%	0.608	51%	0.513	S	S	*	.	S	Bend	trans	-172.6	79.5	-178.1	0	0	0	0	0	111.9	A653 I658	A653-G656 PolarHBondContact O-N 2.88Å; G656-I658 PolarHBondContact O-N 3.03Å
657	V	35.7	Very low	45.5	Very low	108 Å²	108	87.6 Å²	87.6	66%	0.655	52%	0.518	S	S	*	.			trans	-62.9	106	-171.2	175.3	0	0	0	0	113.1
658	I	39	Very low	47.5	Very low	122 Å²	122	87 Å²	87	63%	0.626	51%	0.509	S	S	*	.			trans	70.2	111.6	139.1	-50.7	170.9	0	0	0	119.2	K584 G656 D660	K584-I658 WeakPolarHBondContact CE-O 3.49Å; K584-I658 PolarHBondContact NZ-O 2.92Å; G656-I658 PolarHBondContact O-N 3.03Å; I658-D660 PolarHBondContact O-N 3.26Å; I658-D660 VanDerWaalsContact O-N 3.14Å
659	D	43.4	Very low	49.6	Very low	118 Å²	118	81.9 Å²	81.9	63%	0.631	48%	0.483	S	S	*	.			trans	-46.3	103.3	162.8	-165.2	7.4	0	0	0	112.5
660	D	50.4	Low	51.5	Low	73 Å²	73	74.5 Å²	74.5	39%	0.39	45%	0.452	S	S	.	.			trans	-121	117.2	155.3	-112	-46.4	0	0	0	104.4	K584 I658 K662	K584-D660 IonicContact NZ-OD2 3.52Å; K584-D660 PolarHBondContact NZ-OD2 3.01Å; I658-D660 PolarHBondContact O-N 3.26Å; I658-D660 VanDerWaalsContact O-N 3.14Å; D660-K662 PolarHBondContact O-N 2.99Å
661	T	57.3	Low	53.6	Low	63 Å²	63	73 Å²	73	39%	0.387	44%	0.444	S	S	.	.	S	Bend	trans	-63	-3.2	-168.7	-19.4	0	0	0	0	115.5	E612 N616	E612-T661 WeakPolarHBondContact CG-O 3.37Å; N616-T661 VanDerWaalsContact CG-CG2 3.46Å; N616-T661 VanDerWaalsContact ND2-CG2 3.28Å; N616-T661 WeakPolarHBondContact ND2-CG2 3.32Å; N616-T661 WeakPolarHBondContact OD1-CG2 3.49Å
662	K	72.7	Confident	56	Low	118 Å²	118	73.3 Å²	73.3	51%	0.513	43%	0.433	S	S	.	.			trans	-109.9	114	-172.1	-62.8	-177.1	-178.8	178.6	0	110.5	K588 D660	K588-K662 PolarHBondContact NZ-O 3.26Å; D660-K662 PolarHBondContact O-N 2.99Å
663	F	84	Confident	58.4	Low	37 Å²	37	69.9 Å²	69.9	16%	0.162	41%	0.412	C	S	.	.	S	Bend	trans	-67.3	-44.2	176.4	179.9	-102.3	0	0	0	113.4	Y493 Q497 P589 F604 I608 E612	Y493-F663 HydrophobicContact CE2-CE2 4.14Å; Y493-F663 AromaticContact CE2-CZ 3.62Å; Y493-F663 HydrophobicContact CE2-CZ 3.62Å; Y493-F663 AromaticContact CZ-CZ 3.98Å; Q497-F663 HydrophobicContact CG-CE2 3.76Å; Q497-F663 HydrophobicContact CG-CZ 3.92Å; P589-F663 HydrophobicContact CB-CE1 4.45Å; P589-F663 HydrophobicContact CG-CE1 3.97Å; P589-F663 HydrophobicContact CG-CE2 4.33Å; P589-F663 HydrophobicContact CG-CZ 3.79Å; F604-F663 AromaticContact CZ-CE1 3.81Å; F604-F663 HydrophobicContact CZ-CE1 3.81Å; F604-F663 HydrophobicContact CZ-CZ 4.27Å; I608-F663 HydrophobicContact CD1-CD1 3.88Å; I608-F663 HydrophobicContact CD1-CD2 4.17Å; I608-F663 HydrophobicContact CD1-CE1 3.79Å; I608-F663 HydrophobicContact CD1-CE2 4.09Å; I608-F663 HydrophobicContact CD1-CG 4.05Å; I608-F663 HydrophobicContact CD1-CZ 3.87Å; I608-F663 HydrophobicContact CG1-CD1 4.08Å; I608-F663 HydrophobicContact CG1-CE1 4.2Å; I608-F663 HydrophobicContact CG2-CB 3.63Å; I608-F663 HydrophobicContact CG2-CD1 3.96Å; I608-F663 HydrophobicContact CG2-CG 3.87Å; E612-F663 WeakPolarHBondContact OE1-CB 3.42Å; E612-F663 PolarHBondContact OE1-N 3.34Å
664	F	83.4	Confident	60.5	Low	33 Å²	33	70.3 Å²	70.3	15%	0.145	41%	0.405	C	S	.	.	S	Bend	trans	-90.8	145.8	179.2	-63.1	-74.6	0	0	0	112.1	V590 F604 I608	V590-F664 WeakPolarHBondContact O-CD1 3.44Å; F604-F664 HydrophobicContact CD1-CZ 4.29Å; F604-F664 HydrophobicContact CE1-CE1 4.04Å; F604-F664 AromaticContact CE1-CZ 3.54Å; F604-F664 HydrophobicContact CE1-CZ 3.54Å; F604-F664 HydrophobicContact CZ-CZ 4.18Å; I608-F664 HydrophobicContact CG2-CE2 4.44Å
665	Q	78.1	Confident	62.6	Low	20 Å²	20	68 Å²	68	9%	0.093	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-80.4	132.8	162.3	63.4	-174.1	-58.7	0	0	110.6	K588 P589 V590 V670	K588-Q665 PolarHBondContact O-NE2 3.26Å; P589-Q665 WeakPolarHBondContact O-CG 3.32Å; P589-Q665 PolarHBondContact O-N 2.81Å; V590-Q665 HydrophobicContact CG1-CG 4.32Å; Q665-V670 HydrophobicContact CB-CG2 4.3Å
666	S	70.9	Confident	64.5	Low	48 Å²	48	68 Å²	68	34%	0.336	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-93.7	137.2	168	170.8	0	0	0	0	109.3	L668 N669 V670	S666-L668 PolarHBondContact O-N 2.91Å; S666-L668 PolarHBondContact OG-N 3.49Å; S666-N669 PolarHBondContact O-N 3Å; S666-V670 WeakPolarHBondContact O-CG2 3.07Å; S666-V670 PolarHBondContact O-N 3.45Å
667	K	67.7	Low	66.3	Low	164 Å²	164	65.7 Å²	65.7	71%	0.713	34%	0.342	S	S	*	.	H	α-helix	trans	-55	-33.8	173.6	-69.9	-174.1	-178.4	177.2	0	111.8	E592 A671	E592-K667 IonicContact OE1-NZ 3.64Å; K667-A671 WeakPolarHBondContact O-CB 3.08Å; K667-A671 PolarHBondContact O-N 3.04Å
668	L	68.2	Low	67.8	Low	52 Å²	52	66.3 Å²	66.3	27%	0.272	34%	0.337	S	S	.	.	H	α-helix	trans	-67.4	-48.1	175.4	-170.6	77.2	0	0	0	111.6	S666 V670 A671 E672 V714 A715	S666-L668 PolarHBondContact O-N 2.91Å; S666-L668 PolarHBondContact OG-N 3.49Å; L668-V670 VanDerWaalsContact C-N 3.26Å; L668-V670 PolarHBondContact O-N 3.2Å; L668-A671 CarbonylContact O-C 3.29Å; L668-A671 WeakPolarHBondContact O-CB 3.08Å; L668-A671 PolarHBondContact O-N 3.22Å; L668-A671 VanDerWaalsContact O-N 3.12Å; L668-E672 WeakPolarHBondContact O-CB 3.46Å; L668-E672 WeakPolarHBondContact O-CG 3.43Å; L668-E672 PolarHBondContact O-N 3.45Å; L668-V714 HydrophobicContact CD1-CG1 4.27Å; L668-A715 HydrophobicContact CD1-CB 4.33Å; L668-A715 HydrophobicContact CD2-CB 3.62Å; L668-A715 HydrophobicContact CG-CB 4.31Å
669	N	70.6	Confident	69.2	Low	33 Å²	33	61.7 Å²	61.7	18%	0.176	32%	0.315	C	S	.	.	H	α-helix	trans	-60	-37.8	176.5	-66.8	-3.2	0	0	0	111.8	S666 K673	S666-N669 PolarHBondContact O-N 3Å; N669-K673 WeakPolarHBondContact O-CB 3.43Å; N669-K673 WeakPolarHBondContact O-CG 3.46Å; N669-K673 PolarHBondContact O-N 3.25Å
670	V	70.7	Confident	70.4	Confident	20 Å²	20	61.9 Å²	61.9	12%	0.121	31%	0.31	C	S	.	.	H	α-helix	trans	-66	-45.9	176.5	175.9	0	0	0	0	109.8	L582 F586 Q665 S666 L668 K673 L674	L582-V670 HydrophobicContact CD1-CG1 3.82Å; L582-V670 HydrophobicContact CD2-CG1 4.36Å; F586-V670 HydrophobicContact CE1-CG1 4.48Å; Q665-V670 HydrophobicContact CB-CG2 4.3Å; S666-V670 WeakPolarHBondContact O-CG2 3.07Å; S666-V670 PolarHBondContact O-N 3.45Å; L668-V670 VanDerWaalsContact C-N 3.26Å; L668-V670 PolarHBondContact O-N 3.2Å; V670-K673 PolarHBondContact O-N 3.44Å; V670-L674 HydrophobicContact CG1-CD1 4.16Å; V670-L674 WeakPolarHBondContact O-CB 3.39Å; V670-L674 WeakPolarHBondContact O-CG 3.5Å; V670-L674 PolarHBondContact O-N 3.37Å
671	A	72.1	Confident	71.2	Confident	38 Å²	38	62.7 Å²	62.7	31%	0.314	31%	0.311	S	S	.	.	H	α-helix	trans	-61.3	-43	175.6	0	0	0	0	0	112.6	K667 L668 L674 T675	K667-A671 WeakPolarHBondContact O-CB 3.08Å; K667-A671 PolarHBondContact O-N 3.04Å; L668-A671 CarbonylContact O-C 3.29Å; L668-A671 WeakPolarHBondContact O-CB 3.08Å; L668-A671 PolarHBondContact O-N 3.22Å; L668-A671 VanDerWaalsContact O-N 3.12Å; A671-L674 WeakPolarHBondContact O-CB 3.48Å; A671-L674 PolarHBondContact O-N 2.85Å; A671-T675 PolarHBondContact O-N 2.85Å; A671-T675 PolarHBondContact O-OG1 3.25Å; A671-T675 VanDerWaalsContact O-OG1 3.08Å
672	E	74.6	Confident	71.7	Confident	55 Å²	55	60.7 Å²	60.7	26%	0.257	30%	0.299	S	S	.	.	H	α-helix	trans	-60.5	-45.8	174.4	-75.6	171.2	-174.5	0	0	112.2	L668 L674 T675 H676 V711	L668-E672 WeakPolarHBondContact O-CB 3.46Å; L668-E672 WeakPolarHBondContact O-CG 3.43Å; L668-E672 PolarHBondContact O-N 3.45Å; E672-L674 VanDerWaalsContact C-N 3.3Å; E672-L674 PolarHBondContact O-N 3.36Å; E672-T675 WeakPolarHBondContact CA-OG1 3.38Å; E672-T675 PolarHBondContact O-N 3.19Å; E672-T675 PolarHBondContact O-OG1 3.49Å; E672-H676 VanDerWaalsContact O-CB 3.26Å; E672-H676 WeakPolarHBondContact O-CB 3.31Å; E672-H676 PolarHBondContact O-N 3.48Å; E672-V711 HydrophobicContact CB-CG1 4.33Å; E672-V711 HydrophobicContact CG-CG1 3.39Å
673	K	74	Confident	71.5	Confident	74 Å²	74	57.9 Å²	57.9	32%	0.322	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-35.7	177	-78.2	-177	177.3	-171.3	0	111.5	L582 E585 N669 V670 A677	L582-K673 HydrophobicContact CD2-CB 3.59Å; L582-K673 HydrophobicContact CD2-CD 3.97Å; L582-K673 HydrophobicContact CD2-CG 4.41Å; E585-K673 HydrophobicContact CG-CD 3.84Å; E585-K673 IonicContact OE1-NZ 2.65Å; E585-K673 PolarHBondContact OE1-NZ 2.96Å; N669-K673 WeakPolarHBondContact O-CB 3.43Å; N669-K673 WeakPolarHBondContact O-CG 3.46Å; N669-K673 PolarHBondContact O-N 3.25Å; V670-K673 PolarHBondContact O-N 3.44Å; K673-A677 WeakPolarHBondContact O-CB 3.21Å; K673-A677 PolarHBondContact O-N 2.91Å
674	L	70.5	Confident	70.7	Confident	69 Å²	69	62.5 Å²	62.5	36%	0.361	31%	0.312	S	S	.	.	H	α-helix	trans	-66.2	-46.5	173.3	-78.7	167.4	0	0	0	112.6	L582 V670 A671 E672 A677 H678	L582-L674 HydrophobicContact CD1-CD1 4.07Å; L582-L674 HydrophobicContact CD1-CD2 3.58Å; L582-L674 HydrophobicContact CD1-CG 3.54Å; V670-L674 HydrophobicContact CG1-CD1 4.16Å; V670-L674 WeakPolarHBondContact O-CB 3.39Å; V670-L674 WeakPolarHBondContact O-CG 3.5Å; V670-L674 PolarHBondContact O-N 3.37Å; A671-L674 WeakPolarHBondContact O-CB 3.48Å; A671-L674 PolarHBondContact O-N 2.85Å; E672-L674 VanDerWaalsContact C-N 3.3Å; E672-L674 PolarHBondContact O-N 3.36Å; L674-A677 WeakPolarHBondContact O-CB 3.44Å; L674-A677 PolarHBondContact O-N 3.44Å; L674-H678 WeakPolarHBondContact O-CB 3.42Å; L674-H678 PolarHBondContact O-N 3.36Å
675	T	73.9	Confident	69.9	Low	28 Å²	28	68.7 Å²	68.7	17%	0.172	33%	0.334	C	S	.	.	H	α-helix	trans	-66.5	-41.3	178.9	46.9	0	0	0	0	111.5	A671 E672 A677 H678 T679 V711	A671-T675 PolarHBondContact O-N 2.85Å; A671-T675 PolarHBondContact O-OG1 3.25Å; A671-T675 VanDerWaalsContact O-OG1 3.08Å; E672-T675 WeakPolarHBondContact CA-OG1 3.38Å; E672-T675 PolarHBondContact O-N 3.19Å; E672-T675 PolarHBondContact O-OG1 3.49Å; T675-A677 VanDerWaalsContact C-N 3.32Å; T675-A677 PolarHBondContact O-N 3.03Å; T675-H678 PolarHBondContact O-N 3.37Å; T675-T679 WeakPolarHBondContact O-CB 3.45Å; T675-T679 PolarHBondContact O-N 2.74Å; T675-T679 PolarHBondContact O-OG1 3.17Å; T675-V711 HydrophobicContact CG2-CG2 3.68Å
676	H	69.6	Low	69.3	Low	96 Å²	96	68.8 Å²	68.8	44%	0.444	34%	0.336	S	S	.	.	H	α-helix	trans	-63.8	-38.4	174.4	-173.2	-105.5	0	0	0	112.1	E672 K680 L708	E672-H676 VanDerWaalsContact O-CB 3.26Å; E672-H676 WeakPolarHBondContact O-CB 3.31Å; E672-H676 PolarHBondContact O-N 3.48Å; H676-K680 WeakPolarHBondContact CE1-CE 3.28Å; H676-K680 PolarHBondContact CE1-NZ 2.93Å; H676-K680 WeakPolarHBondContact O-CG 3.5Å; H676-K680 PolarHBondContact O-N 3.2Å; H676-L708 HydrophobicContact CB-CD1 4.25Å
677	A	64.8	Low	69.2	Low	11 Å²	11	72.2 Å²	72.2	9%	0.091	35%	0.354	C	S	.	.	H	α-helix	trans	-63.8	-48.7	173.3	0	0	0	0	0	112.7	L581 K673 L674 T675 T679 K680 E681	L581-A677 HydrophobicContact CB-CB 4.36Å; L581-A677 HydrophobicContact CD1-CB 3.58Å; L581-A677 HydrophobicContact CD2-CB 3.65Å; L581-A677 HydrophobicContact CG-CB 4.03Å; K673-A677 WeakPolarHBondContact O-CB 3.21Å; K673-A677 PolarHBondContact O-N 2.91Å; L674-A677 WeakPolarHBondContact O-CB 3.44Å; L674-A677 PolarHBondContact O-N 3.44Å; T675-A677 VanDerWaalsContact C-N 3.32Å; T675-A677 PolarHBondContact O-N 3.03Å; A677-T679 VanDerWaalsContact C-N 3.29Å; A677-T679 PolarHBondContact O-N 3.39Å; A677-K680 WeakPolarHBondContact O-CB 3.27Å; A677-K680 PolarHBondContact O-N 2.77Å; A677-E681 PolarHBondContact O-N 3.03Å
678	H	67.4	Low	69	Low	121 Å²	121	68.4 Å²	68.4	56%	0.56	35%	0.348	S	S	*	.	H	α-helix	trans	-58.6	-45.1	178.1	-175.8	72	0	0	0	110.6	L674 T675 K680 E681 V682	L674-H678 WeakPolarHBondContact O-CB 3.42Å; L674-H678 PolarHBondContact O-N 3.36Å; T675-H678 PolarHBondContact O-N 3.37Å; H678-K680 PolarHBondContact O-N 2.73Å; H678-E681 PolarHBondContact O-N 2.93Å; H678-V682 VanDerWaalsContact O-CG2 3.26Å; H678-V682 WeakPolarHBondContact O-CG2 3.1Å; H678-V682 PolarHBondContact O-N 3.09Å
679	T	69.1	Low	68	Low	24 Å²	24	70.6 Å²	70.6	15%	0.147	36%	0.36	C	S	.	.	H	α-helix	trans	-58.2	-46.7	175.7	-57	0	0	0	0	111.7	T675 A677 E681 V682 V683	T675-T679 WeakPolarHBondContact O-CB 3.45Å; T675-T679 PolarHBondContact O-N 2.74Å; T675-T679 PolarHBondContact O-OG1 3.17Å; A677-T679 VanDerWaalsContact C-N 3.29Å; A677-T679 PolarHBondContact O-N 3.39Å; T679-E681 VanDerWaalsContact C-N 3.31Å; T679-E681 PolarHBondContact O-N 3.48Å; T679-V682 PolarHBondContact O-N 2.78Å; T679-V683 HydrophobicContact CG2-CG2 4.47Å; T679-V683 WeakPolarHBondContact O-CG2 3.5Å; T679-V683 PolarHBondContact O-N 3.43Å
680	K	69.3	Low	67.2	Low	123 Å²	123	73.8 Å²	73.8	54%	0.535	39%	0.391	S	S	.	.	H	α-helix	trans	-59.3	-40	176.6	-81.1	-179.5	170.4	-179.9	0	112.9	H676 A677 H678 K684	H676-K680 WeakPolarHBondContact CE1-CE 3.28Å; H676-K680 PolarHBondContact CE1-NZ 2.93Å; H676-K680 WeakPolarHBondContact O-CG 3.5Å; H676-K680 PolarHBondContact O-N 3.2Å; A677-K680 WeakPolarHBondContact O-CB 3.27Å; A677-K680 PolarHBondContact O-N 2.77Å; H678-K680 PolarHBondContact O-N 2.73Å; K680-K684 WeakPolarHBondContact O-CB 3.49Å; K680-K684 PolarHBondContact O-N 3.49Å
681	E	66.2	Low	66.3	Low	89 Å²	89	80.6 Å²	80.6	42%	0.416	43%	0.427	S	S	.	.	H	α-helix	trans	-73.2	-38.7	-179.6	-165.5	60.2	-158.4	0	0	112.1	A677 H678 T679 K684 R685	A677-E681 PolarHBondContact O-N 3.03Å; H678-E681 PolarHBondContact O-N 2.93Å; T679-E681 VanDerWaalsContact C-N 3.31Å; T679-E681 PolarHBondContact O-N 3.48Å; E681-K684 PolarHBondContact O-N 3.23Å; E681-R685 WeakPolarHBondContact O-CG 3.48Å; E681-R685 PolarHBondContact O-N 2.94Å
682	V	67.9	Low	65.2	Low	21 Å²	21	81.6 Å²	81.6	13%	0.127	43%	0.427	C	S	.	.	H	α-helix	trans	-58.2	-50	171.6	170.4	0	0	0	0	110.3	H678 T679 K684 R685 V686 L700	H678-V682 VanDerWaalsContact O-CG2 3.26Å; H678-V682 WeakPolarHBondContact O-CG2 3.1Å; H678-V682 PolarHBondContact O-N 3.09Å; T679-V682 PolarHBondContact O-N 2.78Å; V682-K684 VanDerWaalsContact C-N 3.33Å; V682-K684 PolarHBondContact O-N 3.42Å; V682-R685 PolarHBondContact O-N 3.21Å; V682-V686 WeakPolarHBondContact O-CG2 3.3Å; V682-V686 PolarHBondContact O-N 3.48Å; V682-L700 HydrophobicContact CG1-CB 4.42Å; V682-L700 HydrophobicContact CG1-CD2 3.54Å; V682-L700 HydrophobicContact CG1-CG 3.84Å
683	V	69.6	Low	64.3	Low	59 Å²	59	81.7 Å²	81.7	36%	0.358	43%	0.433	S	S	.	.	H	α-helix	trans	-57.4	-46.4	176	172.4	0	0	0	0	110.9	T679 R685 V686 V687 L701	T679-V683 HydrophobicContact CG2-CG2 4.47Å; T679-V683 WeakPolarHBondContact O-CG2 3.5Å; T679-V683 PolarHBondContact O-N 3.43Å; V683-R685 PolarHBondContact O-N 3.35Å; V683-V686 PolarHBondContact O-N 2.04Å; V683-V687 HydrophobicContact CG1-CG2 4.42Å; V683-V687 WeakPolarHBondContact O-CG2 3.33Å; V683-V687 PolarHBondContact O-N 3.02Å; V683-L701 HydrophobicContact CB-CD2 4.41Å; V683-L701 HydrophobicContact CG2-CD2 3.5Å
684	K	67.4	Low	63.3	Low	135 Å²	135	83.2 Å²	83.2	59%	0.587	45%	0.451	S	S	*	.	H	α-helix	trans	-60.7	-42.3	-179.8	-172.5	-178.1	175.8	-170.4	0	112.3	K680 E681 V682 V687 S688	K680-K684 WeakPolarHBondContact O-CB 3.49Å; K680-K684 PolarHBondContact O-N 3.49Å; E681-K684 PolarHBondContact O-N 3.23Å; V682-K684 VanDerWaalsContact C-N 3.33Å; V682-K684 PolarHBondContact O-N 3.42Å; K684-V687 PolarHBondContact O-N 2.93Å; K684-S688 WeakPolarHBondContact O-CB 3.43Å; K684-S688 PolarHBondContact O-N 3.16Å; K684-S688 PolarHBondContact O-OG 3.11Å
685	R	64.8	Low	62.6	Low	163 Å²	163	83.2 Å²	83.2	62%	0.615	46%	0.461	S	S	*	.	H	α-helix	trans	-66.7	-38.5	176.9	-74	-176	-177.8	-175.1	-0.2	112.9	E681 V682 V683 V687 S688 N689	E681-R685 WeakPolarHBondContact O-CG 3.48Å; E681-R685 PolarHBondContact O-N 2.94Å; V682-R685 PolarHBondContact O-N 3.21Å; V683-R685 PolarHBondContact O-N 3.35Å; R685-V687 VanDerWaalsContact C-N 3.33Å; R685-S688 WeakPolarHBondContact CA-OG 3.04Å; R685-S688 PolarHBondContact O-N 3.06Å; R685-S688 PolarHBondContact O-OG 3.41Å; R685-N689 PolarHBondContact O-N 2.96Å; R685-N689 VanDerWaalsContact O-N 3.08Å
686	V	66.9	Low	61.8	Low	22 Å²	22	86.9 Å²	86.9	13%	0.133	48%	0.479	C	S	.	.	H	α-helix	trans	-63.3	-41.8	175.1	172.4	0	0	0	0	110.7	V682 V683 A697 L700	V682-V686 WeakPolarHBondContact O-CG2 3.3Å; V682-V686 PolarHBondContact O-N 3.48Å; V683-V686 PolarHBondContact O-N 2.04Å; V686-A697 HydrophobicContact CG1-CB 3.58Å; V686-L700 HydrophobicContact CG2-CB 4.37Å; V686-L700 HydrophobicContact CG2-CD2 3.57Å
687	V	68.5	Low	60.9	Low	119 Å²	119	83 Å²	83	72%	0.721	47%	0.465	S	S	*	.	H	α-helix	trans	-72	-33.1	178.2	175.3	0	0	0	0	112.2	V683 K684 R685	V683-V687 HydrophobicContact CG1-CG2 4.42Å; V683-V687 WeakPolarHBondContact O-CG2 3.33Å; V683-V687 PolarHBondContact O-N 3.02Å; K684-V687 PolarHBondContact O-N 2.93Å; R685-V687 VanDerWaalsContact C-N 3.33Å
688	S	62.6	Low	60.6	Low	84 Å²	84	87.2 Å²	87.2	59%	0.587	49%	0.489	S	S	*	.	H	α-helix	trans	-80.4	-28.1	-178.4	65.8	0	0	0	0	114.6	K684 R685 A690	K684-S688 WeakPolarHBondContact O-CB 3.43Å; K684-S688 PolarHBondContact O-N 3.16Å; K684-S688 PolarHBondContact O-OG 3.11Å; R685-S688 WeakPolarHBondContact CA-OG 3.04Å; R685-S688 PolarHBondContact O-N 3.06Å; R685-S688 PolarHBondContact O-OG 3.41Å; S688-A690 PolarHBondContact O-N 3.46Å
689	N	48.6	Very low	60.2	Low	98 Å²	98	84.1 Å²	84.1	52%	0.524	48%	0.484	S	S	.	.			trans	-90.6	97.3	175	-83.2	-1.7	0	0	0	110	R685 D691 I692	R685-N689 PolarHBondContact O-N 2.96Å; R685-N689 VanDerWaalsContact O-N 3.08Å; N689-D691 PolarHBondContact O-N 3.23Å; N689-D691 VanDerWaalsContact O-N 3.1Å; N689-I692 HydrophobicContact CB-CD1 3.67Å; N689-I692 HydrophobicContact CB-CG1 3.87Å; N689-I692 PolarHBondContact O-N 3.37Å
690	A	53.8	Low	59.4	Low	100 Å²	100	87.1 Å²	87.1	83%	0.826	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-14.7	176.6	0	0	0	0	0	114.3	S688	S688-A690 PolarHBondContact O-N 3.46Å
691	D	50	Low	58.6	Low	164 Å²	164	84.1 Å²	84.1	88%	0.877	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	11.1	-175.6	-66.2	-35	0	0	0	115	N689	N689-D691 PolarHBondContact O-N 3.23Å; N689-D691 VanDerWaalsContact O-N 3.1Å
692	I	50.6	Low	58.3	Low	58 Å²	58	82.5 Å²	82.5	30%	0.297	49%	0.486	S	S	.	.	S	Bend	trans	-80.3	123.7	172.9	-63.8	169.9	0	0	0	109.1	N689 N696 A697	N689-I692 HydrophobicContact CB-CD1 3.67Å; N689-I692 HydrophobicContact CB-CG1 3.87Å; N689-I692 PolarHBondContact O-N 3.37Å; I692-N696 HydrophobicContact CG2-CB 3.77Å; I692-A697 HydrophobicContact CG2-CB 4.08Å
693	S	54.4	Low	57.8	Low	57 Å²	57	84.3 Å²	84.3	40%	0.399	50%	0.504	S	S	.	.			trans	-58.3	142.5	174.8	74.7	0	0	0	0	111	A695 N696 A697	S693-A695 PolarHBondContact O-N 2.9Å; S693-N696 PolarHBondContact O-N 3.24Å; S693-N696 PolarHBondContact OG-ND2 2.95Å; S693-A697 PolarHBondContact O-N 2.62Å; S693-A697 VanDerWaalsContact O-N 3.15Å
694	P	53.2	Low	56.9	Low	106 Å²	106	81.9 Å²	81.9	69%	0.688	49%	0.489	S	S	*	.	H	α-helix	trans	-52.6	-34.6	-176.8	-27	32.6	0	0	0	113.8	A697 V698	P694-A697 PolarHBondContact O-N 2.68Å; P694-V698 VanDerWaalsContact O-CG2 3.27Å; P694-V698 WeakPolarHBondContact O-CG2 3.25Å; P694-V698 PolarHBondContact O-N 3.03Å
695	A	56.9	Low	56.2	Low	70 Å²	70	82.1 Å²	82.1	58%	0.579	49%	0.492	S	S	*	.	H	α-helix	trans	-65.5	-41.4	177.8	0	0	0	0	0	112.8	S693 V698 A699	S693-A695 PolarHBondContact O-N 2.9Å; A695-V698 PolarHBondContact O-N 3.48Å; A695-A699 PolarHBondContact O-N 3.49Å; A695-A699 VanDerWaalsContact O-N 3.08Å
696	N	55.6	Low	55.7	Low	104 Å²	104	77.6 Å²	77.6	56%	0.556	48%	0.483	S	S	*	.	H	α-helix	trans	-70.9	-36.2	178.3	-72.4	-6.7	0	0	0	111.5	I692 S693 A699 L700	I692-N696 HydrophobicContact CG2-CB 3.77Å; S693-N696 PolarHBondContact O-N 3.24Å; S693-N696 PolarHBondContact OG-ND2 2.95Å; N696-A699 PolarHBondContact O-N 3.46Å; N696-L700 WeakPolarHBondContact O-CB 3.39Å; N696-L700 PolarHBondContact O-N 3.26Å
697	A	50.5	Low	54.9	Low	16 Å²	16	78.6 Å²	78.6	13%	0.132	49%	0.494	C	S	.	.	H	α-helix	trans	-62.5	-44.7	174.1	0	0	0	0	0	112	V686 I692 S693 P694 L700 L701	V686-A697 HydrophobicContact CG1-CB 3.58Å; I692-A697 HydrophobicContact CG2-CB 4.08Å; S693-A697 PolarHBondContact O-N 2.62Å; S693-A697 VanDerWaalsContact O-N 3.15Å; P694-A697 PolarHBondContact O-N 2.68Å; A697-L700 PolarHBondContact O-N 3.28Å; A697-L701 WeakPolarHBondContact O-CB 3.41Å; A697-L701 VanDerWaalsContact O-CG 3.3Å; A697-L701 WeakPolarHBondContact O-CG 3.41Å; A697-L701 PolarHBondContact O-N 3Å
698	V	59	Low	54	Low	99 Å²	99	75.5 Å²	75.5	60%	0.6	47%	0.473	S	S	*	.	H	α-helix	trans	-65	-41.7	177.8	171.3	0	0	0	0	111.6	P694 A695 L701 S702	P694-V698 VanDerWaalsContact O-CG2 3.27Å; P694-V698 WeakPolarHBondContact O-CG2 3.25Å; P694-V698 PolarHBondContact O-N 3.03Å; A695-V698 PolarHBondContact O-N 3.48Å; V698-L701 PolarHBondContact O-N 3.46Å; V698-S702 WeakPolarHBondContact O-CB 3.41Å; V698-S702 PolarHBondContact O-N 3.05Å; V698-S702 PolarHBondContact O-OG 2.95Å
699	A	58.5	Low	53.5	Low	55 Å²	55	73.9 Å²	73.9	46%	0.455	46%	0.464	S	S	.	.	H	α-helix	trans	-64.6	-38.6	177.1	0	0	0	0	0	112.9	A695 N696 S702 A703	A695-A699 PolarHBondContact O-N 3.49Å; A695-A699 VanDerWaalsContact O-N 3.08Å; N696-A699 PolarHBondContact O-N 3.46Å; A699-S702 PolarHBondContact O-OG 3.44Å; A699-A703 WeakPolarHBondContact O-CB 3.39Å; A699-A703 PolarHBondContact O-N 3.5Å; A699-A703 VanDerWaalsContact O-N 3.12Å
700	L	53	Low	53.7	Low	88 Å²	88	70.8 Å²	70.8	46%	0.461	45%	0.453	S	S	.	.	H	α-helix	trans	-67.9	-42.5	177.3	-142	83.8	0	0	0	111.5	V682 V686 N696 A697 S704	V682-L700 HydrophobicContact CG1-CB 4.42Å; V682-L700 HydrophobicContact CG1-CD2 3.54Å; V682-L700 HydrophobicContact CG1-CG 3.84Å; V686-L700 HydrophobicContact CG2-CB 4.37Å; V686-L700 HydrophobicContact CG2-CD2 3.57Å; N696-L700 WeakPolarHBondContact O-CB 3.39Å; N696-L700 PolarHBondContact O-N 3.26Å; A697-L700 PolarHBondContact O-N 3.28Å; L700-S704 PolarHBondContact O-N 3.33Å
701	L	53.2	Low	53.2	Low	60 Å²	60	67.1 Å²	67.1	31%	0.314	42%	0.42	S	S	.	.	H	α-helix	trans	-66.3	-42.8	176.9	-72.1	171.1	0	0	0	111.7	V683 A697 V698 S704 Q705	V683-L701 HydrophobicContact CB-CD2 4.41Å; V683-L701 HydrophobicContact CG2-CD2 3.5Å; A697-L701 WeakPolarHBondContact O-CB 3.41Å; A697-L701 VanDerWaalsContact O-CG 3.3Å; A697-L701 WeakPolarHBondContact O-CG 3.41Å; A697-L701 PolarHBondContact O-N 3Å; V698-L701 PolarHBondContact O-N 3.46Å; L701-S704 PolarHBondContact O-N 3.17Å; L701-S704 PolarHBondContact O-OG 3.14Å; L701-Q705 PolarHBondContact O-N 3.18Å
702	S	59.7	Low	52.9	Low	54 Å²	54	63.1 Å²	63.1	38%	0.378	40%	0.399	S	S	.	.	H	α-helix	trans	-63.2	-43.4	178	67	0	0	0	0	111.6	V698 A699 S704 Q705 T706	V698-S702 WeakPolarHBondContact O-CB 3.41Å; V698-S702 PolarHBondContact O-N 3.05Å; V698-S702 PolarHBondContact O-OG 2.95Å; A699-S702 PolarHBondContact O-OG 3.44Å; S702-S704 VanDerWaalsContact C-N 3.31Å; S702-S704 PolarHBondContact O-N 3.48Å; S702-Q705 PolarHBondContact O-N 3.41Å; S702-T706 PolarHBondContact O-N 2.61Å; S702-T706 PolarHBondContact O-OG1 3.37Å
703	A	56.3	Low	52.6	Low	60 Å²	60	63.8 Å²	63.8	50%	0.496	41%	0.408	S	S	.	.	H	α-helix	trans	-57.4	-41.8	175	0	0	0	0	0	112.7	A699 T706 A707	A699-A703 WeakPolarHBondContact O-CB 3.39Å; A699-A703 PolarHBondContact O-N 3.5Å; A699-A703 VanDerWaalsContact O-N 3.12Å; A703-T706 PolarHBondContact O-N 2.94Å; A703-A707 PolarHBondContact O-N 3.36Å
704	S	50.4	Low	51.9	Low	7 Å²	7	65.4 Å²	65.4	5%	0.049	42%	0.416	C	S	.	.	H	α-helix	trans	-66.6	-39.2	176.8	72.1	0	0	0	0	113.1	L700 L701 S702 A707 L708	L700-S704 PolarHBondContact O-N 3.33Å; L701-S704 PolarHBondContact O-N 3.17Å; L701-S704 PolarHBondContact O-OG 3.14Å; S702-S704 VanDerWaalsContact C-N 3.31Å; S702-S704 PolarHBondContact O-N 3.48Å; S704-A707 PolarHBondContact O-N 3.48Å; S704-L708 PolarHBondContact O-N 3.46Å; S704-L708 VanDerWaalsContact O-N 3.08Å
705	Q	52.5	Low	50.9	Low	140 Å²	140	61 Å²	61	65%	0.654	39%	0.389	S	S	*	.	H	α-helix	trans	-66.3	-39	174.5	-73.9	-176.5	-20	0	0	111.7	L701 S702 A707 L708 A709	L701-Q705 PolarHBondContact O-N 3.18Å; S702-Q705 PolarHBondContact O-N 3.41Å; Q705-A707 VanDerWaalsContact C-N 3.35Å; Q705-L708 PolarHBondContact O-N 3.03Å; Q705-A709 WeakPolarHBondContact O-CB 3.42Å; Q705-A709 PolarHBondContact O-N 3.35Å
706	T	55.7	Low	49.8	Very low	68 Å²	68	63.2 Å²	63.2	42%	0.417	39%	0.39	S	S	.	.	H	α-helix	trans	-63.6	-39.9	175.4	-47.1	0	0	0	0	111.5	S702 A703 A709 A710	S702-T706 PolarHBondContact O-N 2.61Å; S702-T706 PolarHBondContact O-OG1 3.37Å; A703-T706 PolarHBondContact O-N 2.94Å; T706-A709 PolarHBondContact O-N 2.83Å; T706-A710 WeakPolarHBondContact O-CB 3.26Å; T706-A710 PolarHBondContact O-N 3.42Å
707	A	50.7	Low	48.6	Very low	44 Å²	44	64.7 Å²	64.7	36%	0.364	40%	0.397	S	S	.	.	H	α-helix	trans	-63.8	-42.2	174.6	0	0	0	0	0	112.2	A703 S704 Q705 A710 V711	A703-A707 PolarHBondContact O-N 3.36Å; S704-A707 PolarHBondContact O-N 3.48Å; Q705-A707 VanDerWaalsContact C-N 3.35Å; A707-A710 PolarHBondContact O-N 3.34Å; A707-V711 WeakPolarHBondContact O-CG2 3.42Å; A707-V711 PolarHBondContact O-N 3.24Å; A707-V711 VanDerWaalsContact O-N 3.14Å
708	L	48.9	Very low	47.5	Very low	54 Å²	54	67.3 Å²	67.3	28%	0.283	43%	0.426	S	S	.	.	H	α-helix	trans	-64.5	-42.2	175.1	-158.3	95.4	0	0	0	111.6	H676 S704 Q705 V711 N712	H676-L708 HydrophobicContact CB-CD1 4.25Å; S704-L708 PolarHBondContact O-N 3.46Å; S704-L708 VanDerWaalsContact O-N 3.08Å; Q705-L708 PolarHBondContact O-N 3.03Å; L708-V711 PolarHBondContact O-N 3.03Å; L708-N712 PolarHBondContact O-N 2.84Å
709	A	52.6	Low	46	Very low	49 Å²	49	66 Å²	66	41%	0.405	42%	0.421	S	S	.	.	H	α-helix	trans	-63.9	-42.1	176.6	0	0	0	0	0	111.7	Q705 T706 V711 N712 S713	Q705-A709 WeakPolarHBondContact O-CB 3.42Å; Q705-A709 PolarHBondContact O-N 3.35Å; T706-A709 PolarHBondContact O-N 2.83Å; A709-V711 VanDerWaalsContact C-N 3.35Å; A709-V711 PolarHBondContact O-N 3.13Å; A709-N712 PolarHBondContact O-N 3.31Å; A709-S713 WeakPolarHBondContact O-CB 3.3Å; A709-S713 PolarHBondContact O-N 2.85Å; A709-S713 PolarHBondContact O-OG 2.79Å
710	A	51.2	Low	44.4	Very low	34 Å²	34	71.3 Å²	71.3	28%	0.281	44%	0.436	S	S	.	.	H	α-helix	trans	-60.6	-42.4	175.9	0	0	0	0	0	112	T706 A707 S713 V714 L739	T706-A710 WeakPolarHBondContact O-CB 3.26Å; T706-A710 PolarHBondContact O-N 3.42Å; A707-A710 PolarHBondContact O-N 3.34Å; A710-S713 PolarHBondContact O-N 3.21Å; A710-V714 WeakPolarHBondContact O-CG2 3.47Å; A710-V714 PolarHBondContact O-N 2.97Å; A710-V714 VanDerWaalsContact O-N 3.15Å; A710-L739 HydrophobicContact CB-CD2 4.45Å
711	V	44	Very low	43	Very low	23 Å²	23	72.5 Å²	72.5	14%	0.139	45%	0.452	C	S	.	.	H	α-helix	trans	-65.2	-43.1	175.1	177.1	0	0	0	0	111.5	E672 T675 A707 L708 A709 S713 V714 A715	E672-V711 HydrophobicContact CB-CG1 4.33Å; E672-V711 HydrophobicContact CG-CG1 3.39Å; T675-V711 HydrophobicContact CG2-CG2 3.68Å; A707-V711 WeakPolarHBondContact O-CG2 3.42Å; A707-V711 PolarHBondContact O-N 3.24Å; A707-V711 VanDerWaalsContact O-N 3.14Å; L708-V711 PolarHBondContact O-N 3.03Å; A709-V711 VanDerWaalsContact C-N 3.35Å; A709-V711 PolarHBondContact O-N 3.13Å; V711-S713 VanDerWaalsContact C-N 3.34Å; V711-S713 PolarHBondContact O-N 2.94Å; V711-V714 PolarHBondContact O-N 2.64Å; V711-A715 WeakPolarHBondContact O-CB 3.21Å; V711-A715 PolarHBondContact O-N 3.3Å
712	N	43.6	Very low	41.6	Very low	80 Å²	80	77.2 Å²	77.2	43%	0.428	48%	0.477	S	S	.	.	H	α-helix	trans	-64.6	-35.5	176.7	-77.5	-13.8	0	0	0	112.8	L708 A709 A715 L716	L708-N712 PolarHBondContact O-N 2.84Å; A709-N712 PolarHBondContact O-N 3.31Å; N712-A715 WeakPolarHBondContact O-CB 3.33Å; N712-A715 PolarHBondContact O-N 3.03Å; N712-L716 WeakPolarHBondContact O-CG 3.31Å; N712-L716 PolarHBondContact O-N 2.93Å
713	S	45	Very low	39.8	Very low	71 Å²	71	80.3 Å²	80.3	50%	0.497	50%	0.499	S	S	.	.	H	α-helix	trans	-66.2	-38.7	175.4	-62.5	0	0	0	0	112	A709 A710 V711 L717	A709-S713 WeakPolarHBondContact O-CB 3.3Å; A709-S713 PolarHBondContact O-N 2.85Å; A709-S713 PolarHBondContact O-OG 2.79Å; A710-S713 PolarHBondContact O-N 3.21Å; V711-S713 VanDerWaalsContact C-N 3.34Å; V711-S713 PolarHBondContact O-N 2.94Å; S713-L717 PolarHBondContact O-N 2.85Å
714	V	39.8	Very low	38.2	Very low	91 Å²	91	80.7 Å²	80.7	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-69.7	-37.1	173.2	176	0	0	0	0	111.1	L668 A710 V711 L717 G718	L668-V714 HydrophobicContact CD1-CG1 4.27Å; A710-V714 WeakPolarHBondContact O-CG2 3.47Å; A710-V714 PolarHBondContact O-N 2.97Å; A710-V714 VanDerWaalsContact O-N 3.15Å; V711-V714 PolarHBondContact O-N 2.64Å; V714-L717 PolarHBondContact O-N 3.1Å; V714-G718 PolarHBondContact O-N 2.71Å; V714-G718 VanDerWaalsContact O-N 3.16Å
715	A	32.6	Very low	36.8	Very low	15 Å²	15	86.3 Å²	86.3	12%	0.124	55%	0.546	C	S	.	.	H	α-helix	trans	-61.1	-43	175.3	0	0	0	0	0	112.6	L668 V711 N712 L717 G718 S719	L668-A715 HydrophobicContact CD1-CB 4.33Å; L668-A715 HydrophobicContact CD2-CB 3.62Å; L668-A715 HydrophobicContact CG-CB 4.31Å; V711-A715 WeakPolarHBondContact O-CB 3.21Å; V711-A715 PolarHBondContact O-N 3.3Å; N712-A715 WeakPolarHBondContact O-CB 3.33Å; N712-A715 PolarHBondContact O-N 3.03Å; A715-L717 VanDerWaalsContact C-N 3.31Å; A715-L717 PolarHBondContact O-N 2.92Å; A715-G718 PolarHBondContact O-N 3.19Å; A715-S719 PolarHBondContact O-N 3.47Å; A715-S719 PolarHBondContact O-OG 3.33Å
716	L	32.6	Very low	35.5	Very low	115 Å²	115	87.8 Å²	87.8	60%	0.602	56%	0.556	S	S	*	*	H	α-helix	trans	-65.2	-31.5	177.2	-81.5	162.3	0	0	0	112.9	N712	N712-L716 WeakPolarHBondContact O-CG 3.31Å; N712-L716 PolarHBondContact O-N 2.93Å
717	L	30.7	Very low	34	Very low	135 Å²	135	90.2 Å²	90.2	71%	0.707	57%	0.574	S	S	*	*	H	α-helix	trans	-75.3	-30.4	175.4	-72.5	165.7	0	0	0	112.6	S713 V714 A715	S713-L717 PolarHBondContact O-N 2.85Å; V714-L717 PolarHBondContact O-N 3.1Å; A715-L717 VanDerWaalsContact C-N 3.31Å; A715-L717 PolarHBondContact O-N 2.92Å
718	G	27.8	Very low	32.6	Very low	71 Å²	71	91.5 Å²	91.5	73%	0.732	59%	0.591	S	S	*	*	H	α-helix	trans	-81.9	-15.6	178.3	0	0	0	0	0	115.3	V714 A715	V714-G718 PolarHBondContact O-N 2.71Å; V714-G718 VanDerWaalsContact O-N 3.16Å; A715-G718 PolarHBondContact O-N 3.19Å
719	S	26.5	Very low	31.4	Very low	72 Å²	72	96.7 Å²	96.7	50%	0.503	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.5	18.4	-175.5	70.9	0	0	0	0	114.7	A715 S721	A715-S719 PolarHBondContact O-N 3.47Å; A715-S719 PolarHBondContact O-OG 3.33Å; S719-S721 PolarHBondContact O-N 3.25Å
720	Q	24.9	Very low	30	Very low	167 Å²	167	100 Å²	100	78%	0.78	63%	0.634	S	S	*	*			trans	-78	70.4	170.6	-76.5	-172.6	-1.5	0	0	111.5
721	S	23.7	Very low	28.6	Very low	113 Å²	113	105.9 Å²	105.9	79%	0.79	66%	0.661	S	S	*	*			trans	-138.5	53.6	149.7	63	0	0	0	0	109.5	S719	S719-S721 PolarHBondContact O-N 3.25Å
722	L	24.7	Very low	27.6	Very low	158 Å²	158	111.4 Å²	111.4	83%	0.827	69%	0.688	S	S	*	*			trans	-124.1	100.3	157.2	-96	107.5	0	0	0	109.1	G724	L722-G724 PolarHBondContact O-N 3.22Å
723	S	22.3	Very low	26.6	Very low	120 Å²	120	114.2 Å²	114.2	84%	0.839	70%	0.703	S	S	*	*			trans	-47.9	128.3	157.8	52.1	0	0	0	0	110.9
724	G	22.3	Very low	25.5	Very low	67 Å²	67	117.6 Å²	117.6	69%	0.691	72%	0.721	S	S	*	*			trans	126.1	107.3	156.3	0	0	0	0	0	115.4	L722	L722-G724 PolarHBondContact O-N 3.22Å
725	C	21.5	Very low	24.7	Very low	125 Å²	125	120 Å²	120	85%	0.845	73%	0.729	S	S	*	*			trans	76.8	84.7	144.1	-54.5	0	0	0	0	118.3
726	I	24.8	Very low	24.1	Very low	171 Å²	171	122.7 Å²	122.7	88%	0.877	76%	0.759	S	S	*	*			trans	-133.6	115.3	133.4	-56.8	-178.3	0	0	0	108.3
727	P	22.9	Very low	23.6	Very low	120 Å²	120	123.3 Å²	123.3	78%	0.779	76%	0.761	S	S	*	*			trans	-86.2	141.3	175.8	32.9	-29	0	0	0	111.3
728	G	23.1	Very low	23.1	Very low	70 Å²	70	126.5 Å²	126.5	72%	0.722	77%	0.769	S	S	*	*	S	Bend	trans	91	103.7	149.3	0	0	0	0	0	117.3
729	N	21.9	Very low	22.9	Very low	164 Å²	164	129.4 Å²	129.4	88%	0.877	77%	0.767	S	S	*	*			trans	39.7	89.5	139.2	-101.5	8.8	0	0	0	117.8
730	T	23.4	Very low	22.7	Very low	119 Å²	119	131.1 Å²	131.1	73%	0.73	78%	0.777	S	S	*	*			trans	-133.3	113.3	143	39.8	0	0	0	0	108.4	I732	T730-I732 VanDerWaalsContact C-N 3.33Å; T730-I732 PolarHBondContact O-N 3.38Å
731	N	21.8	Very low	22.7	Very low	156 Å²	156	132.5 Å²	132.5	83%	0.834	78%	0.784	S	S	*	*			trans	-54.6	98.8	162.4	-74.5	-21.3	0	0	0	107.6
732	I	23.2	Very low	22.7	Very low	139 Å²	139	135.2 Å²	135.2	71%	0.713	78%	0.784	S	S	*	*			trans	-92.4	97.4	164.2	-61.9	176.1	0	0	0	104.4	T730 T734	T730-I732 VanDerWaalsContact C-N 3.33Å; T730-I732 PolarHBondContact O-N 3.38Å; I732-T734 PolarHBondContact O-N 2.6Å; I732-T734 VanDerWaalsContact O-N 3.11Å
733	D	22.1	Very low	22.6	Very low	140 Å²	140	137.2 Å²	137.2	75%	0.749	79%	0.786	S	S	*	*			trans	-51.6	116.8	161.8	-77.9	-37.7	0	0	0	107.3	I735	D733-I735 PolarHBondContact O-N 3.3Å
734	T	22.9	Very low	22.7	Very low	142 Å²	142	141.7 Å²	141.7	87%	0.871	79%	0.791	S	S	*	*			trans	-66.7	86.8	177.4	-16.3	0	0	0	0	107.9	I732 G736	I732-T734 PolarHBondContact O-N 2.6Å; I732-T734 VanDerWaalsContact O-N 3.11Å; T734-G736 PolarHBondContact O-N 3.44Å
735	I	21.9	Very low	22.8	Very low	140 Å²	140	146.1 Å²	146.1	72%	0.718	80%	0.797	S	S	*	*			trans	-62.6	104.2	164.7	-63.8	173.2	0	0	0	105.5	D733 I737	D733-I735 PolarHBondContact O-N 3.3Å; I735-I737 HydrophobicContact CG2-CG1 4.07Å; I735-I737 PolarHBondContact O-N 3.24Å
736	G	21.2	Very low	22.8	Very low	72 Å²	72	144.3 Å²	144.3	74%	0.742	79%	0.786	S	S	*	*			trans	-63.6	97.4	172.4	0	0	0	0	0	109.7	T734 K738	T734-G736 PolarHBondContact O-N 3.44Å; G736-K738 PolarHBondContact O-N 3.41Å
737	I	22.2	Very low	23	Very low	129 Å²	129	141.4 Å²	141.4	66%	0.662	78%	0.781	S	S	*	*			trans	-83	103.9	176.6	-62.7	172.7	0	0	0	107.9	I735 L739	I735-I737 HydrophobicContact CG2-CG1 4.07Å; I735-I737 PolarHBondContact O-N 3.24Å; I737-L739 PolarHBondContact O-N 2.92Å
738	K	20.2	Very low	23	Very low	201 Å²	201	142 Å²	142	87%	0.874	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-63	119.4	166.3	-80.6	-178.2	171.9	-176	0	109.3	G736	G736-K738 PolarHBondContact O-N 3.41Å
739	L	22.9	Very low	23.2	Very low	132 Å²	132	144.7 Å²	144.7	69%	0.691	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-67.6	142.1	168.5	-84.3	152.3	0	0	0	110.2	A710 I737	A710-L739 HydrophobicContact CB-CD2 4.45Å; I737-L739 PolarHBondContact O-N 2.92Å
740	P	22.6	Very low	23.3	Very low	109 Å²	109	143.6 Å²	143.6	71%	0.708	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-71.8	132.6	178.4	-10.8	26.1	0	0	0	111.7	Q742	P740-Q742 VanDerWaalsContact C-N 3.34Å; P740-Q742 PolarHBondContact O-N 3.09Å
741	E	25.2	Very low	23.4	Very low	196 Å²	196	146.5 Å²	146.5	92%	0.916	78%	0.783	S	S	*	*			trans	-66.4	80.5	172.3	-70	176.9	160.2	0	0	111.7
742	Q	23	Very low	23.7	Very low	169 Å²	169	148.5 Å²	148.5	79%	0.79	79%	0.79	S	S	*	*			trans	-143	131	160	-70.9	-170.9	-13.6	0	0	108.7	P740	P740-Q742 VanDerWaalsContact C-N 3.34Å; P740-Q742 PolarHBondContact O-N 3.09Å
743	F	23.8	Very low	23.7	Very low	201 Å²	201	149.7 Å²	149.7	88%	0.882	80%	0.797	S	S	*	*			trans	89.5	56.2	-167.4	-60.7	-78.3	0	0	0	116.6
744	F	24	Very low	23.9	Very low	213 Å²	213	151.6 Å²	151.6	93%	0.934	80%	0.802	S	S	*	*			trans	-107.9	119	136.7	-90.3	-88.5	0	0	0	108	S746	F744-S746 PolarHBondContact O-N 2.9Å
745	I	24.3	Very low	24.1	Very low	160 Å²	160	150.2 Å²	150.2	82%	0.821	80%	0.798	S	S	*	*			trans	-70	112.6	164.6	-66.8	171.4	0	0	0	105.1	S747	I745-S747 PolarHBondContact O-N 2.95Å
746	S	22.3	Very low	24.5	Very low	88 Å²	88	151 Å²	151	62%	0.615	80%	0.802	S	S	*	*			trans	-59	120.2	173.3	53.2	0	0	0	0	109.2	F744	F744-S746 PolarHBondContact O-N 2.9Å
747	S	27.4	Very low	24.7	Very low	110 Å²	110	157 Å²	157	77%	0.769	81%	0.808	S	S	*	*			trans	-92.7	98.8	149.3	59.8	0	0	0	0	106.1	I745 C749	I745-S747 PolarHBondContact O-N 2.95Å; S747-C749 PolarHBondContact O-N 3Å
748	D	23.5	Very low	25.1	Very low	133 Å²	133	155.9 Å²	155.9	71%	0.711	81%	0.811	S	S	*	*			trans	-58.5	105.3	165.6	-65.6	-37	0	0	0	108.2
749	C	27.5	Very low	25.2	Very low	125 Å²	125	151.9 Å²	151.9	85%	0.845	80%	0.804	S	S	*	*			trans	-127.4	86.8	155.3	-85.2	0	0	0	0	105.6	S747	S747-C749 PolarHBondContact O-N 3Å
750	D	24.2	Very low	25.3	Very low	142 Å²	142	152.7 Å²	152.7	76%	0.759	81%	0.809	S	S	*	*			trans	-56.9	161.1	166.3	-84.8	-44.8	0	0	0	112.1
751	E	25.8	Very low	25.7	Very low	179 Å²	179	160.5 Å²	160.5	84%	0.836	84%	0.836	S	S	*	*			trans	79.6	92.3	161.1	-69.2	175.8	177.7	0	0	118.2
752	M	27.5	Very low	25.7	Very low	199 Å²	199	158.7 Å²	158.7	98%	0.98	83%	0.832	S	S	*	*				-162.3	76.2	116	-99.9	179.3	-143.5	0	0	109
753	N	24.2	Very low	25.9	Very low	163 Å²	163	158.2 Å²	158.2	87%	0.872	83%	0.834	S	S	*	*			trans	-75.7	126.2	155.5	-103	-22.5	0	0	0	107.3
754	E	25.9	Very low	26	Very low	180 Å²	180	155.8 Å²	155.8	84%	0.841	83%	0.831	S	S	*	*				165.5	145	122.8	-92.1	-172.6	165.8	0	0	112.2
755	S	26.9	Very low	26.1	Very low	113 Å²	113	152.4 Å²	152.4	79%	0.79	83%	0.825	S	S	*	*			trans	80.3	127	171.2	86.6	0	0	0	0	113.9
756	I	30.7	Very low	26.2	Very low	156 Å²	156	151.9 Å²	151.9	80%	0.8	83%	0.825	S	S	*	*			cis	-148.7	136.5	29.8	-73.1	172.6	0	0	0	109.6
757	K	25	Very low	26.5	Very low	200 Å²	200	156.2 Å²	156.2	87%	0.87	84%	0.839	S	S	*	*			trans	-77.9	138.8	165.1	-74.4	164.3	166.4	174	0	110
758	S	30.9	Very low	26.4	Very low	104 Å²	104	159.5 Å²	159.5	73%	0.727	84%	0.844	S	S	*	*			trans	-177.1	100.6	136.5	55.6	0	0	0	0	107.8
759	T	22.8	Very low	26.6	Very low	118 Å²	118	161.5 Å²	161.5	72%	0.724	86%	0.855	S	S	*	*				43.9	117.6	88.7	37.2	0	0	0	0	116.6
760	D	24	Very low	26.5	Very low	148 Å²	148	164.6 Å²	164.6	79%	0.791	86%	0.856	S	S	*	*			trans	77.3	129.2	138.8	-59.7	-24.2	0	0	0	121.6
761	Q	30.8	Very low	26.8	Very low	273 Å²	273	166.6 Å²	166.6	100%	1.276	86%	0.864	S	S	*	*			trans	79.9	0	166.7	-68.6	-174.1	-18.9	0	0	118.4

Retrieved 761 of 761 residues in 1189.6 ms (Link to these results)

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