A0A077ZHK2_TRITR Loading...

NFU1 iron-sulfur cluster scaffold homolog, mitochondrial

Molecular scaffold for [Fe-S] cluster assembly of mitochondrial iron-sulfur proteins.

AlphaFold DB , UniProt , Accession A0A077ZHK2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 667 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	38.5	Very low	32.7	Very low	238 Å²	238	179.9 Å²	179.9	100%	1.172	88%	0.882	S	S	*	*				0	57.8	0	-66.4	-176.6	-171.1	0	0	110.9	R3	M1-R3 PolarHBondContact O-N 3.49Å
2	F	36.9	Very low	32.4	Very low	220 Å²	220	179.4 Å²	179.4	97%	0.965	89%	0.885	S	S	*	*			trans	-92.7	92.5	177	-90	-91.7	0	0	0	108.9
3	R	34.9	Very low	32.5	Very low	249 Å²	249	172.7 Å²	172.7	94%	0.94	88%	0.875	S	S	*	*			trans	-86.9	108.7	170.8	-74	-179	77.6	-177.5	3.8	108.4	M1	M1-R3 PolarHBondContact O-N 3.49Å
4	S	36.8	Very low	32.2	Very low	110 Å²	110	169.9 Å²	169.9	77%	0.769	88%	0.879	S	S	*	*			trans	-57.5	128.2	174.8	176.3	0	0	0	0	112	A6	S4-A6 PolarHBondContact O-N 3.1Å
5	S	33.6	Very low	32.2	Very low	116 Å²	116	164.9 Å²	164.9	81%	0.811	87%	0.865	S	S	*	*			trans	-79.1	88.2	172.8	53.6	0	0	0	0	110.5
6	A	34.6	Very low	32.3	Very low	82 Å²	82	164.6 Å²	164.6	68%	0.678	86%	0.864	S	S	*	*			trans	-115.8	75.4	171.5	0	0	0	0	0	110	S4	S4-A6 PolarHBondContact O-N 3.1Å
7	W	27.5	Very low	32.8	Very low	237 Å²	237	160.4 Å²	160.4	90%	0.898	86%	0.859	S	S	*	*			trans	-139.4	105.5	170.1	-70.5	68	0	0	0	108.4
8	R	29.9	Very low	32.7	Very low	238 Å²	238	163.4 Å²	163.4	90%	0.898	86%	0.864	S	S	*	*			trans	164	139.8	135.1	-93.2	174.7	-110.4	-114.3	6	112.8
9	K	31.2	Very low	32.8	Very low	196 Å²	196	166.9 Å²	166.9	85%	0.852	86%	0.864	S	S	*	*			trans	84.5	73.4	158.5	-65.6	176.2	-179	-176.4	0	118.5
10	L	28.9	Very low	32.9	Very low	187 Å²	187	163.2 Å²	163.2	98%	0.979	85%	0.853	S	S	*	*			trans	-143	76.3	145.8	-86.2	167.1	0	0	0	108.1
11	S	26.6	Very low	33.2	Very low	106 Å²	106	162.5 Å²	162.5	74%	0.741	86%	0.855	S	S	*	*			trans	-162.9	101.6	172	163.6	0	0	0	0	108.3
12	L	29.9	Very low	33.4	Very low	174 Å²	174	156.4 Å²	156.4	91%	0.911	83%	0.831	S	S	*	*			trans	147.6	114	168.5	-104.4	74.4	0	0	0	103.5
13	A	33.3	Very low	33.8	Very low	92 Å²	92	149 Å²	149	76%	0.76	82%	0.817	S	S	*	*			cis	-148.7	117.4	33.3	0	0	0	0	0	109.9
14	S	29	Very low	34.6	Very low	134 Å²	134	142.2 Å²	142.2	94%	0.937	81%	0.806	S	S	*	*			trans	-114.3	90.1	155.8	178.5	0	0	0	0	105.4
15	S	32	Very low	35.7	Very low	95 Å²	95	142.4 Å²	142.4	66%	0.664	81%	0.808	S	S	*	*			trans	-143.6	100.7	174.2	62.4	0	0	0	0	109.6
16	N	33.4	Very low	37.8	Very low	160 Å²	160	139 Å²	139	86%	0.856	78%	0.78	S	S	*	*			trans	43.6	83.3	146.1	-66.1	-10.1	0	0	0	117.4
17	A	40.3	Very low	40.1	Very low	93 Å²	93	142.7 Å²	142.7	77%	0.769	78%	0.78	S	S	*	*			trans	-104.5	56.8	153	0	0	0	0	0	110	R19	A17-R19 PolarHBondContact O-N 2.93Å
18	F	31.3	Very low	43	Very low	215 Å²	215	131.9 Å²	131.9	94%	0.943	74%	0.74	S	S	*	*			trans	-74.2	61.9	157.2	-116.8	-90.3	0	0	0	107.6	S20	F18-S20 PolarHBondContact O-N 2.78Å
19	R	34.9	Very low	45.9	Very low	230 Å²	230	124.7 Å²	124.7	87%	0.868	72%	0.717	S	S	*	*			trans	-82	104.2	172.7	-87.7	-176.8	170.8	-128.6	-0	107.2	A17	A17-R19 PolarHBondContact O-N 2.93Å
20	S	33.9	Very low	48.7	Very low	92 Å²	92	117.3 Å²	117.3	64%	0.643	69%	0.692	S	S	*	*			trans	8.7	116.9	143.9	172.6	0	0	0	0	114	F18 V22	F18-S20 PolarHBondContact O-N 2.78Å; S20-V22 PolarHBondContact O-N 2.88Å; S20-V22 VanDerWaalsContact OG-CG2 3.26Å; S20-V22 WeakPolarHBondContact OG-CG2 3.39Å
21	V	39.5	Very low	51.6	Low	148 Å²	148	115 Å²	115	90%	0.897	67%	0.67	S	S	*	*			trans	-63.3	70.1	166.9	-175.4	0	0	0	0	108.5	G23	V21-G23 PolarHBondContact O-N 3.34Å
22	V	43.5	Very low	54.6	Low	111 Å²	111	118.2 Å²	118.2	67%	0.673	67%	0.674	S	S	*	*			trans	-76.2	109.4	160.7	-169.3	0	0	0	0	102.9	S20 C24	S20-V22 PolarHBondContact O-N 2.88Å; S20-V22 VanDerWaalsContact OG-CG2 3.26Å; S20-V22 WeakPolarHBondContact OG-CG2 3.39Å; V22-C24 VanDerWaalsContact C-N 3.27Å; V22-C24 PolarHBondContact O-N 3.12Å
23	G	44.2	Very low	57.3	Low	65 Å²	65	110.8 Å²	110.8	67%	0.67	64%	0.636	S	S	*	*			trans	-52.8	96	176	0	0	0	0	0	108.7	V21 S25	V21-G23 PolarHBondContact O-N 3.34Å; G23-S25 PolarHBondContact O-N 3.46Å
24	C	53.2	Low	59.6	Low	106 Å²	106	109.7 Å²	109.7	72%	0.716	62%	0.621	S	S	*	*			trans	-81.8	77.2	-176.9	-148.4	0	0	0	0	105.6	V22 M26	V22-C24 VanDerWaalsContact C-N 3.27Å; V22-C24 PolarHBondContact O-N 3.12Å; C24-M26 PolarHBondContact O-N 3.06Å
25	S	59.7	Low	62.3	Low	114 Å²	114	103.8 Å²	103.8	80%	0.797	58%	0.579	S	S	*	*			trans	-72.7	75.9	178	61.5	0	0	0	0	108.6	G23 F27	G23-S25 PolarHBondContact O-N 3.46Å; S25-F27 PolarHBondContact O-N 2.68Å
26	M	77.7	Confident	64.6	Low	45 Å²	45	104.2 Å²	104.2	22%	0.222	58%	0.579	C	S	.	*			trans	-64.7	122.1	163.6	177.7	172.2	-73.8	0	0	107.5	C24 I28 P43 V45 F100	C24-M26 PolarHBondContact O-N 3.06Å; M26-I28 HydrophobicContact CG-CG1 4.44Å; M26-P43 HydrophobicContact SD-CB 4.08Å; M26-V45 HydrophobicContact CE-CG2 3.83Å; M26-F100 HydrophobicContact CE-CB 3.68Å; M26-F100 HydrophobicContact CE-CG 4.18Å; M26-F100 HydrophobicContact SD-CB 3.77Å; M26-F100 HydrophobicContact SD-CD2 4.2Å; M26-F100 HydrophobicContact SD-CG 4.19Å
27	F	82.3	Confident	66.9	Low	158 Å²	158	100.2 Å²	100.2	69%	0.693	56%	0.558	S	S	*	*			trans	-105.5	118.7	176.7	-178.4	-109.1	0	0	0	109.7	S25 Q29	S25-F27 PolarHBondContact O-N 2.68Å; F27-Q29 HydrophobicContact CD1-CG 3.96Å; F27-Q29 HydrophobicContact CE1-CG 3.63Å
28	I	89	Confident	69.1	Low	10 Å²	10	97.3 Å²	97.3	5%	0.051	53%	0.531	C	S	.	.	P	Polyproline II helix	trans	-96.4	119.7	179.1	-52.5	173.2	0	0	0	108.5	M26 F41 I42 P43 F93 I96 M97	M26-I28 HydrophobicContact CG-CG1 4.44Å; I28-F41 HydrophobicContact CG2-CB 4.18Å; I28-F41 HydrophobicContact CG2-CD1 4.29Å; I28-I42 WeakPolarHBondContact CA-O 3.03Å; I28-P43 HydrophobicContact CG1-CB 4.09Å; I28-F93 HydrophobicContact CB-CD1 3.84Å; I28-F93 HydrophobicContact CB-CE1 4Å; I28-F93 HydrophobicContact CD1-CD1 4.19Å; I28-F93 HydrophobicContact CG2-CD1 3.83Å; I28-F93 HydrophobicContact CG2-CE1 3.8Å; I28-I96 HydrophobicContact CD1-CB 3.6Å; I28-I96 HydrophobicContact CD1-CG2 3.43Å; I28-I96 VanDerWaalsContact CD1-CG2 3.43Å; I28-I96 HydrophobicContact CG1-CG2 4.36Å; I28-M97 HydrophobicContact CD1-CG 3.66Å; I28-M97 HydrophobicContact CG1-CG 4.32Å
29	Q	90.1	Very high	71.8	Confident	87 Å²	87	88.1 Å²	88.1	41%	0.407	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.1	172.9	-67.7	-178.4	2.3	0	0	110	F27 F41 I42	F27-Q29 HydrophobicContact CD1-CG 3.96Å; F27-Q29 HydrophobicContact CE1-CG 3.63Å; Q29-F41 CarbonylContact O-C 3.48Å; Q29-I42 HydrophobicContact CB-CB 4.36Å; Q29-I42 PolarHBondContact N-O 3.32Å; Q29-I42 PolarHBondContact O-N 2.74Å
30	A	90.3	Very high	74.5	Confident	41 Å²	41	79.8 Å²	79.8	34%	0.339	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.2	167.2	0	0	0	0	0	109.6	L39 K40 F41 F93	A30-L39 HydrophobicContact CB-CD2 4.24Å; A30-K40 CarbonylContact C-O 3.54Å; A30-K40 VanDerWaalsContact CA-O 3.32Å; A30-K40 WeakPolarHBondContact CA-O 3.48Å; A30-F41 HydrophobicContact CB-CD1 4.2Å; A30-F41 HydrophobicContact CB-CE1 4.15Å; A30-F93 HydrophobicContact CB-CE1 4.18Å; A30-F93 HydrophobicContact CB-CZ 3.89Å
31	R	90.1	Very high	77.2	Confident	138 Å²	138	77.4 Å²	77.4	52%	0.521	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	140.7	175.5	-65.5	-171.2	-175.1	-177.4	1.7	110	L39 K40 I42	R31-L39 VanDerWaalsContact O-CD1 3.28Å; R31-L39 WeakPolarHBondContact O-CD1 3.35Å; R31-K40 HydrophobicContact CB-CB 4.48Å; R31-K40 PolarHBondContact N-O 3.41Å; R31-K40 PolarHBondContact O-N 3.07Å; R31-I42 HydrophobicContact CG-CD1 4.3Å
32	E	88.7	Confident	79.7	Confident	174 Å²	174	72.8 Å²	72.8	81%	0.813	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	146.5	171.1	-67.7	172.6	-175.4	0	0	109.8	L39	E32-L39 HydrophobicContact CG-CD1 4.32Å
33	T	86.3	Confident	81.7	Confident	18 Å²	18	67.9 Å²	67.9	11%	0.11	38%	0.381	C	S	.	.			trans	-114.5	162.3	174.8	74.2	0	0	0	0	108.8	N35 S38 K40 D144	T33-N35 PolarHBondContact O-N 3.08Å; T33-N35 PolarHBondContact OG1-N 3.28Å; T33-N35 PolarHBondContact OG1-O 2.85Å; T33-S38 PolarHBondContact OG1-O 3.38Å; T33-K40 HydrophobicContact CG2-CB 3.79Å; T33-D144 VanDerWaalsContact CB-O 3.28Å; T33-D144 WeakPolarHBondContact CB-O 3.5Å; T33-D144 VanDerWaalsContact CG2-O 3.26Å; T33-D144 WeakPolarHBondContact CG2-O 3.47Å
34	P	83.2	Confident	83.6	Confident	69 Å²	69	68.1 Å²	68.1	45%	0.448	38%	0.383	S	S	.	.	S	Bend	trans	-57.6	-20.3	174	-25.2	35	0	0	0	113.8	D144	P34-D144 HydrophobicContact CG-CB 4.13Å
35	N	83.8	Confident	85.1	Confident	10 Å²	10	66.9 Å²	66.9	5%	0.053	37%	0.372	C	S	.	.	S	Bend	trans	-89.8	114.9	173.9	-177	-5.1	0	0	0	109.9	T33 L37 S38 A182 C186	T33-N35 PolarHBondContact O-N 3.08Å; T33-N35 PolarHBondContact OG1-N 3.28Å; T33-N35 PolarHBondContact OG1-O 2.85Å; N35-L37 PolarHBondContact O-N 2.87Å; N35-L37 WeakPolarHBondContact OD1-CB 3.23Å; N35-L37 PolarHBondContact OD1-N 3.48Å; N35-S38 PolarHBondContact O-N 2.89Å; N35-A182 PolarHBondContact ND2-O 2.78Å; N35-C186 HydrophobicContact CB-CB 4.12Å
36	P	81.5	Confident	86.3	Confident	104 Å²	104	65 Å²	65	68%	0.675	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-24	-179.8	26.9	-35.1	0	0	0	113.3	S38 W85	P36-S38 PolarHBondContact O-N 3.01Å; P36-W85 PolarHBondContact O-NE1 3.49Å
37	L	81.2	Confident	86.8	Confident	77 Å²	77	65.7 Å²	65.7	40%	0.403	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	2.7	177.1	-51.4	178.6	0	0	0	112.5	N35 A79 E81 W85	N35-L37 PolarHBondContact O-N 2.87Å; N35-L37 WeakPolarHBondContact OD1-CB 3.23Å; N35-L37 PolarHBondContact OD1-N 3.48Å; L37-A79 WeakPolarHBondContact CD2-O 3.5Å; L37-E81 HydrophobicContact CD2-CG 4.1Å; L37-W85 WeakPolarHBondContact O-CZ2 3.37Å
38	S	86.4	Confident	86.9	Confident	31 Å²	31	60.5 Å²	60.5	22%	0.217	35%	0.349	C	S	.	.			trans	-131.6	136	-177.6	-165.3	0	0	0	0	112.2	T33 N35 P36 A182	T33-S38 PolarHBondContact OG1-O 3.38Å; N35-S38 PolarHBondContact O-N 2.89Å; P36-S38 PolarHBondContact O-N 3.01Å; S38-A182 WeakPolarHBondContact OG-CB 3.25Å
39	L	89.2	Confident	86.5	Confident	23 Å²	23	64.6 Å²	64.6	12%	0.12	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	134.8	179.4	-170.3	73.3	0	0	0	110.4	A30 R31 E32 F41 W85 K89	A30-L39 HydrophobicContact CB-CD2 4.24Å; R31-L39 VanDerWaalsContact O-CD1 3.28Å; R31-L39 WeakPolarHBondContact O-CD1 3.35Å; E32-L39 HydrophobicContact CG-CD1 4.32Å; L39-F41 HydrophobicContact CB-CE2 4.15Å; L39-F41 HydrophobicContact CD2-CE1 4.22Å; L39-F41 HydrophobicContact CD2-CE2 3.88Å; L39-F41 HydrophobicContact CD2-CZ 3.54Å; L39-F41 HydrophobicContact CG-CE2 4.14Å; L39-F41 HydrophobicContact CG-CZ 4.26Å; L39-W85 HydrophobicContact CB-CD2 4.11Å; L39-W85 HydrophobicContact CB-CE3 4.08Å; L39-W85 HydrophobicContact CB-CH2 3.93Å; L39-W85 HydrophobicContact CB-CZ2 3.93Å; L39-W85 HydrophobicContact CB-CZ3 4Å; L39-W85 HydrophobicContact CD2-CD2 4.16Å; L39-W85 HydrophobicContact CD2-CE3 3.86Å; L39-W85 HydrophobicContact CD2-CZ3 4.36Å; L39-K89 HydrophobicContact CD2-CD 4.21Å; L39-K89 HydrophobicContact CD2-CG 3.85Å
40	K	89.9	Confident	85.7	Confident	55 Å²	55	72.2 Å²	72.2	24%	0.239	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	122.5	-175	-179.5	172.3	176.9	171.8	0	111.3	A30 R31 T33 I42 Q142 Q143	A30-K40 CarbonylContact C-O 3.54Å; A30-K40 VanDerWaalsContact CA-O 3.32Å; A30-K40 WeakPolarHBondContact CA-O 3.48Å; R31-K40 HydrophobicContact CB-CB 4.48Å; R31-K40 PolarHBondContact N-O 3.41Å; R31-K40 PolarHBondContact O-N 3.07Å; T33-K40 HydrophobicContact CG2-CB 3.79Å; K40-I42 HydrophobicContact CG-CG1 4.22Å; K40-Q142 PolarHBondContact NZ-O 3.24Å; K40-Q143 PolarHBondContact NZ-O 2.66Å
41	F	92	Very high	85.1	Confident	42 Å²	42	74.8 Å²	74.8	18%	0.184	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.6	178.1	-64.6	-93.8	0	0	0	111.2	I28 Q29 A30 L39 W85 K89 I92 F93 I96	I28-F41 HydrophobicContact CG2-CB 4.18Å; I28-F41 HydrophobicContact CG2-CD1 4.29Å; Q29-F41 CarbonylContact O-C 3.48Å; A30-F41 HydrophobicContact CB-CD1 4.2Å; A30-F41 HydrophobicContact CB-CE1 4.15Å; L39-F41 HydrophobicContact CB-CE2 4.15Å; L39-F41 HydrophobicContact CD2-CE1 4.22Å; L39-F41 HydrophobicContact CD2-CE2 3.88Å; L39-F41 HydrophobicContact CD2-CZ 3.54Å; L39-F41 HydrophobicContact CG-CE2 4.14Å; L39-F41 HydrophobicContact CG-CZ 4.26Å; F41-W85 HydrophobicContact CE2-CZ3 4.31Å; F41-K89 HydrophobicContact CE1-CG 4.42Å; F41-K89 HydrophobicContact CZ-CG 4.37Å; F41-I92 HydrophobicContact CD1-CG2 3.95Å; F41-I92 HydrophobicContact CD2-CG2 4.14Å; F41-I92 HydrophobicContact CE1-CB 4.2Å; F41-I92 HydrophobicContact CE1-CG2 3.71Å; F41-I92 HydrophobicContact CE2-CD1 3.99Å; F41-I92 HydrophobicContact CE2-CG2 3.9Å; F41-I92 HydrophobicContact CG-CG2 4.16Å; F41-I92 HydrophobicContact CZ-CB 4.08Å; F41-I92 HydrophobicContact CZ-CD1 3.75Å; F41-I92 HydrophobicContact CZ-CG2 3.67Å; F41-F93 AromaticContact CD1-CD1 3.85Å; F41-F93 HydrophobicContact CD1-CD1 3.85Å; F41-F93 AromaticContact CD1-CE1 3.44Å; F41-F93 HydrophobicContact CD1-CE1 3.44Å; F41-F93 VanDerWaalsContact CD1-CE1 3.44Å; F41-F93 HydrophobicContact CD1-CZ 4.34Å; F41-F93 AromaticContact CE1-CD1 3.91Å; F41-F93 HydrophobicContact CE1-CD1 3.91Å; F41-F93 AromaticContact CE1-CE1 3.5Å; F41-F93 HydrophobicContact CE1-CE1 3.5Å; F41-F93 VanDerWaalsContact CE1-CE1 3.5Å; F41-F93 HydrophobicContact CE1-CZ 4.05Å; F41-I96 HydrophobicContact CB-CD1 4.05Å; F41-I96 HydrophobicContact CG-CD1 4.33Å
42	I	90.7	Very high	84.9	Confident	50 Å²	50	71.2 Å²	71.2	26%	0.256	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	99.1	-175.7	-53.6	174.2	0	0	0	108.7	I28 Q29 R31 K40 G44	I28-I42 WeakPolarHBondContact CA-O 3.03Å; Q29-I42 HydrophobicContact CB-CB 4.36Å; Q29-I42 PolarHBondContact N-O 3.32Å; Q29-I42 PolarHBondContact O-N 2.74Å; R31-I42 HydrophobicContact CG-CD1 4.3Å; K40-I42 HydrophobicContact CG-CG1 4.22Å; I42-G44 PolarHBondContact O-N 3.27Å; I42-G44 VanDerWaalsContact O-N 3.15Å
43	P	86.2	Confident	84.7	Confident	9 Å²	9	65.1 Å²	65.1	6%	0.058	38%	0.376	C	S	.	.			trans	-75.8	6	-176.8	29.2	-33.8	0	0	0	114.8	M26 I28 V45 V47 I96 F100	M26-P43 HydrophobicContact SD-CB 4.08Å; I28-P43 HydrophobicContact CG1-CB 4.09Å; P43-V45 PolarHBondContact O-N 3.35Å; P43-V45 VanDerWaalsContact O-N 3.13Å; P43-V47 HydrophobicContact CG-CG2 3.83Å; P43-I96 HydrophobicContact CB-CG2 4.08Å; P43-F100 HydrophobicContact CB-CD2 4.3Å; P43-F100 HydrophobicContact CB-CE2 4.15Å; P43-F100 HydrophobicContact CG-CD2 4.48Å; P43-F100 HydrophobicContact CG-CE2 3.84Å; P43-F100 HydrophobicContact CG-CZ 4.3Å
44	G	84	Confident	84.7	Confident	70 Å²	70	67.1 Å²	67.1	72%	0.722	39%	0.386	S	S	*	.	S	Bend	trans	76.3	-13.9	-176.1	0	0	0	0	0	114.7	I42	I42-G44 PolarHBondContact O-N 3.27Å; I42-G44 VanDerWaalsContact O-N 3.15Å
45	V	85.9	Confident	85	Confident	80 Å²	80	65.7 Å²	65.7	49%	0.485	37%	0.373	S	S	.	.	S	Bend	trans	-106.7	142.4	172.3	-179	0	0	0	0	109.4	M26 P43 V47	M26-V45 HydrophobicContact CE-CG2 3.83Å; P43-V45 PolarHBondContact O-N 3.35Å; P43-V45 VanDerWaalsContact O-N 3.13Å; V45-V47 PolarHBondContact O-N 2.76Å
46	A	84	Confident	84.8	Confident	75 Å²	75	68.1 Å²	68.1	62%	0.62	39%	0.389	S	S	*	.			trans	-64.3	115.1	174.7	0	0	0	0	0	110.3
47	V	87.7	Confident	84.8	Confident	58 Å²	58	66.7 Å²	66.7	35%	0.352	38%	0.375	S	S	.	.	S	Bend	trans	-68.1	-50.5	-177.5	-179.3	0	0	0	0	111	P43 V45 L66 F100 V106	P43-V47 HydrophobicContact CG-CG2 3.83Å; V45-V47 PolarHBondContact O-N 2.76Å; V47-L66 HydrophobicContact CG1-CD2 4.19Å; V47-F100 HydrophobicContact CB-CZ 4.48Å; V47-F100 HydrophobicContact CG1-CZ 4.37Å; V47-F100 HydrophobicContact CG2-CZ 4.06Å; V47-V106 HydrophobicContact CG1-CG1 4Å; V47-V106 HydrophobicContact CG1-CG2 4.2Å; V47-V106 WeakPolarHBondContact O-CG2 3.35Å
48	L	85.6	Confident	85	Confident	49 Å²	49	70.7 Å²	70.7	26%	0.257	39%	0.385	S	S	.	.	S	Bend	trans	-134.2	112.3	171.6	-72.3	172.4	0	0	0	108.1	R50 R51 A53 V106 L107	L48-R50 PolarHBondContact O-N 3.32Å; L48-R51 VanDerWaalsContact CB-O 3.26Å; L48-R51 WeakPolarHBondContact CB-O 3.32Å; L48-A53 HydrophobicContact CD1-CB 3.8Å; L48-V106 HydrophobicContact CD1-CG1 4.46Å; L48-V106 HydrophobicContact CD2-CB 4.1Å; L48-V106 HydrophobicContact CD2-CG1 4.02Å; L48-V106 HydrophobicContact CG-CG1 4.11Å; L48-L107 HydrophobicContact CD1-CD1 4.13Å; L48-L107 HydrophobicContact CD1-CG 4.46Å; L48-L107 HydrophobicContact CD2-CD1 3.77Å; L48-L107 HydrophobicContact CD2-CG 4.01Å
49	P	78.8	Confident	84.9	Confident	97 Å²	97	80 Å²	80	63%	0.63	42%	0.415	S	S	*	.	S	Bend	trans	-65.3	129.2	176.2	-20.1	31.9	0	0	0	110.7	R51	P49-R51 PolarHBondContact O-N 3.24Å
50	R	73.3	Confident	84.6	Confident	247 Å²	247	82.5 Å²	82.5	93%	0.932	43%	0.428	S	S	*	.	S	Bend	trans	64.2	-13.1	173.9	-56.3	179.8	171.5	-177.6	-4	117.2	L48	L48-R50 PolarHBondContact O-N 3.32Å
51	R	79.2	Confident	84.5	Confident	95 Å²	95	79.9 Å²	79.9	36%	0.358	42%	0.417	S	S	.	.			trans	-123.2	155.8	-176.4	-65.2	-177.1	173	173	-1.8	110.4	L48 P49 V111 D112 G113 N114	L48-R51 VanDerWaalsContact CB-O 3.26Å; L48-R51 WeakPolarHBondContact CB-O 3.32Å; P49-R51 PolarHBondContact O-N 3.24Å; R51-V111 PolarHBondContact NH1-O 3.14Å; R51-D112 IonicContact CZ-OD1 3.74Å; R51-D112 IonicContact NH1-OD1 3.3Å; R51-D112 PolarHBondContact NH1-OD1 3.48Å; R51-D112 IonicContact NH2-OD1 2.66Å; R51-D112 PolarHBondContact NH2-OD1 3.44Å; R51-G113 VanDerWaalsContact NH1-N 3.13Å; R51-N114 PolarHBondContact NH2-OD1 3.45Å
52	T	84.6	Confident	84.2	Confident	62 Å²	62	80.9 Å²	80.9	38%	0.38	43%	0.429	S	S	.	.			trans	-120.6	153.2	175.1	49.3	0	0	0	0	108.1	R138 D147	T52-R138 PolarHBondContact OG1-NH2 2.72Å; T52-D147 VanDerWaalsContact CB-OD2 3.23Å; T52-D147 WeakPolarHBondContact CB-OD2 3.3Å; T52-D147 VanDerWaalsContact CG2-OD2 3.29Å; T52-D147 WeakPolarHBondContact CG2-OD2 3.29Å; T52-D147 PolarHBondContact OG1-OD2 3.35Å
53	A	86.2	Confident	84.1	Confident	47 Å²	47	84.1 Å²	84.1	39%	0.388	44%	0.441	S	S	.	.			trans	-139.6	131.7	175.4	0	0	0	0	0	108.5	L48 F55 L107	L48-A53 HydrophobicContact CD1-CB 3.8Å; A53-F55 HydrophobicContact CB-CE2 3.79Å; A53-F55 HydrophobicContact CB-CZ 3.92Å; A53-L107 HydrophobicContact CB-CD2 4.46Å
54	N	86.3	Confident	84.3	Confident	60 Å²	60	83.8 Å²	83.8	32%	0.321	44%	0.44	S	S	.	.			trans	-112.2	135.1	177.9	-172.9	27.1	0	0	0	110.2	Q180	N54-Q180 HydrophobicContact CB-CB 4.14Å; N54-Q180 HydrophobicContact CB-CG 4.3Å
55	F	89.1	Confident	84.5	Confident	39 Å²	39	81.6 Å²	81.6	17%	0.171	41%	0.413	C	S	.	.			trans	-132	93.2	177.9	-57.5	-70.9	0	0	0	107.8	A53 D57 L60 A61 K63 A67 F71 L107	A53-F55 HydrophobicContact CB-CE2 3.79Å; A53-F55 HydrophobicContact CB-CZ 3.92Å; F55-D57 VanDerWaalsContact C-N 3.33Å; F55-L60 HydrophobicContact CD1-CB 4.47Å; F55-L60 VanDerWaalsContact CD1-O 3.29Å; F55-L60 WeakPolarHBondContact CD1-O 3.28Å; F55-A61 HydrophobicContact CB-CB 4.42Å; F55-K63 HydrophobicContact CE1-CB 3.88Å; F55-K63 HydrophobicContact CE1-CD 4.48Å; F55-K63 HydrophobicContact CZ-CB 4.39Å; F55-A67 HydrophobicContact CB-CB 4.44Å; F55-A67 HydrophobicContact CD2-CB 3.68Å; F55-A67 HydrophobicContact CE2-CB 4.19Å; F55-A67 HydrophobicContact CG-CB 4.13Å; F55-F71 HydrophobicContact CB-CE2 4.12Å; F55-F71 VanDerWaalsContact O-CZ 3.24Å; F55-F71 WeakPolarHBondContact O-CZ 3.4Å; F55-L107 HydrophobicContact CE2-CD2 4.35Å; F55-L107 HydrophobicContact CZ-CD2 3.82Å
56	P	79.6	Confident	84.8	Confident	61 Å²	61	78.5 Å²	78.5	40%	0.396	39%	0.393	S	S	.	.			trans	-70	-34.1	-178.2	26.8	-32.6	0	0	0	111.6	L60	P56-L60 HydrophobicContact CG-CD1 3.78Å
57	D	81.3	Confident	85.1	Confident	73 Å²	73	75.4 Å²	75.4	39%	0.39	37%	0.367	S	S	.	.	S	Bend	trans	-121.5	153.3	-177.2	-73.1	-53	0	0	0	113.8	F55 R59 L60 A61	F55-D57 VanDerWaalsContact C-N 3.33Å; D57-R59 PolarHBondContact O-N 3.06Å; D57-R59 VanDerWaalsContact O-N 3.12Å; D57-L60 PolarHBondContact O-N 3.13Å; D57-A61 PolarHBondContact O-N 3.42Å
58	R	84.4	Confident	85.3	Confident	161 Å²	161	75.1 Å²	75.1	61%	0.608	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-32	171.9	-178.6	174	170.9	-168.5	-2.1	113.3	A61 F71	R58-A61 WeakPolarHBondContact O-CB 3.23Å; R58-A61 PolarHBondContact O-N 3.41Å; R58-F71 HydrophobicContact CB-CB 4.06Å; R58-F71 HydrophobicContact CB-CD1 4.25Å; R58-F71 HydrophobicContact CB-CG 4.14Å; R58-F71 HydrophobicContact CG-CB 3.99Å
59	R	84	Confident	85.5	Confident	227 Å²	227	74.9 Å²	74.9	86%	0.857	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-47.6	177.5	-66.9	-177.4	-179.1	177.1	2	111.1	D57 A61 S62	D57-R59 PolarHBondContact O-N 3.06Å; D57-R59 VanDerWaalsContact O-N 3.12Å; R59-A61 VanDerWaalsContact C-N 3.31Å; R59-S62 WeakPolarHBondContact O-CB 3.36Å; R59-S62 PolarHBondContact O-N 2.91Å; R59-S62 PolarHBondContact O-OG 3.37Å
60	L	84	Confident	86.1	Confident	75 Å²	75	72.1 Å²	72.1	39%	0.393	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-71.9	-26.9	179.1	-66.4	173.2	0	0	0	112.2	F55 P56 D57 S62 K63	F55-L60 HydrophobicContact CD1-CB 4.47Å; F55-L60 VanDerWaalsContact CD1-O 3.29Å; F55-L60 WeakPolarHBondContact CD1-O 3.28Å; P56-L60 HydrophobicContact CG-CD1 3.78Å; D57-L60 PolarHBondContact O-N 3.13Å; L60-S62 PolarHBondContact O-N 3.5Å; L60-S62 VanDerWaalsContact O-N 3.09Å; L60-K63 PolarHBondContact O-N 3.15Å
61	A	87.4	Confident	86.8	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-58.9	-19.7	174.9	0	0	0	0	0	113.9	F55 D57 R58 R59 K63 S64 A67 F71	F55-A61 HydrophobicContact CB-CB 4.42Å; D57-A61 PolarHBondContact O-N 3.42Å; R58-A61 WeakPolarHBondContact O-CB 3.23Å; R58-A61 PolarHBondContact O-N 3.41Å; R59-A61 VanDerWaalsContact C-N 3.31Å; A61-K63 PolarHBondContact O-N 3.31Å; A61-S64 CarbonylContact O-C 3.53Å; A61-S64 PolarHBondContact O-N 3.28Å; A61-A67 HydrophobicContact CB-CB 3.8Å; A61-F71 HydrophobicContact CB-CD2 3.33Å; A61-F71 HydrophobicContact CB-CE2 3.7Å; A61-F71 HydrophobicContact CB-CG 4.33Å
62	S	86.8	Confident	87.3	Confident	63 Å²	63	64 Å²	64	44%	0.441	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-53.7	-23.6	177.4	-54.4	0	0	0	0	113.8	R59 L60 S64 K108	R59-S62 WeakPolarHBondContact O-CB 3.36Å; R59-S62 PolarHBondContact O-N 2.91Å; R59-S62 PolarHBondContact O-OG 3.37Å; L60-S62 PolarHBondContact O-N 3.5Å; L60-S62 VanDerWaalsContact O-N 3.09Å; S62-S64 VanDerWaalsContact C-N 3.31Å; S62-K108 VanDerWaalsContact O-CD 3.26Å; S62-K108 WeakPolarHBondContact O-CD 3.39Å; S62-K108 VanDerWaalsContact O-CE 3.23Å; S62-K108 WeakPolarHBondContact O-CE 3.01Å; S62-K108 PolarHBondContact O-NZ 2.81Å
63	K	87.1	Confident	87.4	Confident	118 Å²	118	61.8 Å²	61.8	51%	0.513	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-72.6	-20.3	176.3	-62.4	179.6	-179	178.8	0	113.5	F55 L60 A61 K108	F55-K63 HydrophobicContact CE1-CB 3.88Å; F55-K63 HydrophobicContact CE1-CD 4.48Å; F55-K63 HydrophobicContact CZ-CB 4.39Å; L60-K63 PolarHBondContact O-N 3.15Å; A61-K63 PolarHBondContact O-N 3.31Å; K63-K108 PolarHBondContact O-N 3.37Å
64	S	90.4	Very high	87.2	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.021	31%	0.314	C	S	.	.			trans	-123.2	117.5	179.6	173.8	0	0	0	0	110.5	A61 S62 L66 A67 E68 V106	A61-S64 CarbonylContact O-C 3.53Å; A61-S64 PolarHBondContact O-N 3.28Å; S62-S64 VanDerWaalsContact C-N 3.31Å; S64-L66 PolarHBondContact O-N 3.36Å; S64-L66 PolarHBondContact OG-N 2.89Å; S64-A67 PolarHBondContact O-N 3.49Å; S64-A67 PolarHBondContact OG-N 3.5Å; S64-A67 VanDerWaalsContact OG-N 3.15Å; S64-E68 WeakPolarHBondContact O-CB 3.39Å; S64-E68 PolarHBondContact O-N 3Å; S64-V106 VanDerWaalsContact CA-O 3.28Å; S64-V106 WeakPolarHBondContact CA-O 3.45Å; S64-V106 VanDerWaalsContact CB-O 3.26Å; S64-V106 WeakPolarHBondContact CB-O 3.38Å; S64-V106 PolarHBondContact OG-O 3.15Å
65	P	90	Very high	86.7	Confident	24 Å²	24	64.7 Å²	64.7	16%	0.156	31%	0.312	C	S	.	.	H	α-helix	trans	-63.4	-29.4	176.4	-19.1	33.3	0	0	0	112.4	L69 F99 V106 K108	P65-L69 VanDerWaalsContact O-CG 3.3Å; P65-L69 WeakPolarHBondContact O-CG 3.15Å; P65-L69 PolarHBondContact O-N 2.9Å; P65-F99 HydrophobicContact CB-CE2 4.03Å; P65-V106 WeakPolarHBondContact CD-O 3.26Å; P65-K108 HydrophobicContact CG-CD 4.33Å; P65-K108 HydrophobicContact CG-CG 3.55Å
66	L	90.8	Very high	85.9	Confident	15 Å²	15	64.8 Å²	64.8	8%	0.079	32%	0.316	C	S	.	.	H	α-helix	trans	-66.5	-50.1	173.3	176.7	60.6	0	0	0	110.8	V47 S64 E68 L69 L70 I96 F99 V106	V47-L66 HydrophobicContact CG1-CD2 4.19Å; S64-L66 PolarHBondContact O-N 3.36Å; S64-L66 PolarHBondContact OG-N 2.89Å; L66-E68 VanDerWaalsContact C-N 3.31Å; L66-E68 PolarHBondContact O-N 3.46Å; L66-L69 PolarHBondContact O-N 3.45Å; L66-L69 VanDerWaalsContact O-N 3.17Å; L66-L70 HydrophobicContact CD1-CD1 4.24Å; L66-L70 HydrophobicContact CD1-CG 4.32Å; L66-L70 HydrophobicContact CG-CD1 4.1Å; L66-L70 WeakPolarHBondContact O-CG 3.42Å; L66-L70 PolarHBondContact O-N 2.89Å; L66-I96 HydrophobicContact CD1-CG1 4.47Å; L66-F99 HydrophobicContact CB-CD1 4.14Å; L66-F99 HydrophobicContact CB-CD2 4.15Å; L66-F99 HydrophobicContact CB-CE1 3.95Å; L66-F99 HydrophobicContact CB-CE2 3.94Å; L66-F99 HydrophobicContact CB-CG 4.24Å; L66-F99 HydrophobicContact CB-CZ 3.83Å; L66-F99 HydrophobicContact CD1-CB 3.91Å; L66-F99 HydrophobicContact CD1-CD1 3.86Å; L66-F99 HydrophobicContact CD1-CD2 4.21Å; L66-F99 HydrophobicContact CD1-CG 3.69Å; L66-F99 HydrophobicContact CD2-CD1 4.38Å; L66-F99 HydrophobicContact CD2-CE1 4.48Å; L66-F99 HydrophobicContact CG-CD1 4.34Å; L66-F99 HydrophobicContact CG-CG 4.48Å; L66-V106 HydrophobicContact CB-CG1 4.46Å; L66-V106 HydrophobicContact CD2-CG1 4.29Å
67	A	91	Very high	85.3	Confident	9 Å²	9	69.6 Å²	69.6	7%	0.074	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-41.7	177.8	0	0	0	0	0	111.3	F55 A61 S64 L69 L70 F71	F55-A67 HydrophobicContact CB-CB 4.44Å; F55-A67 HydrophobicContact CD2-CB 3.68Å; F55-A67 HydrophobicContact CE2-CB 4.19Å; F55-A67 HydrophobicContact CG-CB 4.13Å; A61-A67 HydrophobicContact CB-CB 3.8Å; S64-A67 PolarHBondContact O-N 3.49Å; S64-A67 PolarHBondContact OG-N 3.5Å; S64-A67 VanDerWaalsContact OG-N 3.15Å; A67-L69 VanDerWaalsContact C-N 3.25Å; A67-L69 PolarHBondContact O-N 3.09Å; A67-L70 PolarHBondContact O-N 2.94Å; A67-L70 VanDerWaalsContact O-N 3.14Å; A67-F71 HydrophobicContact CB-CD2 4.45Å; A67-F71 VanDerWaalsContact O-CD2 3.24Å; A67-F71 WeakPolarHBondContact O-CD2 3.39Å; A67-F71 PolarHBondContact O-N 3.27Å
68	E	90.8	Very high	84	Confident	52 Å²	52	68.9 Å²	68.9	24%	0.243	33%	0.332	C	S	.	.	H	α-helix	trans	-58.5	-36.9	176.9	-163.2	-168.5	142.1	0	0	112.4	S64 L66 R72 K108	S64-E68 WeakPolarHBondContact O-CB 3.39Å; S64-E68 PolarHBondContact O-N 3Å; L66-E68 VanDerWaalsContact C-N 3.31Å; L66-E68 PolarHBondContact O-N 3.46Å; E68-R72 WeakPolarHBondContact O-CG 3.49Å; E68-R72 IonicContact OE1-CZ 2.76Å; E68-R72 IonicContact OE1-NH2 3Å; E68-R72 PolarHBondContact OE1-NH2 3.09Å; E68-K108 IonicContact OE2-NZ 2.9Å; E68-K108 PolarHBondContact OE2-NZ 3.41Å
69	L	90.1	Very high	82.2	Confident	44 Å²	44	61.6 Å²	61.6	23%	0.23	31%	0.306	C	S	.	.	H	α-helix	trans	-72.8	-40.4	174.9	-70.9	172.3	0	0	0	112.1	P65 L66 A67 R72 F99	P65-L69 VanDerWaalsContact O-CG 3.3Å; P65-L69 WeakPolarHBondContact O-CG 3.15Å; P65-L69 PolarHBondContact O-N 2.9Å; L66-L69 PolarHBondContact O-N 3.45Å; L66-L69 VanDerWaalsContact O-N 3.17Å; A67-L69 VanDerWaalsContact C-N 3.25Å; A67-L69 PolarHBondContact O-N 3.09Å; L69-R72 WeakPolarHBondContact O-CB 3.43Å; L69-R72 PolarHBondContact O-N 3.16Å; L69-F99 HydrophobicContact CD1-CD2 3.88Å
70	L	91	Very high	80.7	Confident	39 Å²	39	55.5 Å²	55.5	20%	0.204	29%	0.29	C	S	.	.	H	α-helix	trans	-63.9	-42.1	178	-70.2	172.1	0	0	0	111.7	L66 A67 R72 I73 I92 I96	L66-L70 HydrophobicContact CD1-CD1 4.24Å; L66-L70 HydrophobicContact CD1-CG 4.32Å; L66-L70 HydrophobicContact CG-CD1 4.1Å; L66-L70 WeakPolarHBondContact O-CG 3.42Å; L66-L70 PolarHBondContact O-N 2.89Å; A67-L70 PolarHBondContact O-N 2.94Å; A67-L70 VanDerWaalsContact O-N 3.14Å; L70-R72 PolarHBondContact O-N 3.42Å; L70-I73 HydrophobicContact CD2-CD1 4.44Å; L70-I73 WeakPolarHBondContact O-CB 3.32Å; L70-I73 PolarHBondContact O-N 2.82Å; L70-I73 VanDerWaalsContact O-N 3.09Å; L70-I92 HydrophobicContact CD2-CG2 4.11Å; L70-I96 HydrophobicContact CD2-CG1 4.09Å
71	F	89.9	Confident	79.3	Confident	35 Å²	35	60.6 Å²	60.6	15%	0.154	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-4.1	176.5	-80.7	-70.5	0	0	0	114.6	F55 R58 A61 A67	F55-F71 HydrophobicContact CB-CE2 4.12Å; F55-F71 VanDerWaalsContact O-CZ 3.24Å; F55-F71 WeakPolarHBondContact O-CZ 3.4Å; R58-F71 HydrophobicContact CB-CB 4.06Å; R58-F71 HydrophobicContact CB-CD1 4.25Å; R58-F71 HydrophobicContact CB-CG 4.14Å; R58-F71 HydrophobicContact CG-CB 3.99Å; A61-F71 HydrophobicContact CB-CD2 3.33Å; A61-F71 HydrophobicContact CB-CE2 3.7Å; A61-F71 HydrophobicContact CB-CG 4.33Å; A67-F71 HydrophobicContact CB-CD2 4.45Å; A67-F71 VanDerWaalsContact O-CD2 3.24Å; A67-F71 WeakPolarHBondContact O-CD2 3.39Å; A67-F71 PolarHBondContact O-N 3.27Å
72	R	88.6	Confident	77.8	Confident	138 Å²	138	69.6 Å²	69.6	52%	0.521	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-18.7	169.3	-70.7	169.2	-169.9	-166.3	-0.3	112.3	E68 L69 L70	E68-R72 WeakPolarHBondContact O-CG 3.49Å; E68-R72 IonicContact OE1-CZ 2.76Å; E68-R72 IonicContact OE1-NH2 3Å; E68-R72 PolarHBondContact OE1-NH2 3.09Å; L69-R72 WeakPolarHBondContact O-CB 3.43Å; L69-R72 PolarHBondContact O-N 3.16Å; L70-R72 PolarHBondContact O-N 3.42Å
73	I	87.5	Confident	76.8	Confident	15 Å²	15	69 Å²	69	8%	0.077	35%	0.348	C	S	.	.	S	Bend	trans	-72.8	129.1	173.4	-65	162.1	0	0	0	108.1	L70 G75 V76 L88 E91 I92 T95	L70-I73 HydrophobicContact CD2-CD1 4.44Å; L70-I73 WeakPolarHBondContact O-CB 3.32Å; L70-I73 PolarHBondContact O-N 2.82Å; L70-I73 VanDerWaalsContact O-N 3.09Å; I73-G75 PolarHBondContact O-N 2.7Å; I73-V76 HydrophobicContact CB-CG2 3.73Å; I73-V76 HydrophobicContact CG2-CG2 3.7Å; I73-L88 HydrophobicContact CG2-CD2 4.05Å; I73-E91 HydrophobicContact CD1-CB 4.17Å; I73-E91 HydrophobicContact CG1-CB 4.29Å; I73-E91 HydrophobicContact CG2-CB 4.09Å; I73-E91 VanDerWaalsContact CG2-OE2 3.29Å; I73-E91 WeakPolarHBondContact CG2-OE2 3.4Å; I73-I92 HydrophobicContact CD1-CG1 3.94Å; I73-T95 HydrophobicContact CD1-CG2 3.67Å; I73-T95 WeakPolarHBondContact CD1-OG1 3.26Å; I73-T95 HydrophobicContact CG1-CG2 4.13Å
74	N	81.6	Confident	76.4	Confident	141 Å²	141	66.3 Å²	66.3	75%	0.754	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	131.2	178.8	-64.2	-37	0	0	0	109.4	L88	N74-L88 WeakPolarHBondContact O-CD2 3.17Å
75	G	75.3	Confident	76	Confident	27 Å²	27	69 Å²	69	28%	0.278	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.5	4.5	179.8	0	0	0	0	0	116.2	I73	I73-G75 PolarHBondContact O-N 2.7Å
76	V	73.4	Confident	75.8	Confident	41 Å²	41	72.3 Å²	72.3	25%	0.248	37%	0.373	C	S	.	.			trans	-87.8	-14	-177.3	175.1	0	0	0	0	114.6	I73 S78 I92	I73-V76 HydrophobicContact CB-CG2 3.73Å; I73-V76 HydrophobicContact CG2-CG2 3.7Å; V76-S78 VanDerWaalsContact C-N 3.32Å; V76-S78 PolarHBondContact O-N 3.47Å; V76-I92 HydrophobicContact CG2-CD1 4.48Å
77	K	65.8	Low	75.5	Confident	161 Å²	161	77.9 Å²	77.9	70%	0.7	40%	0.402	S	S	*	.	S	Bend	trans	-61.2	-41.1	-174.2	-171.6	-176.4	175.5	-165.6	0	112.9
78	S	53.4	Low	75.4	Confident	59 Å²	59	77.7 Å²	77.7	41%	0.413	40%	0.4	S	S	.	.	S	Bend	trans	-155.7	134.8	165.8	38.3	0	0	0	0	101	V76 D80	V76-S78 VanDerWaalsContact C-N 3.32Å; V76-S78 PolarHBondContact O-N 3.47Å; S78-D80 PolarHBondContact O-N 2.87Å; S78-D80 PolarHBondContact OG-OD1 3.5Å
79	A	48.3	Very low	75.3	Confident	8 Å²	8	78.2 Å²	78.2	7%	0.066	40%	0.401	C	S	.	.			trans	-66.9	87.1	167.2	0	0	0	0	0	105.7	L37 E81 W85	L37-A79 WeakPolarHBondContact CD2-O 3.5Å; A79-E81 PolarHBondContact O-N 3.39Å; A79-W85 HydrophobicContact CB-CD2 4.46Å; A79-W85 HydrophobicContact CB-CH2 4.13Å; A79-W85 HydrophobicContact CB-CZ2 3.44Å; A79-W85 VanDerWaalsContact CB-CZ2 3.44Å
80	D	51.6	Low	75.3	Confident	98 Å²	98	79.7 Å²	79.7	52%	0.524	41%	0.414	S	S	.	.			trans	-56.1	139.3	169.3	-65	-19.2	0	0	0	105.6	S78 E82 T83	S78-D80 PolarHBondContact O-N 2.87Å; S78-D80 PolarHBondContact OG-OD1 3.5Å; D80-E82 PolarHBondContact O-N 2.9Å; D80-T83 PolarHBondContact O-N 3.5Å; D80-T83 PolarHBondContact O-OG1 3.41Å
81	E	55.1	Low	75.3	Confident	182 Å²	182	82.7 Å²	82.7	85%	0.85	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-22.6	-171.1	-62.7	-168.5	161.4	0	0	113	L37 A79	L37-E81 HydrophobicContact CD2-CG 4.1Å; A79-E81 PolarHBondContact O-N 3.39Å
82	E	55.6	Low	75.4	Confident	189 Å²	189	81.4 Å²	81.4	88%	0.883	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-36.2	174.5	-68.3	-174.4	162.8	0	0	113.8	D80 S84	D80-E82 PolarHBondContact O-N 2.9Å; E82-S84 PolarHBondContact O-N 3.32Å
83	T	66.8	Low	75.6	Confident	52 Å²	52	77.3 Å²	77.3	32%	0.319	41%	0.407	S	S	.	.	S	Bend	trans	-86.5	100.5	-178	15.9	0	0	0	0	111	D80 W85	D80-T83 PolarHBondContact O-N 3.5Å; D80-T83 PolarHBondContact O-OG1 3.41Å; T83-W85 PolarHBondContact O-N 3.49Å
84	S	77.6	Confident	75.7	Confident	60 Å²	60	78.5 Å²	78.5	42%	0.42	42%	0.42	S	S	.	.			trans	-63.7	126.1	176	-168.1	0	0	0	0	111.9	E82 T86 L87	E82-S84 PolarHBondContact O-N 3.32Å; S84-T86 PolarHBondContact O-N 2.92Å; S84-T86 PolarHBondContact OG-OG1 3.36Å; S84-L87 PolarHBondContact O-N 3.31Å
85	W	83.1	Confident	76.1	Confident	61 Å²	61	73.2 Å²	73.2	23%	0.231	39%	0.393	C	S	.	.	H	α-helix	trans	-50.5	-22	172	-78	111	0	0	0	113.8	P36 L37 L39 F41 A79 T83 L87 L88 K89 I92	P36-W85 PolarHBondContact O-NE1 3.49Å; L37-W85 WeakPolarHBondContact O-CZ2 3.37Å; L39-W85 HydrophobicContact CB-CD2 4.11Å; L39-W85 HydrophobicContact CB-CE3 4.08Å; L39-W85 HydrophobicContact CB-CH2 3.93Å; L39-W85 HydrophobicContact CB-CZ2 3.93Å; L39-W85 HydrophobicContact CB-CZ3 4Å; L39-W85 HydrophobicContact CD2-CD2 4.16Å; L39-W85 HydrophobicContact CD2-CE3 3.86Å; L39-W85 HydrophobicContact CD2-CZ3 4.36Å; F41-W85 HydrophobicContact CE2-CZ3 4.31Å; A79-W85 HydrophobicContact CB-CD2 4.46Å; A79-W85 HydrophobicContact CB-CH2 4.13Å; A79-W85 HydrophobicContact CB-CZ2 3.44Å; A79-W85 VanDerWaalsContact CB-CZ2 3.44Å; T83-W85 PolarHBondContact O-N 3.49Å; W85-L87 PolarHBondContact O-N 3.49Å; W85-L88 HydrophobicContact CE3-CB 4.13Å; W85-L88 HydrophobicContact CE3-CD1 4.11Å; W85-L88 HydrophobicContact CZ3-CD1 4.29Å; W85-L88 PolarHBondContact O-N 2.89Å; W85-K89 VanDerWaalsContact O-CB 3.3Å; W85-K89 WeakPolarHBondContact O-CB 3.28Å; W85-K89 WeakPolarHBondContact O-CG 3.44Å; W85-K89 PolarHBondContact O-N 3.3Å; W85-I92 HydrophobicContact CZ3-CD1 3.95Å
86	T	85.1	Confident	76.9	Confident	93 Å²	93	72.6 Å²	72.6	57%	0.571	38%	0.383	S	S	*	.	H	α-helix	trans	-61	-33	176.6	57.1	0	0	0	0	112.9	S84 P90	S84-T86 PolarHBondContact O-N 2.92Å; S84-T86 PolarHBondContact OG-OG1 3.36Å; T86-P90 WeakPolarHBondContact O-CD 3.43Å
87	L	85.1	Confident	77.6	Confident	131 Å²	131	73.9 Å²	73.9	69%	0.686	39%	0.387	S	S	*	.	H	α-helix	trans	-84.7	-35.5	178.1	-61	178	0	0	0	111.7	S84 W85 P90	S84-L87 PolarHBondContact O-N 3.31Å; W85-L87 PolarHBondContact O-N 3.49Å; L87-P90 WeakPolarHBondContact O-CD 3.3Å
88	L	87.5	Confident	78.7	Confident	6 Å²	6	71 Å²	71	3%	0.031	38%	0.379	C	S	.	.	H	α-helix	trans	-73.3	-36.7	-179.9	-64.4	175.2	0	0	0	112.8	I73 N74 W85 E91 I92	I73-L88 HydrophobicContact CG2-CD2 4.05Å; N74-L88 WeakPolarHBondContact O-CD2 3.17Å; W85-L88 HydrophobicContact CE3-CB 4.13Å; W85-L88 HydrophobicContact CE3-CD1 4.11Å; W85-L88 HydrophobicContact CZ3-CD1 4.29Å; W85-L88 PolarHBondContact O-N 2.89Å; L88-E91 PolarHBondContact O-N 3.46Å; L88-I92 HydrophobicContact CB-CD1 3.98Å; L88-I92 WeakPolarHBondContact O-CB 3.23Å; L88-I92 VanDerWaalsContact O-CG1 3.25Å; L88-I92 WeakPolarHBondContact O-CG1 3.11Å; L88-I92 PolarHBondContact O-N 2.83Å
89	K	90	Very high	80.4	Confident	62 Å²	62	68.4 Å²	68.4	27%	0.27	36%	0.361	S	S	.	.	H	α-helix	trans	-52.1	-52.4	-177.5	-83.8	168.6	-177.7	178	0	112.5	L39 F41 W85 E91 I92 F93	L39-K89 HydrophobicContact CD2-CD 4.21Å; L39-K89 HydrophobicContact CD2-CG 3.85Å; F41-K89 HydrophobicContact CE1-CG 4.42Å; F41-K89 HydrophobicContact CZ-CG 4.37Å; W85-K89 VanDerWaalsContact O-CB 3.3Å; W85-K89 WeakPolarHBondContact O-CB 3.28Å; W85-K89 WeakPolarHBondContact O-CG 3.44Å; W85-K89 PolarHBondContact O-N 3.3Å; K89-E91 PolarHBondContact O-N 2.91Å; K89-I92 PolarHBondContact O-N 3.04Å; K89-F93 HydrophobicContact CB-CE2 4.06Å; K89-F93 WeakPolarHBondContact O-CB 3.27Å; K89-F93 WeakPolarHBondContact O-CD2 3.37Å; K89-F93 WeakPolarHBondContact O-CG 3.32Å; K89-F93 PolarHBondContact O-N 2.84Å
90	P	89.7	Confident	82.3	Confident	76 Å²	76	69.9 Å²	69.9	49%	0.494	37%	0.365	S	S	.	.	H	α-helix	trans	-58.9	-43.8	177.6	-25.7	34.2	0	0	0	114.4	T86 L87 F93 A94	T86-P90 WeakPolarHBondContact O-CD 3.43Å; L87-P90 WeakPolarHBondContact O-CD 3.3Å; P90-F93 PolarHBondContact O-N 3.35Å; P90-A94 PolarHBondContact O-N 2.86Å
91	E	90.2	Very high	84	Confident	102 Å²	102	70.4 Å²	70.4	48%	0.477	37%	0.367	S	S	.	.	H	α-helix	trans	-67.6	-41.5	-179.3	-63.7	-167.3	179.5	0	0	111.6	I73 L88 K89 A94 T95	I73-E91 HydrophobicContact CD1-CB 4.17Å; I73-E91 HydrophobicContact CG1-CB 4.29Å; I73-E91 HydrophobicContact CG2-CB 4.09Å; I73-E91 VanDerWaalsContact CG2-OE2 3.29Å; I73-E91 WeakPolarHBondContact CG2-OE2 3.4Å; L88-E91 PolarHBondContact O-N 3.46Å; K89-E91 PolarHBondContact O-N 2.91Å; E91-A94 PolarHBondContact O-N 3.27Å; E91-T95 WeakPolarHBondContact O-CG2 3.32Å; E91-T95 PolarHBondContact O-N 3.47Å; E91-T95 PolarHBondContact O-OG1 2.91Å; E91-T95 VanDerWaalsContact O-OG1 3.07Å
92	I	92.1	Very high	85.5	Confident	7 Å²	7	65.4 Å²	65.4	4%	0.036	35%	0.352	C	S	.	.	H	α-helix	trans	-63.8	-42.9	174.8	-65.9	167.4	0	0	0	110.5	F41 L70 I73 V76 W85 L88 K89 A94 T95 I96	F41-I92 HydrophobicContact CD1-CG2 3.95Å; F41-I92 HydrophobicContact CD2-CG2 4.14Å; F41-I92 HydrophobicContact CE1-CB 4.2Å; F41-I92 HydrophobicContact CE1-CG2 3.71Å; F41-I92 HydrophobicContact CE2-CD1 3.99Å; F41-I92 HydrophobicContact CE2-CG2 3.9Å; F41-I92 HydrophobicContact CG-CG2 4.16Å; F41-I92 HydrophobicContact CZ-CB 4.08Å; F41-I92 HydrophobicContact CZ-CD1 3.75Å; F41-I92 HydrophobicContact CZ-CG2 3.67Å; L70-I92 HydrophobicContact CD2-CG2 4.11Å; I73-I92 HydrophobicContact CD1-CG1 3.94Å; V76-I92 HydrophobicContact CG2-CD1 4.48Å; W85-I92 HydrophobicContact CZ3-CD1 3.95Å; L88-I92 HydrophobicContact CB-CD1 3.98Å; L88-I92 WeakPolarHBondContact O-CB 3.23Å; L88-I92 VanDerWaalsContact O-CG1 3.25Å; L88-I92 WeakPolarHBondContact O-CG1 3.11Å; L88-I92 PolarHBondContact O-N 2.83Å; K89-I92 PolarHBondContact O-N 3.04Å; I92-A94 PolarHBondContact O-N 3.06Å; I92-T95 WeakPolarHBondContact CA-OG1 3.29Å; I92-T95 PolarHBondContact O-N 3.36Å; I92-T95 PolarHBondContact O-OG1 3.4Å; I92-I96 HydrophobicContact CG2-CD1 3.6Å; I92-I96 HydrophobicContact CG2-CG1 4.28Å; I92-I96 WeakPolarHBondContact O-CB 3.45Å; I92-I96 VanDerWaalsContact O-CG1 3.27Å; I92-I96 WeakPolarHBondContact O-CG1 3.24Å; I92-I96 PolarHBondContact O-N 3.42Å
93	F	92	Very high	86.7	Confident	52 Å²	52	59.2 Å²	59.2	23%	0.228	34%	0.339	C	S	.	.	H	α-helix	trans	-61.6	-45.2	176.8	-68.3	-36.9	0	0	0	112	I28 A30 F41 K89 P90 I96 M97	I28-F93 HydrophobicContact CB-CD1 3.84Å; I28-F93 HydrophobicContact CB-CE1 4Å; I28-F93 HydrophobicContact CD1-CD1 4.19Å; I28-F93 HydrophobicContact CG2-CD1 3.83Å; I28-F93 HydrophobicContact CG2-CE1 3.8Å; A30-F93 HydrophobicContact CB-CE1 4.18Å; A30-F93 HydrophobicContact CB-CZ 3.89Å; F41-F93 AromaticContact CD1-CD1 3.85Å; F41-F93 HydrophobicContact CD1-CD1 3.85Å; F41-F93 AromaticContact CD1-CE1 3.44Å; F41-F93 HydrophobicContact CD1-CE1 3.44Å; F41-F93 VanDerWaalsContact CD1-CE1 3.44Å; F41-F93 HydrophobicContact CD1-CZ 4.34Å; F41-F93 AromaticContact CE1-CD1 3.91Å; F41-F93 HydrophobicContact CE1-CD1 3.91Å; F41-F93 AromaticContact CE1-CE1 3.5Å; F41-F93 HydrophobicContact CE1-CE1 3.5Å; F41-F93 VanDerWaalsContact CE1-CE1 3.5Å; F41-F93 HydrophobicContact CE1-CZ 4.05Å; K89-F93 HydrophobicContact CB-CE2 4.06Å; K89-F93 WeakPolarHBondContact O-CB 3.27Å; K89-F93 WeakPolarHBondContact O-CD2 3.37Å; K89-F93 WeakPolarHBondContact O-CG 3.32Å; K89-F93 PolarHBondContact O-N 2.84Å; P90-F93 PolarHBondContact O-N 3.35Å; F93-I96 PolarHBondContact O-N 2.86Å; F93-M97 HydrophobicContact CB-CE 4.24Å; F93-M97 WeakPolarHBondContact O-CB 3.45Å; F93-M97 WeakPolarHBondContact O-CE 3.38Å; F93-M97 VanDerWaalsContact O-CG 3.28Å; F93-M97 WeakPolarHBondContact O-CG 3.48Å; F93-M97 PolarHBondContact O-N 3.29Å
94	A	89.9	Confident	87.6	Confident	41 Å²	41	63.7 Å²	63.7	34%	0.339	35%	0.35	S	S	.	.	H	α-helix	trans	-59.4	-49.1	178.4	0	0	0	0	0	111.5	P90 E91 I92 I96 M97 D98	P90-A94 PolarHBondContact O-N 2.86Å; E91-A94 PolarHBondContact O-N 3.27Å; I92-A94 PolarHBondContact O-N 3.06Å; A94-I96 PolarHBondContact O-N 2.94Å; A94-M97 PolarHBondContact O-N 2.86Å; A94-D98 WeakPolarHBondContact O-CB 3.45Å; A94-D98 PolarHBondContact O-N 3.28Å
95	T	91.4	Very high	87.9	Confident	30 Å²	30	67 Å²	67	18%	0.184	36%	0.362	C	S	.	.	H	α-helix	trans	-63.8	-40.4	-179.6	51.5	0	0	0	0	113.3	I73 E91 I92 F99	I73-T95 HydrophobicContact CD1-CG2 3.67Å; I73-T95 WeakPolarHBondContact CD1-OG1 3.26Å; I73-T95 HydrophobicContact CG1-CG2 4.13Å; E91-T95 WeakPolarHBondContact O-CG2 3.32Å; E91-T95 PolarHBondContact O-N 3.47Å; E91-T95 PolarHBondContact O-OG1 2.91Å; E91-T95 VanDerWaalsContact O-OG1 3.07Å; I92-T95 WeakPolarHBondContact CA-OG1 3.29Å; I92-T95 PolarHBondContact O-N 3.36Å; I92-T95 PolarHBondContact O-OG1 3.4Å; T95-F99 VanDerWaalsContact O-CB 3.3Å; T95-F99 WeakPolarHBondContact O-CB 3.31Å; T95-F99 PolarHBondContact O-N 3.32Å
96	I	90.6	Very high	88	Confident	13 Å²	13	65 Å²	65	7%	0.067	36%	0.357	C	S	.	.	H	α-helix	trans	-67.5	-44.9	176.6	-65.8	172.5	0	0	0	110.8	I28 F41 P43 L66 L70 I92 F93 A94 F99 F100	I28-I96 HydrophobicContact CD1-CB 3.6Å; I28-I96 HydrophobicContact CD1-CG2 3.43Å; I28-I96 VanDerWaalsContact CD1-CG2 3.43Å; I28-I96 HydrophobicContact CG1-CG2 4.36Å; F41-I96 HydrophobicContact CB-CD1 4.05Å; F41-I96 HydrophobicContact CG-CD1 4.33Å; P43-I96 HydrophobicContact CB-CG2 4.08Å; L66-I96 HydrophobicContact CD1-CG1 4.47Å; L70-I96 HydrophobicContact CD2-CG1 4.09Å; I92-I96 HydrophobicContact CG2-CD1 3.6Å; I92-I96 HydrophobicContact CG2-CG1 4.28Å; I92-I96 WeakPolarHBondContact O-CB 3.45Å; I92-I96 VanDerWaalsContact O-CG1 3.27Å; I92-I96 WeakPolarHBondContact O-CG1 3.24Å; I92-I96 PolarHBondContact O-N 3.42Å; F93-I96 PolarHBondContact O-N 2.86Å; A94-I96 PolarHBondContact O-N 2.94Å; I96-F99 PolarHBondContact O-N 2.86Å; I96-F100 HydrophobicContact CG2-CD2 3.69Å; I96-F100 HydrophobicContact CG2-CE2 3.79Å; I96-F100 WeakPolarHBondContact O-CD2 3.42Å; I96-F100 PolarHBondContact O-N 3.08Å; I96-F100 VanDerWaalsContact O-N 3.11Å
97	M	88.5	Confident	88	Confident	68 Å²	68	62.7 Å²	62.7	34%	0.335	34%	0.341	S	S	.	.	H	α-helix	trans	-59.2	-50.8	177.5	-75.3	-173	-67.8	0	0	110.9	I28 F93 A94 F99 F100 I101	I28-M97 HydrophobicContact CD1-CG 3.66Å; I28-M97 HydrophobicContact CG1-CG 4.32Å; F93-M97 HydrophobicContact CB-CE 4.24Å; F93-M97 WeakPolarHBondContact O-CB 3.45Å; F93-M97 WeakPolarHBondContact O-CE 3.38Å; F93-M97 VanDerWaalsContact O-CG 3.28Å; F93-M97 WeakPolarHBondContact O-CG 3.48Å; F93-M97 PolarHBondContact O-N 3.29Å; A94-M97 PolarHBondContact O-N 2.86Å; M97-F99 VanDerWaalsContact C-N 3.27Å; M97-F99 PolarHBondContact O-N 3.27Å; M97-F100 PolarHBondContact O-N 3.06Å; M97-I101 HydrophobicContact CB-CD1 4.34Å; M97-I101 WeakPolarHBondContact O-CB 3.21Å; M97-I101 WeakPolarHBondContact O-CD1 3.32Å; M97-I101 WeakPolarHBondContact O-CG1 3.29Å; M97-I101 PolarHBondContact O-N 2.96Å
98	D	88.8	Confident	87.8	Confident	102 Å²	102	62 Å²	62	55%	0.545	33%	0.332	S	S	.	.	H	α-helix	trans	-59	-39.7	179.3	-74.3	-13.9	0	0	0	112	A94 C102	A94-D98 WeakPolarHBondContact O-CB 3.45Å; A94-D98 PolarHBondContact O-N 3.28Å; D98-C102 WeakPolarHBondContact O-CB 3.16Å; D98-C102 PolarHBondContact O-N 3.44Å; D98-C102 PolarHBondContact O-SG 3.04Å
99	F	90.4	Very high	86.9	Confident	4 Å²	4	68.2 Å²	68.2	2%	0.018	36%	0.361	C	S	.	.	H	α-helix	trans	-62.2	-49.8	179.3	-176.5	-93.9	0	0	0	112.4	P65 L66 L69 T95 I96 M97 C102 G103 R104 V106	P65-F99 HydrophobicContact CB-CE2 4.03Å; L66-F99 HydrophobicContact CB-CD1 4.14Å; L66-F99 HydrophobicContact CB-CD2 4.15Å; L66-F99 HydrophobicContact CB-CE1 3.95Å; L66-F99 HydrophobicContact CB-CE2 3.94Å; L66-F99 HydrophobicContact CB-CG 4.24Å; L66-F99 HydrophobicContact CB-CZ 3.83Å; L66-F99 HydrophobicContact CD1-CB 3.91Å; L66-F99 HydrophobicContact CD1-CD1 3.86Å; L66-F99 HydrophobicContact CD1-CD2 4.21Å; L66-F99 HydrophobicContact CD1-CG 3.69Å; L66-F99 HydrophobicContact CD2-CD1 4.38Å; L66-F99 HydrophobicContact CD2-CE1 4.48Å; L66-F99 HydrophobicContact CG-CD1 4.34Å; L66-F99 HydrophobicContact CG-CG 4.48Å; L69-F99 HydrophobicContact CD1-CD2 3.88Å; T95-F99 VanDerWaalsContact O-CB 3.3Å; T95-F99 WeakPolarHBondContact O-CB 3.31Å; T95-F99 PolarHBondContact O-N 3.32Å; I96-F99 PolarHBondContact O-N 2.86Å; M97-F99 VanDerWaalsContact C-N 3.27Å; M97-F99 PolarHBondContact O-N 3.27Å; F99-C102 PolarHBondContact O-N 3.48Å; F99-G103 PolarHBondContact O-N 3.33Å; F99-R104 HydrophobicContact CD2-CB 4.43Å; F99-R104 WeakPolarHBondContact CE1-O 3.35Å; F99-R104 HydrophobicContact CE2-CB 3.73Å; F99-R104 HydrophobicContact CZ-CB 3.84Å; F99-R104 WeakPolarHBondContact CZ-O 3.08Å; F99-V106 HydrophobicContact CE1-CG2 3.79Å; F99-V106 HydrophobicContact CZ-CG2 4.36Å
100	F	87.8	Confident	85.3	Confident	38 Å²	38	74.5 Å²	74.5	17%	0.167	39%	0.392	C	S	.	.	H	α-helix	trans	-74.3	-32	-178.8	-79	-69.8	0	0	0	112.8	M26 P43 V47 I96 M97 C102 G103 V106	M26-F100 HydrophobicContact CE-CB 3.68Å; M26-F100 HydrophobicContact CE-CG 4.18Å; M26-F100 HydrophobicContact SD-CB 3.77Å; M26-F100 HydrophobicContact SD-CD2 4.2Å; M26-F100 HydrophobicContact SD-CG 4.19Å; P43-F100 HydrophobicContact CB-CD2 4.3Å; P43-F100 HydrophobicContact CB-CE2 4.15Å; P43-F100 HydrophobicContact CG-CD2 4.48Å; P43-F100 HydrophobicContact CG-CE2 3.84Å; P43-F100 HydrophobicContact CG-CZ 4.3Å; V47-F100 HydrophobicContact CB-CZ 4.48Å; V47-F100 HydrophobicContact CG1-CZ 4.37Å; V47-F100 HydrophobicContact CG2-CZ 4.06Å; I96-F100 HydrophobicContact CG2-CD2 3.69Å; I96-F100 HydrophobicContact CG2-CE2 3.79Å; I96-F100 WeakPolarHBondContact O-CD2 3.42Å; I96-F100 PolarHBondContact O-N 3.08Å; I96-F100 VanDerWaalsContact O-N 3.11Å; M97-F100 PolarHBondContact O-N 3.06Å; F100-C102 VanDerWaalsContact C-N 3.32Å; F100-G103 PolarHBondContact O-N 3.02Å; F100-G103 VanDerWaalsContact O-N 3.16Å; F100-V106 HydrophobicContact CE1-CG2 4.44Å; F100-V106 HydrophobicContact CZ-CG2 4.49Å
101	I	86.8	Confident	83.5	Confident	109 Å²	109	74.6 Å²	74.6	56%	0.559	39%	0.39	S	S	*	.	H	α-helix	trans	-63.4	-40.7	172.2	-68.5	164.4	0	0	0	110.5	M97 G103	M97-I101 HydrophobicContact CB-CD1 4.34Å; M97-I101 WeakPolarHBondContact O-CB 3.21Å; M97-I101 WeakPolarHBondContact O-CD1 3.32Å; M97-I101 WeakPolarHBondContact O-CG1 3.29Å; M97-I101 PolarHBondContact O-N 2.96Å; I101-G103 PolarHBondContact O-N 2.9Å
102	C	87.3	Confident	81.3	Confident	78 Å²	78	74.4 Å²	74.4	53%	0.527	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.2	176.1	-70.2	0	0	0	0	113.8	D98 F99 F100 R104	D98-C102 WeakPolarHBondContact O-CB 3.16Å; D98-C102 PolarHBondContact O-N 3.44Å; D98-C102 PolarHBondContact O-SG 3.04Å; F99-C102 PolarHBondContact O-N 3.48Å; F100-C102 VanDerWaalsContact C-N 3.32Å; C102-R104 VanDerWaalsContact C-N 3.32Å; C102-R104 HydrophobicContact CB-CG 4.17Å; C102-R104 PolarHBondContact O-N 3.27Å
103	G	81.1	Confident	79.1	Confident	59 Å²	59	76.2 Å²	76.2	61%	0.608	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	32.5	178	0	0	0	0	0	114.6	F99 F100 I101	F99-G103 PolarHBondContact O-N 3.33Å; F100-G103 PolarHBondContact O-N 3.02Å; F100-G103 VanDerWaalsContact O-N 3.16Å; I101-G103 PolarHBondContact O-N 2.9Å
104	R	84.7	Confident	76.6	Confident	146 Å²	146	78.2 Å²	78.2	55%	0.551	43%	0.426	S	S	*	.			trans	-80	149.8	177.7	-64.6	-178.3	-171.2	170.4	5.9	111	F99 C102	F99-R104 HydrophobicContact CD2-CB 4.43Å; F99-R104 WeakPolarHBondContact CE1-O 3.35Å; F99-R104 HydrophobicContact CE2-CB 3.73Å; F99-R104 HydrophobicContact CZ-CB 3.84Å; F99-R104 WeakPolarHBondContact CZ-O 3.08Å; C102-R104 VanDerWaalsContact C-N 3.32Å; C102-R104 HydrophobicContact CB-CG 4.17Å; C102-R104 PolarHBondContact O-N 3.27Å
105	N	83.9	Confident	74.1	Confident	129 Å²	129	84.6 Å²	84.6	69%	0.69	45%	0.446	S	S	*	.			trans	-67.8	134.1	173.9	-69	-9.8	0	0	0	110.7	L107	N105-L107 VanDerWaalsContact C-N 3.27Å; N105-L107 PolarHBondContact O-N 3.46Å
106	V	85.7	Confident	71.9	Confident	19 Å²	19	86.3 Å²	86.3	12%	0.115	46%	0.456	C	S	.	.	S	Bend	trans	-64.3	-31.4	-178	175.7	0	0	0	0	112.1	V47 L48 S64 P65 L66 F99 F100	V47-V106 HydrophobicContact CG1-CG1 4Å; V47-V106 HydrophobicContact CG1-CG2 4.2Å; V47-V106 WeakPolarHBondContact O-CG2 3.35Å; L48-V106 HydrophobicContact CD1-CG1 4.46Å; L48-V106 HydrophobicContact CD2-CB 4.1Å; L48-V106 HydrophobicContact CD2-CG1 4.02Å; L48-V106 HydrophobicContact CG-CG1 4.11Å; S64-V106 VanDerWaalsContact CA-O 3.28Å; S64-V106 WeakPolarHBondContact CA-O 3.45Å; S64-V106 VanDerWaalsContact CB-O 3.26Å; S64-V106 WeakPolarHBondContact CB-O 3.38Å; S64-V106 PolarHBondContact OG-O 3.15Å; P65-V106 WeakPolarHBondContact CD-O 3.26Å; L66-V106 HydrophobicContact CB-CG1 4.46Å; L66-V106 HydrophobicContact CD2-CG1 4.29Å; F99-V106 HydrophobicContact CE1-CG2 3.79Å; F99-V106 HydrophobicContact CZ-CG2 4.36Å; F100-V106 HydrophobicContact CE1-CG2 4.44Å; F100-V106 HydrophobicContact CZ-CG2 4.49Å
107	L	85.2	Confident	69.5	Low	44 Å²	44	92 Å²	92	23%	0.23	49%	0.486	C	S	.	.			trans	-116.8	139.7	175.4	-62.3	172.4	0	0	0	109.5	L48 A53 F55 N105 E109	L48-L107 HydrophobicContact CD1-CD1 4.13Å; L48-L107 HydrophobicContact CD1-CG 4.46Å; L48-L107 HydrophobicContact CD2-CD1 3.77Å; L48-L107 HydrophobicContact CD2-CG 4.01Å; A53-L107 HydrophobicContact CB-CD2 4.46Å; F55-L107 HydrophobicContact CE2-CD2 4.35Å; F55-L107 HydrophobicContact CZ-CD2 3.82Å; N105-L107 VanDerWaalsContact C-N 3.27Å; N105-L107 PolarHBondContact O-N 3.46Å; L107-E109 WeakPolarHBondContact CB-O 3.42Å
108	K	80.9	Confident	67.3	Low	117 Å²	117	94.4 Å²	94.4	51%	0.509	50%	0.501	S	S	.	.	S	Bend	trans	-71.6	-38.3	177.2	-68.2	-175	-173.1	158.3	0	111.4	S62 K63 P65 E68	S62-K108 VanDerWaalsContact O-CD 3.26Å; S62-K108 WeakPolarHBondContact O-CD 3.39Å; S62-K108 VanDerWaalsContact O-CE 3.23Å; S62-K108 WeakPolarHBondContact O-CE 3.01Å; S62-K108 PolarHBondContact O-NZ 2.81Å; K63-K108 PolarHBondContact O-N 3.37Å; P65-K108 HydrophobicContact CG-CD 4.33Å; P65-K108 HydrophobicContact CG-CG 3.55Å; E68-K108 IonicContact OE2-NZ 2.9Å; E68-K108 PolarHBondContact OE2-NZ 3.41Å
109	E	67.5	Low	65.2	Low	137 Å²	137	91.9 Å²	91.9	64%	0.64	49%	0.491	S	S	*	.	S	Bend	trans	-111.3	137.8	174.2	-66.2	179.4	169.3	0	0	108.3	L107 V111	L107-E109 WeakPolarHBondContact CB-O 3.42Å; E109-V111 HydrophobicContact CB-CG2 4.21Å; E109-V111 PolarHBondContact O-N 3.44Å
110	E	56.7	Low	63.3	Low	194 Å²	194	103.2 Å²	103.2	91%	0.907	53%	0.534	S	S	*	.			trans	-68	80.5	154.3	-69.1	-175.2	-177.6	0	0	106	D112	E110-D112 VanDerWaalsContact C-N 3.29Å; E110-D112 PolarHBondContact O-N 3.37Å
111	V	52.1	Low	61.3	Low	77 Å²	77	107.6 Å²	107.6	47%	0.467	56%	0.559	S	S	.	*			trans	-60.9	110.1	162.2	-166.7	0	0	0	0	103.1	R51 E109 G113	R51-V111 PolarHBondContact NH1-O 3.14Å; E109-V111 HydrophobicContact CB-CG2 4.21Å; E109-V111 PolarHBondContact O-N 3.44Å; V111-G113 PolarHBondContact O-N 2.83Å
112	D	44.4	Very low	59.9	Low	99 Å²	99	104.9 Å²	104.9	53%	0.529	54%	0.544	S	S	.	.			trans	-61.4	96.6	168.2	-134.7	-17.7	0	0	0	105.1	R51 E110 N114 K115	R51-D112 IonicContact CZ-OD1 3.74Å; R51-D112 IonicContact NH1-OD1 3.3Å; R51-D112 PolarHBondContact NH1-OD1 3.48Å; R51-D112 IonicContact NH2-OD1 2.66Å; R51-D112 PolarHBondContact NH2-OD1 3.44Å; E110-D112 VanDerWaalsContact C-N 3.29Å; E110-D112 PolarHBondContact O-N 3.37Å; D112-N114 PolarHBondContact O-N 3.28Å; D112-K115 WeakPolarHBondContact O-CB 3.48Å; D112-K115 PolarHBondContact O-N 3.24Å
113	G	45	Very low	58.9	Low	45 Å²	45	104.4 Å²	104.4	46%	0.464	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-7.1	172.9	0	0	0	0	0	111.4	R51 V111 K115	R51-G113 VanDerWaalsContact NH1-N 3.13Å; V111-G113 PolarHBondContact O-N 2.83Å; G113-K115 VanDerWaalsContact C-N 3.35Å
114	N	40.9	Very low	58.8	Low	93 Å²	93	109.9 Å²	109.9	50%	0.497	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	25.9	166	-76.9	63.3	0	0	0	112.6	R51 D112 V116	R51-N114 PolarHBondContact NH2-OD1 3.45Å; D112-N114 PolarHBondContact O-N 3.28Å; N114-V116 CarbonylContact C-O 3.6Å; N114-V116 CarbonylContact O-C 3.6Å; N114-V116 PolarHBondContact O-N 2.72Å
115	K	36.6	Very low	58.5	Low	176 Å²	176	105.5 Å²	105.5	77%	0.765	53%	0.533	S	S	*	.			trans	-80.3	21.5	153.7	-124.4	-175.8	-173.1	-178.8	0	111.8	D112 G113 L117	D112-K115 WeakPolarHBondContact O-CB 3.48Å; D112-K115 PolarHBondContact O-N 3.24Å; G113-K115 VanDerWaalsContact C-N 3.35Å; K115-L117 PolarHBondContact O-N 2.92Å
116	V	44.5	Very low	58.4	Low	65 Å²	65	99.6 Å²	99.6	39%	0.394	50%	0.501	S	S	.	.	S	Bend	trans	-58.3	96.5	133	-176.7	0	0	0	0	103.4	N114 D118	N114-V116 CarbonylContact C-O 3.6Å; N114-V116 CarbonylContact O-C 3.6Å; N114-V116 PolarHBondContact O-N 2.72Å; V116-D118 VanDerWaalsContact C-N 3.35Å; V116-D118 PolarHBondContact O-N 2.8Å
117	L	41.8	Very low	58.3	Low	133 Å²	133	101.9 Å²	101.9	70%	0.696	52%	0.515	S	S	*	.			trans	-45.3	114.4	166.9	-77.1	121.5	0	0	0	104.6	K115 S119	K115-L117 PolarHBondContact O-N 2.92Å; L117-S119 PolarHBondContact O-N 3.33Å; L117-S119 PolarHBondContact O-OG 3.08Å
118	D	40.6	Very low	58.3	Low	119 Å²	119	101.2 Å²	101.2	64%	0.636	52%	0.517	S	S	*	.			trans	-64.8	59.6	161.9	-64	-34.2	0	0	0	105.7	V116 R120	V116-D118 VanDerWaalsContact C-N 3.35Å; V116-D118 PolarHBondContact O-N 2.8Å; D118-R120 PolarHBondContact O-N 3.29Å
119	S	46.6	Very low	58.5	Low	49 Å²	49	95.7 Å²	95.7	34%	0.343	49%	0.492	S	S	.	.			trans	-59	113.2	167.1	45.6	0	0	0	0	102.4	L117 D121 E122	L117-S119 PolarHBondContact O-N 3.33Å; L117-S119 PolarHBondContact O-OG 3.08Å; S119-D121 PolarHBondContact O-N 3.36Å; S119-E122 PolarHBondContact O-N 2.76Å
120	R	48.7	Very low	59.4	Low	242 Å²	242	91.2 Å²	91.2	91%	0.913	47%	0.471	S	S	*	.	S	Bend	trans	-59.7	9.7	-166.9	-69.2	169.6	159.4	177.4	-7.9	114.6	D118	D118-R120 PolarHBondContact O-N 3.29Å
121	D	46.9	Very low	60.9	Low	129 Å²	129	88 Å²	88	69%	0.69	46%	0.456	S	S	*	.			trans	-126.4	36.7	-174.1	-46.2	-41.8	0	0	0	109.7	S119 D123	S119-D121 PolarHBondContact O-N 3.36Å; D121-D123 PolarHBondContact O-N 3.02Å
122	E	56	Low	62.6	Low	53 Å²	53	85.6 Å²	85.6	25%	0.248	44%	0.44	C	S	.	.			trans	-66.8	127.2	165.5	-66.5	-160.9	179.5	0	0	108.6	S119 E124 K130	S119-E122 PolarHBondContact O-N 2.76Å; E122-E124 PolarHBondContact O-N 2.9Å; E122-K130 IonicContact OE1-NZ 3.14Å; E122-K130 PolarHBondContact OE1-NZ 3.04Å; E122-K130 IonicContact OE2-NZ 3.22Å; E122-K130 PolarHBondContact OE2-NZ 2.93Å
123	D	66.5	Low	64.7	Low	67 Å²	67	81.3 Å²	81.3	36%	0.358	42%	0.417	S	S	.	.			trans	-55.8	140	172.1	-60.3	-54.3	0	0	0	109.2	D121 L125 V126 T127	D121-D123 PolarHBondContact O-N 3.02Å; D123-L125 HydrophobicContact CB-CB 4.49Å; D123-L125 PolarHBondContact O-N 3.4Å; D123-V126 HydrophobicContact CB-CB 4.5Å; D123-V126 HydrophobicContact CB-CG2 4.2Å; D123-V126 PolarHBondContact O-N 3.26Å; D123-T127 PolarHBondContact O-N 3.13Å; D123-T127 PolarHBondContact O-OG1 3.38Å
124	E	79.9	Confident	66.7	Low	174 Å²	174	83.3 Å²	83.3	81%	0.813	42%	0.417	S	S	*	.	H	α-helix	trans	-49.5	-34.1	173.5	-175.6	175.5	179.5	0	0	110.8	E122 A128	E122-E124 PolarHBondContact O-N 2.9Å; E124-A128 VanDerWaalsContact O-CB 3.23Å; E124-A128 WeakPolarHBondContact O-CB 3.46Å; E124-A128 PolarHBondContact O-N 3.08Å
125	L	78.7	Confident	68.9	Low	55 Å²	55	82.5 Å²	82.5	29%	0.288	42%	0.416	S	S	.	.	H	α-helix	trans	-65.1	-47	174	-61.8	-178.7	0	0	0	113.5	D123 T127 A128 I129 F170 I205 E207	D123-L125 HydrophobicContact CB-CB 4.49Å; D123-L125 PolarHBondContact O-N 3.4Å; L125-T127 VanDerWaalsContact C-N 3.33Å; L125-A128 PolarHBondContact O-N 3.47Å; L125-I129 VanDerWaalsContact O-CG1 3.24Å; L125-I129 WeakPolarHBondContact O-CG1 3.25Å; L125-I129 PolarHBondContact O-N 3.35Å; L125-F170 HydrophobicContact CD1-CE1 4.36Å; L125-I205 HydrophobicContact CD2-CG2 4.16Å; L125-E207 HydrophobicContact CD1-CB 4.27Å; L125-E207 HydrophobicContact CD1-CG 4.15Å; L125-E207 HydrophobicContact CD2-CG 4.22Å
126	V	80.4	Confident	71.3	Confident	4 Å²	4	80.2 Å²	80.2	2%	0.024	40%	0.402	C	S	.	.	H	α-helix	trans	-66.7	-40.2	-179.9	173.1	0	0	0	0	110.4	D123 I129 K130 F150 H168	D123-V126 HydrophobicContact CB-CB 4.5Å; D123-V126 HydrophobicContact CB-CG2 4.2Å; D123-V126 PolarHBondContact O-N 3.26Å; V126-I129 PolarHBondContact O-N 3.16Å; V126-K130 HydrophobicContact CG1-CD 4.31Å; V126-K130 WeakPolarHBondContact O-CG 3.32Å; V126-K130 PolarHBondContact O-N 3.01Å; V126-F150 HydrophobicContact CG1-CE1 4.01Å; V126-H168 HydrophobicContact CG2-CB 4.45Å
127	T	83.8	Confident	73.4	Confident	67 Å²	67	77.5 Å²	77.5	41%	0.411	39%	0.386	S	S	.	.	H	α-helix	trans	-62.1	-45.1	174.7	-54.7	0	0	0	0	110.6	D123 L125 I129 K130 E131	D123-T127 PolarHBondContact O-N 3.13Å; D123-T127 PolarHBondContact O-OG1 3.38Å; L125-T127 VanDerWaalsContact C-N 3.33Å; T127-I129 PolarHBondContact O-N 3.44Å; T127-K130 PolarHBondContact O-N 2.79Å; T127-E131 WeakPolarHBondContact O-CB 3.2Å; T127-E131 PolarHBondContact O-N 3.24Å
128	A	84.9	Confident	75.7	Confident	31 Å²	31	73.2 Å²	73.2	26%	0.256	36%	0.36	S	S	.	.	H	α-helix	trans	-62.5	-41.1	175.3	0	0	0	0	0	112.5	E124 L125 E131 L132 I205	E124-A128 VanDerWaalsContact O-CB 3.23Å; E124-A128 WeakPolarHBondContact O-CB 3.46Å; E124-A128 PolarHBondContact O-N 3.08Å; L125-A128 PolarHBondContact O-N 3.47Å; A128-E131 PolarHBondContact O-N 2.76Å; A128-L132 WeakPolarHBondContact O-CB 3.37Å; A128-L132 VanDerWaalsContact O-CG 3.3Å; A128-L132 WeakPolarHBondContact O-CG 3.33Å; A128-L132 PolarHBondContact O-N 3.01Å; A128-I205 HydrophobicContact CB-CD1 3.8Å
129	I	85.4	Confident	78	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.2	-48	175.2	-70.1	164.6	0	0	0	110.2	L125 V126 T127 E131 L132 L133 F150 F170 V175 L201 I205 V208	L125-I129 VanDerWaalsContact O-CG1 3.24Å; L125-I129 WeakPolarHBondContact O-CG1 3.25Å; L125-I129 PolarHBondContact O-N 3.35Å; V126-I129 PolarHBondContact O-N 3.16Å; T127-I129 PolarHBondContact O-N 3.44Å; I129-E131 PolarHBondContact O-N 3.48Å; I129-L132 PolarHBondContact O-N 3.2Å; I129-L133 HydrophobicContact CG2-CD1 3.78Å; I129-L133 HydrophobicContact CG2-CG 4.32Å; I129-L133 WeakPolarHBondContact O-CB 2.82Å; I129-L133 VanDerWaalsContact O-CG 3.26Å; I129-L133 WeakPolarHBondContact O-CG 3.44Å; I129-L133 PolarHBondContact O-N 3.13Å; I129-F150 HydrophobicContact CG2-CD2 4.47Å; I129-F170 HydrophobicContact CD1-CD2 4.14Å; I129-F170 HydrophobicContact CD1-CE2 4.39Å; I129-V175 HydrophobicContact CD1-CG2 3.98Å; I129-V175 HydrophobicContact CG2-CG1 4.42Å; I129-L201 HydrophobicContact CG2-CD2 4.42Å; I129-I205 HydrophobicContact CB-CD1 4.34Å; I129-I205 HydrophobicContact CG1-CD1 3.49Å; I129-I205 VanDerWaalsContact CG1-CD1 3.49Å; I129-V208 HydrophobicContact CD1-CG2 4.42Å
130	K	86.1	Confident	79.9	Confident	43 Å²	43	70.4 Å²	70.4	19%	0.187	35%	0.352	C	S	.	.	H	α-helix	trans	-61.3	-44.2	178	-73.2	174.3	-177.5	170.6	0	111.7	E122 V126 T127 L133 D134	E122-K130 IonicContact OE1-NZ 3.14Å; E122-K130 PolarHBondContact OE1-NZ 3.04Å; E122-K130 IonicContact OE2-NZ 3.22Å; E122-K130 PolarHBondContact OE2-NZ 2.93Å; V126-K130 HydrophobicContact CG1-CD 4.31Å; V126-K130 WeakPolarHBondContact O-CG 3.32Å; V126-K130 PolarHBondContact O-N 3.01Å; T127-K130 PolarHBondContact O-N 2.79Å; K130-L133 PolarHBondContact O-N 2.88Å; K130-D134 WeakPolarHBondContact O-CB 3.39Å; K130-D134 PolarHBondContact O-N 3.18Å
131	E	88	Confident	81.7	Confident	127 Å²	127	59.2 Å²	59.2	59%	0.593	31%	0.31	S	S	*	.	H	α-helix	trans	-61.7	-45.2	177	-174.6	179.8	174.1	0	0	111.7	T127 A128 I129 L133 D134 T135	T127-E131 WeakPolarHBondContact O-CB 3.2Å; T127-E131 PolarHBondContact O-N 3.24Å; A128-E131 PolarHBondContact O-N 2.76Å; I129-E131 PolarHBondContact O-N 3.48Å; E131-L133 PolarHBondContact O-N 3.45Å; E131-D134 PolarHBondContact O-N 2.81Å; E131-T135 HydrophobicContact CG-CG2 4.09Å; E131-T135 VanDerWaalsContact O-CB 3.28Å; E131-T135 WeakPolarHBondContact O-CB 3.44Å; E131-T135 WeakPolarHBondContact O-CG2 3.26Å; E131-T135 PolarHBondContact O-N 2.89Å; E131-T135 PolarHBondContact O-OG1 2.8Å
132	L	88.5	Confident	83.7	Confident	27 Å²	27	56.3 Å²	56.3	14%	0.141	29%	0.293	C	S	.	.	H	α-helix	trans	-64.9	-39.5	176.8	-73.1	174.4	0	0	0	112.6	A128 I129 T135 R136 I137 L201 Y204 I205	A128-L132 WeakPolarHBondContact O-CB 3.37Å; A128-L132 VanDerWaalsContact O-CG 3.3Å; A128-L132 WeakPolarHBondContact O-CG 3.33Å; A128-L132 PolarHBondContact O-N 3.01Å; I129-L132 PolarHBondContact O-N 3.2Å; L132-T135 PolarHBondContact O-OG1 2.78Å; L132-R136 PolarHBondContact O-N 2.94Å; L132-R136 VanDerWaalsContact O-N 3.09Å; L132-I137 PolarHBondContact O-N 3.14Å; L132-L201 HydrophobicContact CB-CD2 4.48Å; L132-L201 HydrophobicContact CD1-CD2 4.37Å; L132-Y204 VanDerWaalsContact CD1-CB 3.4Å; L132-Y204 HydrophobicContact CD1-CD2 4.47Å; L132-Y204 HydrophobicContact CD1-CG 4.1Å; L132-Y204 HydrophobicContact CD2-CD1 4.3Å; L132-Y204 HydrophobicContact CD2-CD2 4.13Å; L132-Y204 HydrophobicContact CD2-CG 3.89Å; L132-I205 HydrophobicContact CD1-CD1 3.56Å; L132-I205 HydrophobicContact CD1-CG1 3.68Å
133	L	87.9	Confident	85.1	Confident	8 Å²	8	60.7 Å²	60.7	4%	0.042	31%	0.313	C	S	.	.	I	π-helix	trans	-61.6	-48.6	175.5	-74.3	169.1	0	0	0	110.6	I129 K130 E131 I137 R138 V148 F150	I129-L133 HydrophobicContact CG2-CD1 3.78Å; I129-L133 HydrophobicContact CG2-CG 4.32Å; I129-L133 WeakPolarHBondContact O-CB 2.82Å; I129-L133 VanDerWaalsContact O-CG 3.26Å; I129-L133 WeakPolarHBondContact O-CG 3.44Å; I129-L133 PolarHBondContact O-N 3.13Å; K130-L133 PolarHBondContact O-N 2.88Å; E131-L133 PolarHBondContact O-N 3.45Å; L133-I137 HydrophobicContact CD2-CB 4.09Å; L133-I137 HydrophobicContact CD2-CD1 3.56Å; L133-I137 HydrophobicContact CD2-CG1 4.39Å; L133-I137 HydrophobicContact CD2-CG2 4.02Å; L133-I137 HydrophobicContact CG-CD1 4.41Å; L133-I137 PolarHBondContact O-N 2.9Å; L133-R138 WeakPolarHBondContact O-CB 3.28Å; L133-R138 WeakPolarHBondContact O-CG 3.35Å; L133-R138 PolarHBondContact O-N 3.15Å; L133-V148 HydrophobicContact CD2-CG2 4.16Å; L133-F150 HydrophobicContact CD1-CB 3.89Å; L133-F150 HydrophobicContact CD1-CG 4.41Å
134	D	87.6	Confident	86.1	Confident	87 Å²	87	61.6 Å²	61.6	47%	0.465	32%	0.318	S	S	.	.	I	π-helix	trans	-69.9	-36	-178.6	-78.5	-14.7	0	0	0	113.5	K130 E131 R138 P139	K130-D134 WeakPolarHBondContact O-CB 3.39Å; K130-D134 PolarHBondContact O-N 3.18Å; E131-D134 PolarHBondContact O-N 2.81Å; D134-R138 WeakPolarHBondContact OD1-CD 3.29Å; D134-R138 IonicContact OD1-CZ 3.44Å; D134-R138 IonicContact OD1-NE 3.46Å; D134-R138 IonicContact OD1-NH1 2.62Å; D134-R138 PolarHBondContact OD1-NH1 3.4Å; D134-P139 WeakPolarHBondContact O-CD 3.23Å
135	T	87.5	Confident	86.3	Confident	77 Å²	77	54.5 Å²	54.5	47%	0.472	29%	0.292	S	S	.	.	I	π-helix	trans	-82.4	-35	-175.1	55	0	0	0	0	113.7	E131 L132	E131-T135 HydrophobicContact CG-CG2 4.09Å; E131-T135 VanDerWaalsContact O-CB 3.28Å; E131-T135 WeakPolarHBondContact O-CB 3.44Å; E131-T135 WeakPolarHBondContact O-CG2 3.26Å; E131-T135 PolarHBondContact O-N 2.89Å; E131-T135 PolarHBondContact O-OG1 2.8Å; L132-T135 PolarHBondContact O-OG1 2.78Å
136	R	87.2	Confident	86.8	Confident	127 Å²	127	52.2 Å²	52.2	48%	0.479	28%	0.281	S	S	.	.	I	π-helix	trans	-124.5	-44.6	-170.5	-63.5	-173.2	178.4	-146.1	12.4	114.6	L132 M200 Y204	L132-R136 PolarHBondContact O-N 2.94Å; L132-R136 VanDerWaalsContact O-N 3.09Å; R136-M200 HydrophobicContact CB-CE 3.83Å; R136-Y204 VanDerWaalsContact NH1-CZ 3.26Å; R136-Y204 PolarHBondContact NH1-OH 2.93Å
137	I	88.1	Confident	87.2	Confident	9 Å²	9	52.4 Å²	52.4	5%	0.046	28%	0.282	C	S	.	.	I	π-helix	trans	-79	-52.9	-172.1	-66.5	168.5	0	0	0	110.7	L132 L133 A140 I141 V148 I197 M200 L201	L132-I137 PolarHBondContact O-N 3.14Å; L133-I137 HydrophobicContact CD2-CB 4.09Å; L133-I137 HydrophobicContact CD2-CD1 3.56Å; L133-I137 HydrophobicContact CD2-CG1 4.39Å; L133-I137 HydrophobicContact CD2-CG2 4.02Å; L133-I137 HydrophobicContact CG-CD1 4.41Å; L133-I137 PolarHBondContact O-N 2.9Å; I137-A140 PolarHBondContact O-N 3.05Å; I137-A140 VanDerWaalsContact O-N 3.16Å; I137-I141 HydrophobicContact CG2-CD1 3.4Å; I137-I141 HydrophobicContact CG2-CG1 4.22Å; I137-I141 WeakPolarHBondContact O-CG1 3.28Å; I137-I141 PolarHBondContact O-N 2.5Å; I137-V148 HydrophobicContact CG2-CG2 4.07Å; I137-I197 HydrophobicContact CD1-CG1 4.48Å; I137-I197 HydrophobicContact CD1-CG2 4.2Å; I137-I197 HydrophobicContact CG2-CD1 4.27Å; I137-I197 HydrophobicContact CG2-CG1 3.94Å; I137-M200 HydrophobicContact CD1-CB 4.42Å; I137-M200 HydrophobicContact CD1-CE 4.21Å; I137-M200 HydrophobicContact CG1-CE 3.51Å; I137-L201 HydrophobicContact CD1-CD2 4.38Å; I137-L201 HydrophobicContact CD1-CG 4.41Å
138	R	90.1	Very high	87.3	Confident	42 Å²	42	49.4 Å²	49.4	16%	0.158	26%	0.264	C	S	.	.	H	α-helix	trans	-59.7	-43.1	-178.5	-71.3	-179.5	73.4	-156.7	2.1	113.1	T52 L133 D134 A140 I141 Q142 D147 V148	T52-R138 PolarHBondContact OG1-NH2 2.72Å; L133-R138 WeakPolarHBondContact O-CB 3.28Å; L133-R138 WeakPolarHBondContact O-CG 3.35Å; L133-R138 PolarHBondContact O-N 3.15Å; D134-R138 WeakPolarHBondContact OD1-CD 3.29Å; D134-R138 IonicContact OD1-CZ 3.44Å; D134-R138 IonicContact OD1-NE 3.46Å; D134-R138 IonicContact OD1-NH1 2.62Å; D134-R138 PolarHBondContact OD1-NH1 3.4Å; R138-A140 VanDerWaalsContact C-N 3.26Å; R138-A140 PolarHBondContact O-N 3Å; R138-I141 PolarHBondContact O-N 3.27Å; R138-Q142 WeakPolarHBondContact O-CB 3.42Å; R138-Q142 WeakPolarHBondContact O-CG 3.47Å; R138-Q142 PolarHBondContact O-N 2.93Å; R138-D147 IonicContact CZ-OD1 3.83Å; R138-D147 IonicContact CZ-OD2 3.84Å; R138-D147 IonicContact NE-OD1 2.9Å; R138-D147 PolarHBondContact NE-OD1 2.87Å; R138-D147 IonicContact NE-OD2 3.91Å; R138-D147 IonicContact NH2-OD1 3.81Å; R138-D147 IonicContact NH2-OD2 2.83Å; R138-D147 PolarHBondContact NH2-OD2 2.9Å; R138-V148 HydrophobicContact CG-CG2 3.77Å
139	P	88.6	Confident	87.3	Confident	55 Å²	55	50.4 Å²	50.4	36%	0.357	27%	0.266	S	S	.	.	H	α-helix	trans	-59.3	-34.3	176.2	-27.5	36.9	0	0	0	114	D134 Q143	D134-P139 WeakPolarHBondContact O-CD 3.23Å; P139-Q143 VanDerWaalsContact O-CG 3.31Å; P139-Q143 WeakPolarHBondContact O-CG 3.36Å; P139-Q143 PolarHBondContact O-N 3.4Å
140	A	86.3	Confident	87.2	Confident	55 Å²	55	51.5 Å²	51.5	46%	0.455	27%	0.271	S	S	.	.	H	α-helix	trans	-72.5	-48.1	176	0	0	0	0	0	111.3	I137 R138 Q142 Q143	I137-A140 PolarHBondContact O-N 3.05Å; I137-A140 VanDerWaalsContact O-N 3.16Å; R138-A140 VanDerWaalsContact C-N 3.26Å; R138-A140 PolarHBondContact O-N 3Å; A140-Q142 PolarHBondContact O-N 3.3Å; A140-Q143 WeakPolarHBondContact O-CB 3.48Å; A140-Q143 PolarHBondContact O-N 3.26Å
141	I	87.7	Confident	86.6	Confident	6 Å²	6	52.3 Å²	52.3	3%	0.031	28%	0.276	C	S	.	.	H	α-helix	trans	-67	-37.4	-178.4	-60.6	174.6	0	0	0	111.7	I137 R138 Q143 D144 G145 G146 V148 C183 L193 I197	I137-I141 HydrophobicContact CG2-CD1 3.4Å; I137-I141 HydrophobicContact CG2-CG1 4.22Å; I137-I141 WeakPolarHBondContact O-CG1 3.28Å; I137-I141 PolarHBondContact O-N 2.5Å; R138-I141 PolarHBondContact O-N 3.27Å; I141-Q143 VanDerWaalsContact C-N 3.26Å; I141-Q143 PolarHBondContact O-N 2.69Å; I141-D144 PolarHBondContact O-N 2.84Å; I141-D144 VanDerWaalsContact O-N 3.15Å; I141-G145 PolarHBondContact O-N 2.81Å; I141-G145 VanDerWaalsContact O-N 3.14Å; I141-G146 CarbonylContact C-O 3.57Å; I141-G146 PolarHBondContact O-N 3.01Å; I141-G146 VanDerWaalsContact O-N 3.08Å; I141-V148 HydrophobicContact CD1-CB 4.4Å; I141-V148 HydrophobicContact CD1-CG1 3.54Å; I141-V148 HydrophobicContact CD1-CG2 3.95Å; I141-C183 WeakPolarHBondContact CG2-SG 3.03Å; I141-L193 HydrophobicContact CD1-CD1 3.79Å; I141-L193 HydrophobicContact CD1-CD2 3.97Å; I141-L193 HydrophobicContact CD1-CG 4.23Å; I141-L193 HydrophobicContact CG1-CD1 3.84Å; I141-L193 HydrophobicContact CG1-CD2 4.18Å; I141-L193 HydrophobicContact CG2-CD2 4.4Å; I141-I197 HydrophobicContact CD1-CD1 4.23Å
142	Q	88	Confident	85.3	Confident	68 Å²	68	48.9 Å²	48.9	32%	0.318	26%	0.264	S	S	.	.	H	α-helix	trans	-68.9	-24.2	178.2	-71.9	172.7	9.2	0	0	112.8	K40 R138 A140 D144 G145 G146 D147	K40-Q142 PolarHBondContact NZ-O 3.24Å; R138-Q142 WeakPolarHBondContact O-CB 3.42Å; R138-Q142 WeakPolarHBondContact O-CG 3.47Å; R138-Q142 PolarHBondContact O-N 2.93Å; A140-Q142 PolarHBondContact O-N 3.3Å; Q142-D144 VanDerWaalsContact C-N 3.32Å; Q142-G145 PolarHBondContact O-N 2.99Å; Q142-G146 VanDerWaalsContact CA-O 3.29Å; Q142-G146 WeakPolarHBondContact CA-O 3.48Å; Q142-G146 WeakPolarHBondContact CG-O 3.46Å; Q142-G146 PolarHBondContact N-O 2.62Å; Q142-D147 PolarHBondContact NE2-OD1 2.78Å
143	Q	86.3	Confident	83.3	Confident	146 Å²	146	49.2 Å²	49.2	68%	0.682	27%	0.274	S	S	*	.	H	α-helix	trans	-62.7	-43.3	170.8	-77.1	174.8	14.6	0	0	110.7	K40 P139 A140 I141 G145	K40-Q143 PolarHBondContact NZ-O 2.66Å; P139-Q143 VanDerWaalsContact O-CG 3.31Å; P139-Q143 WeakPolarHBondContact O-CG 3.36Å; P139-Q143 PolarHBondContact O-N 3.4Å; A140-Q143 WeakPolarHBondContact O-CB 3.48Å; A140-Q143 PolarHBondContact O-N 3.26Å; I141-Q143 VanDerWaalsContact C-N 3.26Å; I141-Q143 PolarHBondContact O-N 2.69Å; Q143-G145 PolarHBondContact O-N 3Å
144	D	86.6	Confident	81.1	Confident	85 Å²	85	54 Å²	54	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-75.7	-9.9	177.1	-65.9	-15.5	0	0	0	113.4	T33 P34 I141 Q142	T33-D144 VanDerWaalsContact CB-O 3.28Å; T33-D144 WeakPolarHBondContact CB-O 3.5Å; T33-D144 VanDerWaalsContact CG2-O 3.26Å; T33-D144 WeakPolarHBondContact CG2-O 3.47Å; P34-D144 HydrophobicContact CG-CB 4.13Å; I141-D144 PolarHBondContact O-N 2.84Å; I141-D144 VanDerWaalsContact O-N 3.15Å; Q142-D144 VanDerWaalsContact C-N 3.32Å
145	G	85.7	Confident	78.5	Confident	26 Å²	26	57 Å²	57	27%	0.268	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.5	10.6	176.3	0	0	0	0	0	114.8	I141 Q142 Q143 A182	I141-G145 PolarHBondContact O-N 2.81Å; I141-G145 VanDerWaalsContact O-N 3.14Å; Q142-G145 PolarHBondContact O-N 2.99Å; Q143-G145 PolarHBondContact O-N 3Å; G145-A182 WeakPolarHBondContact O-CB 3.07Å; G145-A182 PolarHBondContact O-N 3.35Å
146	G	87.9	Confident	75.9	Confident	6 Å²	6	61.6 Å²	61.6	6%	0.062	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	179	169.5	0	0	0	0	0	112.9	I141 Q142 Q180	I141-G146 CarbonylContact C-O 3.57Å; I141-G146 PolarHBondContact O-N 3.01Å; I141-G146 VanDerWaalsContact O-N 3.08Å; Q142-G146 VanDerWaalsContact CA-O 3.29Å; Q142-G146 WeakPolarHBondContact CA-O 3.48Å; Q142-G146 WeakPolarHBondContact CG-O 3.46Å; Q142-G146 PolarHBondContact N-O 2.62Å; G146-Q180 WeakPolarHBondContact CA-O 3.43Å
147	D	89	Confident	73.5	Confident	8 Å²	8	57.9 Å²	57.9	4%	0.043	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	165	164	-157.6	19.2	0	0	0	110.3	T52 R138 Q142 Q180	T52-D147 VanDerWaalsContact CB-OD2 3.23Å; T52-D147 WeakPolarHBondContact CB-OD2 3.3Å; T52-D147 VanDerWaalsContact CG2-OD2 3.29Å; T52-D147 WeakPolarHBondContact CG2-OD2 3.29Å; T52-D147 PolarHBondContact OG1-OD2 3.35Å; R138-D147 IonicContact CZ-OD1 3.83Å; R138-D147 IonicContact CZ-OD2 3.84Å; R138-D147 IonicContact NE-OD1 2.9Å; R138-D147 PolarHBondContact NE-OD1 2.87Å; R138-D147 IonicContact NE-OD2 3.91Å; R138-D147 IonicContact NH2-OD1 3.81Å; R138-D147 IonicContact NH2-OD2 2.83Å; R138-D147 PolarHBondContact NH2-OD2 2.9Å; Q142-D147 PolarHBondContact NE2-OD1 2.78Å; D147-Q180 PolarHBondContact N-O 3.07Å; D147-Q180 PolarHBondContact O-N 2.9Å
148	V	86.7	Confident	71.3	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.03	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.5	174.4	-68.2	0	0	0	0	110	L133 I137 R138 I141 K178 M179 I197	L133-V148 HydrophobicContact CD2-CG2 4.16Å; I137-V148 HydrophobicContact CG2-CG2 4.07Å; R138-V148 HydrophobicContact CG-CG2 3.77Å; I141-V148 HydrophobicContact CD1-CB 4.4Å; I141-V148 HydrophobicContact CD1-CG1 3.54Å; I141-V148 HydrophobicContact CD1-CG2 3.95Å; V148-K178 WeakPolarHBondContact CA-O 3.41Å; V148-M179 HydrophobicContact CG1-CE 3.49Å; V148-M179 VanDerWaalsContact CG1-CE 3.49Å; V148-M179 HydrophobicContact CG1-SD 3.58Å; V148-M179 VanDerWaalsContact CG1-SD 3.58Å; V148-I197 HydrophobicContact CG1-CD1 4.16Å
149	V	84.8	Confident	68.7	Low	51 Å²	51	69.7 Å²	69.7	31%	0.309	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.2	175.9	179.2	0	0	0	0	108.2	M151 K178 Q180	V149-M151 PolarHBondContact O-N 3.11Å; V149-K178 PolarHBondContact N-O 3.27Å; V149-K178 PolarHBondContact O-N 3.3Å; V149-Q180 HydrophobicContact CG2-CG 4.36Å
150	F	82.3	Confident	66.6	Low	24 Å²	24	70.9 Å²	70.9	11%	0.105	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	117.8	174.5	-177.1	-116.4	0	0	0	109.6	V126 I129 L133 V152 V175	V126-F150 HydrophobicContact CG1-CE1 4.01Å; I129-F150 HydrophobicContact CG2-CD2 4.47Å; L133-F150 HydrophobicContact CD1-CB 3.89Å; L133-F150 HydrophobicContact CD1-CG 4.41Å; F150-V152 HydrophobicContact CD1-CG2 3.75Å; F150-V152 HydrophobicContact CE1-CG2 3.79Å; F150-V152 PolarHBondContact O-N 3.26Å; F150-V175 HydrophobicContact CD2-CG1 3.8Å; F150-V175 HydrophobicContact CE2-CB 4.41Å; F150-V175 HydrophobicContact CE2-CG1 3.5Å; F150-V175 VanDerWaalsContact CE2-CG1 3.5Å
151	M	73.4	Confident	64.7	Low	59 Å²	59	74.8 Å²	74.8	29%	0.291	43%	0.427	S	S	.	.			trans	-83.6	101	178.8	-68.8	-67.9	-76.2	0	0	109	V149 G153 K176 K178 D216	V149-M151 PolarHBondContact O-N 3.11Å; M151-G153 PolarHBondContact O-N 3.23Å; M151-K176 PolarHBondContact N-O 2.98Å; M151-K178 HydrophobicContact CG-CB 3.74Å; M151-K178 HydrophobicContact SD-CB 4.27Å; M151-K178 HydrophobicContact SD-CD 4.4Å; M151-D216 WeakPolarHBondContact CE-OD1 3.34Å
152	V	61.1	Low	62.4	Low	56 Å²	56	78.8 Å²	78.8	34%	0.339	47%	0.471	S	S	.	.			trans	-75.3	109.3	167.6	-175.3	0	0	0	0	107.4	F150 S154 H168	F150-V152 HydrophobicContact CD1-CG2 3.75Å; F150-V152 HydrophobicContact CE1-CG2 3.79Å; F150-V152 PolarHBondContact O-N 3.26Å; V152-S154 PolarHBondContact O-N 3.5Å; V152-S154 VanDerWaalsContact O-N 3.08Å; V152-H168 HydrophobicContact CG1-CB 4.07Å
153	G	47.1	Very low	60.3	Low	34 Å²	34	81.5 Å²	81.5	35%	0.351	48%	0.483	S	S	.	.			trans	-62.6	111.1	170.7	0	0	0	0	0	109.2	M151 L155	M151-G153 PolarHBondContact O-N 3.23Å; G153-L155 PolarHBondContact O-N 2.76Å
154	S	40.6	Very low	58.3	Low	108 Å²	108	78.6 Å²	78.6	76%	0.755	48%	0.484	S	S	*	.			trans	-74.8	36.9	169.9	-158.1	0	0	0	0	111.3	V152 H156	V152-S154 PolarHBondContact O-N 3.5Å; V152-S154 VanDerWaalsContact O-N 3.08Å; S154-H156 PolarHBondContact O-N 3.29Å
155	L	34.4	Very low	56.2	Low	149 Å²	149	79.9 Å²	79.9	78%	0.78	49%	0.491	S	S	*	.			trans	-75.4	97.2	176	-157.1	76.8	0	0	0	106.4	G153 C157	G153-L155 PolarHBondContact O-N 2.76Å; L155-C157 PolarHBondContact O-N 3.14Å
156	H	32.6	Very low	54.1	Low	174 Å²	174	81.8 Å²	81.8	81%	0.806	50%	0.499	S	S	*	.			trans	-41.5	111.4	155.1	-82.8	102	0	0	0	107.7	S154 S158	S154-H156 PolarHBondContact O-N 3.29Å; H156-S158 VanDerWaalsContact C-N 3.28Å; H156-S158 PolarHBondContact O-N 3.44Å
157	C	36.6	Very low	51.9	Low	49 Å²	49	86.1 Å²	86.1	33%	0.331	52%	0.517	S	S	.	.			trans	-65.7	99.9	162.8	-44.3	0	0	0	0	105.6	L155 H159 C166	L155-C157 PolarHBondContact O-N 3.14Å; C157-H159 PolarHBondContact O-N 3.12Å; C157-H159 VanDerWaalsContact O-N 3.07Å; C157-C166 PolarHBondContact SG-O 2.88Å
158	S	41	Very low	50	Low	101 Å²	101	88.4 Å²	88.4	71%	0.706	53%	0.527	S	S	*	.			trans	-58.8	114.4	166.8	49.7	0	0	0	0	107.4	H156 A160	H156-S158 VanDerWaalsContact C-N 3.28Å; H156-S158 PolarHBondContact O-N 3.44Å; S158-A160 PolarHBondContact O-N 2.91Å
159	H	36.1	Very low	48.2	Very low	198 Å²	198	89 Å²	89	92%	0.917	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	61.1	176.7	-77	-82.7	0	0	0	114.1	C157	C157-H159 PolarHBondContact O-N 3.12Å; C157-H159 VanDerWaalsContact O-N 3.07Å
160	A	44.6	Very low	46.6	Very low	81 Å²	81	88.1 Å²	88.1	67%	0.669	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-44.3	170.6	0	0	0	0	0	110.8	S158	S158-A160 PolarHBondContact O-N 2.91Å
161	D	45.5	Very low	45.4	Very low	136 Å²	136	90.6 Å²	90.6	73%	0.727	54%	0.54	S	S	*	.	S	Bend	trans	-109.7	124.8	177.4	-56.8	-40.5	0	0	0	107.8	H163	D161-H163 PolarHBondContact O-N 2.98Å
162	G	40.2	Very low	45.1	Very low	91 Å²	91	92.6 Å²	92.6	94%	0.938	55%	0.552	S	S	*	*			trans	-64.7	35	176.6	0	0	0	0	0	114.2	A164	G162-A164 VanDerWaalsContact C-N 3.34Å; G162-A164 PolarHBondContact O-N 3.07Å; G162-A164 VanDerWaalsContact O-N 3.07Å
163	H	43.6	Very low	45.7	Very low	124 Å²	124	90 Å²	90	57%	0.574	54%	0.537	S	S	*	.			trans	-78.1	87	173.1	-143.8	77	0	0	0	108.2	D161 N165	D161-H163 PolarHBondContact O-N 2.98Å; H163-N165 PolarHBondContact O-N 2.69Å
164	A	44.9	Very low	47.4	Very low	85 Å²	85	89.9 Å²	89.9	70%	0.702	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	21.3	-179.4	0	0	0	0	0	114.6	G162 F167	G162-A164 VanDerWaalsContact C-N 3.34Å; G162-A164 PolarHBondContact O-N 3.07Å; G162-A164 VanDerWaalsContact O-N 3.07Å; A164-F167 WeakPolarHBondContact O-CE2 3.26Å
165	N	42.9	Very low	49.4	Very low	113 Å²	113	84.8 Å²	84.8	60%	0.604	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.4	14.2	-168.8	-154.7	21.6	0	0	0	115.7	H163 F167	H163-N165 PolarHBondContact O-N 2.69Å; N165-F167 PolarHBondContact O-N 3Å
166	C	40.4	Very low	51.7	Low	65 Å²	65	80.7 Å²	80.7	44%	0.439	47%	0.469	S	S	.	.			trans	-98.3	46.9	176.7	-62.9	0	0	0	0	111.8	C157	C157-C166 PolarHBondContact SG-O 2.88Å
167	F	41.9	Very low	54.3	Low	98 Å²	98	72.7 Å²	72.7	43%	0.43	43%	0.433	S	S	.	.			trans	-94.7	135.2	-173.9	-74.7	-81.4	0	0	0	112	A164 N165	A164-F167 WeakPolarHBondContact O-CE2 3.26Å; N165-F167 PolarHBondContact O-N 3Å
168	H	49.6	Very low	56.6	Low	55 Å²	55	71.5 Å²	71.5	26%	0.255	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	65.8	153.9	-58.2	111.5	0	0	0	118.5	V126 V152 F170	V126-H168 HydrophobicContact CG2-CB 4.45Å; V152-H168 HydrophobicContact CG1-CB 4.07Å; H168-F170 PolarHBondContact O-N 2.89Å
169	G	48.5	Very low	58.7	Low	17 Å²	17	67.6 Å²	67.6	18%	0.175	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	64	-2.3	164.4	0	0	0	0	0	116.6
170	F	50.4	Low	61.1	Low	34 Å²	34	59.6 Å²	59.6	15%	0.149	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	80.2	171.7	-174.9	-103.9	0	0	0	107.4	L125 I129 H168 N172 V175 E207 V208	L125-F170 HydrophobicContact CD1-CE1 4.36Å; I129-F170 HydrophobicContact CD1-CD2 4.14Å; I129-F170 HydrophobicContact CD1-CE2 4.39Å; H168-F170 PolarHBondContact O-N 2.89Å; F170-N172 PolarHBondContact O-N 2.72Å; F170-V175 HydrophobicContact CD2-CG2 3.94Å; F170-V175 HydrophobicContact CE2-CG2 4.11Å; F170-E207 HydrophobicContact CZ-CB 4.07Å; F170-E207 WeakPolarHBondContact CZ-O 3.43Å; F170-V208 HydrophobicContact CE2-CG2 3.92Å
171	D	58.2	Low	63	Low	75 Å²	75	57.4 Å²	57.4	40%	0.401	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	113.5	178.3	-168.9	-0	0	0	0	108	G173 V174	D171-G173 PolarHBondContact O-N 3.34Å; D171-V174 WeakPolarHBondContact O-CB 3.47Å; D171-V174 WeakPolarHBondContact O-CG2 3.26Å; D171-V174 PolarHBondContact O-N 3.44Å
172	N	66.1	Low	64.8	Low	102 Å²	102	51.3 Å²	51.3	55%	0.545	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	21.2	171.5	-73.1	-63.9	0	0	0	117.1	F170 K209	F170-N172 PolarHBondContact O-N 2.72Å; N172-K209 WeakPolarHBondContact O-CD 3.49Å; N172-K209 WeakPolarHBondContact O-CE 3.44Å; N172-K209 PolarHBondContact O-NZ 3.45Å
173	G	75.1	Confident	66.9	Low	2 Å²	2	47.4 Å²	47.4	2%	0.021	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	102.7	1	-173.6	0	0	0	0	0	114.8	D171 V208 K209 S210	D171-G173 PolarHBondContact O-N 3.34Å; G173-V208 CarbonylContact O-C 3.36Å; G173-K209 PolarHBondContact O-N 2.83Å; G173-S210 PolarHBondContact O-N 2.97Å
174	V	81.8	Confident	68.6	Low	31 Å²	31	45 Å²	45	19%	0.188	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	119.3	-176.4	-172.2	0	0	0	0	110.7	D171 S210 E212	D171-V174 WeakPolarHBondContact O-CB 3.47Å; D171-V174 WeakPolarHBondContact O-CG2 3.26Å; D171-V174 PolarHBondContact O-N 3.44Å; V174-S210 WeakPolarHBondContact CA-O 3.46Å; V174-E212 HydrophobicContact CG1-CB 3.84Å
175	V	83.1	Confident	69.9	Low	1 Å²	1	43.5 Å²	43.5	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130	176.2	176.8	0	0	0	0	109.2	I129 F150 F170 P177 L201 V208 S210 V211 E212	I129-V175 HydrophobicContact CD1-CG2 3.98Å; I129-V175 HydrophobicContact CG2-CG1 4.42Å; F150-V175 HydrophobicContact CD2-CG1 3.8Å; F150-V175 HydrophobicContact CE2-CB 4.41Å; F150-V175 HydrophobicContact CE2-CG1 3.5Å; F150-V175 VanDerWaalsContact CE2-CG1 3.5Å; F170-V175 HydrophobicContact CD2-CG2 3.94Å; F170-V175 HydrophobicContact CE2-CG2 4.11Å; V175-P177 VanDerWaalsContact C-CD 3.46Å; V175-P177 WeakPolarHBondContact O-CD 3.47Å; V175-L201 HydrophobicContact CB-CD1 4.28Å; V175-L201 HydrophobicContact CG1-CD1 3.93Å; V175-L201 HydrophobicContact CG2-CD1 4.2Å; V175-V208 HydrophobicContact CG2-CG1 3.85Å; V175-V208 HydrophobicContact CG2-CG2 3.94Å; V175-S210 PolarHBondContact N-O 2.9Å; V175-V211 HydrophobicContact CB-CG2 4.29Å; V175-V211 CarbonylContact O-C 3.5Å; V175-V211 WeakPolarHBondContact O-CA 3.44Å; V175-E212 PolarHBondContact O-N 3.03Å
176	K	83.7	Confident	71.5	Confident	63 Å²	63	38.2 Å²	38.2	27%	0.274	23%	0.227	S	C	.	.			trans	-109.5	81.8	-176.9	-70.7	173.8	172.1	-177	0	113.2	M151 E212 V214	M151-K176 PolarHBondContact N-O 2.98Å; K176-E212 VanDerWaalsContact CA-O 3.29Å; K176-E212 WeakPolarHBondContact CA-O 3.37Å; K176-E212 WeakPolarHBondContact CE-OE2 3.32Å; K176-E212 HydrophobicContact CG-CB 4.49Å; K176-V214 HydrophobicContact CB-CB 4.46Å; K176-V214 HydrophobicContact CB-CG2 3.78Å; K176-V214 HydrophobicContact CD-CG2 3.85Å; K176-V214 HydrophobicContact CG-CG2 3.71Å
177	P	86.2	Confident	72.9	Confident	5 Å²	5	40.6 Å²	40.6	3%	0.032	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	139.8	175.3	32	-34.8	0	0	0	112.1	V175 V211 E212 V214	V175-P177 VanDerWaalsContact C-CD 3.46Å; V175-P177 WeakPolarHBondContact O-CD 3.47Å; P177-V211 VanDerWaalsContact CD-CG1 3.5Å; P177-V211 HydrophobicContact CG-CG1 3.48Å; P177-V211 VanDerWaalsContact CG-CG1 3.48Å; P177-E212 WeakPolarHBondContact CD-O 3.48Å; P177-V214 PolarHBondContact O-N 3.3Å
178	K	85.1	Confident	74.2	Confident	25 Å²	25	40.1 Å²	40.1	11%	0.109	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.1	164.6	-175.6	-179.2	-166	-176.4	0	109.9	V148 V149 M151 Q180 D216 D219	V148-K178 WeakPolarHBondContact CA-O 3.41Å; V149-K178 PolarHBondContact N-O 3.27Å; V149-K178 PolarHBondContact O-N 3.3Å; M151-K178 HydrophobicContact CG-CB 3.74Å; M151-K178 HydrophobicContact SD-CB 4.27Å; M151-K178 HydrophobicContact SD-CD 4.4Å; K178-Q180 HydrophobicContact CG-CG 4.42Å; K178-D216 VanDerWaalsContact CD-OD1 3.25Å; K178-D216 WeakPolarHBondContact CD-OD1 3.47Å; K178-D216 WeakPolarHBondContact CE-OD1 3.44Å; K178-D216 IonicContact NZ-OD1 2.79Å; K178-D216 PolarHBondContact NZ-OD1 3.36Å; K178-D216 IonicContact NZ-OD2 2.72Å; K178-D216 PolarHBondContact NZ-OD2 3.28Å; K178-D219 IonicContact NZ-OD2 3.82Å; K178-D219 PolarHBondContact NZ-OD2 3.03Å
179	M	86.1	Confident	75	Confident	18 Å²	18	38.6 Å²	38.6	9%	0.089	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.1	174.7	-54.2	-55.1	-57.5	0	0	110.7	V148 C183 T184 L193 Q213	V148-M179 HydrophobicContact CG1-CE 3.49Å; V148-M179 VanDerWaalsContact CG1-CE 3.49Å; V148-M179 HydrophobicContact CG1-SD 3.58Å; V148-M179 VanDerWaalsContact CG1-SD 3.58Å; M179-C183 HydrophobicContact CB-CB 4.48Å; M179-C183 HydrophobicContact CE-CB 3.59Å; M179-T184 PolarHBondContact O-OG1 3.01Å; M179-L193 HydrophobicContact CE-CD2 3.32Å; M179-L193 HydrophobicContact CE-CG 4.14Å; M179-Q213 VanDerWaalsContact CG-CD 3.47Å; M179-Q213 HydrophobicContact CG-CG 3.89Å
180	Q	85.6	Confident	76.3	Confident	30 Å²	30	40.8 Å²	40.8	14%	0.14	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	161.4	178.3	-62.8	-171.3	-5.5	0	0	111.8	N54 G146 D147 V149 K178 T184	N54-Q180 HydrophobicContact CB-CB 4.14Å; N54-Q180 HydrophobicContact CB-CG 4.3Å; G146-Q180 WeakPolarHBondContact CA-O 3.43Å; D147-Q180 PolarHBondContact N-O 3.07Å; D147-Q180 PolarHBondContact O-N 2.9Å; V149-Q180 HydrophobicContact CG2-CG 4.36Å; K178-Q180 HydrophobicContact CG-CG 4.42Å; Q180-T184 WeakPolarHBondContact CA-OG1 3.42Å
181	G	84.5	Confident	77.7	Confident	36 Å²	36	41.2 Å²	41.2	37%	0.371	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	70.7	-141.7	177.3	0	0	0	0	0	113.1	C183 T184	G181-C183 PolarHBondContact O-N 3.35Å; G181-C183 VanDerWaalsContact O-N 3.11Å; G181-T184 WeakPolarHBondContact O-CB 3.46Å; G181-T184 PolarHBondContact O-N 3.01Å; G181-T184 PolarHBondContact O-OG1 2.74Å
182	A	83.4	Confident	78.9	Confident	8 Å²	8	42.6 Å²	42.6	7%	0.066	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-20.5	-175.9	0	0	0	0	0	114.3	N35 S38 G145 T184	N35-A182 PolarHBondContact ND2-O 2.78Å; S38-A182 WeakPolarHBondContact OG-CB 3.25Å; G145-A182 WeakPolarHBondContact O-CB 3.07Å; G145-A182 PolarHBondContact O-N 3.35Å; A182-T184 VanDerWaalsContact C-N 3.32Å
183	C	83.1	Confident	79.7	Confident	9 Å²	9	39.6 Å²	39.6	6%	0.061	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-25	176.4	-67	0	0	0	0	113.1	I141 M179 G181 G185 C186 L193	I141-C183 WeakPolarHBondContact CG2-SG 3.03Å; M179-C183 HydrophobicContact CB-CB 4.48Å; M179-C183 HydrophobicContact CE-CB 3.59Å; G181-C183 PolarHBondContact O-N 3.35Å; G181-C183 VanDerWaalsContact O-N 3.11Å; C183-G185 PolarHBondContact O-N 3.45Å; C183-C186 PolarHBondContact O-N 2.98Å; C183-L193 HydrophobicContact CB-CD2 4.39Å
184	T	79.3	Confident	80.2	Confident	73 Å²	73	43.6 Å²	43.6	45%	0.448	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	123.4	176.6	-50.4	0	0	0	0	109	M179 Q180 G181 A182 C186	M179-T184 PolarHBondContact O-OG1 3.01Å; Q180-T184 WeakPolarHBondContact CA-OG1 3.42Å; G181-T184 WeakPolarHBondContact O-CB 3.46Å; G181-T184 PolarHBondContact O-N 3.01Å; G181-T184 PolarHBondContact O-OG1 2.74Å; A182-T184 VanDerWaalsContact C-N 3.32Å; T184-C186 VanDerWaalsContact C-N 3.34Å; T184-C186 PolarHBondContact O-N 3.44Å
185	G	73	Confident	80.5	Confident	54 Å²	54	45.6 Å²	45.6	56%	0.557	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	6.8	179.1	0	0	0	0	0	115.9	C183 P187	C183-G185 PolarHBondContact O-N 3.45Å; G185-P187 VanDerWaalsContact O-CD 3.22Å; G185-P187 WeakPolarHBondContact O-CD 3.14Å
186	C	77	Confident	80.7	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.007	31%	0.307	C	S	.	.			trans	-84	109.8	178.3	-176.8	0	0	0	0	111.4	N35 C183 T184 S188 S189 I190	N35-C186 HydrophobicContact CB-CB 4.12Å; C183-C186 PolarHBondContact O-N 2.98Å; T184-C186 VanDerWaalsContact C-N 3.34Å; T184-C186 PolarHBondContact O-N 3.44Å; C186-S188 VanDerWaalsContact C-N 3.28Å; C186-S188 PolarHBondContact O-N 3.11Å; C186-S189 PolarHBondContact O-N 3.48Å; C186-S189 VanDerWaalsContact O-N 3.14Å; C186-S189 VanDerWaalsContact SG-CB 3.6Å; C186-S189 PolarHBondContact SG-OG 3.44Å; C186-I190 WeakPolarHBondContact O-CD1 3.37Å; C186-I190 VanDerWaalsContact O-CG1 3.3Å; C186-I190 WeakPolarHBondContact O-CG1 3.22Å; C186-I190 PolarHBondContact O-N 3.18Å; C186-I190 VanDerWaalsContact O-N 3.12Å
187	P	70	Confident	80.9	Confident	115 Å²	115	44.3 Å²	44.3	75%	0.747	30%	0.295	S	S	*	.	H	α-helix	trans	-64.7	-33	-176.8	26	-34.3	0	0	0	112.4	G185 S189	G185-P187 VanDerWaalsContact O-CD 3.22Å; G185-P187 WeakPolarHBondContact O-CD 3.14Å; P187-S189 VanDerWaalsContact C-N 3.33Å; P187-S189 PolarHBondContact O-N 3.06Å
188	S	69.2	Low	81.1	Confident	88 Å²	88	46 Å²	46	62%	0.615	30%	0.302	S	S	*	.	H	α-helix	trans	-73.6	-24.3	178.6	-170	0	0	0	0	113.4	C186 T192	C186-S188 VanDerWaalsContact C-N 3.28Å; C186-S188 PolarHBondContact O-N 3.11Å; S188-T192 PolarHBondContact O-OG1 3.21Å; S188-T192 VanDerWaalsContact O-OG1 3.13Å
189	S	66.8	Low	81.3	Confident	23 Å²	23	49.2 Å²	49.2	16%	0.161	32%	0.321	C	S	.	.	H	α-helix	trans	-103	-32.5	-169.8	-58.6	0	0	0	0	113.4	C186 P187 G191 T192 L193	C186-S189 PolarHBondContact O-N 3.48Å; C186-S189 VanDerWaalsContact O-N 3.14Å; C186-S189 VanDerWaalsContact SG-CB 3.6Å; C186-S189 PolarHBondContact SG-OG 3.44Å; P187-S189 VanDerWaalsContact C-N 3.33Å; P187-S189 PolarHBondContact O-N 3.06Å; S189-G191 PolarHBondContact O-N 3.03Å; S189-T192 PolarHBondContact O-N 3.36Å; S189-L193 WeakPolarHBondContact O-CA 3.43Å; S189-L193 WeakPolarHBondContact O-CB 3.28Å; S189-L193 PolarHBondContact O-N 3.08Å
190	I	74.4	Confident	81.5	Confident	64 Å²	64	51.6 Å²	51.6	33%	0.328	33%	0.332	S	S	.	.	H	α-helix	trans	-56.6	-50.8	-172.4	-70	160.2	0	0	0	111.8	C186 K194	C186-I190 WeakPolarHBondContact O-CD1 3.37Å; C186-I190 VanDerWaalsContact O-CG1 3.3Å; C186-I190 WeakPolarHBondContact O-CG1 3.22Å; C186-I190 PolarHBondContact O-N 3.18Å; C186-I190 VanDerWaalsContact O-N 3.12Å; I190-K194 WeakPolarHBondContact O-CB 3.38Å; I190-K194 PolarHBondContact O-N 2.72Å; I190-K194 VanDerWaalsContact O-N 3.16Å
191	G	79.5	Confident	81.6	Confident	43 Å²	43	50.2 Å²	50.2	44%	0.443	33%	0.326	S	S	.	.	H	α-helix	trans	-67.9	-49.7	178.7	0	0	0	0	0	113.1	S189 L193 K194 V195	S189-G191 PolarHBondContact O-N 3.03Å; G191-L193 PolarHBondContact O-N 2.92Å; G191-K194 PolarHBondContact O-N 3.47Å; G191-V195 VanDerWaalsContact O-CG2 3.32Å; G191-V195 WeakPolarHBondContact O-CG2 3.37Å; G191-V195 PolarHBondContact O-N 3.02Å; G191-V195 VanDerWaalsContact O-N 3.08Å
192	T	83.8	Confident	81.8	Confident	104 Å²	104	51.9 Å²	51.9	64%	0.638	32%	0.324	S	S	*	.	H	α-helix	trans	-63.9	-41	-176.5	-48.1	0	0	0	0	112.2	S188 S189 G196	S188-T192 PolarHBondContact O-OG1 3.21Å; S188-T192 VanDerWaalsContact O-OG1 3.13Å; S189-T192 PolarHBondContact O-N 3.36Å; T192-G196 PolarHBondContact O-N 2.91Å
193	L	82.7	Confident	82	Confident	39 Å²	39	59 Å²	59	20%	0.204	35%	0.354	C	S	.	.	H	α-helix	trans	-75.9	-37.9	-177.6	-172	56.3	0	0	0	111.6	I141 M179 C183 S189 G191 G196 I197	I141-L193 HydrophobicContact CD1-CD1 3.79Å; I141-L193 HydrophobicContact CD1-CD2 3.97Å; I141-L193 HydrophobicContact CD1-CG 4.23Å; I141-L193 HydrophobicContact CG1-CD1 3.84Å; I141-L193 HydrophobicContact CG1-CD2 4.18Å; I141-L193 HydrophobicContact CG2-CD2 4.4Å; M179-L193 HydrophobicContact CE-CD2 3.32Å; M179-L193 HydrophobicContact CE-CG 4.14Å; C183-L193 HydrophobicContact CB-CD2 4.39Å; S189-L193 WeakPolarHBondContact O-CA 3.43Å; S189-L193 WeakPolarHBondContact O-CB 3.28Å; S189-L193 PolarHBondContact O-N 3.08Å; G191-L193 PolarHBondContact O-N 2.92Å; L193-G196 PolarHBondContact O-N 2.97Å; L193-I197 HydrophobicContact CD1-CD1 4.27Å; L193-I197 HydrophobicContact CD1-CG1 4.28Å; L193-I197 HydrophobicContact CG-CD1 4.01Å; L193-I197 HydrophobicContact CG-CG1 4.45Å; L193-I197 WeakPolarHBondContact O-CB 3.4Å; L193-I197 VanDerWaalsContact O-CG1 3.25Å; L193-I197 WeakPolarHBondContact O-CG1 3.37Å; L193-I197 PolarHBondContact O-N 2.75Å
194	K	86.1	Confident	82.3	Confident	86 Å²	86	62.9 Å²	62.9	37%	0.374	37%	0.368	S	S	.	.	H	α-helix	trans	-56.1	-52.3	170.9	-179.9	-167.8	177.9	-171.1	0	110.7	I190 G191 G196 I197 E198 V211	I190-K194 WeakPolarHBondContact O-CB 3.38Å; I190-K194 PolarHBondContact O-N 2.72Å; I190-K194 VanDerWaalsContact O-N 3.16Å; G191-K194 PolarHBondContact O-N 3.47Å; K194-G196 VanDerWaalsContact C-N 3.3Å; K194-G196 PolarHBondContact O-N 3.07Å; K194-I197 PolarHBondContact O-N 3.13Å; K194-E198 VanDerWaalsContact O-CB 3.29Å; K194-E198 WeakPolarHBondContact O-CB 3.08Å; K194-E198 PolarHBondContact O-N 3.33Å; K194-V211 WeakPolarHBondContact CE-O 3.34Å
195	V	87.9	Confident	82.7	Confident	73 Å²	73	59.8 Å²	59.8	44%	0.442	35%	0.349	S	S	.	.	H	α-helix	trans	-63.5	-37.4	178.3	174	0	0	0	0	111.3	G191 E198 N199	G191-V195 VanDerWaalsContact O-CG2 3.32Å; G191-V195 WeakPolarHBondContact O-CG2 3.37Å; G191-V195 PolarHBondContact O-N 3.02Å; G191-V195 VanDerWaalsContact O-N 3.08Å; V195-E198 PolarHBondContact O-N 2.69Å; V195-N199 WeakPolarHBondContact O-CB 3.43Å; V195-N199 PolarHBondContact O-N 3.27Å; V195-N199 PolarHBondContact O-ND2 2.9Å
196	G	87.3	Confident	83.1	Confident	33 Å²	33	62.2 Å²	62.2	34%	0.34	35%	0.354	S	S	.	.	H	α-helix	trans	-64.1	-45.8	176.2	0	0	0	0	0	113.2	T192 L193 K194 M200	T192-G196 PolarHBondContact O-N 2.91Å; L193-G196 PolarHBondContact O-N 2.97Å; K194-G196 VanDerWaalsContact C-N 3.3Å; K194-G196 PolarHBondContact O-N 3.07Å; G196-M200 VanDerWaalsContact O-CB 3.27Å; G196-M200 WeakPolarHBondContact O-CB 3.49Å; G196-M200 WeakPolarHBondContact O-CG 3.27Å; G196-M200 PolarHBondContact O-N 3.16Å
197	I	88.3	Confident	83.3	Confident	4 Å²	4	66.6 Å²	66.6	2%	0.021	38%	0.375	C	S	.	.	H	α-helix	trans	-65.1	-42.9	176.1	-67.6	168.9	0	0	0	110	I137 I141 V148 L193 K194 M200 L201 V211	I137-I197 HydrophobicContact CD1-CG1 4.48Å; I137-I197 HydrophobicContact CD1-CG2 4.2Å; I137-I197 HydrophobicContact CG2-CD1 4.27Å; I137-I197 HydrophobicContact CG2-CG1 3.94Å; I141-I197 HydrophobicContact CD1-CD1 4.23Å; V148-I197 HydrophobicContact CG1-CD1 4.16Å; L193-I197 HydrophobicContact CD1-CD1 4.27Å; L193-I197 HydrophobicContact CD1-CG1 4.28Å; L193-I197 HydrophobicContact CG-CD1 4.01Å; L193-I197 HydrophobicContact CG-CG1 4.45Å; L193-I197 WeakPolarHBondContact O-CB 3.4Å; L193-I197 VanDerWaalsContact O-CG1 3.25Å; L193-I197 WeakPolarHBondContact O-CG1 3.37Å; L193-I197 PolarHBondContact O-N 2.75Å; K194-I197 PolarHBondContact O-N 3.13Å; I197-M200 PolarHBondContact O-N 3.34Å; I197-L201 HydrophobicContact CG2-CD1 3.7Å; I197-L201 HydrophobicContact CG2-CG 4.21Å; I197-L201 WeakPolarHBondContact O-CB 3.37Å; I197-L201 VanDerWaalsContact O-CG 3.32Å; I197-L201 WeakPolarHBondContact O-CG 3.17Å; I197-L201 PolarHBondContact O-N 3.34Å; I197-V211 HydrophobicContact CG2-CG1 4.28Å; I197-V211 HydrophobicContact CG2-CG2 4.24Å
198	E	89.7	Confident	84	Confident	41 Å²	41	61.3 Å²	61.3	19%	0.192	34%	0.34	C	S	.	.	H	α-helix	trans	-59.7	-53.1	178.1	-177.7	172.1	-174.5	0	0	112.1	K194 V195 M200 L201 Q202 S210 V211	K194-E198 VanDerWaalsContact O-CB 3.29Å; K194-E198 WeakPolarHBondContact O-CB 3.08Å; K194-E198 PolarHBondContact O-N 3.33Å; V195-E198 PolarHBondContact O-N 2.69Å; E198-M200 VanDerWaalsContact C-N 3.3Å; E198-M200 PolarHBondContact O-N 3.3Å; E198-L201 PolarHBondContact O-N 2.93Å; E198-Q202 HydrophobicContact CG-CG 4.49Å; E198-Q202 VanDerWaalsContact CG-NE2 3.33Å; E198-Q202 WeakPolarHBondContact O-CB 3.26Å; E198-Q202 VanDerWaalsContact O-CG 3.32Å; E198-Q202 WeakPolarHBondContact O-CG 3.28Å; E198-Q202 PolarHBondContact O-N 3.32Å; E198-Q202 PolarHBondContact OE1-NE2 3.45Å; E198-S210 WeakPolarHBondContact OE1-CA 3.12Å; E198-V211 HydrophobicContact CB-CB 4.07Å; E198-V211 HydrophobicContact CB-CG2 3.71Å; E198-V211 HydrophobicContact CG-CG2 4.17Å
199	N	90.2	Very high	84.7	Confident	92 Å²	92	63.8 Å²	63.8	49%	0.492	34%	0.34	S	S	.	.	H	α-helix	trans	-62.3	-38.5	178.9	-69.9	-19.3	0	0	0	112.2	V195 F203	V195-N199 WeakPolarHBondContact O-CB 3.43Å; V195-N199 PolarHBondContact O-N 3.27Å; V195-N199 PolarHBondContact O-ND2 2.9Å; N199-F203 WeakPolarHBondContact O-CB 3.43Å; N199-F203 PolarHBondContact O-N 3.01Å; N199-F203 VanDerWaalsContact O-N 3.14Å
200	M	89.3	Confident	85.5	Confident	67 Å²	67	64.7 Å²	64.7	33%	0.33	35%	0.346	S	S	.	.	H	α-helix	trans	-64.4	-48.5	176.3	-78.8	-98.8	-62.7	0	0	111.5	R136 I137 G196 I197 E198 F203 Y204	R136-M200 HydrophobicContact CB-CE 3.83Å; I137-M200 HydrophobicContact CD1-CB 4.42Å; I137-M200 HydrophobicContact CD1-CE 4.21Å; I137-M200 HydrophobicContact CG1-CE 3.51Å; G196-M200 VanDerWaalsContact O-CB 3.27Å; G196-M200 WeakPolarHBondContact O-CB 3.49Å; G196-M200 WeakPolarHBondContact O-CG 3.27Å; G196-M200 PolarHBondContact O-N 3.16Å; I197-M200 PolarHBondContact O-N 3.34Å; E198-M200 VanDerWaalsContact C-N 3.3Å; E198-M200 PolarHBondContact O-N 3.3Å; M200-F203 PolarHBondContact O-N 3.31Å; M200-Y204 VanDerWaalsContact O-CD2 3.23Å; M200-Y204 WeakPolarHBondContact O-CD2 3.16Å; M200-Y204 PolarHBondContact O-N 3.37Å
201	L	88.7	Confident	86.1	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-67.5	-44.3	-178.9	-73	176.6	0	0	0	111.3	I129 L132 I137 V175 I197 E198 F203 Y204 I205 V208 V211	I129-L201 HydrophobicContact CG2-CD2 4.42Å; L132-L201 HydrophobicContact CB-CD2 4.48Å; L132-L201 HydrophobicContact CD1-CD2 4.37Å; I137-L201 HydrophobicContact CD1-CD2 4.38Å; I137-L201 HydrophobicContact CD1-CG 4.41Å; V175-L201 HydrophobicContact CB-CD1 4.28Å; V175-L201 HydrophobicContact CG1-CD1 3.93Å; V175-L201 HydrophobicContact CG2-CD1 4.2Å; I197-L201 HydrophobicContact CG2-CD1 3.7Å; I197-L201 HydrophobicContact CG2-CG 4.21Å; I197-L201 WeakPolarHBondContact O-CB 3.37Å; I197-L201 VanDerWaalsContact O-CG 3.32Å; I197-L201 WeakPolarHBondContact O-CG 3.17Å; I197-L201 PolarHBondContact O-N 3.34Å; E198-L201 PolarHBondContact O-N 2.93Å; L201-F203 PolarHBondContact O-N 3.11Å; L201-Y204 PolarHBondContact O-N 2.9Å; L201-I205 CarbonylContact O-C 3.59Å; L201-I205 WeakPolarHBondContact O-CA 3.3Å; L201-I205 PolarHBondContact O-N 3.45Å; L201-I205 VanDerWaalsContact O-O 3.1Å; L201-V208 HydrophobicContact CB-CB 4.35Å; L201-V208 HydrophobicContact CB-CG1 4Å; L201-V208 HydrophobicContact CB-CG2 4.23Å; L201-V211 HydrophobicContact CD1-CG2 4.14Å
202	Q	87.9	Confident	86.3	Confident	72 Å²	72	64.4 Å²	64.4	34%	0.336	33%	0.332	S	S	.	.	H	α-helix	trans	-57.2	-34.5	174.9	-78.7	174.7	7	0	0	112.8	E198 V208 K209	E198-Q202 HydrophobicContact CG-CG 4.49Å; E198-Q202 VanDerWaalsContact CG-NE2 3.33Å; E198-Q202 WeakPolarHBondContact O-CB 3.26Å; E198-Q202 VanDerWaalsContact O-CG 3.32Å; E198-Q202 WeakPolarHBondContact O-CG 3.28Å; E198-Q202 PolarHBondContact O-N 3.32Å; E198-Q202 PolarHBondContact OE1-NE2 3.45Å; Q202-V208 VanDerWaalsContact CG-O 3.26Å; Q202-V208 WeakPolarHBondContact CG-O 3.2Å; Q202-K209 PolarHBondContact NE2-O 3.48Å
203	F	89	Confident	86.2	Confident	157 Å²	157	63.3 Å²	63.3	69%	0.689	32%	0.32	S	S	*	.	H	α-helix	trans	-71.4	-41.1	180	179.6	-94.8	0	0	0	113.1	N199 M200 L201	N199-F203 WeakPolarHBondContact O-CB 3.43Å; N199-F203 PolarHBondContact O-N 3.01Å; N199-F203 VanDerWaalsContact O-N 3.14Å; M200-F203 PolarHBondContact O-N 3.31Å; L201-F203 PolarHBondContact O-N 3.11Å
204	Y	87.9	Confident	85.8	Confident	91 Å²	91	63.6 Å²	63.6	36%	0.357	32%	0.323	S	S	.	.	H	α-helix	trans	-90	-28.7	-178.8	-70.5	-72.7	0	0	0	113.3	L132 R136 M200 L201	L132-Y204 VanDerWaalsContact CD1-CB 3.4Å; L132-Y204 HydrophobicContact CD1-CD2 4.47Å; L132-Y204 HydrophobicContact CD1-CG 4.1Å; L132-Y204 HydrophobicContact CD2-CD1 4.3Å; L132-Y204 HydrophobicContact CD2-CD2 4.13Å; L132-Y204 HydrophobicContact CD2-CG 3.89Å; R136-Y204 VanDerWaalsContact NH1-CZ 3.26Å; R136-Y204 PolarHBondContact NH1-OH 2.93Å; M200-Y204 VanDerWaalsContact O-CD2 3.23Å; M200-Y204 WeakPolarHBondContact O-CD2 3.16Å; M200-Y204 PolarHBondContact O-N 3.37Å; L201-Y204 PolarHBondContact O-N 2.9Å
205	I	87.4	Confident	85.1	Confident	8 Å²	8	62.4 Å²	62.4	4%	0.041	33%	0.33	C	S	.	.			trans	-131.6	89.7	-176.2	-55.9	-178.8	0	0	0	107.4	L125 A128 I129 L132 L201 E207 V208	L125-I205 HydrophobicContact CD2-CG2 4.16Å; A128-I205 HydrophobicContact CB-CD1 3.8Å; I129-I205 HydrophobicContact CB-CD1 4.34Å; I129-I205 HydrophobicContact CG1-CD1 3.49Å; I129-I205 VanDerWaalsContact CG1-CD1 3.49Å; L132-I205 HydrophobicContact CD1-CD1 3.56Å; L132-I205 HydrophobicContact CD1-CG1 3.68Å; L201-I205 CarbonylContact O-C 3.59Å; L201-I205 WeakPolarHBondContact O-CA 3.3Å; L201-I205 PolarHBondContact O-N 3.45Å; L201-I205 VanDerWaalsContact O-O 3.1Å; I205-E207 HydrophobicContact CG2-CB 4.28Å; I205-E207 WeakPolarHBondContact CG2-OE2 3.47Å; I205-E207 PolarHBondContact O-N 3.48Å; I205-E207 VanDerWaalsContact O-N 3.13Å; I205-V208 HydrophobicContact CB-CG2 3.93Å; I205-V208 HydrophobicContact CG2-CG2 3.74Å; I205-V208 WeakPolarHBondContact O-CB 3.25Å; I205-V208 PolarHBondContact O-N 2.63Å
206	P	81.9	Confident	84.2	Confident	104 Å²	104	60.9 Å²	60.9	68%	0.675	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-14.9	-176	27.3	-35.1	0	0	0	113.7	V208	P206-V208 PolarHBondContact O-N 2.82Å
207	E	81.6	Confident	83	Confident	94 Å²	94	64.2 Å²	64.2	44%	0.439	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-23.7	173	-60.3	82.1	-178.6	0	0	112.6	L125 F170 I205 K209	L125-E207 HydrophobicContact CD1-CB 4.27Å; L125-E207 HydrophobicContact CD1-CG 4.15Å; L125-E207 HydrophobicContact CD2-CG 4.22Å; F170-E207 HydrophobicContact CZ-CB 4.07Å; F170-E207 WeakPolarHBondContact CZ-O 3.43Å; I205-E207 HydrophobicContact CG2-CB 4.28Å; I205-E207 WeakPolarHBondContact CG2-OE2 3.47Å; I205-E207 PolarHBondContact O-N 3.48Å; I205-E207 VanDerWaalsContact O-N 3.13Å; E207-K209 PolarHBondContact O-N 2.92Å
208	V	84.1	Confident	81.9	Confident	4 Å²	4	67.3 Å²	67.3	2%	0.024	36%	0.361	C	S	.	.			trans	-71.2	116.4	175.9	178.4	0	0	0	0	108.5	I129 F170 G173 V175 L201 Q202 I205 P206	I129-V208 HydrophobicContact CD1-CG2 4.42Å; F170-V208 HydrophobicContact CE2-CG2 3.92Å; G173-V208 CarbonylContact O-C 3.36Å; V175-V208 HydrophobicContact CG2-CG1 3.85Å; V175-V208 HydrophobicContact CG2-CG2 3.94Å; L201-V208 HydrophobicContact CB-CB 4.35Å; L201-V208 HydrophobicContact CB-CG1 4Å; L201-V208 HydrophobicContact CB-CG2 4.23Å; Q202-V208 VanDerWaalsContact CG-O 3.26Å; Q202-V208 WeakPolarHBondContact CG-O 3.2Å; I205-V208 HydrophobicContact CB-CG2 3.93Å; I205-V208 HydrophobicContact CG2-CG2 3.74Å; I205-V208 WeakPolarHBondContact O-CB 3.25Å; I205-V208 PolarHBondContact O-N 2.63Å; P206-V208 PolarHBondContact O-N 2.82Å
209	K	84.5	Confident	80.7	Confident	140 Å²	140	67.8 Å²	67.8	61%	0.609	37%	0.365	S	S	*	.			trans	-90.3	-40.9	176.8	-67.1	-176.9	-167.8	153.1	0	112.4	N172 G173 Q202 E207	N172-K209 WeakPolarHBondContact O-CD 3.49Å; N172-K209 WeakPolarHBondContact O-CE 3.44Å; N172-K209 PolarHBondContact O-NZ 3.45Å; G173-K209 PolarHBondContact O-N 2.83Å; Q202-K209 PolarHBondContact NE2-O 3.48Å; E207-K209 PolarHBondContact O-N 2.92Å
210	S	84.4	Confident	79.3	Confident	42 Å²	42	64.7 Å²	64.7	29%	0.294	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	169.3	-179.7	64.7	0	0	0	0	112.3	G173 V174 V175 E198	G173-S210 PolarHBondContact O-N 2.97Å; V174-S210 WeakPolarHBondContact CA-O 3.46Å; V175-S210 PolarHBondContact N-O 2.9Å; E198-S210 WeakPolarHBondContact OE1-CA 3.12Å
211	V	85.5	Confident	78.1	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.024	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.1	178	179.1	0	0	0	0	109.2	V175 P177 K194 I197 E198 L201	V175-V211 HydrophobicContact CB-CG2 4.29Å; V175-V211 CarbonylContact O-C 3.5Å; V175-V211 WeakPolarHBondContact O-CA 3.44Å; P177-V211 VanDerWaalsContact CD-CG1 3.5Å; P177-V211 HydrophobicContact CG-CG1 3.48Å; P177-V211 VanDerWaalsContact CG-CG1 3.48Å; K194-V211 WeakPolarHBondContact CE-O 3.34Å; I197-V211 HydrophobicContact CG2-CG1 4.28Å; I197-V211 HydrophobicContact CG2-CG2 4.24Å; E198-V211 HydrophobicContact CB-CB 4.07Å; E198-V211 HydrophobicContact CB-CG2 3.71Å; E198-V211 HydrophobicContact CG-CG2 4.17Å; L201-V211 HydrophobicContact CD1-CG2 4.14Å
212	E	84.8	Confident	77.3	Confident	97 Å²	97	68.5 Å²	68.5	45%	0.453	38%	0.384	S	S	.	.			trans	-124.7	121.5	178.3	-174.2	-176.4	-167.8	0	0	110.4	V174 V175 K176 P177 V214	V174-E212 HydrophobicContact CG1-CB 3.84Å; V175-E212 PolarHBondContact O-N 3.03Å; K176-E212 VanDerWaalsContact CA-O 3.29Å; K176-E212 WeakPolarHBondContact CA-O 3.37Å; K176-E212 WeakPolarHBondContact CE-OE2 3.32Å; K176-E212 HydrophobicContact CG-CB 4.49Å; P177-E212 WeakPolarHBondContact CD-O 3.48Å; E212-V214 PolarHBondContact O-N 2.92Å
213	Q	80.4	Confident	76.6	Confident	80 Å²	80	70.6 Å²	70.6	37%	0.374	39%	0.394	S	S	.	.			trans	-72.5	127.4	177	178.6	-179.8	2.2	0	0	110.1	M179	M179-Q213 VanDerWaalsContact CG-CD 3.47Å; M179-Q213 HydrophobicContact CG-CG 3.89Å
214	V	75.7	Confident	76	Confident	45 Å²	45	66.2 Å²	66.2	27%	0.273	38%	0.38	S	S	.	.			trans	-116.2	135.5	178.1	176.9	0	0	0	0	110	K176 P177 E212	K176-V214 HydrophobicContact CB-CB 4.46Å; K176-V214 HydrophobicContact CB-CG2 3.78Å; K176-V214 HydrophobicContact CD-CG2 3.85Å; K176-V214 HydrophobicContact CG-CG2 3.71Å; P177-V214 PolarHBondContact O-N 3.3Å; E212-V214 PolarHBondContact O-N 2.92Å
215	A	71.6	Confident	75.5	Confident	62 Å²	62	68.3 Å²	68.3	51%	0.512	39%	0.393	S	S	.	.			trans	-85.8	154.7	166.3	0	0	0	0	0	109.7
216	D	68.2	Low	74.9	Confident	41 Å²	41	73.6 Å²	73.6	22%	0.219	42%	0.416	C	S	.	.			trans	-64.3	140.9	178.4	-76.4	-6.6	0	0	0	109.4	M151 K178 A218 D219 G220	M151-D216 WeakPolarHBondContact CE-OD1 3.34Å; K178-D216 VanDerWaalsContact CD-OD1 3.25Å; K178-D216 WeakPolarHBondContact CD-OD1 3.47Å; K178-D216 WeakPolarHBondContact CE-OD1 3.44Å; K178-D216 IonicContact NZ-OD1 2.79Å; K178-D216 PolarHBondContact NZ-OD1 3.36Å; K178-D216 IonicContact NZ-OD2 2.72Å; K178-D216 PolarHBondContact NZ-OD2 3.28Å; D216-A218 HydrophobicContact CB-CB 4.49Å; D216-A218 PolarHBondContact O-N 2.62Å; D216-A218 VanDerWaalsContact O-N 3.12Å; D216-D219 HydrophobicContact CB-CB 4.48Å; D216-D219 WeakPolarHBondContact CB-OD2 3.43Å; D216-D219 WeakPolarHBondContact O-CA 3.36Å; D216-D219 WeakPolarHBondContact O-CB 3.39Å; D216-D219 PolarHBondContact O-N 3.46Å; D216-G220 PolarHBondContact O-N 3.37Å
217	P	62.7	Low	74.8	Confident	103 Å²	103	74.4 Å²	74.4	67%	0.669	41%	0.411	S	S	*	.	H	α-helix	trans	-60.2	-25.9	175.2	24.3	-33.5	0	0	0	112	D219 G220 V221	P217-D219 VanDerWaalsContact C-N 3.31Å; P217-G220 PolarHBondContact O-N 3.17Å; P217-V221 WeakPolarHBondContact O-CG2 3.49Å; P217-V221 PolarHBondContact O-N 3.27Å; P217-V221 VanDerWaalsContact O-N 3.17Å
218	A	64.9	Low	74.7	Confident	69 Å²	69	75.8 Å²	75.8	57%	0.57	42%	0.417	S	S	*	.	H	α-helix	trans	-65.4	-34.3	173	0	0	0	0	0	112.6	D216 S222	D216-A218 HydrophobicContact CB-CB 4.49Å; D216-A218 PolarHBondContact O-N 2.62Å; D216-A218 VanDerWaalsContact O-N 3.12Å; A218-S222 PolarHBondContact O-N 3.46Å
219	D	64.7	Low	74.3	Confident	51 Å²	51	79.9 Å²	79.9	27%	0.273	44%	0.438	S	S	.	.	H	α-helix	trans	-70.7	-42.5	176.8	-57.9	-26.2	0	0	0	108.9	K178 D216 P217 V221 S222 E223	K178-D219 IonicContact NZ-OD2 3.82Å; K178-D219 PolarHBondContact NZ-OD2 3.03Å; D216-D219 HydrophobicContact CB-CB 4.48Å; D216-D219 WeakPolarHBondContact CB-OD2 3.43Å; D216-D219 WeakPolarHBondContact O-CA 3.36Å; D216-D219 WeakPolarHBondContact O-CB 3.39Å; D216-D219 PolarHBondContact O-N 3.46Å; P217-D219 VanDerWaalsContact C-N 3.31Å; D219-V221 PolarHBondContact O-N 3.22Å; D219-S222 WeakPolarHBondContact O-CB 3.44Å; D219-S222 PolarHBondContact O-N 3Å; D219-S222 VanDerWaalsContact O-N 3.09Å; D219-S222 PolarHBondContact O-OG 3.34Å; D219-E223 WeakPolarHBondContact O-CG 3.46Å; D219-E223 PolarHBondContact O-N 3.21Å
220	G	60.9	Low	74.1	Confident	27 Å²	27	76.4 Å²	76.4	28%	0.278	42%	0.424	S	S	.	.	H	α-helix	trans	-61.6	-38.8	177.7	0	0	0	0	0	114.7	D216 P217 S222 E223 T224	D216-G220 PolarHBondContact O-N 3.37Å; P217-G220 PolarHBondContact O-N 3.17Å; G220-S222 VanDerWaalsContact C-N 3.3Å; G220-S222 PolarHBondContact O-N 3.39Å; G220-E223 PolarHBondContact O-N 3.34Å; G220-T224 WeakPolarHBondContact O-CG2 3.3Å; G220-T224 PolarHBondContact O-N 3.12Å
221	V	63.9	Low	73.9	Confident	84 Å²	84	79.2 Å²	79.2	51%	0.509	44%	0.436	S	S	.	.	H	α-helix	trans	-62.4	-42	174.1	178.6	0	0	0	0	110.3	P217 D219 E223 T224 E225	P217-V221 WeakPolarHBondContact O-CG2 3.49Å; P217-V221 PolarHBondContact O-N 3.27Å; P217-V221 VanDerWaalsContact O-N 3.17Å; D219-V221 PolarHBondContact O-N 3.22Å; V221-E223 VanDerWaalsContact C-N 3.33Å; V221-E223 PolarHBondContact O-N 3.29Å; V221-T224 PolarHBondContact O-N 2.93Å; V221-T224 PolarHBondContact O-OG1 3.1Å; V221-E225 PolarHBondContact O-N 3.13Å
222	S	71.8	Confident	73.6	Confident	64 Å²	64	85.7 Å²	85.7	45%	0.448	46%	0.464	S	S	.	.	H	α-helix	trans	-66.4	-34.8	178.3	73.5	0	0	0	0	112.9	A218 D219 G220 E225 F226	A218-S222 PolarHBondContact O-N 3.46Å; D219-S222 WeakPolarHBondContact O-CB 3.44Å; D219-S222 PolarHBondContact O-N 3Å; D219-S222 VanDerWaalsContact O-N 3.09Å; D219-S222 PolarHBondContact O-OG 3.34Å; G220-S222 VanDerWaalsContact C-N 3.3Å; G220-S222 PolarHBondContact O-N 3.39Å; S222-E225 PolarHBondContact O-N 3.4Å; S222-F226 VanDerWaalsContact O-CB 3.3Å; S222-F226 WeakPolarHBondContact O-CB 3.43Å; S222-F226 PolarHBondContact O-N 3Å
223	E	73.6	Confident	73.2	Confident	116 Å²	116	85.9 Å²	85.9	54%	0.542	47%	0.467	S	S	.	.	H	α-helix	trans	-63.7	-46.3	173.6	-72.8	172.8	-179.5	0	0	110.9	D219 G220 V221 E225 F226 E227	D219-E223 WeakPolarHBondContact O-CG 3.46Å; D219-E223 PolarHBondContact O-N 3.21Å; G220-E223 PolarHBondContact O-N 3.34Å; V221-E223 VanDerWaalsContact C-N 3.33Å; V221-E223 PolarHBondContact O-N 3.29Å; E223-E225 PolarHBondContact O-N 2.92Å; E223-F226 WeakPolarHBondContact O-CB 3.46Å; E223-F226 PolarHBondContact O-N 3.45Å; E223-F226 VanDerWaalsContact O-N 3.14Å; E223-E227 WeakPolarHBondContact O-CG 3.45Å; E223-E227 PolarHBondContact O-N 3.18Å
224	T	75.1	Confident	72.9	Confident	65 Å²	65	89.4 Å²	89.4	40%	0.399	48%	0.477	S	S	.	.	H	α-helix	trans	-61.6	-43.7	176.9	61.8	0	0	0	0	112	G220 V221 F226 E227 H228	G220-T224 WeakPolarHBondContact O-CG2 3.3Å; G220-T224 PolarHBondContact O-N 3.12Å; V221-T224 PolarHBondContact O-N 2.93Å; V221-T224 PolarHBondContact O-OG1 3.1Å; T224-F226 VanDerWaalsContact C-N 3.26Å; T224-F226 PolarHBondContact O-N 3.05Å; T224-E227 PolarHBondContact O-N 3.24Å; T224-H228 PolarHBondContact O-N 3.5Å; T224-H228 VanDerWaalsContact O-N 3.11Å; T224-H228 PolarHBondContact O-ND1 3.1Å
225	E	78	Confident	72.9	Confident	134 Å²	134	93.1 Å²	93.1	63%	0.626	49%	0.492	S	S	*	.	H	α-helix	trans	-62.7	-35.6	176.6	-71.4	-172.1	166.3	0	0	112.3	V221 S222 E223 L229	V221-E225 PolarHBondContact O-N 3.13Å; S222-E225 PolarHBondContact O-N 3.4Å; E223-E225 PolarHBondContact O-N 2.92Å; E225-L229 PolarHBondContact O-N 3.38Å
226	F	74.9	Confident	72.9	Confident	119 Å²	119	94.8 Å²	94.8	52%	0.522	49%	0.493	S	S	.	.	H	α-helix	trans	-69.3	-43.6	177.4	-176.6	-102.5	0	0	0	111.9	S222 E223 T224 H228 L229 E230	S222-F226 VanDerWaalsContact O-CB 3.3Å; S222-F226 WeakPolarHBondContact O-CB 3.43Å; S222-F226 PolarHBondContact O-N 3Å; E223-F226 WeakPolarHBondContact O-CB 3.46Å; E223-F226 PolarHBondContact O-N 3.45Å; E223-F226 VanDerWaalsContact O-N 3.14Å; T224-F226 VanDerWaalsContact C-N 3.26Å; T224-F226 PolarHBondContact O-N 3.05Å; F226-H228 PolarHBondContact O-N 3.37Å; F226-L229 WeakPolarHBondContact O-CA 3.5Å; F226-L229 WeakPolarHBondContact O-CB 3.46Å; F226-L229 PolarHBondContact O-N 2.96Å; F226-E230 HydrophobicContact CD1-CG 4.19Å; F226-E230 HydrophobicContact CE1-CG 3.79Å; F226-E230 WeakPolarHBondContact CE1-OE1 3.3Å; F226-E230 HydrophobicContact CZ-CG 4.04Å; F226-E230 WeakPolarHBondContact CZ-OE1 3.25Å; F226-E230 PolarHBondContact O-N 3.28Å
227	E	79.6	Confident	73	Confident	121 Å²	121	95.6 Å²	95.6	57%	0.565	50%	0.502	S	S	*	.	H	α-helix	trans	-57.8	-46.3	173.6	-73.9	-179.2	166.2	0	0	111.5	E223 T224 L229 E230 D231	E223-E227 WeakPolarHBondContact O-CG 3.45Å; E223-E227 PolarHBondContact O-N 3.18Å; T224-E227 PolarHBondContact O-N 3.24Å; E227-L229 PolarHBondContact O-N 3.07Å; E227-E230 PolarHBondContact O-N 3.18Å; E227-E230 VanDerWaalsContact O-N 3.12Å; E227-D231 PolarHBondContact O-N 3.33Å
228	H	80.3	Confident	73.4	Confident	123 Å²	123	94 Å²	94	57%	0.569	49%	0.493	S	S	*	.	H	α-helix	trans	-60.6	-30.3	175.8	-70.9	103	0	0	0	113.1	T224 F226 K232	T224-H228 PolarHBondContact O-N 3.5Å; T224-H228 VanDerWaalsContact O-N 3.11Å; T224-H228 PolarHBondContact O-ND1 3.1Å; F226-H228 PolarHBondContact O-N 3.37Å; H228-K232 WeakPolarHBondContact O-CG 3.43Å; H228-K232 PolarHBondContact O-N 2.99Å
229	L	75.7	Confident	73.5	Confident	91 Å²	91	94.2 Å²	94.2	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-75.6	-43.6	175	-179.7	63.6	0	0	0	111.2	E225 F226 E227 D231 K232 I233	E225-L229 PolarHBondContact O-N 3.38Å; F226-L229 WeakPolarHBondContact O-CA 3.5Å; F226-L229 WeakPolarHBondContact O-CB 3.46Å; F226-L229 PolarHBondContact O-N 2.96Å; E227-L229 PolarHBondContact O-N 3.07Å; L229-D231 VanDerWaalsContact C-N 3.31Å; L229-D231 PolarHBondContact O-N 3.04Å; L229-K232 PolarHBondContact O-N 3.46Å; L229-I233 HydrophobicContact CD1-CD1 4.32Å; L229-I233 HydrophobicContact CG-CD1 4.03Å; L229-I233 WeakPolarHBondContact O-CG1 3.4Å; L229-I233 PolarHBondContact O-N 3.23Å
230	E	78.8	Confident	73.4	Confident	67 Å²	67	97.3 Å²	97.3	31%	0.313	50%	0.5	S	S	.	.	H	α-helix	trans	-57.5	-45.1	175	-74.1	-154.3	170	0	0	111.4	F226 E227 K232 I233 R234	F226-E230 HydrophobicContact CD1-CG 4.19Å; F226-E230 HydrophobicContact CE1-CG 3.79Å; F226-E230 WeakPolarHBondContact CE1-OE1 3.3Å; F226-E230 HydrophobicContact CZ-CG 4.04Å; F226-E230 WeakPolarHBondContact CZ-OE1 3.25Å; F226-E230 PolarHBondContact O-N 3.28Å; E227-E230 PolarHBondContact O-N 3.18Å; E227-E230 VanDerWaalsContact O-N 3.12Å; E230-K232 VanDerWaalsContact C-N 3.33Å; E230-K232 PolarHBondContact O-N 2.89Å; E230-I233 PolarHBondContact O-N 3.19Å; E230-I233 VanDerWaalsContact O-N 3.11Å; E230-R234 WeakPolarHBondContact O-CG 3.38Å; E230-R234 PolarHBondContact O-N 3.48Å; E230-R234 IonicContact OE2-CZ 2.7Å; E230-R234 IonicContact OE2-NE 3.98Å; E230-R234 IonicContact OE2-NH2 3.84Å; E230-R234 PolarHBondContact OE2-NH2 2.99Å
231	D	81	Confident	73.8	Confident	101 Å²	101	100.9 Å²	100.9	54%	0.54	52%	0.516	S	S	.	.	H	α-helix	trans	-60.8	-42.9	178.7	-75.1	-18.6	0	0	0	111.8	E227 L229 I233 R234 M235	E227-D231 PolarHBondContact O-N 3.33Å; L229-D231 VanDerWaalsContact C-N 3.31Å; L229-D231 PolarHBondContact O-N 3.04Å; D231-I233 VanDerWaalsContact C-N 3.33Å; D231-I233 PolarHBondContact O-N 2.94Å; D231-R234 PolarHBondContact O-N 2.92Å; D231-M235 WeakPolarHBondContact O-CB 3.24Å; D231-M235 PolarHBondContact O-N 3.18Å
232	K	78.5	Confident	73.8	Confident	140 Å²	140	102.6 Å²	102.6	61%	0.609	52%	0.519	S	S	*	.	H	α-helix	trans	-62.9	-39.6	174.6	-76.2	173.5	-176.6	170.4	0	112.1	H228 L229 E230 N236	H228-K232 WeakPolarHBondContact O-CG 3.43Å; H228-K232 PolarHBondContact O-N 2.99Å; L229-K232 PolarHBondContact O-N 3.46Å; E230-K232 VanDerWaalsContact C-N 3.33Å; E230-K232 PolarHBondContact O-N 2.89Å; K232-N236 WeakPolarHBondContact O-CB 3.29Å; K232-N236 PolarHBondContact O-N 2.88Å; K232-N236 PolarHBondContact O-ND2 2.97Å
233	I	77.1	Confident	73.1	Confident	100 Å²	100	104.4 Å²	104.4	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-67.3	-45.6	177.4	-69.1	169.4	0	0	0	110.2	L229 E230 D231 M235 N236 S237	L229-I233 HydrophobicContact CD1-CD1 4.32Å; L229-I233 HydrophobicContact CG-CD1 4.03Å; L229-I233 WeakPolarHBondContact O-CG1 3.4Å; L229-I233 PolarHBondContact O-N 3.23Å; E230-I233 PolarHBondContact O-N 3.19Å; E230-I233 VanDerWaalsContact O-N 3.11Å; D231-I233 VanDerWaalsContact C-N 3.33Å; D231-I233 PolarHBondContact O-N 2.94Å; I233-M235 PolarHBondContact O-N 3.46Å; I233-N236 PolarHBondContact O-N 3.22Å; I233-S237 WeakPolarHBondContact O-CB 3.48Å; I233-S237 PolarHBondContact O-N 3.41Å; I233-S237 PolarHBondContact O-OG 3.22Å
234	R	74.7	Confident	72.4	Confident	154 Å²	154	103.6 Å²	103.6	58%	0.581	52%	0.522	S	S	*	.	H	α-helix	trans	-58.7	-47.2	176.7	-71	175.5	-161.9	-95.4	0.6	110.8	E230 D231 N236 S237 S238	E230-R234 WeakPolarHBondContact O-CG 3.38Å; E230-R234 PolarHBondContact O-N 3.48Å; E230-R234 IonicContact OE2-CZ 2.7Å; E230-R234 IonicContact OE2-NE 3.98Å; E230-R234 IonicContact OE2-NH2 3.84Å; E230-R234 PolarHBondContact OE2-NH2 2.99Å; D231-R234 PolarHBondContact O-N 2.92Å; R234-N236 PolarHBondContact O-N 2.9Å; R234-S237 WeakPolarHBondContact CA-OG 3.44Å; R234-S237 PolarHBondContact O-N 2.9Å; R234-S237 PolarHBondContact O-OG 3.17Å; R234-S238 PolarHBondContact O-N 2.87Å
235	M	75.2	Confident	71.7	Confident	123 Å²	123	103.5 Å²	103.5	61%	0.606	53%	0.528	S	S	*	.	H	α-helix	trans	-57.7	-48.3	176.4	-160.2	101.9	174.2	0	0	111.6	D231 I233 S238 L239	D231-M235 WeakPolarHBondContact O-CB 3.24Å; D231-M235 PolarHBondContact O-N 3.18Å; I233-M235 PolarHBondContact O-N 3.46Å; M235-S238 PolarHBondContact O-N 2.96Å; M235-L239 WeakPolarHBondContact O-CG 3.45Å; M235-L239 PolarHBondContact O-N 3.09Å; M235-L239 VanDerWaalsContact O-N 3.1Å
236	N	71.6	Confident	70.5	Confident	97 Å²	97	102.3 Å²	102.3	52%	0.519	53%	0.525	S	S	.	.	H	α-helix	trans	-66.8	-37.2	178.5	-72.2	-21.5	0	0	0	112.6	K232 I233 R234 L239 L240	K232-N236 WeakPolarHBondContact O-CB 3.29Å; K232-N236 PolarHBondContact O-N 2.88Å; K232-N236 PolarHBondContact O-ND2 2.97Å; I233-N236 PolarHBondContact O-N 3.22Å; R234-N236 PolarHBondContact O-N 2.9Å; N236-L239 PolarHBondContact O-N 3.14Å; N236-L240 WeakPolarHBondContact O-CG 3.21Å; N236-L240 PolarHBondContact O-N 3.1Å
237	S	70.9	Confident	69.6	Low	58 Å²	58	104.2 Å²	104.2	41%	0.406	54%	0.536	S	S	.	.	H	α-helix	trans	-67.4	-39.9	177.7	74.1	0	0	0	0	111.6	I233 R234 L239 L240 V241	I233-S237 WeakPolarHBondContact O-CB 3.48Å; I233-S237 PolarHBondContact O-N 3.41Å; I233-S237 PolarHBondContact O-OG 3.22Å; R234-S237 WeakPolarHBondContact CA-OG 3.44Å; R234-S237 PolarHBondContact O-N 2.9Å; R234-S237 PolarHBondContact O-OG 3.17Å; S237-L239 VanDerWaalsContact C-N 3.31Å; S237-L239 PolarHBondContact O-N 3.29Å; S237-L240 WeakPolarHBondContact O-CB 3.39Å; S237-L240 PolarHBondContact O-N 3.1Å; S237-L240 VanDerWaalsContact O-N 3.12Å; S237-V241 WeakPolarHBondContact O-CG2 3.39Å; S237-V241 PolarHBondContact O-N 3.15Å
238	S	70.9	Confident	68.6	Low	69 Å²	69	103.4 Å²	103.4	48%	0.483	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-40.3	175.2	-159	0	0	0	0	111	R234 M235 L240 V241 E242	R234-S238 PolarHBondContact O-N 2.87Å; M235-S238 PolarHBondContact O-N 2.96Å; S238-L240 VanDerWaalsContact C-N 3.34Å; S238-L240 PolarHBondContact O-N 3.48Å; S238-V241 PolarHBondContact O-N 2.99Å; S238-E242 PolarHBondContact O-N 3.45Å
239	L	66.3	Low	67.5	Low	75 Å²	75	102.4 Å²	102.4	39%	0.393	54%	0.54	S	S	.	.	H	α-helix	trans	-64.4	-36.7	173	-71.2	171.9	0	0	0	112.5	M235 N236 S237 E242 L243	M235-L239 WeakPolarHBondContact O-CG 3.45Å; M235-L239 PolarHBondContact O-N 3.09Å; M235-L239 VanDerWaalsContact O-N 3.1Å; N236-L239 PolarHBondContact O-N 3.14Å; S237-L239 VanDerWaalsContact C-N 3.31Å; S237-L239 PolarHBondContact O-N 3.29Å; L239-E242 PolarHBondContact O-N 3.14Å; L239-L243 WeakPolarHBondContact O-CB 3.13Å; L239-L243 VanDerWaalsContact O-CG 3.24Å; L239-L243 WeakPolarHBondContact O-CG 3.24Å; L239-L243 PolarHBondContact O-N 3.34Å
240	L	63.3	Low	66.4	Low	115 Å²	115	106.5 Å²	106.5	60%	0.602	56%	0.557	S	S	*	*	H	α-helix	trans	-66.4	-36.9	175.6	-76.6	171.3	0	0	0	112.1	N236 S237 S238 L243 N244	N236-L240 WeakPolarHBondContact O-CG 3.21Å; N236-L240 PolarHBondContact O-N 3.1Å; S237-L240 WeakPolarHBondContact O-CB 3.39Å; S237-L240 PolarHBondContact O-N 3.1Å; S237-L240 VanDerWaalsContact O-N 3.12Å; S238-L240 VanDerWaalsContact C-N 3.34Å; S238-L240 PolarHBondContact O-N 3.48Å; L240-L243 PolarHBondContact O-N 3.36Å; L240-N244 VanDerWaalsContact O-CB 3.27Å; L240-N244 WeakPolarHBondContact O-CB 3.29Å; L240-N244 PolarHBondContact O-N 3.47Å
241	V	68.7	Low	64.9	Low	103 Å²	103	109.2 Å²	109.2	62%	0.624	58%	0.58	S	S	*	*	H	α-helix	trans	-64.9	-46.4	173.8	175.2	0	0	0	0	110.5	S237 S238 L243 N244 A245	S237-V241 WeakPolarHBondContact O-CG2 3.39Å; S237-V241 PolarHBondContact O-N 3.15Å; S238-V241 PolarHBondContact O-N 2.99Å; V241-L243 VanDerWaalsContact C-N 3.34Å; V241-L243 PolarHBondContact O-N 3.05Å; V241-N244 PolarHBondContact O-N 3.12Å; V241-A245 WeakPolarHBondContact O-CB 3.49Å; V241-A245 PolarHBondContact O-N 2.97Å
242	E	63.5	Low	63.4	Low	119 Å²	119	111.7 Å²	111.7	56%	0.556	59%	0.593	S	S	*	*	H	α-helix	trans	-61.3	-41.1	176.1	-73.8	-176.5	168.4	0	0	112.2	S238 L239 L246	S238-E242 PolarHBondContact O-N 3.45Å; L239-E242 PolarHBondContact O-N 3.14Å; E242-L246 WeakPolarHBondContact O-CG 3.35Å; E242-L246 PolarHBondContact O-N 3.4Å
243	L	57.4	Low	61.7	Low	102 Å²	102	114.4 Å²	114.4	53%	0.534	61%	0.607	S	S	.	*	H	α-helix	trans	-67.9	-38.5	175.9	-73.9	170.6	0	0	0	112.4	L239 L240 V241 L246 Q247	L239-L243 WeakPolarHBondContact O-CB 3.13Å; L239-L243 VanDerWaalsContact O-CG 3.24Å; L239-L243 WeakPolarHBondContact O-CG 3.24Å; L239-L243 PolarHBondContact O-N 3.34Å; L240-L243 PolarHBondContact O-N 3.36Å; V241-L243 VanDerWaalsContact C-N 3.34Å; V241-L243 PolarHBondContact O-N 3.05Å; L243-L246 PolarHBondContact O-N 3.04Å; L243-Q247 PolarHBondContact O-N 3.32Å; L243-Q247 VanDerWaalsContact O-N 3.1Å
244	N	60	Low	60.1	Low	99 Å²	99	117.3 Å²	117.3	53%	0.529	62%	0.617	S	S	.	*	H	α-helix	trans	-67.8	-39.9	178.1	-171.2	40.9	0	0	0	111.9	L240 V241 L246 Q247 N248	L240-N244 VanDerWaalsContact O-CB 3.27Å; L240-N244 WeakPolarHBondContact O-CB 3.29Å; L240-N244 PolarHBondContact O-N 3.47Å; V241-N244 PolarHBondContact O-N 3.12Å; N244-L246 PolarHBondContact O-N 3.28Å; N244-Q247 PolarHBondContact O-N 3.34Å; N244-N248 PolarHBondContact O-N 3.01Å; N244-N248 VanDerWaalsContact O-N 3.08Å; N244-N248 PolarHBondContact OD1-ND2 2.82Å; N244-N248 VanDerWaalsContact OD1-ND2 3.11Å
245	A	60.4	Low	58.5	Low	63 Å²	63	116.3 Å²	116.3	52%	0.521	62%	0.623	S	S	.	*	H	α-helix	trans	-61.8	-30.4	174.6	0	0	0	0	0	112.6	V241 N248	V241-A245 WeakPolarHBondContact O-CB 3.49Å; V241-A245 PolarHBondContact O-N 2.97Å; A245-N248 CarbonylContact O-C 3.6Å
246	L	51.9	Low	57.1	Low	109 Å²	109	115.7 Å²	115.7	57%	0.571	63%	0.625	S	S	*	*	H	α-helix	trans	-77	-34	174.2	-70.5	170.6	0	0	0	113.2	E242 L243 N244 N248	E242-L246 WeakPolarHBondContact O-CG 3.35Å; E242-L246 PolarHBondContact O-N 3.4Å; L243-L246 PolarHBondContact O-N 3.04Å; N244-L246 PolarHBondContact O-N 3.28Å; L246-N248 VanDerWaalsContact C-N 3.32Å
247	Q	57	Low	55.8	Low	159 Å²	159	117.3 Å²	117.3	74%	0.743	63%	0.634	S	S	*	*	H	α-helix	trans	-70.8	-32.4	178.7	-165	89.1	30.9	0	0	111.4	L243 N244	L243-Q247 PolarHBondContact O-N 3.32Å; L243-Q247 VanDerWaalsContact O-N 3.1Å; N244-Q247 PolarHBondContact O-N 3.34Å
248	N	56.9	Low	54.4	Low	105 Å²	105	122.8 Å²	122.8	56%	0.561	65%	0.654	S	S	*	*	S	Bend	trans	-127.8	77.3	-176.6	-57.5	-52.4	0	0	0	110.4	N244 A245 L246	N244-N248 PolarHBondContact O-N 3.01Å; N244-N248 VanDerWaalsContact O-N 3.08Å; N244-N248 PolarHBondContact OD1-ND2 2.82Å; N244-N248 VanDerWaalsContact OD1-ND2 3.11Å; A245-N248 CarbonylContact O-C 3.6Å; L246-N248 VanDerWaalsContact C-N 3.32Å
249	P	57.2	Low	52.9	Low	102 Å²	102	124 Å²	124	66%	0.662	66%	0.662	S	S	*	*			trans	-64	137.3	173.4	27.2	-32.9	0	0	0	109.9
250	E	52.3	Low	51.8	Low	177 Å²	177	128.4 Å²	128.4	83%	0.827	69%	0.686	S	S	*	*			trans	-57.2	135.2	170.5	-71.1	-177.9	169	0	0	109.3	L252	E250-L252 PolarHBondContact O-N 2.72Å
251	P	49.2	Very low	51	Low	124 Å²	124	126.1 Å²	126.1	81%	0.805	68%	0.68	S	S	*	*			trans	-64.2	108.7	178.3	24.8	-30.5	0	0	0	108.8	E253	P251-E253 PolarHBondContact O-N 3.35Å
252	L	48.7	Very low	50.2	Low	153 Å²	153	129.5 Å²	129.5	80%	0.801	69%	0.689	S	S	*	*			trans	-63.4	117.7	166.7	-77.9	169.6	0	0	0	107.5	E250 F254	E250-L252 PolarHBondContact O-N 2.72Å; L252-F254 VanDerWaalsContact C-N 3.31Å; L252-F254 PolarHBondContact O-N 2.87Å
253	E	42.5	Very low	49.5	Very low	196 Å²	196	128.9 Å²	128.9	92%	0.916	69%	0.689	S	S	*	*			trans	-59.5	92.5	175.4	-68.7	-178.8	167	0	0	109.3	P251	P251-E253 PolarHBondContact O-N 3.35Å
254	F	42.9	Very low	49	Very low	162 Å²	162	125.8 Å²	125.8	71%	0.711	68%	0.681	S	S	*	*			trans	-86.6	108	170.2	-168.2	-96.9	0	0	0	107.1	L252 V256	L252-F254 VanDerWaalsContact C-N 3.31Å; L252-F254 PolarHBondContact O-N 2.87Å; F254-V256 HydrophobicContact CD1-CG2 3.83Å; F254-V256 HydrophobicContact CE1-CG2 4.45Å; F254-V256 PolarHBondContact O-N 2.88Å; F254-V256 VanDerWaalsContact O-N 3.14Å
255	N	41.7	Very low	48.2	Very low	133 Å²	133	131 Å²	131	71%	0.711	69%	0.694	S	S	*	*			trans	-73.3	104.2	175.6	-155.5	38.9	0	0	0	107.9	D257	N255-D257 PolarHBondContact O-N 2.78Å
256	V	46.2	Very low	47.6	Very low	109 Å²	109	135 Å²	135	66%	0.661	70%	0.7	S	S	*	*			trans	-74.8	13	-171.3	178.3	0	0	0	0	113	F254 E258	F254-V256 HydrophobicContact CD1-CG2 3.83Å; F254-V256 HydrophobicContact CE1-CG2 4.45Å; F254-V256 PolarHBondContact O-N 2.88Å; F254-V256 VanDerWaalsContact O-N 3.14Å; V256-E258 PolarHBondContact O-N 3.45Å
257	D	43.6	Very low	47.4	Very low	132 Å²	132	136 Å²	136	71%	0.706	71%	0.705	S	S	*	*			trans	-79.6	59.5	-179.5	-66.5	-25.3	0	0	0	111.9	N255	N255-D257 PolarHBondContact O-N 2.78Å
258	E	41.6	Very low	47.1	Very low	173 Å²	173	130 Å²	130	81%	0.808	68%	0.682	S	S	*	*			trans	-169.3	80.7	153.6	-108.2	163.8	-162.1	0	0	109.6	V256	V256-E258 PolarHBondContact O-N 3.45Å
259	S	38.7	Very low	47.1	Very low	95 Å²	95	129.6 Å²	129.6	66%	0.664	68%	0.68	S	S	*	*			trans	-64.8	136.6	166.1	47	0	0	0	0	111.8
260	D	43.8	Very low	47.1	Very low	167 Å²	167	128.8 Å²	128.8	89%	0.893	67%	0.674	S	S	*	*	S	Bend	trans	84.8	19.1	149.6	-52.2	-27.2	0	0	0	120.9
261	S	47.4	Very low	47.3	Very low	67 Å²	67	123.8 Å²	123.8	47%	0.469	66%	0.656	S	S	.	*			trans	-103.2	136	161.3	67	0	0	0	0	111.3	D263 G264	S261-D263 PolarHBondContact O-N 3.12Å; S261-G264 PolarHBondContact O-N 2.78Å
262	E	50.6	Low	47.5	Very low	174 Å²	174	122.2 Å²	122.2	81%	0.813	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.7	-17	176.7	-68	-176.8	154.1	0	0	112.8	G264	E262-G264 VanDerWaalsContact C-N 3.26Å; E262-G264 PolarHBondContact O-N 2.96Å
263	D	49.9	Very low	48.3	Very low	106 Å²	106	123.3 Å²	123.3	57%	0.567	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-19.9	174.7	-62.4	-27.4	0	0	0	113.8	S261 W265 F266 L267	S261-D263 PolarHBondContact O-N 3.12Å; D263-W265 PolarHBondContact O-N 3.09Å; D263-F266 WeakPolarHBondContact O-CB 3.47Å; D263-F266 PolarHBondContact O-N 3.39Å; D263-L267 PolarHBondContact O-N 3.45Å
264	G	46.5	Very low	49.1	Very low	36 Å²	36	117.3 Å²	117.3	37%	0.371	61%	0.613	S	S	.	*	H	α-helix	trans	-60.2	-30.8	177.9	0	0	0	0	0	113.5	S261 E262 F266 L267 A268	S261-G264 PolarHBondContact O-N 2.78Å; E262-G264 VanDerWaalsContact C-N 3.26Å; E262-G264 PolarHBondContact O-N 2.96Å; G264-F266 VanDerWaalsContact C-N 3.3Å; G264-F266 PolarHBondContact O-N 3.17Å; G264-L267 PolarHBondContact O-N 3.3Å; G264-A268 PolarHBondContact O-N 3.04Å
265	W	42.9	Very low	49.7	Very low	208 Å²	208	114 Å²	114	79%	0.788	60%	0.602	S	S	*	*	H	α-helix	trans	-68.1	-30.8	174.4	-70	89.1	0	0	0	112.3	D263 L267 A268 L269	D263-W265 PolarHBondContact O-N 3.09Å; W265-L267 VanDerWaalsContact C-N 3.33Å; W265-A268 PolarHBondContact O-N 3.39Å; W265-L269 PolarHBondContact O-N 3.25Å
266	F	47.8	Very low	50.5	Low	147 Å²	147	112 Å²	112	65%	0.645	59%	0.594	S	S	*	*	H	α-helix	trans	-70.3	-30.9	175.9	-74.4	-82.6	0	0	0	112.3	D263 G264 L269	D263-F266 WeakPolarHBondContact O-CB 3.47Å; D263-F266 PolarHBondContact O-N 3.39Å; G264-F266 VanDerWaalsContact C-N 3.3Å; G264-F266 PolarHBondContact O-N 3.17Å; F266-L269 HydrophobicContact CD1-CD1 4.05Å
267	L	48.8	Very low	51.1	Low	132 Å²	132	112.2 Å²	112.2	69%	0.691	59%	0.588	S	S	*	*	H	α-helix	trans	-75.3	-24.2	174.8	-65.6	174.2	0	0	0	113.2	D263 G264 W265 P270	D263-L267 PolarHBondContact O-N 3.45Å; G264-L267 PolarHBondContact O-N 3.3Å; W265-L267 VanDerWaalsContact C-N 3.33Å; L267-P270 WeakPolarHBondContact O-CD 3.29Å
268	A	50.4	Low	51.6	Low	31 Å²	31	108.9 Å²	108.9	26%	0.256	58%	0.575	S	S	.	*	H	α-helix	trans	-80.6	-23.9	177	0	0	0	0	0	113.7	G264 W265 V271 I272	G264-A268 PolarHBondContact O-N 3.04Å; W265-A268 PolarHBondContact O-N 3.39Å; A268-V271 WeakPolarHBondContact O-CB 3.49Å; A268-V271 PolarHBondContact O-N 3.29Å; A268-V271 VanDerWaalsContact O-N 3.09Å; A268-I272 WeakPolarHBondContact O-CG1 3.47Å; A268-I272 PolarHBondContact O-N 2.94Å
269	L	55.7	Low	52.1	Low	97 Å²	97	105.5 Å²	105.5	51%	0.508	56%	0.561	S	S	.	*	H	α-helix	trans	-55.5	-42.8	-177.1	-85	164.5	0	0	0	114.3	W265 F266 V271 I272 R273	W265-L269 PolarHBondContact O-N 3.25Å; F266-L269 HydrophobicContact CD1-CD1 4.05Å; L269-V271 VanDerWaalsContact C-N 3.33Å; L269-V271 PolarHBondContact O-N 3.06Å; L269-I272 PolarHBondContact O-N 3.09Å; L269-R273 WeakPolarHBondContact O-CB 3.37Å; L269-R273 PolarHBondContact O-N 3.23Å
270	P	58.7	Low	52.7	Low	85 Å²	85	104.4 Å²	104.4	55%	0.552	55%	0.554	S	S	*	*	H	α-helix	trans	-61.7	-38.7	175.2	-22.9	33.6	0	0	0	113.2	L267 R273 S274	L267-P270 WeakPolarHBondContact O-CD 3.29Å; P270-R273 PolarHBondContact O-N 3.14Å; P270-S274 WeakPolarHBondContact O-CB 3.22Å; P270-S274 PolarHBondContact O-N 2.91Å
271	V	56.6	Low	53.3	Low	72 Å²	72	100.4 Å²	100.4	44%	0.436	54%	0.535	S	S	.	.	H	α-helix	trans	-66.7	-46.8	178.9	179.5	0	0	0	0	110.3	A268 L269 R273 S274 I275	A268-V271 WeakPolarHBondContact O-CB 3.49Å; A268-V271 PolarHBondContact O-N 3.29Å; A268-V271 VanDerWaalsContact O-N 3.09Å; L269-V271 VanDerWaalsContact C-N 3.33Å; L269-V271 PolarHBondContact O-N 3.06Å; V271-R273 VanDerWaalsContact C-N 3.32Å; V271-R273 PolarHBondContact O-N 2.65Å; V271-S274 WeakPolarHBondContact O-CB 3.36Å; V271-S274 PolarHBondContact O-N 2.86Å; V271-I275 HydrophobicContact CG1-CD1 4.13Å; V271-I275 WeakPolarHBondContact O-CG1 3.23Å; V271-I275 PolarHBondContact O-N 2.8Å
272	I	53.7	Low	53.4	Low	91 Å²	91	100 Å²	100	47%	0.467	53%	0.53	S	S	.	.	H	α-helix	trans	-61.7	-42.9	176.7	-63.1	170.5	0	0	0	110.4	A268 L269 S274 I275 V276	A268-I272 WeakPolarHBondContact O-CG1 3.47Å; A268-I272 PolarHBondContact O-N 2.94Å; L269-I272 PolarHBondContact O-N 3.09Å; I272-S274 VanDerWaalsContact C-N 3.33Å; I272-S274 PolarHBondContact O-N 2.83Å; I272-I275 PolarHBondContact O-N 3.17Å; I272-V276 HydrophobicContact CG2-CG2 4.43Å; I272-V276 WeakPolarHBondContact O-CG2 3.48Å; I272-V276 PolarHBondContact O-N 2.95Å
273	R	65.1	Low	53.3	Low	176 Å²	176	100.8 Å²	100.8	66%	0.664	53%	0.526	S	S	*	.	H	α-helix	trans	-60.6	-43.2	176.8	-172.7	-179	-117.2	172.4	-1.8	111.5	L269 P270 V271 V276 E277	L269-R273 WeakPolarHBondContact O-CB 3.37Å; L269-R273 PolarHBondContact O-N 3.23Å; P270-R273 PolarHBondContact O-N 3.14Å; V271-R273 VanDerWaalsContact C-N 3.32Å; V271-R273 PolarHBondContact O-N 2.65Å; R273-V276 PolarHBondContact O-N 3.4Å; R273-E277 WeakPolarHBondContact O-CB 3.26Å; R273-E277 PolarHBondContact O-N 3.09Å
274	S	58.8	Low	53.4	Low	71 Å²	71	98.1 Å²	98.1	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-61.1	-45	177	-177.6	0	0	0	0	112.2	P270 V271 I272 V276 E277 S278	P270-S274 WeakPolarHBondContact O-CB 3.22Å; P270-S274 PolarHBondContact O-N 2.91Å; V271-S274 WeakPolarHBondContact O-CB 3.36Å; V271-S274 PolarHBondContact O-N 2.86Å; I272-S274 VanDerWaalsContact C-N 3.33Å; I272-S274 PolarHBondContact O-N 2.83Å; S274-V276 VanDerWaalsContact C-N 3.34Å; S274-V276 PolarHBondContact O-N 2.83Å; S274-E277 PolarHBondContact O-N 2.91Å; S274-S278 PolarHBondContact O-N 2.9Å; S274-S278 PolarHBondContact O-OG 3.48Å
275	I	54.3	Low	53.6	Low	91 Å²	91	102.8 Å²	102.8	47%	0.467	53%	0.528	S	S	.	.	H	α-helix	trans	-62.5	-41.5	176.3	-66.4	166.9	0	0	0	111.1	V271 I272 S278 I279	V271-I275 HydrophobicContact CG1-CD1 4.13Å; V271-I275 WeakPolarHBondContact O-CG1 3.23Å; V271-I275 PolarHBondContact O-N 2.8Å; I272-I275 PolarHBondContact O-N 3.17Å; I275-S278 WeakPolarHBondContact CA-OG 3.18Å; I275-S278 PolarHBondContact O-N 2.85Å; I275-S278 PolarHBondContact O-OG 3.05Å; I275-I279 HydrophobicContact CG2-CD1 3.87Å; I275-I279 WeakPolarHBondContact O-CD1 3.43Å; I275-I279 WeakPolarHBondContact O-CG1 3.34Å; I275-I279 PolarHBondContact O-N 3.06Å; I275-I279 VanDerWaalsContact O-N 3.09Å
276	V	59.9	Low	53.8	Low	91 Å²	91	97.8 Å²	97.8	55%	0.552	52%	0.516	S	S	*	.	H	α-helix	trans	-68.5	-39.1	178.5	172.9	0	0	0	0	111.2	I272 R273 S274 I279 S280	I272-V276 HydrophobicContact CG2-CG2 4.43Å; I272-V276 WeakPolarHBondContact O-CG2 3.48Å; I272-V276 PolarHBondContact O-N 2.95Å; R273-V276 PolarHBondContact O-N 3.4Å; S274-V276 VanDerWaalsContact C-N 3.34Å; S274-V276 PolarHBondContact O-N 2.83Å; V276-I279 PolarHBondContact O-N 3Å; V276-S280 WeakPolarHBondContact O-CB 3.41Å; V276-S280 PolarHBondContact O-N 2.64Å
277	E	59.3	Low	54	Low	114 Å²	114	95.1 Å²	95.1	53%	0.533	51%	0.512	S	S	.	.	H	α-helix	trans	-65.9	-40.8	175.4	-85.3	171.1	175.6	0	0	112.1	R273 S274 I279 S280 V281	R273-E277 WeakPolarHBondContact O-CB 3.26Å; R273-E277 PolarHBondContact O-N 3.09Å; S274-E277 PolarHBondContact O-N 2.91Å; E277-I279 PolarHBondContact O-N 2.73Å; E277-S280 WeakPolarHBondContact O-CB 3.39Å; E277-S280 PolarHBondContact O-N 3.32Å; E277-V281 WeakPolarHBondContact O-CG2 3.42Å; E277-V281 PolarHBondContact O-N 3.46Å
278	S	53.8	Low	54.2	Low	62 Å²	62	94.9 Å²	94.9	43%	0.434	51%	0.511	S	S	.	.	H	α-helix	trans	-65.1	-38	175.9	63.4	0	0	0	0	112.3	S274 I275 T282	S274-S278 PolarHBondContact O-N 2.9Å; S274-S278 PolarHBondContact O-OG 3.48Å; I275-S278 WeakPolarHBondContact CA-OG 3.18Å; I275-S278 PolarHBondContact O-N 2.85Å; I275-S278 PolarHBondContact O-OG 3.05Å; S278-T282 WeakPolarHBondContact O-CG2 3.41Å; S278-T282 PolarHBondContact O-N 3.29Å; S278-T282 VanDerWaalsContact O-N 3.09Å; S278-T282 PolarHBondContact O-OG1 2.91Å
279	I	51.6	Low	53.9	Low	102 Å²	102	98.7 Å²	98.7	52%	0.523	53%	0.527	S	S	.	.	H	α-helix	trans	-67.7	-37.5	174	-66.6	167.1	0	0	0	111.3	I275 V276 E277 T282 R283	I275-I279 HydrophobicContact CG2-CD1 3.87Å; I275-I279 WeakPolarHBondContact O-CD1 3.43Å; I275-I279 WeakPolarHBondContact O-CG1 3.34Å; I275-I279 PolarHBondContact O-N 3.06Å; I275-I279 VanDerWaalsContact O-N 3.09Å; V276-I279 PolarHBondContact O-N 3Å; E277-I279 PolarHBondContact O-N 2.73Å; I279-T282 VanDerWaalsContact CA-OG1 3.3Å; I279-T282 WeakPolarHBondContact CA-OG1 3.23Å; I279-T282 PolarHBondContact O-OG1 2.86Å; I279-R283 WeakPolarHBondContact O-CB 3.5Å; I279-R283 PolarHBondContact O-N 2.9Å
280	S	51.6	Low	53.4	Low	73 Å²	73	101.5 Å²	101.5	51%	0.51	54%	0.535	S	S	.	.	H	α-helix	trans	-64.5	-48.8	176.2	169.6	0	0	0	0	112	V276 E277 T282 R283 A284	V276-S280 WeakPolarHBondContact O-CB 3.41Å; V276-S280 PolarHBondContact O-N 2.64Å; E277-S280 WeakPolarHBondContact O-CB 3.39Å; E277-S280 PolarHBondContact O-N 3.32Å; S280-T282 VanDerWaalsContact C-N 3.34Å; S280-T282 PolarHBondContact O-N 2.75Å; S280-R283 PolarHBondContact O-N 3.37Å; S280-A284 PolarHBondContact O-N 3.09Å
281	V	55.9	Low	52.6	Low	82 Å²	82	101.9 Å²	101.9	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-63.1	-40.5	179.3	171.7	0	0	0	0	111.1	E277 A284 K285	E277-V281 WeakPolarHBondContact O-CG2 3.42Å; E277-V281 PolarHBondContact O-N 3.46Å; V281-A284 PolarHBondContact O-N 2.98Å; V281-K285 PolarHBondContact O-N 3.47Å
282	T	50.6	Low	51.8	Low	58 Å²	58	104.3 Å²	104.3	36%	0.356	56%	0.558	S	S	.	*	H	α-helix	trans	-67.6	-41.4	176.6	44	0	0	0	0	112	S278 I279 S280 A284 K285 L286	S278-T282 WeakPolarHBondContact O-CG2 3.41Å; S278-T282 PolarHBondContact O-N 3.29Å; S278-T282 VanDerWaalsContact O-N 3.09Å; S278-T282 PolarHBondContact O-OG1 2.91Å; I279-T282 VanDerWaalsContact CA-OG1 3.3Å; I279-T282 WeakPolarHBondContact CA-OG1 3.23Å; I279-T282 PolarHBondContact O-OG1 2.86Å; S280-T282 VanDerWaalsContact C-N 3.34Å; S280-T282 PolarHBondContact O-N 2.75Å; T282-A284 VanDerWaalsContact C-N 3.28Å; T282-A284 PolarHBondContact O-N 3.05Å; T282-K285 PolarHBondContact O-N 3.31Å; T282-L286 WeakPolarHBondContact O-CB 3.45Å; T282-L286 PolarHBondContact O-N 2.69Å
283	R	47.6	Very low	51.1	Low	192 Å²	192	107.5 Å²	107.5	73%	0.725	57%	0.571	S	S	*	*	H	α-helix	trans	-58.3	-41.3	171.5	-174.9	-178.4	179.1	-151.8	-0.8	111.6	I279 S280 L286 V287	I279-R283 WeakPolarHBondContact O-CB 3.5Å; I279-R283 PolarHBondContact O-N 2.9Å; S280-R283 PolarHBondContact O-N 3.37Å; R283-L286 PolarHBondContact O-N 2.66Å; R283-V287 VanDerWaalsContact O-CG2 3.25Å; R283-V287 WeakPolarHBondContact O-CG2 3.4Å; R283-V287 PolarHBondContact O-N 3.3Å
284	A	51	Low	49.8	Very low	49 Å²	49	108.4 Å²	108.4	41%	0.405	58%	0.582	S	S	.	*	H	α-helix	trans	-65.5	-42.1	176.6	0	0	0	0	0	112.3	S280 V281 T282 V287 N288	S280-A284 PolarHBondContact O-N 3.09Å; V281-A284 PolarHBondContact O-N 2.98Å; T282-A284 VanDerWaalsContact C-N 3.28Å; T282-A284 PolarHBondContact O-N 3.05Å; A284-V287 PolarHBondContact O-N 2.72Å; A284-N288 WeakPolarHBondContact O-CB 3.22Å; A284-N288 PolarHBondContact O-N 2.67Å
285	K	51.1	Low	48.7	Very low	134 Å²	134	111.3 Å²	111.3	58%	0.583	59%	0.591	S	S	*	*	H	α-helix	trans	-60.5	-45.7	172.8	-79.2	-177.1	175.8	-177.9	0	111.6	V281 T282 V287 N288 L289	V281-K285 PolarHBondContact O-N 3.47Å; T282-K285 PolarHBondContact O-N 3.31Å; K285-V287 VanDerWaalsContact C-N 3.33Å; K285-V287 PolarHBondContact O-N 2.89Å; K285-N288 PolarHBondContact O-N 3.42Å; K285-L289 WeakPolarHBondContact O-CB 3Å; K285-L289 WeakPolarHBondContact O-CD1 3.19Å; K285-L289 WeakPolarHBondContact O-CG 3.45Å; K285-L289 PolarHBondContact O-N 3.11Å
286	L	48	Very low	47.8	Very low	104 Å²	104	110.6 Å²	110.6	55%	0.545	60%	0.599	S	S	.	*	H	α-helix	trans	-62.7	-39.1	179.2	-126.9	160.5	0	0	0	111.8	T282 R283 F290	T282-L286 WeakPolarHBondContact O-CB 3.45Å; T282-L286 PolarHBondContact O-N 2.69Å; R283-L286 PolarHBondContact O-N 2.66Å; L286-F290 HydrophobicContact CD2-CD2 4.18Å; L286-F290 HydrophobicContact CD2-CE2 3.75Å; L286-F290 WeakPolarHBondContact O-CD2 3.5Å
287	V	51.5	Low	46.7	Very low	91 Å²	91	112.9 Å²	112.9	55%	0.552	62%	0.616	S	S	*	*	H	α-helix	trans	-69.4	-39.4	175.6	171.7	0	0	0	0	111.6	R283 A284 K285 F290	R283-V287 VanDerWaalsContact O-CG2 3.25Å; R283-V287 WeakPolarHBondContact O-CG2 3.4Å; R283-V287 PolarHBondContact O-N 3.3Å; A284-V287 PolarHBondContact O-N 2.72Å; K285-V287 VanDerWaalsContact C-N 3.33Å; K285-V287 PolarHBondContact O-N 2.89Å; V287-F290 CarbonylContact O-C 3.49Å; V287-F290 PolarHBondContact O-N 3.17Å
288	N	52	Low	45.6	Very low	126 Å²	126	112.2 Å²	112.2	67%	0.674	62%	0.623	S	S	*	*	H	α-helix	trans	-74.8	-21.8	177.9	-72.5	-18.5	0	0	0	113.8	A284 K285 F290 P291	A284-N288 WeakPolarHBondContact O-CB 3.22Å; A284-N288 PolarHBondContact O-N 2.67Å; K285-N288 PolarHBondContact O-N 3.42Å; N288-F290 VanDerWaalsContact C-N 3.3Å; N288-P291 VanDerWaalsContact O-CD 3.25Å; N288-P291 WeakPolarHBondContact O-CD 3.36Å; N288-P291 WeakPolarHBondContact O-CG 3.48Å
289	L	45	Very low	45.1	Very low	111 Å²	111	117.6 Å²	117.6	58%	0.581	64%	0.642	S	S	*	*	H	α-helix	trans	-79.7	-12.3	174.9	-85.4	154.2	0	0	0	113.4	K285 P291	K285-L289 WeakPolarHBondContact O-CB 3Å; K285-L289 WeakPolarHBondContact O-CD1 3.19Å; K285-L289 WeakPolarHBondContact O-CG 3.45Å; K285-L289 PolarHBondContact O-N 3.11Å; L289-P291 WeakPolarHBondContact O-CD 3.3Å
290	F	44.4	Very low	44.9	Very low	157 Å²	157	115.6 Å²	115.6	69%	0.689	64%	0.635	S	S	*	*	S	Bend	trans	-113	68.9	160.8	-62.3	-77.9	0	0	0	109	L286 V287 N288 S292	L286-F290 HydrophobicContact CD2-CD2 4.18Å; L286-F290 HydrophobicContact CD2-CE2 3.75Å; L286-F290 WeakPolarHBondContact O-CD2 3.5Å; V287-F290 CarbonylContact O-C 3.49Å; V287-F290 PolarHBondContact O-N 3.17Å; N288-F290 VanDerWaalsContact C-N 3.3Å; F290-S292 PolarHBondContact O-N 3.35Å
291	P	42.4	Very low	45.1	Very low	92 Å²	92	116.8 Å²	116.8	60%	0.597	64%	0.64	S	S	*	*			trans	-53	132.4	163.3	-10.5	24.6	0	0	0	106.2	N288 L289 E293	N288-P291 VanDerWaalsContact O-CD 3.25Å; N288-P291 WeakPolarHBondContact O-CD 3.36Å; N288-P291 WeakPolarHBondContact O-CG 3.48Å; L289-P291 WeakPolarHBondContact O-CD 3.3Å; P291-E293 PolarHBondContact O-N 3.16Å
292	S	39.4	Very low	44.9	Very low	124 Å²	124	119.1 Å²	119.1	87%	0.867	65%	0.649	S	S	*	*			trans	-57.8	86	171.2	-56.8	0	0	0	0	107.7	F290 E294	F290-S292 PolarHBondContact O-N 3.35Å; S292-E294 PolarHBondContact O-N 3.26Å; S292-E294 VanDerWaalsContact O-N 3.14Å
293	E	40.5	Very low	45.3	Very low	158 Å²	158	126 Å²	126	74%	0.738	67%	0.668	S	S	*	*			trans	-66.1	117.2	-174.6	-154.4	171.7	-162.3	0	0	105.8	P291 I295	P291-E293 PolarHBondContact O-N 3.16Å; E293-I295 HydrophobicContact CB-CG1 4.34Å; E293-I295 WeakPolarHBondContact O-CG1 3.4Å; E293-I295 PolarHBondContact O-N 3.48Å
294	E	35.9	Very low	45.6	Very low	194 Å²	194	122 Å²	122	91%	0.907	66%	0.657	S	S	*	*			trans	-62.9	80.4	171.8	-78.4	-178.8	145.3	0	0	108	S292 A296	S292-E294 PolarHBondContact O-N 3.26Å; S292-E294 VanDerWaalsContact O-N 3.14Å; E294-A296 PolarHBondContact O-N 2.97Å
295	I	35.8	Very low	45.8	Very low	132 Å²	132	124.6 Å²	124.6	68%	0.677	66%	0.66	S	S	*	*			trans	-69.7	107.2	-179.5	-68.3	159	0	0	0	107.8	E293	E293-I295 HydrophobicContact CB-CG1 4.34Å; E293-I295 WeakPolarHBondContact O-CG1 3.4Å; E293-I295 PolarHBondContact O-N 3.48Å
296	A	35.3	Very low	45.8	Very low	77 Å²	77	122.8 Å²	122.8	64%	0.636	66%	0.656	S	S	*	*			trans	-49.5	148.9	164.8	0	0	0	0	0	111	E294 S298	E294-A296 PolarHBondContact O-N 2.97Å; A296-S298 PolarHBondContact O-N 3.42Å
297	P	38	Very low	46.3	Very low	139 Å²	139	120.2 Å²	120.2	90%	0.903	65%	0.65	S	S	*	*			trans	-74.2	96.6	-157.2	30.4	-34	0	0	0	111.3
298	S	36.3	Very low	46.5	Very low	99 Å²	99	119.9 Å²	119.9	69%	0.692	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-102.7	147.6	159.7	56.7	0	0	0	0	109.2	A296	A296-S298 PolarHBondContact O-N 3.42Å
299	E	43.1	Very low	46.5	Very low	176 Å²	176	118.8 Å²	118.8	82%	0.822	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-49.2	139.1	-158.4	-69.3	-177.2	142.4	0	0	116	T301	E299-T301 PolarHBondContact O-N 3.13Å
300	P	47.4	Very low	47	Very low	59 Å²	59	119.4 Å²	119.4	38%	0.383	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-67.4	127.1	-174.4	26.1	-33	0	0	0	111.7	H304 K305	P300-H304 HydrophobicContact CB-CB 3.91Å; P300-K305 HydrophobicContact CG-CG 4.45Å; P300-K305 WeakPolarHBondContact O-CE 3.45Å
301	T	55.9	Low	47.2	Very low	99 Å²	99	116.8 Å²	116.8	61%	0.607	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-53.4	155.7	172.1	62	0	0	0	0	112	E299 R303 H304 K305	E299-T301 PolarHBondContact O-N 3.13Å; T301-R303 PolarHBondContact O-N 3.38Å; T301-H304 WeakPolarHBondContact O-CA 3.28Å; T301-H304 WeakPolarHBondContact O-CB 3.46Å; T301-H304 PolarHBondContact O-N 2.68Å; T301-K305 PolarHBondContact O-N 2.85Å
302	L	51.2	Low	47.9	Very low	131 Å²	131	120.6 Å²	120.6	69%	0.686	64%	0.644	S	S	*	*	H	α-helix	trans	-51.6	-31.7	177.7	-81	166.8	0	0	0	113.8	K305 N306	L302-K305 PolarHBondContact O-N 3.34Å; L302-N306 WeakPolarHBondContact O-CB 3.35Å; L302-N306 PolarHBondContact O-N 2.83Å; L302-N306 PolarHBondContact O-OD1 3.4Å
303	R	59.2	Low	48.8	Very low	201 Å²	201	124.4 Å²	124.4	76%	0.758	65%	0.645	S	S	*	*	H	α-helix	trans	-62.6	-42.1	173.2	-94	-178.1	173.9	-119.7	-7	112.1	T301 N306 A307	T301-R303 PolarHBondContact O-N 3.38Å; R303-N306 PolarHBondContact O-N 2.88Å; R303-A307 WeakPolarHBondContact O-CB 3.32Å; R303-A307 PolarHBondContact O-N 2.88Å
304	H	53.8	Low	49.2	Very low	108 Å²	108	119.8 Å²	119.8	50%	0.5	63%	0.625	S	S	.	*	H	α-helix	trans	-73.7	-36.3	178.5	-156.9	83.6	0	0	0	111	P300 T301 N306 A307 I308	P300-H304 HydrophobicContact CB-CB 3.91Å; T301-H304 WeakPolarHBondContact O-CA 3.28Å; T301-H304 WeakPolarHBondContact O-CB 3.46Å; T301-H304 PolarHBondContact O-N 2.68Å; H304-N306 VanDerWaalsContact C-N 3.32Å; H304-N306 PolarHBondContact O-N 2.79Å; H304-A307 PolarHBondContact O-N 3.4Å; H304-I308 WeakPolarHBondContact O-CB 3.17Å; H304-I308 VanDerWaalsContact O-CG1 3.23Å; H304-I308 WeakPolarHBondContact O-CG1 3.44Å; H304-I308 PolarHBondContact O-N 2.87Å
305	K	54.9	Low	50.3	Low	105 Å²	105	114.3 Å²	114.3	46%	0.457	61%	0.613	S	S	.	*	H	α-helix	trans	-59.5	-41.1	169.5	-66	-177.2	179.1	178.1	0	112.5	P300 T301 L302 I308 L309	P300-K305 HydrophobicContact CG-CG 4.45Å; P300-K305 WeakPolarHBondContact O-CE 3.45Å; T301-K305 PolarHBondContact O-N 2.85Å; L302-K305 PolarHBondContact O-N 3.34Å; K305-I308 PolarHBondContact O-N 3.29Å; K305-L309 PolarHBondContact O-N 2.88Å
306	N	51.6	Low	51	Low	95 Å²	95	117.5 Å²	117.5	51%	0.508	62%	0.617	S	S	.	*	H	α-helix	trans	-71	-31.9	176.7	-69.8	-8.4	0	0	0	112.6	L302 R303 H304 L310	L302-N306 WeakPolarHBondContact O-CB 3.35Å; L302-N306 PolarHBondContact O-N 2.83Å; L302-N306 PolarHBondContact O-OD1 3.4Å; R303-N306 PolarHBondContact O-N 2.88Å; H304-N306 VanDerWaalsContact C-N 3.32Å; H304-N306 PolarHBondContact O-N 2.79Å; N306-L310 PolarHBondContact O-N 3.36Å
307	A	58.9	Low	51.7	Low	51 Å²	51	120.8 Å²	120.8	42%	0.421	61%	0.614	S	S	.	*	H	α-helix	trans	-69.5	-39.6	171.3	0	0	0	0	0	111.4	R303 H304 L309 L310 D311	R303-A307 WeakPolarHBondContact O-CB 3.32Å; R303-A307 PolarHBondContact O-N 2.88Å; H304-A307 PolarHBondContact O-N 3.4Å; A307-L309 VanDerWaalsContact C-N 3.28Å; A307-L309 PolarHBondContact O-N 3.35Å; A307-L310 CarbonylContact O-C 3.53Å; A307-L310 WeakPolarHBondContact O-CA 3.43Å; A307-L310 WeakPolarHBondContact O-CB 3.34Å; A307-L310 PolarHBondContact O-N 2.89Å; A307-D311 PolarHBondContact O-N 3.36Å; A307-D311 VanDerWaalsContact O-N 3.08Å
308	I	54.5	Low	51.9	Low	83 Å²	83	122.1 Å²	122.1	43%	0.426	61%	0.606	S	S	.	*	H	α-helix	trans	-62.6	-35.7	174.4	-69	163.5	0	0	0	111.2	H304 K305 L310 D311	H304-I308 WeakPolarHBondContact O-CB 3.17Å; H304-I308 VanDerWaalsContact O-CG1 3.23Å; H304-I308 WeakPolarHBondContact O-CG1 3.44Å; H304-I308 PolarHBondContact O-N 2.87Å; K305-I308 PolarHBondContact O-N 3.29Å; I308-L310 PolarHBondContact O-N 2.97Å; I308-D311 VanDerWaalsContact O-CB 3.29Å; I308-D311 WeakPolarHBondContact O-CB 3.5Å; I308-D311 PolarHBondContact O-N 3.13Å; I308-D311 VanDerWaalsContact O-N 3.08Å
309	L	52.5	Low	52.3	Low	103 Å²	103	121.4 Å²	121.4	54%	0.539	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.2	-19.5	172.6	-96.4	155.9	0	0	0	113.6	K305 A307	K305-L309 PolarHBondContact O-N 2.88Å; A307-L309 VanDerWaalsContact C-N 3.28Å; A307-L309 PolarHBondContact O-N 3.35Å
310	L	55	Low	52.1	Low	125 Å²	125	123.5 Å²	123.5	65%	0.654	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	0.2	175.2	-68	167.1	0	0	0	112.3	N306 A307 I308	N306-L310 PolarHBondContact O-N 3.36Å; A307-L310 CarbonylContact O-C 3.53Å; A307-L310 WeakPolarHBondContact O-CA 3.43Å; A307-L310 WeakPolarHBondContact O-CB 3.34Å; A307-L310 PolarHBondContact O-N 2.89Å; I308-L310 PolarHBondContact O-N 2.97Å
311	D	49.2	Very low	51.9	Low	101 Å²	101	127 Å²	127	54%	0.54	63%	0.634	S	S	.	*	S	Bend	trans	-73.4	146.3	-177.4	-129.2	-6.4	0	0	0	110.7	A307 I308 K313 D314	A307-D311 PolarHBondContact O-N 3.36Å; A307-D311 VanDerWaalsContact O-N 3.08Å; I308-D311 VanDerWaalsContact O-CB 3.29Å; I308-D311 WeakPolarHBondContact O-CB 3.5Å; I308-D311 PolarHBondContact O-N 3.13Å; I308-D311 VanDerWaalsContact O-N 3.08Å; D311-K313 PolarHBondContact O-N 3.37Å; D311-D314 PolarHBondContact O-N 3.43Å; D311-D314 VanDerWaalsContact O-N 3.16Å
312	E	57.8	Low	51.2	Low	173 Å²	173	128.1 Å²	128.1	81%	0.808	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.4	-10.6	-168.3	-102.3	-177.2	151.6	0	0	116.9
313	K	57.6	Low	50.5	Low	203 Å²	203	125.1 Å²	125.1	88%	0.883	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-21	-179.7	-68	-175.3	-178.6	173.4	0	113.2	D311 A315	D311-K313 PolarHBondContact O-N 3.37Å; K313-A315 PolarHBondContact O-N 2.89Å
314	D	49.8	Very low	49.7	Very low	61 Å²	61	123.9 Å²	123.9	33%	0.326	63%	0.631	S	S	.	*	S	Bend	trans	-81.9	104.2	177.4	-123.9	19.7	0	0	0	110.2	D311 R316 Y317	D311-D314 PolarHBondContact O-N 3.43Å; D311-D314 VanDerWaalsContact O-N 3.16Å; D314-R316 PolarHBondContact O-N 3.45Å; D314-R316 IonicContact OD2-NH2 3.75Å; D314-Y317 HydrophobicContact CB-CD2 4.46Å; D314-Y317 PolarHBondContact O-N 3.21Å
315	A	57.6	Low	49.2	Very low	79 Å²	79	123.1 Å²	123.1	65%	0.653	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-12.1	-172.4	0	0	0	0	0	115.1	K313 Y317	K313-A315 PolarHBondContact O-N 2.89Å; A315-Y317 VanDerWaalsContact C-N 3.34Å
316	R	51.6	Low	48.3	Very low	199 Å²	199	124.6 Å²	124.6	75%	0.751	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-26.1	175	-74.1	-175.9	-70.8	-161.4	-3.2	113.7	D314	D314-R316 PolarHBondContact O-N 3.45Å; D314-R316 IonicContact OD2-NH2 3.75Å
317	Y	50.2	Low	47.7	Very low	147 Å²	147	126.1 Å²	126.1	58%	0.576	66%	0.658	S	S	*	*	S	Bend	trans	-105.2	3.2	-178.6	-59.4	-71.9	0	0	0	113.2	D314 A315 G319	D314-Y317 HydrophobicContact CB-CD2 4.46Å; D314-Y317 PolarHBondContact O-N 3.21Å; A315-Y317 VanDerWaalsContact C-N 3.34Å; Y317-G319 PolarHBondContact O-N 3.3Å
318	K	41.9	Very low	46.4	Very low	167 Å²	167	130 Å²	130	73%	0.726	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	109.5	171.6	-107.1	-173.5	174.7	-178.5	0	110.3	R320	K318-R320 PolarHBondContact O-N 3.09Å
319	G	44.3	Very low	45.4	Very low	83 Å²	83	130.6 Å²	130.6	86%	0.856	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	83.4	9.6	158.3	0	0	0	0	0	117.4	Y317	Y317-G319 PolarHBondContact O-N 3.3Å
320	R	38.8	Very low	44.3	Very low	221 Å²	221	134.8 Å²	134.8	83%	0.834	70%	0.697	S	S	*	*			trans	-107.4	79.4	170.2	-153.3	175.8	-150.8	175.5	5.8	110.5	K318 V322	K318-R320 PolarHBondContact O-N 3.09Å; R320-V322 PolarHBondContact O-N 2.9Å; R320-V322 VanDerWaalsContact O-N 3.09Å
321	V	43	Very low	43.1	Very low	132 Å²	132	134.2 Å²	134.2	80%	0.8	70%	0.704	S	S	*	*			trans	-62.1	111	161	179.4	0	0	0	0	105.8	S323	V321-S323 VanDerWaalsContact C-N 3.28Å; V321-S323 PolarHBondContact O-N 3.22Å
322	V	41.3	Very low	42.4	Very low	123 Å²	123	138 Å²	138	75%	0.745	72%	0.718	S	S	*	*			trans	-68.6	96.8	170.6	-176.8	0	0	0	0	105.6	R320 F324	R320-V322 PolarHBondContact O-N 2.9Å; R320-V322 VanDerWaalsContact O-N 3.09Å; V322-F324 PolarHBondContact O-N 3.14Å; V322-F324 VanDerWaalsContact O-N 3.14Å
323	S	37.8	Very low	41.2	Very low	67 Å²	67	138.9 Å²	138.9	47%	0.469	72%	0.722	S	S	.	*			trans	-61.7	116.5	174.3	54.4	0	0	0	0	107.8	V321 S325 N326	V321-S323 VanDerWaalsContact C-N 3.28Å; V321-S323 PolarHBondContact O-N 3.22Å; S323-S325 PolarHBondContact O-N 3.16Å; S323-N326 PolarHBondContact O-N 3.37Å
324	F	40.9	Very low	40	Very low	176 Å²	176	138.2 Å²	138.2	77%	0.772	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-65.4	-2.6	-175.2	-146.8	-93.9	0	0	0	113.4	V322 N326 L327	V322-F324 PolarHBondContact O-N 3.14Å; V322-F324 VanDerWaalsContact O-N 3.14Å; F324-N326 PolarHBondContact O-N 2.86Å; F324-L327 HydrophobicContact CE1-CD2 4.48Å; F324-L327 PolarHBondContact O-N 3.12Å
325	S	44.6	Very low	39.1	Very low	92 Å²	92	144.2 Å²	144.2	64%	0.643	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-67.6	-6.7	174.5	55.5	0	0	0	0	114.4	S323	S323-S325 PolarHBondContact O-N 3.16Å
326	N	36.2	Very low	37.8	Very low	135 Å²	135	149.5 Å²	149.5	72%	0.722	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-98.9	12.7	177.1	-74.4	31.6	0	0	0	113.8	S323 F324 D328	S323-N326 PolarHBondContact O-N 3.37Å; F324-N326 PolarHBondContact O-N 2.86Å; N326-D328 VanDerWaalsContact C-N 3.3Å; N326-D328 PolarHBondContact O-N 3.05Å
327	L	37.3	Very low	37	Very low	128 Å²	128	146.8 Å²	146.8	67%	0.67	77%	0.765	S	S	*	*	S	Bend	trans	-92.5	75.7	164	-146.9	81.1	0	0	0	108.4	F324	F324-L327 HydrophobicContact CE1-CD2 4.48Å; F324-L327 PolarHBondContact O-N 3.12Å
328	D	33.4	Very low	36	Very low	132 Å²	132	146.2 Å²	146.2	71%	0.706	77%	0.767	S	S	*	*			trans	-55.5	131.9	173.1	-96.2	-30.7	0	0	0	111	N326	N326-D328 VanDerWaalsContact C-N 3.3Å; N326-D328 PolarHBondContact O-N 3.05Å
329	S	32.5	Very low	35.4	Very low	96 Å²	96	147.7 Å²	147.7	67%	0.671	77%	0.768	S	S	*	*			trans	41.3	88.3	148	65.7	0	0	0	0	117.6
330	F	30.5	Very low	34.8	Very low	191 Å²	191	148.8 Å²	148.8	84%	0.838	77%	0.769	S	S	*	*			trans	-100.6	98	139.2	-76.6	-80.4	0	0	0	107	E332	F330-E332 PolarHBondContact O-N 3.44Å
331	S	28.5	Very low	34.4	Very low	113 Å²	113	146.2 Å²	146.2	79%	0.79	77%	0.767	S	S	*	*			trans	-59.6	108.3	167.9	-69.7	0	0	0	0	108.9
332	E	35.7	Very low	33.7	Very low	179 Å²	179	148.3 Å²	148.3	84%	0.836	77%	0.767	S	S	*	*			trans	-112.7	120.5	155.9	-74.5	-177.1	179.1	0	0	106.4	F330 E334	F330-E332 PolarHBondContact O-N 3.44Å; E332-E334 PolarHBondContact O-N 3.2Å
333	E	31	Very low	33.2	Very low	192 Å²	192	152.5 Å²	152.5	90%	0.897	77%	0.771	S	S	*	*			trans	-63.1	116	-175.6	-64.7	166.5	170.1	0	0	108.8	E335	E333-E335 PolarHBondContact O-N 3.18Å
334	E	33.5	Very low	32.9	Very low	190 Å²	190	155.8 Å²	155.8	89%	0.888	78%	0.783	S	S	*	*			trans	-77.4	112.2	173.2	-69.9	-176.5	160.2	0	0	108.7	E332 E336	E332-E334 PolarHBondContact O-N 3.2Å; E334-E336 PolarHBondContact O-N 2.92Å
335	E	31.1	Very low	32.5	Very low	186 Å²	186	152.5 Å²	152.5	87%	0.869	78%	0.783	S	S	*	*			trans	-71.7	119	168.5	-75.4	-174.5	159.3	0	0	109.9	E333 V337	E333-E335 PolarHBondContact O-N 3.18Å; E335-V337 PolarHBondContact O-N 3.38Å
336	E	29.6	Very low	31.7	Very low	190 Å²	190	155.3 Å²	155.3	89%	0.888	79%	0.79	S	S	*	*			trans	-59.7	120.6	171.1	-72.4	179.3	136.2	0	0	111	E334	E334-E336 PolarHBondContact O-N 2.92Å
337	V	34.5	Very low	31.6	Very low	142 Å²	142	154.3 Å²	154.3	86%	0.861	79%	0.789	S	S	*	*			trans	-110.2	120.1	161.3	179.8	0	0	0	0	108.5	E335	E335-V337 PolarHBondContact O-N 3.38Å
338	E	30.6	Very low	31.3	Very low	136 Å²	136	159.1 Å²	159.1	64%	0.636	80%	0.798	S	S	*	*			trans	-68.5	137.9	-170.2	-55.9	-167.9	142	0	0	114.4
339	R	27.7	Very low	31	Very low	198 Å²	198	162.7 Å²	162.7	75%	0.747	81%	0.808	S	S	*	*			trans	41.9	106.7	135.7	-66.5	-177.6	-71.7	-90.5	4.7	118.6
340	A	31.7	Very low	31	Very low	105 Å²	105	166.6 Å²	166.6	87%	0.868	82%	0.815	S	S	*	*			trans	-114.9	130.8	151.6	0	0	0	0	0	109.4
341	E	30.4	Very low	31.2	Very low	168 Å²	168	166.8 Å²	166.8	79%	0.785	82%	0.819	S	S	*	*			trans	-76	148.6	-166.6	-62.7	-173.4	159.9	0	0	114.2
342	H	29.8	Very low	31.4	Very low	176 Å²	176	168.9 Å²	168.9	82%	0.815	82%	0.82	S	S	*	*			trans	-90.7	116.5	-172.1	-157.8	-76	0	0	0	109.4
343	Y	31	Very low	31	Very low	210 Å²	210	169.4 Å²	169.4	82%	0.824	82%	0.822	S	S	*	*			trans	-90	116	170.9	-66.3	-77.8	0	0	0	109.7
344	D	30.8	Very low	30.9	Very low	136 Å²	136	164.9 Å²	164.9	73%	0.727	81%	0.812	S	S	*	*			trans	-89.7	111.4	179.1	-160.5	0.4	0	0	0	109
345	S	33.3	Very low	30.9	Very low	108 Å²	108	165.5 Å²	165.5	76%	0.755	82%	0.815	S	S	*	*			trans	-113	77.4	175.3	69.4	0	0	0	0	109.9
346	N	27.6	Very low	30.9	Very low	151 Å²	151	166.1 Å²	166.1	81%	0.807	81%	0.814	S	S	*	*			trans	-101.5	99.9	162.5	-103.7	-18.8	0	0	0	107.8
347	T	33.8	Very low	31.1	Very low	113 Å²	113	166 Å²	166	69%	0.693	81%	0.814	S	S	*	*			trans	-141.1	115.5	172.8	-34	0	0	0	0	110.9
348	R	30	Very low	31.1	Very low	229 Å²	229	168.7 Å²	168.7	86%	0.864	82%	0.817	S	S	*	*			trans	61.7	104.5	153.8	-79.4	175.6	165.7	134.4	-3.1	118.8
349	K	28	Very low	31.5	Very low	208 Å²	208	169.9 Å²	169.9	90%	0.904	82%	0.823	S	S	*	*			trans	-115	93.7	152.2	-75	-177.9	175.5	-179.4	0	108.2
350	E	31.3	Very low	32.3	Very low	178 Å²	178	169.1 Å²	169.1	83%	0.832	83%	0.828	S	S	*	*			trans	-150.7	87.3	167.2	-74	-171.7	171.6	0	0	108.4
351	E	36	Very low	32.7	Very low	194 Å²	194	171.9 Å²	171.9	91%	0.907	83%	0.828	S	S	*	*			trans	-135.9	93.9	163.8	-77.2	-171.2	168	0	0	109.5
352	I	31.9	Very low	33.4	Very low	158 Å²	158	166 Å²	166	81%	0.81	81%	0.805	S	S	*	*			trans	30.2	112.2	135.6	-59.9	167.1	0	0	0	117.3
353	E	27.8	Very low	34.1	Very low	189 Å²	189	160.4 Å²	160.4	88%	0.883	79%	0.789	S	S	*	*			trans	-63.2	121.9	158	-57.6	170	153.4	0	0	110.9
354	S	29.3	Very low	34.9	Very low	98 Å²	98	156.6 Å²	156.6	69%	0.685	78%	0.783	S	S	*	*			trans	164.8	105.8	137.4	57.5	0	0	0	0	110.5
355	E	33.3	Very low	35.2	Very low	203 Å²	203	157.5 Å²	157.5	95%	0.949	78%	0.781	S	S	*	*			trans	-173.8	88.5	143.1	-101.9	166.5	-146.1	0	0	106.2
356	K	30.6	Very low	35.8	Very low	198 Å²	198	156.3 Å²	156.3	86%	0.861	77%	0.769	S	S	*	*			trans	-98.3	129.3	167.1	-75.6	174.4	176.3	170	0	105.5
357	E	33.9	Very low	36.8	Very low	188 Å²	188	156.5 Å²	156.5	88%	0.879	76%	0.763	S	S	*	*	S	Bend	trans	134.2	86	160.8	-75.6	168.8	-157.4	0	0	109.6
358	E	35.1	Very low	37.4	Very low	198 Å²	198	159.5 Å²	159.5	93%	0.925	77%	0.767	S	S	*	*			trans	158.8	51.9	152	-85.5	179.1	-154.3	0	0	109.8
359	E	39.2	Very low	38	Very low	162 Å²	162	155.2 Å²	155.2	76%	0.757	75%	0.754	S	S	*	*			trans	-128.2	76.7	170.4	-77.5	-161.6	158.7	0	0	109.8
360	E	43.3	Very low	38.9	Very low	182 Å²	182	155.6 Å²	155.6	85%	0.85	75%	0.75	S	S	*	*	S	Bend	trans	-117.3	-17.4	160.9	-77.4	-164.7	158.8	0	0	113.7
361	D	40.5	Very low	39.7	Very low	162 Å²	162	155.6 Å²	155.6	87%	0.866	75%	0.75	S	S	*	*	S	Bend	trans	-98.7	-9.9	-179.5	-70.4	-17.5	0	0	0	114.8
362	S	45.1	Very low	40.5	Very low	45 Å²	45	149.7 Å²	149.7	32%	0.315	73%	0.727	S	S	.	*	S	Bend	trans	-91.4	-14.2	176.8	60	0	0	0	0	113.9	D364 F365 V366	S362-D364 VanDerWaalsContact C-N 3.32Å; S362-D364 PolarHBondContact O-N 2.65Å; S362-F365 PolarHBondContact O-N 3.41Å; S362-F365 VanDerWaalsContact O-N 3.15Å; S362-V366 PolarHBondContact O-N 2.8Å; S362-V366 VanDerWaalsContact O-N 3.11Å
363	A	44	Very low	41.8	Very low	58 Å²	58	147 Å²	147	48%	0.479	72%	0.715	S	S	.	*	H	α-helix	trans	-65	-32.8	-173.7	0	0	0	0	0	113.2	K367	A363-K367 PolarHBondContact O-N 2.78Å
364	D	47.7	Very low	43.5	Very low	130 Å²	130	143.2 Å²	143.2	70%	0.695	70%	0.704	S	S	*	*	H	α-helix	trans	-76.1	-29.6	176.4	-93.8	-5.2	0	0	0	112.7	S362	S362-D364 VanDerWaalsContact C-N 3.32Å; S362-D364 PolarHBondContact O-N 2.65Å
365	F	37.1	Very low	45.2	Very low	155 Å²	155	145.1 Å²	145.1	68%	0.68	70%	0.702	S	S	*	*	H	α-helix	trans	-71.7	-39.8	175.9	-170.7	-101.6	0	0	0	111.9	S362 F368	S362-F365 PolarHBondContact O-N 3.41Å; S362-F365 VanDerWaalsContact O-N 3.15Å; F365-F368 PolarHBondContact O-N 2.68Å
366	V	46.7	Very low	46.8	Very low	84 Å²	84	140.1 Å²	140.1	51%	0.509	68%	0.678	S	S	.	*	H	α-helix	trans	-73.6	-28.1	179.6	178	0	0	0	0	112	S362 F368 F369 R370	S362-V366 PolarHBondContact O-N 2.8Å; S362-V366 VanDerWaalsContact O-N 3.11Å; V366-F368 VanDerWaalsContact C-N 3.25Å; V366-F368 PolarHBondContact O-N 3.19Å; V366-F369 PolarHBondContact O-N 3.45Å; V366-R370 PolarHBondContact O-N 2.97Å; V366-R370 VanDerWaalsContact O-N 3.14Å
367	K	48.6	Very low	48.6	Very low	154 Å²	154	136 Å²	136	67%	0.67	66%	0.662	S	S	*	*	H	α-helix	trans	-62.1	-32.8	176.7	-124.8	177.7	-174.4	172	0	112.9	A363	A363-K367 PolarHBondContact O-N 2.78Å
368	F	46.4	Very low	50.7	Low	177 Å²	177	131.1 Å²	131.1	78%	0.776	64%	0.642	S	S	*	*	H	α-helix	trans	-69.6	-33.7	180	-157.5	-94.1	0	0	0	112.7	F365 V366	F365-F368 PolarHBondContact O-N 2.68Å; V366-F368 VanDerWaalsContact C-N 3.25Å; V366-F368 PolarHBondContact O-N 3.19Å
369	F	41.9	Very low	52.6	Low	138 Å²	138	124 Å²	124	61%	0.605	62%	0.617	S	S	*	*	H	α-helix	trans	-86.3	-20.2	177.6	-90.7	-86.9	0	0	0	114.2	V366 Q371 V372	V366-F369 PolarHBondContact O-N 3.45Å; F369-Q371 PolarHBondContact O-N 2.91Å; F369-Q371 VanDerWaalsContact O-N 3.11Å; F369-V372 PolarHBondContact O-N 3.37Å
370	R	46.9	Very low	54.2	Low	217 Å²	217	121.3 Å²	121.3	82%	0.819	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-7.9	179.8	-157.6	169.7	-179.9	113.7	-0.3	113.7	V366	V366-R370 PolarHBondContact O-N 2.97Å; V366-R370 VanDerWaalsContact O-N 3.14Å
371	Q	49.1	Very low	55.6	Low	177 Å²	177	115.4 Å²	115.4	83%	0.827	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	4.7	177.6	-125	159.6	7.8	0	0	114.6	F369 D373	F369-Q371 PolarHBondContact O-N 2.91Å; F369-Q371 VanDerWaalsContact O-N 3.11Å; Q371-D373 PolarHBondContact O-N 3.24Å
372	V	52.5	Low	57.6	Low	70 Å²	70	113.3 Å²	113.3	42%	0.424	57%	0.568	S	S	.	*	S	Bend	trans	-85.3	97.2	166.3	-176.4	0	0	0	0	107.4	F369 V374	F369-V372 PolarHBondContact O-N 3.37Å; V372-V374 VanDerWaalsContact C-N 3.3Å; V372-V374 PolarHBondContact O-N 3.12Å
373	D	59.5	Low	59.3	Low	103 Å²	103	113.4 Å²	113.4	55%	0.551	57%	0.572	S	S	*	*			trans	-67.5	89.8	179.1	-156	-15.9	0	0	0	109.3	Q371 H375 E376 H377	Q371-D373 PolarHBondContact O-N 3.24Å; D373-H375 PolarHBondContact O-N 3.02Å; D373-E376 HydrophobicContact CB-CB 4.38Å; D373-E376 PolarHBondContact O-N 2.7Å; D373-H377 PolarHBondContact O-N 3.17Å
374	V	62.7	Low	60.9	Low	109 Å²	109	114.5 Å²	114.5	66%	0.661	57%	0.572	S	S	*	*	H	α-helix	trans	-51.6	-31.3	-178.6	177.4	0	0	0	0	110.9	V372 E376 H377 L378	V372-V374 VanDerWaalsContact C-N 3.3Å; V372-V374 PolarHBondContact O-N 3.12Å; V374-E376 PolarHBondContact O-N 3.12Å; V374-H377 PolarHBondContact O-N 2.72Å; V374-L378 WeakPolarHBondContact O-CB 3.38Å; V374-L378 PolarHBondContact O-N 2.88Å
375	H	65.9	Low	62.4	Low	138 Å²	138	115.2 Å²	115.2	64%	0.639	57%	0.571	S	S	*	*	H	α-helix	trans	-64.6	-37.8	178.3	-169.4	-87.7	0	0	0	112.5	D373 L378 A379	D373-H375 PolarHBondContact O-N 3.02Å; H375-L378 PolarHBondContact O-N 3.45Å; H375-A379 WeakPolarHBondContact O-CB 3.26Å; H375-A379 PolarHBondContact O-N 3.46Å
376	E	66.7	Low	64.5	Low	98 Å²	98	113.6 Å²	113.6	46%	0.458	57%	0.566	S	S	.	*	H	α-helix	trans	-69.9	-41.1	178.5	-158.4	-167.4	160.4	0	0	111.3	D373 V374 A379 K380	D373-E376 HydrophobicContact CB-CB 4.38Å; D373-E376 PolarHBondContact O-N 2.7Å; V374-E376 PolarHBondContact O-N 3.12Å; E376-A379 PolarHBondContact O-N 2.95Å; E376-K380 VanDerWaalsContact CD-NZ 3.26Å; E376-K380 WeakPolarHBondContact O-CB 3.39Å; E376-K380 VanDerWaalsContact O-CG 3.27Å; E376-K380 WeakPolarHBondContact O-CG 3.48Å; E376-K380 PolarHBondContact O-N 2.74Å; E376-K380 WeakPolarHBondContact OE1-CE 3.36Å; E376-K380 IonicContact OE1-NZ 2.93Å; E376-K380 PolarHBondContact OE1-NZ 2.74Å; E376-K380 IonicContact OE2-NZ 3.65Å
377	H	67.9	Low	66	Low	110 Å²	110	116.3 Å²	116.3	51%	0.509	57%	0.573	S	S	.	*	H	α-helix	trans	-65.3	-40.7	174.7	-76.1	-80.6	0	0	0	112.1	D373 V374 K380 A381	D373-H377 PolarHBondContact O-N 3.17Å; V374-H377 PolarHBondContact O-N 2.72Å; H377-K380 PolarHBondContact O-N 3.05Å; H377-A381 WeakPolarHBondContact O-CB 3.34Å; H377-A381 PolarHBondContact O-N 3.24Å
378	L	77.9	Confident	67.1	Low	87 Å²	87	114.6 Å²	114.6	46%	0.455	57%	0.571	S	S	.	*	H	α-helix	trans	-63.6	-42.2	175.1	-169.6	103.9	0	0	0	111.5	V374 H375 A381 K382	V374-L378 WeakPolarHBondContact O-CB 3.38Å; V374-L378 PolarHBondContact O-N 2.88Å; H375-L378 PolarHBondContact O-N 3.45Å; L378-A381 PolarHBondContact O-N 2.82Å; L378-K382 HydrophobicContact CD2-CD 4.36Å; L378-K382 WeakPolarHBondContact O-CG 3.43Å; L378-K382 PolarHBondContact O-N 3.09Å
379	A	75.6	Confident	68.6	Low	49 Å²	49	109.3 Å²	109.3	41%	0.405	56%	0.556	S	S	.	*	H	α-helix	trans	-63.4	-43.1	175.7	0	0	0	0	0	111.7	H375 E376 K382 A383	H375-A379 WeakPolarHBondContact O-CB 3.26Å; H375-A379 PolarHBondContact O-N 3.46Å; E376-A379 PolarHBondContact O-N 2.95Å; A379-K382 PolarHBondContact O-N 3.18Å; A379-A383 WeakPolarHBondContact O-CB 3.25Å; A379-A383 PolarHBondContact O-N 3.04Å
380	K	73	Confident	70.1	Confident	104 Å²	104	109.4 Å²	109.4	45%	0.452	56%	0.556	S	S	.	*	H	α-helix	trans	-61.5	-44.6	174	-73.1	169	-176.5	165.9	0	111.5	E376 H377 K382 A383 V384	E376-K380 VanDerWaalsContact CD-NZ 3.26Å; E376-K380 WeakPolarHBondContact O-CB 3.39Å; E376-K380 VanDerWaalsContact O-CG 3.27Å; E376-K380 WeakPolarHBondContact O-CG 3.48Å; E376-K380 PolarHBondContact O-N 2.74Å; E376-K380 WeakPolarHBondContact OE1-CE 3.36Å; E376-K380 IonicContact OE1-NZ 2.93Å; E376-K380 PolarHBondContact OE1-NZ 2.74Å; E376-K380 IonicContact OE2-NZ 3.65Å; H377-K380 PolarHBondContact O-N 3.05Å; K380-K382 PolarHBondContact O-N 3.04Å; K380-A383 PolarHBondContact O-N 2.96Å; K380-V384 WeakPolarHBondContact O-CG2 3.38Å; K380-V384 PolarHBondContact O-N 3.11Å
381	A	72.8	Confident	71.1	Confident	59 Å²	59	106.2 Å²	106.2	49%	0.488	55%	0.548	S	S	.	.	H	α-helix	trans	-61.7	-44.4	177.2	0	0	0	0	0	112.1	H377 L378 A383 V384 Q385	H377-A381 WeakPolarHBondContact O-CB 3.34Å; H377-A381 PolarHBondContact O-N 3.24Å; L378-A381 PolarHBondContact O-N 2.82Å; A381-A383 PolarHBondContact O-N 3.45Å; A381-V384 PolarHBondContact O-N 3.27Å; A381-Q385 PolarHBondContact O-N 2.68Å
382	K	82.6	Confident	71.9	Confident	118 Å²	118	99.3 Å²	99.3	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-61.5	-41.5	174.5	-74	177.3	178.8	179.6	0	112.1	L378 A379 K380 Q385 Q386	L378-K382 HydrophobicContact CD2-CD 4.36Å; L378-K382 WeakPolarHBondContact O-CG 3.43Å; L378-K382 PolarHBondContact O-N 3.09Å; A379-K382 PolarHBondContact O-N 3.18Å; K380-K382 PolarHBondContact O-N 3.04Å; K382-Q385 PolarHBondContact O-N 2.91Å; K382-Q386 WeakPolarHBondContact O-CG 3.27Å; K382-Q386 PolarHBondContact O-N 3.42Å
383	A	80.6	Confident	72.5	Confident	47 Å²	47	101.6 Å²	101.6	39%	0.388	53%	0.529	S	S	.	.	H	α-helix	trans	-63.9	-42.7	176.7	0	0	0	0	0	112	A379 K380 A381 Q386 Q387	A379-A383 WeakPolarHBondContact O-CB 3.25Å; A379-A383 PolarHBondContact O-N 3.04Å; K380-A383 PolarHBondContact O-N 2.96Å; A381-A383 PolarHBondContact O-N 3.45Å; A383-Q386 PolarHBondContact O-N 2.77Å; A383-Q387 WeakPolarHBondContact O-CG 3.5Å; A383-Q387 PolarHBondContact O-N 3.37Å
384	V	77.6	Confident	72.9	Confident	81 Å²	81	102.1 Å²	102.1	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-61.8	-44.7	175.1	171.6	0	0	0	0	111	K380 A381 Q386 Q387 L388	K380-V384 WeakPolarHBondContact O-CG2 3.38Å; K380-V384 PolarHBondContact O-N 3.11Å; A381-V384 PolarHBondContact O-N 3.27Å; V384-Q386 PolarHBondContact O-N 3.45Å; V384-Q387 PolarHBondContact O-N 3.24Å; V384-L388 HydrophobicContact CG1-CD1 4.12Å; V384-L388 PolarHBondContact O-N 3.44Å
385	Q	77.9	Confident	72.7	Confident	145 Å²	145	99.5 Å²	99.5	68%	0.678	52%	0.518	S	S	*	.	H	α-helix	trans	-60.3	-43.4	177.1	-171.7	-179.9	-1.9	0	0	112	A381 K382 L388 S389	A381-Q385 PolarHBondContact O-N 2.68Å; K382-Q385 PolarHBondContact O-N 2.91Å; Q385-L388 PolarHBondContact O-N 3.36Å; Q385-S389 PolarHBondContact O-N 3.26Å
386	Q	80.7	Confident	72.7	Confident	120 Å²	120	100.6 Å²	100.6	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-63.1	-42.4	175.2	-72.5	177.7	9.2	0	0	111.9	K382 A383 V384 S389 K390	K382-Q386 WeakPolarHBondContact O-CG 3.27Å; K382-Q386 PolarHBondContact O-N 3.42Å; A383-Q386 PolarHBondContact O-N 2.77Å; V384-Q386 PolarHBondContact O-N 3.45Å; Q386-S389 PolarHBondContact O-N 3.46Å; Q386-S389 PolarHBondContact O-OG 2.89Å; Q386-K390 WeakPolarHBondContact O-CG 3.26Å; Q386-K390 PolarHBondContact O-N 3Å
387	Q	78.2	Confident	73	Confident	141 Å²	141	99.6 Å²	99.6	66%	0.659	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-41.3	176.2	-74	-167.2	-18.1	0	0	112.3	A383 V384 S389 K390 F391	A383-Q387 WeakPolarHBondContact O-CG 3.5Å; A383-Q387 PolarHBondContact O-N 3.37Å; V384-Q387 PolarHBondContact O-N 3.24Å; Q387-S389 VanDerWaalsContact C-N 3.33Å; Q387-S389 PolarHBondContact O-N 2.78Å; Q387-K390 PolarHBondContact O-N 3.3Å; Q387-F391 PolarHBondContact O-N 2.72Å
388	L	73.3	Confident	72.9	Confident	119 Å²	119	101.7 Å²	101.7	62%	0.623	52%	0.52	S	S	*	.	H	α-helix	trans	-59.9	-43.8	176.3	-121.2	112	0	0	0	111.6	V384 Q385 K390 F391 A392	V384-L388 HydrophobicContact CG1-CD1 4.12Å; V384-L388 PolarHBondContact O-N 3.44Å; Q385-L388 PolarHBondContact O-N 3.36Å; L388-K390 VanDerWaalsContact C-N 3.34Å; L388-K390 PolarHBondContact O-N 3.2Å; L388-F391 PolarHBondContact O-N 2.8Å; L388-A392 WeakPolarHBondContact O-CB 3.49Å; L388-A392 PolarHBondContact O-N 3.31Å
389	S	76.8	Confident	72.4	Confident	66 Å²	66	99.7 Å²	99.7	46%	0.462	52%	0.516	S	S	.	.	H	α-helix	trans	-61.1	-41.4	177.9	76.6	0	0	0	0	112.4	Q385 Q386 Q387 A392 M393	Q385-S389 PolarHBondContact O-N 3.26Å; Q386-S389 PolarHBondContact O-N 3.46Å; Q386-S389 PolarHBondContact O-OG 2.89Å; Q387-S389 VanDerWaalsContact C-N 3.33Å; Q387-S389 PolarHBondContact O-N 2.78Å; S389-A392 PolarHBondContact O-N 3.21Å; S389-M393 PolarHBondContact O-N 2.84Å; S389-M393 VanDerWaalsContact O-N 3.14Å
390	K	73.8	Confident	72.2	Confident	139 Å²	139	104.7 Å²	104.7	60%	0.604	53%	0.529	S	S	*	.	H	α-helix	trans	-66.2	-42.6	176.7	-70.1	177.1	-177.4	178.5	0	111.6	Q386 Q387 L388 M393 L394	Q386-K390 WeakPolarHBondContact O-CG 3.26Å; Q386-K390 PolarHBondContact O-N 3Å; Q387-K390 PolarHBondContact O-N 3.3Å; L388-K390 VanDerWaalsContact C-N 3.34Å; L388-K390 PolarHBondContact O-N 3.2Å; K390-M393 PolarHBondContact O-N 2.92Å; K390-L394 WeakPolarHBondContact O-CG 3.49Å; K390-L394 PolarHBondContact O-N 3.22Å
391	F	67.4	Low	72.2	Confident	150 Å²	150	102.7 Å²	102.7	66%	0.658	53%	0.532	S	S	*	.	H	α-helix	trans	-65.1	-39.8	177.2	-174.7	-97.5	0	0	0	112.3	Q387 L388 M393 L394 S395	Q387-F391 PolarHBondContact O-N 2.72Å; L388-F391 PolarHBondContact O-N 2.8Å; F391-M393 VanDerWaalsContact C-N 3.32Å; F391-M393 PolarHBondContact O-N 2.88Å; F391-L394 PolarHBondContact O-N 3.28Å; F391-S395 WeakPolarHBondContact O-CB 3.31Å; F391-S395 PolarHBondContact O-N 3.02Å; F391-S395 PolarHBondContact O-OG 3.33Å
392	A	65.6	Low	72	Confident	32 Å²	32	106.2 Å²	106.2	26%	0.264	54%	0.536	S	S	.	.	H	α-helix	trans	-61.4	-39	174.8	0	0	0	0	0	112.2	L388 S389 S395 R396	L388-A392 WeakPolarHBondContact O-CB 3.49Å; L388-A392 PolarHBondContact O-N 3.31Å; S389-A392 PolarHBondContact O-N 3.21Å; A392-S395 WeakPolarHBondContact CA-OG 3.42Å; A392-S395 PolarHBondContact O-OG 3.17Å; A392-R396 WeakPolarHBondContact O-CB 3.45Å; A392-R396 WeakPolarHBondContact O-CG 3.46Å; A392-R396 PolarHBondContact O-N 3.39Å; A392-R396 VanDerWaalsContact O-N 3.16Å
393	M	66.3	Low	71.5	Confident	118 Å²	118	106.2 Å²	106.2	58%	0.581	54%	0.54	S	S	*	.	H	α-helix	trans	-67.4	-44.9	174.8	-74.4	-67.5	-83.6	0	0	112.3	S389 K390 F391 R396 T397	S389-M393 PolarHBondContact O-N 2.84Å; S389-M393 VanDerWaalsContact O-N 3.14Å; K390-M393 PolarHBondContact O-N 2.92Å; F391-M393 VanDerWaalsContact C-N 3.32Å; F391-M393 PolarHBondContact O-N 2.88Å; M393-R396 PolarHBondContact O-N 3.22Å; M393-T397 WeakPolarHBondContact O-CG2 3.4Å; M393-T397 PolarHBondContact O-N 2.82Å; M393-T397 PolarHBondContact O-OG1 3.12Å
394	L	67.6	Low	71.4	Confident	115 Å²	115	107.6 Å²	107.6	60%	0.602	55%	0.547	S	S	*	.	H	α-helix	trans	-65.8	-38.6	178.7	-73.1	170.5	0	0	0	113.1	K390 F391 T397 R398	K390-L394 WeakPolarHBondContact O-CG 3.49Å; K390-L394 PolarHBondContact O-N 3.22Å; F391-L394 PolarHBondContact O-N 3.28Å; L394-T397 WeakPolarHBondContact CA-OG1 3.43Å; L394-T397 PolarHBondContact O-OG1 3.24Å; L394-R398 VanDerWaalsContact O-CB 3.26Å; L394-R398 WeakPolarHBondContact O-CB 3.32Å; L394-R398 PolarHBondContact O-N 3.23Å
395	S	57.9	Low	71.4	Confident	54 Å²	54	111.6 Å²	111.6	38%	0.378	56%	0.558	S	S	.	*	H	α-helix	trans	-66.4	-42.8	176.5	49.5	0	0	0	0	111.4	F391 A392 R398 A399	F391-S395 WeakPolarHBondContact O-CB 3.31Å; F391-S395 PolarHBondContact O-N 3.02Å; F391-S395 PolarHBondContact O-OG 3.33Å; A392-S395 WeakPolarHBondContact CA-OG 3.42Å; A392-S395 PolarHBondContact O-OG 3.17Å; S395-R398 PolarHBondContact O-N 2.86Å; S395-A399 WeakPolarHBondContact O-CB 3.46Å; S395-A399 PolarHBondContact O-N 3.47Å
396	R	67.2	Low	71.1	Confident	160 Å²	160	108.6 Å²	108.6	60%	0.604	55%	0.552	S	S	*	*	H	α-helix	trans	-61.8	-44.8	173.4	-75.5	176.3	-172.8	146.5	1	112.8	A392 M393 A399 K400	A392-R396 WeakPolarHBondContact O-CB 3.45Å; A392-R396 WeakPolarHBondContact O-CG 3.46Å; A392-R396 PolarHBondContact O-N 3.39Å; A392-R396 VanDerWaalsContact O-N 3.16Å; M393-R396 PolarHBondContact O-N 3.22Å; R396-A399 PolarHBondContact O-N 3.12Å; R396-K400 WeakPolarHBondContact O-CB 3.43Å; R396-K400 VanDerWaalsContact O-CG 3.29Å; R396-K400 WeakPolarHBondContact O-CG 3.33Å; R396-K400 PolarHBondContact O-N 3Å
397	T	71.3	Confident	70.9	Confident	78 Å²	78	107 Å²	107	48%	0.479	54%	0.544	S	S	.	.	H	α-helix	trans	-67.4	-40.1	179.1	55.9	0	0	0	0	111.8	M393 L394 K400 A401	M393-T397 WeakPolarHBondContact O-CG2 3.4Å; M393-T397 PolarHBondContact O-N 2.82Å; M393-T397 PolarHBondContact O-OG1 3.12Å; L394-T397 WeakPolarHBondContact CA-OG1 3.43Å; L394-T397 PolarHBondContact O-OG1 3.24Å; T397-K400 PolarHBondContact O-N 3.45Å; T397-A401 WeakPolarHBondContact O-CB 3.25Å; T397-A401 PolarHBondContact O-N 3.38Å
398	R	67.7	Low	71	Confident	154 Å²	154	102.9 Å²	102.9	58%	0.581	53%	0.531	S	S	*	.	H	α-helix	trans	-65.1	-40.6	175.5	-169.2	178	-176.9	87.3	-4.3	112.1	L394 S395 K402	L394-R398 VanDerWaalsContact O-CB 3.26Å; L394-R398 WeakPolarHBondContact O-CB 3.32Å; L394-R398 PolarHBondContact O-N 3.23Å; S395-R398 PolarHBondContact O-N 2.86Å; R398-K402 WeakPolarHBondContact O-CG 3.35Å; R398-K402 PolarHBondContact O-N 3.1Å
399	A	65.6	Low	71.2	Confident	45 Å²	45	100 Å²	100	37%	0.372	53%	0.525	S	S	.	.	H	α-helix	trans	-63.8	-49.3	174.4	0	0	0	0	0	111.2	S395 R396 A401 K402 I403	S395-A399 WeakPolarHBondContact O-CB 3.46Å; S395-A399 PolarHBondContact O-N 3.47Å; R396-A399 PolarHBondContact O-N 3.12Å; A399-A401 VanDerWaalsContact C-N 3.33Å; A399-A401 PolarHBondContact O-N 3.49Å; A399-K402 PolarHBondContact O-N 2.94Å; A399-I403 VanDerWaalsContact O-CG1 3.29Å; A399-I403 WeakPolarHBondContact O-CG1 3.46Å; A399-I403 PolarHBondContact O-N 3.41Å
400	K	72.5	Confident	71.3	Confident	153 Å²	153	100 Å²	100	67%	0.665	52%	0.521	S	S	*	.	H	α-helix	trans	-56.9	-43.1	175.6	-75.4	179.7	177.3	-172.2	0	112.4	R396 T397 I403 S404	R396-K400 WeakPolarHBondContact O-CB 3.43Å; R396-K400 VanDerWaalsContact O-CG 3.29Å; R396-K400 WeakPolarHBondContact O-CG 3.33Å; R396-K400 PolarHBondContact O-N 3Å; T397-K400 PolarHBondContact O-N 3.45Å; K400-I403 PolarHBondContact O-N 3.05Å; K400-S404 VanDerWaalsContact O-CB 3.26Å; K400-S404 WeakPolarHBondContact O-CB 3.33Å; K400-S404 PolarHBondContact O-N 3.26Å
401	A	71.9	Confident	71.6	Confident	62 Å²	62	94.4 Å²	94.4	51%	0.512	50%	0.5	S	S	.	.	H	α-helix	trans	-65.8	-40.4	178.1	0	0	0	0	0	112.7	T397 A399 K405	T397-A401 WeakPolarHBondContact O-CB 3.25Å; T397-A401 PolarHBondContact O-N 3.38Å; A399-A401 VanDerWaalsContact C-N 3.33Å; A399-A401 PolarHBondContact O-N 3.49Å; A401-K405 WeakPolarHBondContact O-CB 3.34Å; A401-K405 PolarHBondContact O-N 2.95Å
402	K	69.1	Low	72.3	Confident	134 Å²	134	93.3 Å²	93.3	58%	0.583	50%	0.495	S	S	*	.	H	α-helix	trans	-63.8	-47.6	174.2	-75.9	-179.7	176.2	-173	0	111.4	R398 A399 S404 K405 C406	R398-K402 WeakPolarHBondContact O-CG 3.35Å; R398-K402 PolarHBondContact O-N 3.1Å; A399-K402 PolarHBondContact O-N 2.94Å; K402-S404 VanDerWaalsContact C-N 3.34Å; K402-S404 PolarHBondContact O-N 3.45Å; K402-K405 PolarHBondContact O-N 3.31Å; K402-C406 PolarHBondContact O-N 3.41Å; K402-C406 PolarHBondContact O-SG 2.85Å; K402-C406 VanDerWaalsContact O-SG 3.33Å
403	I	71.9	Confident	73.1	Confident	117 Å²	117	96.7 Å²	96.7	60%	0.6	51%	0.507	S	S	*	.	H	α-helix	trans	-60	-45.4	177.7	-67.6	163.4	0	0	0	110.4	A399 K400 K405 C406 H407	A399-I403 VanDerWaalsContact O-CG1 3.29Å; A399-I403 WeakPolarHBondContact O-CG1 3.46Å; A399-I403 PolarHBondContact O-N 3.41Å; K400-I403 PolarHBondContact O-N 3.05Å; I403-K405 VanDerWaalsContact C-N 3.33Å; I403-K405 PolarHBondContact O-N 2.87Å; I403-C406 WeakPolarHBondContact O-CB 3.36Å; I403-C406 PolarHBondContact O-N 3.4Å; I403-H407 WeakPolarHBondContact O-CB 3.42Å; I403-H407 PolarHBondContact O-N 3.04Å
404	S	78.6	Confident	73.9	Confident	76 Å²	76	93.5 Å²	93.5	53%	0.531	49%	0.491	S	S	.	.	H	α-helix	trans	-59.9	-40.8	175.9	176.3	0	0	0	0	112.4	K400 K402 H407 S408	K400-S404 VanDerWaalsContact O-CB 3.26Å; K400-S404 WeakPolarHBondContact O-CB 3.33Å; K400-S404 PolarHBondContact O-N 3.26Å; K402-S404 VanDerWaalsContact C-N 3.34Å; K402-S404 PolarHBondContact O-N 3.45Å; S404-H407 PolarHBondContact O-N 2.98Å; S404-S408 WeakPolarHBondContact O-CB 3.45Å; S404-S408 PolarHBondContact O-N 3.32Å
405	K	78.9	Confident	74.6	Confident	166 Å²	166	90.2 Å²	90.2	72%	0.722	48%	0.475	S	S	*	.	H	α-helix	trans	-65.1	-42.3	174.8	-168.6	178.8	-178.2	-177.3	0	112.1	A401 K402 I403 S408 A409	A401-K405 WeakPolarHBondContact O-CB 3.34Å; A401-K405 PolarHBondContact O-N 2.95Å; K402-K405 PolarHBondContact O-N 3.31Å; I403-K405 VanDerWaalsContact C-N 3.33Å; I403-K405 PolarHBondContact O-N 2.87Å; K405-S408 PolarHBondContact O-N 3.36Å; K405-A409 PolarHBondContact O-N 3.14Å
406	C	70.2	Confident	75.8	Confident	82 Å²	82	93.6 Å²	93.6	55%	0.554	49%	0.485	S	S	*	.	H	α-helix	trans	-62.3	-45.9	174.2	-65.7	0	0	0	0	111.1	K402 I403 S408 A409 V410	K402-C406 PolarHBondContact O-N 3.41Å; K402-C406 PolarHBondContact O-SG 2.85Å; K402-C406 VanDerWaalsContact O-SG 3.33Å; I403-C406 WeakPolarHBondContact O-CB 3.36Å; I403-C406 PolarHBondContact O-N 3.4Å; C406-S408 VanDerWaalsContact C-N 3.34Å; C406-S408 PolarHBondContact O-N 2.72Å; C406-A409 PolarHBondContact O-N 3.05Å; C406-A409 VanDerWaalsContact O-N 3.14Å; C406-V410 WeakPolarHBondContact O-CG2 3.41Å; C406-V410 PolarHBondContact O-N 3.45Å
407	H	77.7	Confident	76.5	Confident	86 Å²	86	90.9 Å²	90.9	40%	0.398	48%	0.48	S	S	.	.	H	α-helix	trans	-58.8	-43.8	176.4	-177	-79.7	0	0	0	111.8	I403 S404 A409 V410 S411 L479	I403-H407 WeakPolarHBondContact O-CB 3.42Å; I403-H407 PolarHBondContact O-N 3.04Å; S404-H407 PolarHBondContact O-N 2.98Å; H407-A409 PolarHBondContact O-N 3.27Å; H407-V410 PolarHBondContact O-N 3.32Å; H407-S411 VanDerWaalsContact O-CB 3.28Å; H407-S411 WeakPolarHBondContact O-CB 3.4Å; H407-S411 PolarHBondContact O-N 3.19Å; H407-L479 VanDerWaalsContact NE2-CB 3.31Å; H407-L479 WeakPolarHBondContact NE2-CB 3.37Å
408	S	79	Confident	76.9	Confident	54 Å²	54	88.3 Å²	88.3	38%	0.378	46%	0.463	S	S	.	.	H	α-helix	trans	-63.9	-39.3	175	-178.4	0	0	0	0	112.5	S404 K405 C406 K412	S404-S408 WeakPolarHBondContact O-CB 3.45Å; S404-S408 PolarHBondContact O-N 3.32Å; K405-S408 PolarHBondContact O-N 3.36Å; C406-S408 VanDerWaalsContact C-N 3.34Å; C406-S408 PolarHBondContact O-N 2.72Å; S408-K412 VanDerWaalsContact O-CG 3.28Å; S408-K412 WeakPolarHBondContact O-CG 3.27Å; S408-K412 PolarHBondContact O-N 3.22Å; S408-K412 VanDerWaalsContact O-N 3.09Å
409	A	78.3	Confident	77.6	Confident	59 Å²	59	85.2 Å²	85.2	49%	0.488	46%	0.461	S	S	.	.	H	α-helix	trans	-66.7	-44.5	176.6	0	0	0	0	0	112	K405 C406 H407 K412 M413	K405-A409 PolarHBondContact O-N 3.14Å; C406-A409 PolarHBondContact O-N 3.05Å; C406-A409 VanDerWaalsContact O-N 3.14Å; H407-A409 PolarHBondContact O-N 3.27Å; A409-K412 PolarHBondContact O-N 2.93Å; A409-M413 PolarHBondContact O-N 3.34Å
410	V	78.4	Confident	78.1	Confident	65 Å²	65	86.7 Å²	86.7	39%	0.394	46%	0.463	S	S	.	.	H	α-helix	trans	-64	-44.9	176.6	172.7	0	0	0	0	111	C406 H407 K412 M413 L414 L479	C406-V410 WeakPolarHBondContact O-CG2 3.41Å; C406-V410 PolarHBondContact O-N 3.45Å; H407-V410 PolarHBondContact O-N 3.32Å; V410-K412 VanDerWaalsContact C-N 3.3Å; V410-K412 PolarHBondContact O-N 3.22Å; V410-M413 PolarHBondContact O-N 3.45Å; V410-L414 HydrophobicContact CG1-CD1 3.97Å; V410-L414 HydrophobicContact CG1-CG 4.37Å; V410-L414 WeakPolarHBondContact O-CG 3.45Å; V410-L414 PolarHBondContact O-N 2.9Å; V410-L479 HydrophobicContact CG1-CD1 4.33Å
411	S	81.2	Confident	78.4	Confident	22 Å²	22	81.6 Å²	81.6	15%	0.154	44%	0.441	C	S	.	.	H	α-helix	trans	-58.5	-41.1	176.2	-175.4	0	0	0	0	112	H407 L414 D415	H407-S411 VanDerWaalsContact O-CB 3.28Å; H407-S411 WeakPolarHBondContact O-CB 3.4Å; H407-S411 PolarHBondContact O-N 3.19Å; S411-L414 PolarHBondContact O-N 2.89Å; S411-D415 PolarHBondContact O-N 3.08Å
412	K	82.4	Confident	78.7	Confident	128 Å²	128	79.6 Å²	79.6	56%	0.557	42%	0.422	S	S	*	.	H	α-helix	trans	-66.3	-43.1	176.2	-74.2	174.4	-174.9	-175.6	0	112.5	S408 A409 V410 L414 D415 E416	S408-K412 VanDerWaalsContact O-CG 3.28Å; S408-K412 WeakPolarHBondContact O-CG 3.27Å; S408-K412 PolarHBondContact O-N 3.22Å; S408-K412 VanDerWaalsContact O-N 3.09Å; A409-K412 PolarHBondContact O-N 2.93Å; V410-K412 VanDerWaalsContact C-N 3.3Å; V410-K412 PolarHBondContact O-N 3.22Å; K412-L414 VanDerWaalsContact C-N 3.31Å; K412-L414 PolarHBondContact O-N 3.11Å; K412-D415 PolarHBondContact O-N 3.32Å; K412-E416 WeakPolarHBondContact O-CG 3.47Å; K412-E416 PolarHBondContact O-N 3.18Å
413	M	81.6	Confident	79.2	Confident	103 Å²	103	79 Å²	79	51%	0.507	42%	0.422	S	S	.	.	H	α-helix	trans	-60	-43.5	175.7	-176.7	-169.8	75	0	0	110.8	A409 V410 E416 M417	A409-M413 PolarHBondContact O-N 3.34Å; V410-M413 PolarHBondContact O-N 3.45Å; M413-E416 PolarHBondContact O-N 3.1Å; M413-M417 VanDerWaalsContact O-CG 3.29Å; M413-M417 WeakPolarHBondContact O-CG 3.38Å; M413-M417 PolarHBondContact O-N 2.64Å
414	L	83.2	Confident	79.3	Confident	50 Å²	50	78.2 Å²	78.2	26%	0.262	42%	0.419	S	S	.	.	H	α-helix	trans	-64.9	-42.1	176.6	-70.4	171.2	0	0	0	112.2	V410 S411 K412 E416 M417 L418 L479 Y482	V410-L414 HydrophobicContact CG1-CD1 3.97Å; V410-L414 HydrophobicContact CG1-CG 4.37Å; V410-L414 WeakPolarHBondContact O-CG 3.45Å; V410-L414 PolarHBondContact O-N 2.9Å; S411-L414 PolarHBondContact O-N 2.89Å; K412-L414 VanDerWaalsContact C-N 3.31Å; K412-L414 PolarHBondContact O-N 3.11Å; L414-E416 PolarHBondContact O-N 3.04Å; L414-M417 PolarHBondContact O-N 2.75Å; L414-L418 WeakPolarHBondContact O-CG 3.48Å; L414-L418 PolarHBondContact O-N 2.99Å; L414-L479 HydrophobicContact CD1-CD1 3.68Å; L414-Y482 HydrophobicContact CB-CD1 4.09Å; L414-Y482 HydrophobicContact CB-CE1 3.51Å; L414-Y482 HydrophobicContact CB-CE2 4.47Å; L414-Y482 HydrophobicContact CD1-CD1 4.32Å; L414-Y482 HydrophobicContact CD1-CD2 4.45Å; L414-Y482 HydrophobicContact CD1-CE1 4.44Å; L414-Y482 HydrophobicContact CD1-CG 4.3Å; L414-Y482 HydrophobicContact CG-CE1 4.47Å
415	D	82.6	Confident	79.2	Confident	47 Å²	47	75.6 Å²	75.6	25%	0.251	40%	0.398	S	S	.	.	H	α-helix	trans	-59.6	-45.7	173.2	-82.3	-46.6	0	0	0	110.7	S411 K412 M417 L418 T419 Y482	S411-D415 PolarHBondContact O-N 3.08Å; K412-D415 PolarHBondContact O-N 3.32Å; D415-M417 VanDerWaalsContact C-N 3.35Å; D415-M417 PolarHBondContact O-N 3.14Å; D415-L418 PolarHBondContact O-N 3.41Å; D415-T419 WeakPolarHBondContact O-CG2 3.24Å; D415-T419 PolarHBondContact O-N 2.86Å; D415-Y482 PolarHBondContact N-OH 3.31Å; D415-Y482 PolarHBondContact OD1-OH 3.29Å
416	E	83.5	Confident	79	Confident	125 Å²	125	70.8 Å²	70.8	58%	0.584	39%	0.386	S	S	*	.	H	α-helix	trans	-60.7	-41.8	176.5	-76.8	175.4	-169.1	0	0	111.8	K412 M413 L414 T419 L420	K412-E416 WeakPolarHBondContact O-CG 3.47Å; K412-E416 PolarHBondContact O-N 3.18Å; M413-E416 PolarHBondContact O-N 3.1Å; L414-E416 PolarHBondContact O-N 3.04Å; E416-T419 WeakPolarHBondContact CA-OG1 3.36Å; E416-T419 PolarHBondContact O-N 3.43Å; E416-T419 PolarHBondContact O-OG1 3.24Å; E416-L420 PolarHBondContact O-N 3.41Å
417	M	80.5	Confident	79.3	Confident	103 Å²	103	77.3 Å²	77.3	51%	0.507	40%	0.398	S	S	.	.	H	α-helix	trans	-63.2	-42.2	174.8	-69	-61.7	96.4	0	0	112.5	M413 L414 D415 T419 L420 E421	M413-M417 VanDerWaalsContact O-CG 3.29Å; M413-M417 WeakPolarHBondContact O-CG 3.38Å; M413-M417 PolarHBondContact O-N 2.64Å; L414-M417 PolarHBondContact O-N 2.75Å; D415-M417 VanDerWaalsContact C-N 3.35Å; D415-M417 PolarHBondContact O-N 3.14Å; M417-T419 VanDerWaalsContact C-N 3.31Å; M417-T419 PolarHBondContact O-N 2.9Å; M417-L420 HydrophobicContact CE-CD2 4.4Å; M417-L420 WeakPolarHBondContact O-CB 3.46Å; M417-L420 PolarHBondContact O-N 2.96Å; M417-E421 PolarHBondContact O-N 3.2Å
418	L	80.2	Confident	79.2	Confident	24 Å²	24	77.8 Å²	77.8	13%	0.126	40%	0.404	C	S	.	.	H	α-helix	trans	-63.5	-36.5	174.5	-73.4	-177.4	0	0	0	112	L414 D415 L420 E421 D422 Y482	L414-L418 WeakPolarHBondContact O-CG 3.48Å; L414-L418 PolarHBondContact O-N 2.99Å; D415-L418 PolarHBondContact O-N 3.41Å; L418-L420 VanDerWaalsContact C-N 3.34Å; L418-E421 VanDerWaalsContact CD2-OE2 3.29Å; L418-E421 WeakPolarHBondContact CD2-OE2 3.07Å; L418-E421 WeakPolarHBondContact O-CB 3.21Å; L418-E421 PolarHBondContact O-N 3.17Å; L418-D422 PolarHBondContact O-N 2.92Å; L418-Y482 HydrophobicContact CD1-CD1 4Å; L418-Y482 HydrophobicContact CD1-CE1 3.3Å; L418-Y482 HydrophobicContact CG-CE1 3.94Å
419	T	81.6	Confident	79.1	Confident	88 Å²	88	80.5 Å²	80.5	54%	0.54	42%	0.42	S	S	.	.	H	α-helix	trans	-67.7	-35.8	175.4	63.2	0	0	0	0	112.5	D415 E416 M417 M423	D415-T419 WeakPolarHBondContact O-CG2 3.24Å; D415-T419 PolarHBondContact O-N 2.86Å; E416-T419 WeakPolarHBondContact CA-OG1 3.36Å; E416-T419 PolarHBondContact O-N 3.43Å; E416-T419 PolarHBondContact O-OG1 3.24Å; M417-T419 VanDerWaalsContact C-N 3.31Å; M417-T419 PolarHBondContact O-N 2.9Å; T419-M423 WeakPolarHBondContact O-CB 3.49Å; T419-M423 PolarHBondContact O-N 3.28Å
420	L	76.4	Confident	78.5	Confident	77 Å²	77	86.5 Å²	86.5	40%	0.403	44%	0.435	S	S	.	.	H	α-helix	trans	-67.1	-42.4	173.8	-179.1	62.1	0	0	0	110.8	E416 M417 L418 M423 L424	E416-L420 PolarHBondContact O-N 3.41Å; M417-L420 HydrophobicContact CE-CD2 4.4Å; M417-L420 WeakPolarHBondContact O-CB 3.46Å; M417-L420 PolarHBondContact O-N 2.96Å; L418-L420 VanDerWaalsContact C-N 3.34Å; L420-M423 WeakPolarHBondContact O-CB 3.42Å; L420-M423 PolarHBondContact O-N 3.03Å; L420-L424 HydrophobicContact CD1-CG 4.49Å; L420-L424 HydrophobicContact CG-CD1 4.25Å; L420-L424 VanDerWaalsContact O-CG 3.31Å; L420-L424 WeakPolarHBondContact O-CG 3.16Å; L420-L424 PolarHBondContact O-N 3.07Å
421	E	78.7	Confident	78.1	Confident	45 Å²	45	84.2 Å²	84.2	21%	0.21	42%	0.422	C	S	.	.	H	α-helix	trans	-56.6	-50.7	173.6	-175	-168.3	-167.5	0	0	111.4	M417 L418 M423 L424 F425 R474 L489	M417-E421 PolarHBondContact O-N 3.2Å; L418-E421 VanDerWaalsContact CD2-OE2 3.29Å; L418-E421 WeakPolarHBondContact CD2-OE2 3.07Å; L418-E421 WeakPolarHBondContact O-CB 3.21Å; L418-E421 PolarHBondContact O-N 3.17Å; E421-M423 VanDerWaalsContact C-N 3.25Å; E421-M423 PolarHBondContact O-N 3.3Å; E421-L424 PolarHBondContact O-N 3.46Å; E421-L424 VanDerWaalsContact O-N 3.12Å; E421-F425 HydrophobicContact CG-CD2 3.91Å; E421-F425 HydrophobicContact CG-CE1 4.33Å; E421-F425 HydrophobicContact CG-CE2 3.34Å; E421-F425 HydrophobicContact CG-CZ 3.58Å; E421-F425 WeakPolarHBondContact O-CG 3.18Å; E421-F425 PolarHBondContact O-N 3Å; E421-F425 WeakPolarHBondContact OE1-CE2 3.38Å; E421-F425 VanDerWaalsContact OE1-CZ 3.23Å; E421-F425 WeakPolarHBondContact OE1-CZ 3.46Å; E421-R474 IonicContact OE2-NH1 2.67Å; E421-L489 WeakPolarHBondContact OE1-CD1 3.44Å; E421-L489 WeakPolarHBondContact OE2-CD1 3.23Å
422	D	80	Confident	77.5	Confident	20 Å²	20	84.8 Å²	84.8	11%	0.107	43%	0.428	C	S	.	.	H	α-helix	trans	-59.3	-37.3	177.4	-103.5	-27.8	0	0	0	111.9	L418 S426 S435 T436	L418-D422 PolarHBondContact O-N 2.92Å; D422-S426 WeakPolarHBondContact O-CB 3.4Å; D422-S426 PolarHBondContact O-N 3.03Å; D422-S435 PolarHBondContact O-OG 3.29Å; D422-S435 WeakPolarHBondContact OD1-CA 3.4Å; D422-T436 PolarHBondContact OD1-N 3.06Å; D422-T436 PolarHBondContact OD2-OG1 3.4Å
423	M	78.7	Confident	77.1	Confident	121 Å²	121	86.2 Å²	86.2	60%	0.596	44%	0.441	S	S	*	.	H	α-helix	trans	-66.9	-43.5	175.7	-169.4	-170	-54.5	0	0	111.6	T419 L420 E421 S426 R427	T419-M423 WeakPolarHBondContact O-CB 3.49Å; T419-M423 PolarHBondContact O-N 3.28Å; L420-M423 WeakPolarHBondContact O-CB 3.42Å; L420-M423 PolarHBondContact O-N 3.03Å; E421-M423 VanDerWaalsContact C-N 3.25Å; E421-M423 PolarHBondContact O-N 3.3Å; M423-S426 PolarHBondContact O-N 3.48Å; M423-S426 PolarHBondContact O-OG 3.36Å; M423-R427 PolarHBondContact O-N 3.29Å
424	L	74.7	Confident	76.3	Confident	101 Å²	101	82.5 Å²	82.5	53%	0.529	42%	0.423	S	S	.	.	H	α-helix	trans	-65.5	-40.4	177.4	-69.6	173	0	0	0	111.3	L420 E421 R427 D428	L420-L424 HydrophobicContact CD1-CG 4.49Å; L420-L424 HydrophobicContact CG-CD1 4.25Å; L420-L424 VanDerWaalsContact O-CG 3.31Å; L420-L424 WeakPolarHBondContact O-CG 3.16Å; L420-L424 PolarHBondContact O-N 3.07Å; E421-L424 PolarHBondContact O-N 3.46Å; E421-L424 VanDerWaalsContact O-N 3.12Å; L424-R427 PolarHBondContact O-N 3.3Å; L424-D428 PolarHBondContact O-N 3.27Å
425	F	75.5	Confident	75.3	Confident	22 Å²	22	80.5 Å²	80.5	10%	0.096	41%	0.414	C	S	.	.	H	α-helix	trans	-66.7	-36.5	174	-66.9	-23.4	0	0	0	113.2	E421 R427 T431 A432 L434 F493	E421-F425 HydrophobicContact CG-CD2 3.91Å; E421-F425 HydrophobicContact CG-CE1 4.33Å; E421-F425 HydrophobicContact CG-CE2 3.34Å; E421-F425 HydrophobicContact CG-CZ 3.58Å; E421-F425 WeakPolarHBondContact O-CG 3.18Å; E421-F425 PolarHBondContact O-N 3Å; E421-F425 WeakPolarHBondContact OE1-CE2 3.38Å; E421-F425 VanDerWaalsContact OE1-CZ 3.23Å; E421-F425 WeakPolarHBondContact OE1-CZ 3.46Å; F425-R427 PolarHBondContact O-N 3.21Å; F425-T431 HydrophobicContact CD1-CG2 4.24Å; F425-T431 CarbonylContact O-C 3.58Å; F425-T431 PolarHBondContact O-OG1 3.34Å; F425-A432 WeakPolarHBondContact O-CA 3.41Å; F425-A432 PolarHBondContact O-N 3.32Å; F425-L434 HydrophobicContact CD2-CB 3.93Å; F425-L434 HydrophobicContact CE2-CB 4.23Å; F425-L434 HydrophobicContact CG-CB 4.34Å; F425-F493 HydrophobicContact CD1-CE2 4.32Å; F425-F493 HydrophobicContact CE1-CD2 4.12Å; F425-F493 AromaticContact CE1-CE2 3.5Å; F425-F493 HydrophobicContact CE1-CE2 3.5Å; F425-F493 VanDerWaalsContact CE1-CE2 3.5Å; F425-F493 HydrophobicContact CE1-CZ 4.49Å; F425-F493 HydrophobicContact CZ-CD2 4.06Å; F425-F493 AromaticContact CZ-CE2 3.92Å; F425-F493 HydrophobicContact CZ-CE2 3.92Å
426	S	75	Confident	74.3	Confident	65 Å²	65	80.9 Å²	80.9	46%	0.455	42%	0.417	S	S	.	.	H	α-helix	trans	-65.6	-24.4	176.6	76.1	0	0	0	0	113.4	D422 M423	D422-S426 WeakPolarHBondContact O-CB 3.4Å; D422-S426 PolarHBondContact O-N 3.03Å; M423-S426 PolarHBondContact O-N 3.48Å; M423-S426 PolarHBondContact O-OG 3.36Å
427	R	76	Confident	72.8	Confident	219 Å²	219	79 Å²	79	83%	0.826	42%	0.415	S	S	*	.	H	α-helix	trans	-82.2	-32.5	-176.9	-172.4	171.8	177.5	125.4	-1.7	112.9	M423 L424 F425	M423-R427 PolarHBondContact O-N 3.29Å; L424-R427 PolarHBondContact O-N 3.3Å; F425-R427 PolarHBondContact O-N 3.21Å
428	D	76.2	Confident	71.2	Confident	95 Å²	95	75.6 Å²	75.6	51%	0.508	41%	0.406	S	S	.	.			trans	-96	120	-179.3	-111.7	-32.7	0	0	0	110.7	L424 K430 T431 A432	L424-D428 PolarHBondContact O-N 3.27Å; D428-K430 PolarHBondContact O-N 2.94Å; D428-T431 WeakPolarHBondContact CB-OG1 3.32Å; D428-T431 PolarHBondContact O-N 3.33Å; D428-T431 PolarHBondContact O-OG1 2.9Å; D428-A432 PolarHBondContact O-N 2.72Å
429	P	75.9	Confident	69.3	Low	111 Å²	111	78.3 Å²	78.3	72%	0.721	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.2	-178.9	24.9	-33.8	0	0	0	112.7	T431	P429-T431 VanDerWaalsContact C-N 3.31Å
430	K	66.9	Low	67.2	Low	186 Å²	186	80.3 Å²	80.3	81%	0.809	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-22.2	177.6	-64.7	-177.3	-179.7	178.8	0	113.3	D428	D428-K430 PolarHBondContact O-N 2.94Å
431	T	69	Low	65.1	Low	17 Å²	17	80.1 Å²	80.1	10%	0.104	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-1.5	-176.6	50.3	0	0	0	0	112.4	F425 D428 P429 N433 L434 F493	F425-T431 HydrophobicContact CD1-CG2 4.24Å; F425-T431 CarbonylContact O-C 3.58Å; F425-T431 PolarHBondContact O-OG1 3.34Å; D428-T431 WeakPolarHBondContact CB-OG1 3.32Å; D428-T431 PolarHBondContact O-N 3.33Å; D428-T431 PolarHBondContact O-OG1 2.9Å; P429-T431 VanDerWaalsContact C-N 3.31Å; T431-N433 PolarHBondContact O-N 3.29Å; T431-N433 VanDerWaalsContact O-N 3.09Å; T431-L434 WeakPolarHBondContact O-CB 3.34Å; T431-L434 PolarHBondContact O-N 3.28Å; T431-F493 HydrophobicContact CG2-CE2 3.68Å; T431-F493 HydrophobicContact CG2-CZ 3.76Å
432	A	69.5	Low	63	Low	34 Å²	34	83.5 Å²	83.5	28%	0.281	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-53.5	-33.1	-179	0	0	0	0	0	114.2	F425 D428 L434 S435	F425-A432 WeakPolarHBondContact O-CA 3.41Å; F425-A432 PolarHBondContact O-N 3.32Å; D428-A432 PolarHBondContact O-N 2.72Å; A432-L434 PolarHBondContact O-N 2.88Å; A432-S435 WeakPolarHBondContact O-CB 3.37Å; A432-S435 PolarHBondContact O-N 2.7Å; A432-S435 VanDerWaalsContact O-N 3.1Å
433	N	73.2	Confident	60.7	Low	157 Å²	157	91.3 Å²	91.3	84%	0.84	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-64.7	-19.9	177.5	-64	-8.5	0	0	0	113.5	T431	T431-N433 PolarHBondContact O-N 3.29Å; T431-N433 VanDerWaalsContact O-N 3.09Å
434	L	64.9	Low	58.2	Low	26 Å²	26	94.9 Å²	94.9	14%	0.136	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-87.8	-15.4	177.7	-59.2	171.6	0	0	0	112.4	F425 T431 A432 L470 A492 F493	F425-L434 HydrophobicContact CD2-CB 3.93Å; F425-L434 HydrophobicContact CE2-CB 4.23Å; F425-L434 HydrophobicContact CG-CB 4.34Å; T431-L434 WeakPolarHBondContact O-CB 3.34Å; T431-L434 PolarHBondContact O-N 3.28Å; A432-L434 PolarHBondContact O-N 2.88Å; L434-L470 HydrophobicContact CD2-CD1 4.39Å; L434-A492 HydrophobicContact CD2-CB 3.86Å; L434-F493 HydrophobicContact CD1-CD2 3.38Å; L434-F493 HydrophobicContact CD1-CE2 3.78Å; L434-F493 HydrophobicContact CD1-CG 4.27Å
435	S	63.2	Low	55.9	Low	8 Å²	8	101.1 Å²	101.1	6%	0.056	54%	0.537	C	S	.	.			trans	-73.1	130.9	179.5	-176	0	0	0	0	110.7	D422 A432 T437 G438	D422-S435 PolarHBondContact O-OG 3.29Å; D422-S435 WeakPolarHBondContact OD1-CA 3.4Å; A432-S435 WeakPolarHBondContact O-CB 3.37Å; A432-S435 PolarHBondContact O-N 2.7Å; A432-S435 VanDerWaalsContact O-N 3.1Å; S435-T437 PolarHBondContact O-N 3.12Å; S435-T437 PolarHBondContact OG-N 3.47Å; S435-T437 PolarHBondContact OG-OG1 2.71Å; S435-G438 PolarHBondContact O-N 2.9Å
436	T	60	Low	53.7	Low	54 Å²	54	106.3 Å²	106.3	33%	0.331	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.1	-21.3	175.2	65.2	0	0	0	0	113	D422 R474	D422-T436 PolarHBondContact OD1-N 3.06Å; D422-T436 PolarHBondContact OD2-OG1 3.4Å; T436-R474 HydrophobicContact CG2-CG 4.03Å
437	T	53.7	Low	51.4	Low	87 Å²	87	113 Å²	113	53%	0.534	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.2	-20.3	-178.7	65.5	0	0	0	0	113.8	S435	S435-T437 PolarHBondContact O-N 3.12Å; S435-T437 PolarHBondContact OG-N 3.47Å; S435-T437 PolarHBondContact OG-OG1 2.71Å
438	G	46.6	Very low	49	Very low	30 Å²	30	111.3 Å²	111.3	31%	0.309	59%	0.59	S	S	.	*	G	3₁₀ helix	trans	-75.6	-28.4	-174.5	0	0	0	0	0	114.7	S435 T440 A441	S435-G438 PolarHBondContact O-N 2.9Å; G438-T440 VanDerWaalsContact C-N 3.33Å; G438-T440 PolarHBondContact O-N 3.38Å; G438-A441 PolarHBondContact O-N 2.89Å
439	S	40.7	Very low	46.7	Very low	82 Å²	82	113.2 Å²	113.2	57%	0.573	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-74	-16.8	-170.1	-169.9	0	0	0	0	114.4
440	T	36	Very low	44.6	Very low	130 Å²	130	116.1 Å²	116.1	80%	0.798	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-92.3	-13.1	177.7	55.8	0	0	0	0	114.3	G438	G438-T440 VanDerWaalsContact C-N 3.33Å; G438-T440 PolarHBondContact O-N 3.38Å
441	A	32.8	Very low	42.8	Very low	73 Å²	73	113.7 Å²	113.7	60%	0.603	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-21.7	-173.3	0	0	0	0	0	114.4	G438	G438-A441 PolarHBondContact O-N 2.89Å
442	V	35.1	Very low	40.7	Very low	116 Å²	116	118.6 Å²	118.6	70%	0.703	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-82.7	-23	-171.1	-179.1	0	0	0	0	113.4	K444	V442-K444 VanDerWaalsContact C-N 3.3Å; V442-K444 PolarHBondContact O-N 2.85Å
443	E	31.9	Very low	39.1	Very low	184 Å²	184	123.7 Å²	123.7	86%	0.86	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-77.6	-0.5	-176.6	-84.1	-174.8	164.1	0	0	116.2
444	K	26.2	Very low	36.9	Very low	196 Å²	196	122.4 Å²	122.4	85%	0.852	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-113.7	5.2	-176.5	-87.6	-172.3	178.8	178.8	0	117.1	V442	V442-K444 VanDerWaalsContact C-N 3.3Å; V442-K444 PolarHBondContact O-N 2.85Å
445	R	26.3	Very low	35.3	Very low	232 Å²	232	128.2 Å²	128.2	88%	0.875	69%	0.687	S	S	*	*	S	Bend	trans	-114.2	4.3	-175	-95.7	-177	169.7	-175.3	-3.3	118.1
446	T	28.5	Very low	33.6	Very low	130 Å²	130	133.9 Å²	133.9	80%	0.798	72%	0.721	S	S	*	*	S	Bend	trans	-126.4	54.9	176.8	53.4	0	0	0	0	112.1
447	K	27.5	Very low	32.1	Very low	207 Å²	207	138.7 Å²	138.7	90%	0.9	75%	0.745	S	S	*	*			trans	-139.4	63.7	163.9	-80.9	-169.5	178.5	176.9	0	110.1
448	K	24.9	Very low	30.8	Very low	183 Å²	183	138.5 Å²	138.5	80%	0.796	75%	0.752	S	S	*	*	S	Bend	trans	-162.5	131.2	156.6	-119	174.5	178.3	179.2	0	107.8
449	D	28.2	Very low	30.2	Very low	135 Å²	135	143.3 Å²	143.3	72%	0.722	78%	0.776	S	S	*	*			trans	78	78.9	166.3	-38.9	-31.6	0	0	0	113.3
450	D	31	Very low	29.7	Very low	171 Å²	171	146.4 Å²	146.4	91%	0.914	79%	0.786	S	S	*	*				-151.8	117.7	127.9	-88.8	-34.5	0	0	0	110.2
451	V	29	Very low	29.3	Very low	135 Å²	135	147.5 Å²	147.5	82%	0.818	79%	0.787	S	S	*	*			trans	-86	123.8	-179.3	165.3	0	0	0	0	107.4
452	N	25.9	Very low	29.2	Very low	120 Å²	120	151.8 Å²	151.8	64%	0.642	80%	0.8	S	S	*	*			trans	43.7	102.4	145.4	-159.1	8.3	0	0	0	117.7
453	T	34.6	Very low	29.1	Very low	141 Å²	141	154.4 Å²	154.4	87%	0.865	80%	0.804	S	S	*	*			trans	-145.7	98	143	-59.2	0	0	0	0	108.1	L455	T453-L455 PolarHBondContact O-N 2.94Å
454	D	27.7	Very low	29	Very low	130 Å²	130	152.3 Å²	152.3	70%	0.695	80%	0.799	S	S	*	*			trans	-51.2	122.6	158.6	-73.1	-42.1	0	0	0	109.9
455	L	31.8	Very low	29.3	Very low	149 Å²	149	146.9 Å²	146.9	78%	0.78	79%	0.791	S	S	*	*			trans	178	122.9	133.4	-120.3	61.8	0	0	0	111.7	T453	T453-L455 PolarHBondContact O-N 2.94Å
456	T	27.1	Very low	29.9	Very low	127 Å²	127	142.7 Å²	142.7	78%	0.779	79%	0.786	S	S	*	*			trans	67.9	118.8	139.6	56.7	0	0	0	0	121
457	D	27.6	Very low	30.3	Very low	154 Å²	154	144.4 Å²	144.4	82%	0.824	78%	0.784	S	S	*	*				109.5	121.7	127.7	-144.1	14.8	0	0	0	116.3	T459	D457-T459 PolarHBondContact O-N 3.06Å
458	A	27.3	Very low	30.9	Very low	84 Å²	84	140.5 Å²	140.5	69%	0.694	78%	0.778	S	S	*	*			trans	-72.2	112.2	-174.3	0	0	0	0	0	109
459	T	34	Very low	31.3	Very low	130 Å²	130	141 Å²	141	80%	0.798	78%	0.78	S	S	*	*			trans	-103.9	114.9	158.1	52.9	0	0	0	0	107.4	D457	D457-T459 PolarHBondContact O-N 3.06Å
460	D	29.6	Very low	32.1	Very low	147 Å²	147	137.2 Å²	137.2	79%	0.786	76%	0.76	S	S	*	*			trans	-46.8	137	178.2	-64.3	-59.4	0	0	0	112.3	D462	D460-D462 PolarHBondContact O-N 3.39Å
461	D	27.8	Very low	32.7	Very low	154 Å²	154	132 Å²	132	82%	0.824	74%	0.735	S	S	*	*			trans	-62.7	90.6	177.7	-63.4	-63	0	0	0	111.1	E463	D461-E463 VanDerWaalsContact C-N 3.28Å; D461-E463 PolarHBondContact O-N 2.85Å
462	D	30.8	Very low	33.5	Very low	162 Å²	162	134.3 Å²	134.3	87%	0.866	73%	0.734	S	S	*	*			trans	-73.4	89	159.8	-84.3	-34.6	0	0	0	108.4	D460 N464	D460-D462 PolarHBondContact O-N 3.39Å; D462-N464 PolarHBondContact O-N 3.13Å
463	E	33.6	Very low	34.3	Very low	172 Å²	172	137.5 Å²	137.5	80%	0.804	74%	0.742	S	S	*	*			trans	-57.9	95.2	167.9	-69	-157.6	161.9	0	0	110.3	D461 A465	D461-E463 VanDerWaalsContact C-N 3.28Å; D461-E463 PolarHBondContact O-N 2.85Å; E463-A465 PolarHBondContact O-N 3.18Å
464	N	29.3	Very low	35	Very low	140 Å²	140	132 Å²	132	75%	0.749	71%	0.706	S	S	*	*			trans	-70.8	80.7	167.3	-176.9	36.8	0	0	0	109.8	D462 N466	D462-N464 PolarHBondContact O-N 3.13Å; N464-N466 VanDerWaalsContact C-N 3.26Å; N464-N466 PolarHBondContact O-N 2.84Å
465	A	33.2	Very low	35.9	Very low	82 Å²	82	137 Å²	137	68%	0.678	72%	0.715	S	S	*	*			trans	-78.8	17.2	-172.1	0	0	0	0	0	115.9	E463	E463-A465 PolarHBondContact O-N 3.18Å
466	N	38.1	Very low	36.6	Very low	144 Å²	144	135.5 Å²	135.5	77%	0.77	72%	0.715	S	S	*	*			trans	-113.9	30.7	-174	-73.2	-33.1	0	0	0	114.8	N464 V468	N464-N466 VanDerWaalsContact C-N 3.26Å; N464-N466 PolarHBondContact O-N 2.84Å; N466-V468 PolarHBondContact O-N 2.9Å
467	E	37.5	Very low	38.1	Very low	165 Å²	165	130.9 Å²	130.9	77%	0.771	69%	0.686	S	S	*	*			trans	-81.8	101.6	171.5	-156.4	178.1	-157.7	0	0	110	K469	E467-K469 PolarHBondContact O-N 3.36Å
468	V	39.3	Very low	39.7	Very low	126 Å²	126	126.3 Å²	126.3	76%	0.764	67%	0.666	S	S	*	*			trans	-62.7	104.8	177.2	178.4	0	0	0	0	109.3	N466 L470	N466-V468 PolarHBondContact O-N 2.9Å; V468-L470 PolarHBondContact O-N 3.34Å
469	K	33.6	Very low	41.3	Very low	192 Å²	192	125.2 Å²	125.2	84%	0.835	65%	0.648	S	S	*	*			trans	-72.7	105.6	179.1	-68.5	-179.5	-178.6	173.7	0	110.7	E467	E467-K469 PolarHBondContact O-N 3.36Å
470	L	45.8	Very low	42.8	Very low	57 Å²	57	125.3 Å²	125.3	30%	0.298	64%	0.643	S	S	.	*			trans	-67.2	144.9	173.9	-75	157.5	0	0	0	112	L434 V468 K472	L434-L470 HydrophobicContact CD2-CD1 4.39Å; V468-L470 PolarHBondContact O-N 3.34Å; L470-K472 PolarHBondContact O-N 3.23Å
471	P	44	Very low	44.9	Very low	61 Å²	61	123.8 Å²	123.8	40%	0.396	63%	0.63	S	S	.	*			trans	-65.2	125.2	178.6	23.8	-31.3	0	0	0	111.9	K473 L485	P471-K473 PolarHBondContact O-N 2.92Å; P471-K473 VanDerWaalsContact O-N 3.09Å; P471-L485 HydrophobicContact CG-CD2 4.2Å
472	K	44.6	Very low	46.8	Very low	183 Å²	183	117.6 Å²	117.6	80%	0.796	60%	0.595	S	S	*	*	S	Bend	trans	-71.4	-0.2	-171	-66.9	-176.1	176.4	-177.1	0	116	L470	L470-K472 PolarHBondContact O-N 3.23Å
473	K	43.3	Very low	48.6	Very low	187 Å²	187	113 Å²	113	81%	0.813	58%	0.579	S	S	*	*			trans	-142.6	98.7	-176.5	-69.8	-176.2	-179.5	177.1	0	111.2	P471 R475	P471-K473 PolarHBondContact O-N 2.92Å; P471-K473 VanDerWaalsContact O-N 3.09Å; K473-R475 VanDerWaalsContact C-N 3.34Å
474	R	49.3	Very low	50.5	Low	26 Å²	26	109 Å²	109	10%	0.098	56%	0.564	C	S	.	*			trans	-88.2	8.6	173.8	-69.5	-173.8	169.3	-159.2	-11.7	114.5	E421 T436 C476 L477 L485 L489	E421-R474 IonicContact OE2-NH1 2.67Å; T436-R474 HydrophobicContact CG2-CG 4.03Å; R474-C476 PolarHBondContact O-N 2.63Å; R474-L477 HydrophobicContact CB-CD1 4.28Å; R474-L477 VanDerWaalsContact O-CD1 3.24Å; R474-L477 WeakPolarHBondContact O-CD1 3.25Å; R474-L485 HydrophobicContact CG-CD1 4.37Å; R474-L489 VanDerWaalsContact NH1-CD1 3.31Å
475	R	47.2	Very low	52.3	Low	235 Å²	235	102.9 Å²	102.9	89%	0.887	53%	0.531	S	S	*	.	S	Bend	trans	-81.3	120.3	-178.8	-76.3	179.9	161.2	154.1	-3.5	109.9	K473	K473-R475 VanDerWaalsContact C-N 3.34Å
476	C	46.9	Very low	54	Low	117 Å²	117	103.6 Å²	103.6	79%	0.791	52%	0.523	S	S	*	.	S	Bend	trans	71.1	62.5	175	-52.6	0	0	0	0	115.2	R474	R474-C476 PolarHBondContact O-N 2.63Å
477	L	57.3	Low	55.4	Low	31 Å²	31	102.2 Å²	102.2	16%	0.162	51%	0.512	C	S	.	.			trans	-78.3	143.7	167.5	-69.2	111.7	0	0	0	111.3	R474 K481 Y482 L485	R474-L477 HydrophobicContact CB-CD1 4.28Å; R474-L477 VanDerWaalsContact O-CD1 3.24Å; R474-L477 WeakPolarHBondContact O-CD1 3.25Å; L477-K481 HydrophobicContact CB-CB 4.33Å; L477-K481 HydrophobicContact CD2-CB 3.66Å; L477-K481 HydrophobicContact CD2-CD 4.49Å; L477-Y482 HydrophobicContact CB-CD2 4.03Å; L477-Y482 HydrophobicContact CB-CE2 3.79Å; L477-L485 HydrophobicContact CD1-CD1 3.33Å; L477-L485 HydrophobicContact CD2-CD1 3.35Å; L477-L485 HydrophobicContact CD2-CG 3.84Å; L477-L485 HydrophobicContact CG-CD1 3.94Å
478	S	61.5	Low	57	Low	57 Å²	57	98.7 Å²	98.7	40%	0.399	50%	0.495	S	S	.	.			trans	-66.9	151.1	163.4	57.7	0	0	0	0	109.5	D480 K481	S478-D480 PolarHBondContact O-N 3.25Å; S478-D480 VanDerWaalsContact O-N 3.15Å; S478-K481 PolarHBondContact O-N 2.86Å; S478-K481 WeakPolarHBondContact OG-CD 3.45Å; S478-K481 WeakPolarHBondContact OG-CG 3.43Å
479	L	60.1	Low	58.2	Low	61 Å²	61	93.1 Å²	93.1	32%	0.319	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-40.5	-175.3	-172.9	71.1	0	0	0	112.6	H407 V410 L414 K481 Y482	H407-L479 VanDerWaalsContact NE2-CB 3.31Å; H407-L479 WeakPolarHBondContact NE2-CB 3.37Å; V410-L479 HydrophobicContact CG1-CD1 4.33Å; L414-L479 HydrophobicContact CD1-CD1 3.68Å; L479-K481 VanDerWaalsContact C-N 3.28Å; L479-K481 PolarHBondContact O-N 2.77Å; L479-Y482 WeakPolarHBondContact O-CB 3.32Å; L479-Y482 PolarHBondContact O-N 3.37Å
480	D	66.9	Low	59.7	Low	132 Å²	132	88.6 Å²	88.6	71%	0.706	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-31.9	-179.8	-54.3	-31.9	0	0	0	113.2	S478 Y482 A483	S478-D480 PolarHBondContact O-N 3.25Å; S478-D480 VanDerWaalsContact O-N 3.15Å; D480-Y482 VanDerWaalsContact C-N 3.26Å; D480-Y482 PolarHBondContact O-N 3.49Å; D480-A483 PolarHBondContact O-N 3.18Å
481	K	72.5	Confident	60.6	Low	116 Å²	116	89.6 Å²	89.6	50%	0.504	45%	0.454	S	S	.	.	H	α-helix	trans	-78.2	-10.2	-178.1	-66.3	179.6	-177.1	-178.1	0	113.3	L477 S478 L479 A483 L485	L477-K481 HydrophobicContact CB-CB 4.33Å; L477-K481 HydrophobicContact CD2-CB 3.66Å; L477-K481 HydrophobicContact CD2-CD 4.49Å; S478-K481 PolarHBondContact O-N 2.86Å; S478-K481 WeakPolarHBondContact OG-CD 3.45Å; S478-K481 WeakPolarHBondContact OG-CG 3.43Å; L479-K481 VanDerWaalsContact C-N 3.28Å; L479-K481 PolarHBondContact O-N 2.77Å; K481-A483 VanDerWaalsContact C-N 3.31Å; K481-L485 PolarHBondContact O-N 3.41Å
482	Y	68.1	Low	61.5	Low	24 Å²	24	88.5 Å²	88.5	9%	0.094	45%	0.45	C	S	.	.	H	α-helix	trans	-67	-35	174.4	-87.1	-93.3	0	0	0	111.8	L414 D415 L418 L477 L479 D480 L485 L486	L414-Y482 HydrophobicContact CB-CD1 4.09Å; L414-Y482 HydrophobicContact CB-CE1 3.51Å; L414-Y482 HydrophobicContact CB-CE2 4.47Å; L414-Y482 HydrophobicContact CD1-CD1 4.32Å; L414-Y482 HydrophobicContact CD1-CD2 4.45Å; L414-Y482 HydrophobicContact CD1-CE1 4.44Å; L414-Y482 HydrophobicContact CD1-CG 4.3Å; L414-Y482 HydrophobicContact CG-CE1 4.47Å; D415-Y482 PolarHBondContact N-OH 3.31Å; D415-Y482 PolarHBondContact OD1-OH 3.29Å; L418-Y482 HydrophobicContact CD1-CD1 4Å; L418-Y482 HydrophobicContact CD1-CE1 3.3Å; L418-Y482 HydrophobicContact CG-CE1 3.94Å; L477-Y482 HydrophobicContact CB-CD2 4.03Å; L477-Y482 HydrophobicContact CB-CE2 3.79Å; L479-Y482 WeakPolarHBondContact O-CB 3.32Å; L479-Y482 PolarHBondContact O-N 3.37Å; D480-Y482 VanDerWaalsContact C-N 3.26Å; D480-Y482 PolarHBondContact O-N 3.49Å; Y482-L485 PolarHBondContact O-N 3.38Å; Y482-L486 WeakPolarHBondContact O-CB 3.44Å; Y482-L486 PolarHBondContact O-N 3.25Å
483	A	69.2	Low	62.2	Low	64 Å²	64	81.3 Å²	81.3	53%	0.529	42%	0.419	S	S	.	.	H	α-helix	trans	-61	-49.1	176.4	0	0	0	0	0	110.9	D480 K481 L485 L486 E487	D480-A483 PolarHBondContact O-N 3.18Å; K481-A483 VanDerWaalsContact C-N 3.31Å; A483-L485 VanDerWaalsContact C-N 3.33Å; A483-L485 PolarHBondContact O-N 3.42Å; A483-L486 PolarHBondContact O-N 3.35Å; A483-E487 PolarHBondContact O-N 3.38Å
484	D	73.8	Confident	62.8	Low	89 Å²	89	77.6 Å²	77.6	48%	0.476	41%	0.405	S	S	.	.	H	α-helix	trans	-60.8	-40.7	178.9	-56.6	-22	0	0	0	112.3	E487 Q488	D484-E487 PolarHBondContact O-N 3.22Å; D484-Q488 WeakPolarHBondContact O-CG 3.12Å; D484-Q488 PolarHBondContact O-N 2.96Å
485	L	66.7	Low	63.1	Low	11 Å²	11	83.1 Å²	83.1	6%	0.058	43%	0.426	C	S	.	.	H	α-helix	trans	-65.4	-39.9	177	-88.3	-174	0	0	0	112.6	P471 R474 L477 K481 Y482 A483 E487 Q488 L489	P471-L485 HydrophobicContact CG-CD2 4.2Å; R474-L485 HydrophobicContact CG-CD1 4.37Å; L477-L485 HydrophobicContact CD1-CD1 3.33Å; L477-L485 HydrophobicContact CD2-CD1 3.35Å; L477-L485 HydrophobicContact CD2-CG 3.84Å; L477-L485 HydrophobicContact CG-CD1 3.94Å; K481-L485 PolarHBondContact O-N 3.41Å; Y482-L485 PolarHBondContact O-N 3.38Å; A483-L485 VanDerWaalsContact C-N 3.33Å; A483-L485 PolarHBondContact O-N 3.42Å; L485-E487 VanDerWaalsContact C-N 3.33Å; L485-Q488 PolarHBondContact O-N 3.39Å; L485-L489 WeakPolarHBondContact O-CB 3.36Å; L485-L489 WeakPolarHBondContact O-CG 3.44Å; L485-L489 PolarHBondContact O-N 2.82Å
486	L	67.6	Low	63.5	Low	98 Å²	98	74.4 Å²	74.4	51%	0.513	39%	0.393	S	S	.	.	H	α-helix	trans	-66.6	-39.1	178.6	-170.5	67	0	0	0	110.8	Y482 A483 L489 H490	Y482-L486 WeakPolarHBondContact O-CB 3.44Å; Y482-L486 PolarHBondContact O-N 3.25Å; A483-L486 PolarHBondContact O-N 3.35Å; L486-L489 PolarHBondContact O-N 3.09Å; L486-H490 WeakPolarHBondContact O-CB 3.43Å; L486-H490 PolarHBondContact O-N 3.44Å
487	E	68	Low	63.9	Low	115 Å²	115	74 Å²	74	54%	0.537	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-43.1	174.3	-169	-180	177.2	0	0	112	A483 D484 L485 H490 S491 L519	A483-E487 PolarHBondContact O-N 3.38Å; D484-E487 PolarHBondContact O-N 3.22Å; L485-E487 VanDerWaalsContact C-N 3.33Å; E487-H490 PolarHBondContact O-N 3.47Å; E487-S491 WeakPolarHBondContact O-CB 3.31Å; E487-S491 PolarHBondContact O-N 2.86Å; E487-S491 PolarHBondContact O-OG 3.09Å; E487-L519 HydrophobicContact CG-CD1 4.41Å
488	Q	70.4	Confident	63.6	Low	91 Å²	91	79.7 Å²	79.7	43%	0.425	40%	0.403	S	S	.	.	H	α-helix	trans	-62.4	-42.2	174.2	-75.1	177.1	9.9	0	0	112	D484 L485 S491 A492	D484-Q488 WeakPolarHBondContact O-CG 3.12Å; D484-Q488 PolarHBondContact O-N 2.96Å; L485-Q488 PolarHBondContact O-N 3.39Å; Q488-S491 PolarHBondContact O-N 3.33Å; Q488-A492 WeakPolarHBondContact O-CB 3.47Å; Q488-A492 PolarHBondContact O-N 3.49Å
489	L	65.3	Low	63.2	Low	8 Å²	8	80.3 Å²	80.3	4%	0.042	40%	0.404	C	S	.	.	H	α-helix	trans	-66	-44.7	176.7	-80.7	173.8	0	0	0	112.4	E421 R474 L485 L486 S491 A492 F493	E421-L489 WeakPolarHBondContact OE1-CD1 3.44Å; E421-L489 WeakPolarHBondContact OE2-CD1 3.23Å; R474-L489 VanDerWaalsContact NH1-CD1 3.31Å; L485-L489 WeakPolarHBondContact O-CB 3.36Å; L485-L489 WeakPolarHBondContact O-CG 3.44Å; L485-L489 PolarHBondContact O-N 2.82Å; L486-L489 PolarHBondContact O-N 3.09Å; L489-S491 PolarHBondContact O-N 2.78Å; L489-A492 PolarHBondContact O-N 3.3Å; L489-F493 VanDerWaalsContact O-CB 3.26Å; L489-F493 WeakPolarHBondContact O-CB 3.42Å; L489-F493 PolarHBondContact O-N 3.01Å
490	H	64.8	Low	62.7	Low	98 Å²	98	82.6 Å²	82.6	45%	0.454	41%	0.409	S	S	.	.	H	α-helix	trans	-61.8	-34.6	174.4	-88.9	152.9	0	0	0	112.3	L486 E487	L486-H490 WeakPolarHBondContact O-CB 3.43Å; L486-H490 PolarHBondContact O-N 3.44Å; E487-H490 PolarHBondContact O-N 3.47Å
491	S	65.7	Low	61.8	Low	77 Å²	77	81.6 Å²	81.6	54%	0.538	40%	0.401	S	S	.	.	H	α-helix	trans	-70.8	-37.9	175.4	-59.9	0	0	0	0	112.2	E487 Q488 L489	E487-S491 WeakPolarHBondContact O-CB 3.31Å; E487-S491 PolarHBondContact O-N 2.86Å; E487-S491 PolarHBondContact O-OG 3.09Å; Q488-S491 PolarHBondContact O-N 3.33Å; L489-S491 PolarHBondContact O-N 2.78Å
492	A	61.4	Low	60.5	Low	38 Å²	38	82.2 Å²	82.2	31%	0.314	41%	0.414	S	S	.	.	H	α-helix	trans	-75.9	-33.6	177.6	0	0	0	0	0	112.7	L434 Q488 L489 H494	L434-A492 HydrophobicContact CD2-CB 3.86Å; Q488-A492 WeakPolarHBondContact O-CB 3.47Å; Q488-A492 PolarHBondContact O-N 3.49Å; L489-A492 PolarHBondContact O-N 3.3Å; A492-H494 PolarHBondContact O-N 2.94Å
493	F	59.8	Low	59.5	Low	32 Å²	32	87.1 Å²	87.1	14%	0.14	44%	0.442	C	S	.	.	S	Bend	trans	-77.8	111.5	175.8	-146.4	-74.1	0	0	0	108.2	F425 T431 L434 L489 W495	F425-F493 HydrophobicContact CD1-CE2 4.32Å; F425-F493 HydrophobicContact CE1-CD2 4.12Å; F425-F493 AromaticContact CE1-CE2 3.5Å; F425-F493 HydrophobicContact CE1-CE2 3.5Å; F425-F493 VanDerWaalsContact CE1-CE2 3.5Å; F425-F493 HydrophobicContact CE1-CZ 4.49Å; F425-F493 HydrophobicContact CZ-CD2 4.06Å; F425-F493 AromaticContact CZ-CE2 3.92Å; F425-F493 HydrophobicContact CZ-CE2 3.92Å; T431-F493 HydrophobicContact CG2-CE2 3.68Å; T431-F493 HydrophobicContact CG2-CZ 3.76Å; L434-F493 HydrophobicContact CD1-CD2 3.38Å; L434-F493 HydrophobicContact CD1-CE2 3.78Å; L434-F493 HydrophobicContact CD1-CG 4.27Å; L489-F493 VanDerWaalsContact O-CB 3.26Å; L489-F493 WeakPolarHBondContact O-CB 3.42Å; L489-F493 PolarHBondContact O-N 3.01Å; F493-W495 HydrophobicContact CD1-CB 3.99Å; F493-W495 AromaticContact CD1-CD1 2.83Å; F493-W495 HydrophobicContact CD1-CD2 4.21Å; F493-W495 AromaticContact CD1-CG 3.41Å; F493-W495 HydrophobicContact CD1-CG 3.41Å; F493-W495 VanDerWaalsContact CD1-CG 3.41Å; F493-W495 AromaticContact CD1-NE1 3.24Å; F493-W495 AromaticContact CE1-CD1 3.22Å; F493-W495 HydrophobicContact CE1-CD2 4.06Å; F493-W495 AromaticContact CE1-CE2 3.65Å; F493-W495 AromaticContact CE1-CG 3.75Å; F493-W495 HydrophobicContact CE1-CG 3.75Å; F493-W495 HydrophobicContact CE1-CZ2 4.48Å; F493-W495 AromaticContact CE1-NE1 3.05Å; F493-W495 AromaticContact CG-CD1 3.44Å; F493-W495 VanDerWaalsContact CG-CD1 3.44Å; F493-W495 HydrophobicContact CG-CG 4.32Å; F493-W495 AromaticContact CG-NE1 3.9Å; F493-W495 AromaticContact CZ-NE1 3.65Å; F493-W495 PolarHBondContact O-N 2.91Å
494	H	57.3	Low	58.3	Low	110 Å²	110	88.8 Å²	88.8	51%	0.509	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	28	172.7	-100.3	-73.4	0	0	0	114	A492 Y496 E497 K498	A492-H494 PolarHBondContact O-N 2.94Å; H494-Y496 PolarHBondContact O-N 3.45Å; H494-E497 HydrophobicContact CB-CB 4.15Å; H494-E497 IonicContact CE1-OE1 3.6Å; H494-E497 PolarHBondContact CE1-OE1 3.06Å; H494-E497 IonicContact CE1-OE2 3.07Å; H494-E497 PolarHBondContact CE1-OE2 3.33Å; H494-E497 VanDerWaalsContact CE1-OE2 3.28Å; H494-E497 IonicContact CG-OE2 3.66Å; H494-E497 WeakPolarHBondContact ND1-CB 3.5Å; H494-E497 WeakPolarHBondContact ND1-CG 3.48Å; H494-E497 IonicContact ND1-OE1 3.82Å; H494-E497 PolarHBondContact ND1-OE1 3.14Å; H494-E497 IonicContact ND1-OE2 3.46Å; H494-E497 PolarHBondContact ND1-OE2 3.02Å; H494-E497 WeakPolarHBondContact O-CA 3.26Å; H494-E497 WeakPolarHBondContact O-CB 3.47Å; H494-E497 PolarHBondContact O-N 2.97Å; H494-K498 PolarHBondContact O-N 3.23Å
495	W	53.7	Low	56.8	Low	142 Å²	142	94 Å²	94	54%	0.538	46%	0.46	S	S	.	.	H	α-helix	trans	-51.8	-43	170.1	-94.7	117	0	0	0	109.9	F493 E497 K498 T499	F493-W495 HydrophobicContact CD1-CB 3.99Å; F493-W495 AromaticContact CD1-CD1 2.83Å; F493-W495 HydrophobicContact CD1-CD2 4.21Å; F493-W495 AromaticContact CD1-CG 3.41Å; F493-W495 HydrophobicContact CD1-CG 3.41Å; F493-W495 VanDerWaalsContact CD1-CG 3.41Å; F493-W495 AromaticContact CD1-NE1 3.24Å; F493-W495 AromaticContact CE1-CD1 3.22Å; F493-W495 HydrophobicContact CE1-CD2 4.06Å; F493-W495 AromaticContact CE1-CE2 3.65Å; F493-W495 AromaticContact CE1-CG 3.75Å; F493-W495 HydrophobicContact CE1-CG 3.75Å; F493-W495 HydrophobicContact CE1-CZ2 4.48Å; F493-W495 AromaticContact CE1-NE1 3.05Å; F493-W495 AromaticContact CG-CD1 3.44Å; F493-W495 VanDerWaalsContact CG-CD1 3.44Å; F493-W495 HydrophobicContact CG-CG 4.32Å; F493-W495 AromaticContact CG-NE1 3.9Å; F493-W495 AromaticContact CZ-NE1 3.65Å; F493-W495 PolarHBondContact O-N 2.91Å; W495-E497 VanDerWaalsContact C-N 3.28Å; W495-E497 PolarHBondContact O-N 2.92Å; W495-K498 CarbonylContact O-C 3.43Å; W495-K498 PolarHBondContact O-N 3.45Å; W495-T499 PolarHBondContact O-N 2.93Å; W495-T499 PolarHBondContact O-OG1 2.9Å; W495-T499 VanDerWaalsContact O-OG1 3.05Å
496	Y	56.4	Low	55.7	Low	52 Å²	52	98 Å²	98	20%	0.204	49%	0.488	C	S	.	.	H	α-helix	trans	-53.8	-43.7	172.7	172.1	-109.1	0	0	0	111.6	H494 T499 R500 F514 E515 F516 I518	H494-Y496 PolarHBondContact O-N 3.45Å; Y496-T499 CarbonylContact O-C 3.54Å; Y496-T499 PolarHBondContact O-N 3.43Å; Y496-T499 PolarHBondContact O-OG1 3.31Å; Y496-T499 VanDerWaalsContact O-OG1 3.14Å; Y496-R500 WeakPolarHBondContact O-CA 3.43Å; Y496-R500 WeakPolarHBondContact O-CB 3.4Å; Y496-R500 PolarHBondContact O-N 2.88Å; Y496-F514 PolarHBondContact OH-O 3.22Å; Y496-E515 PolarHBondContact OH-O 3.33Å; Y496-F516 WeakPolarHBondContact CE2-O 3.2Å; Y496-I518 HydrophobicContact CD2-CD1 4.35Å; Y496-I518 HydrophobicContact CD2-CG1 4.12Å
497	E	54.8	Low	54.6	Low	109 Å²	109	99.1 Å²	99.1	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-68.5	-35.2	175	-94	-170.2	-176.5	0	0	113.8	H494 W495 T499 R500	H494-E497 HydrophobicContact CB-CB 4.15Å; H494-E497 IonicContact CE1-OE1 3.6Å; H494-E497 PolarHBondContact CE1-OE1 3.06Å; H494-E497 IonicContact CE1-OE2 3.07Å; H494-E497 PolarHBondContact CE1-OE2 3.33Å; H494-E497 VanDerWaalsContact CE1-OE2 3.28Å; H494-E497 IonicContact CG-OE2 3.66Å; H494-E497 WeakPolarHBondContact ND1-CB 3.5Å; H494-E497 WeakPolarHBondContact ND1-CG 3.48Å; H494-E497 IonicContact ND1-OE1 3.82Å; H494-E497 PolarHBondContact ND1-OE1 3.14Å; H494-E497 IonicContact ND1-OE2 3.46Å; H494-E497 PolarHBondContact ND1-OE2 3.02Å; H494-E497 WeakPolarHBondContact O-CA 3.26Å; H494-E497 WeakPolarHBondContact O-CB 3.47Å; H494-E497 PolarHBondContact O-N 2.97Å; W495-E497 VanDerWaalsContact C-N 3.28Å; W495-E497 PolarHBondContact O-N 2.92Å; E497-T499 VanDerWaalsContact C-N 3.31Å; E497-R500 WeakPolarHBondContact O-CB 3.41Å; E497-R500 PolarHBondContact O-N 3.23Å
498	K	52.7	Low	53.4	Low	150 Å²	150	101.6 Å²	101.6	65%	0.652	52%	0.515	S	S	*	.	H	α-helix	trans	-68.3	-32.4	176.4	-69.4	-173.4	175.4	-177.2	0	112.3	H494 W495	H494-K498 PolarHBondContact O-N 3.23Å; W495-K498 CarbonylContact O-C 3.43Å; W495-K498 PolarHBondContact O-N 3.45Å
499	T	51.6	Low	52.2	Low	69 Å²	69	106.9 Å²	106.9	42%	0.423	54%	0.537	S	S	.	.	H	α-helix	trans	-88.4	-16.5	174	58.4	0	0	0	0	112.6	W495 Y496 E497 M501	W495-T499 PolarHBondContact O-N 2.93Å; W495-T499 PolarHBondContact O-OG1 2.9Å; W495-T499 VanDerWaalsContact O-OG1 3.05Å; Y496-T499 CarbonylContact O-C 3.54Å; Y496-T499 PolarHBondContact O-N 3.43Å; Y496-T499 PolarHBondContact O-OG1 3.31Å; Y496-T499 VanDerWaalsContact O-OG1 3.14Å; E497-T499 VanDerWaalsContact C-N 3.31Å; T499-M501 VanDerWaalsContact C-N 3.27Å; T499-M501 PolarHBondContact O-N 3.46Å
500	R	50.5	Low	51.2	Low	110 Å²	110	113.9 Å²	113.9	42%	0.415	57%	0.574	S	S	.	*	S	Bend	trans	-68.3	87.2	172.1	-167.5	178.1	176.8	160.2	4.7	108.5	Y496 E497 V502	Y496-R500 WeakPolarHBondContact O-CA 3.43Å; Y496-R500 WeakPolarHBondContact O-CB 3.4Å; Y496-R500 PolarHBondContact O-N 2.88Å; E497-R500 WeakPolarHBondContact O-CB 3.41Å; E497-R500 PolarHBondContact O-N 3.23Å; R500-V502 PolarHBondContact O-N 2.91Å
501	M	47.2	Very low	50.4	Low	111 Å²	111	115.6 Å²	115.6	55%	0.547	58%	0.581	S	S	.	*			trans	-54.4	131	176	-65.3	-105.7	-118.7	0	0	109.4	T499 N503 R583	T499-M501 VanDerWaalsContact C-N 3.27Å; T499-M501 PolarHBondContact O-N 3.46Å; M501-N503 PolarHBondContact O-N 3.22Å; M501-R583 VanDerWaalsContact CE-CZ 3.43Å; M501-R583 PolarHBondContact SD-NH2 3.48Å
502	V	46.2	Very low	49.7	Very low	129 Å²	129	115.8 Å²	115.8	78%	0.782	58%	0.582	S	S	*	*			trans	-38.9	120.9	-177.1	177.5	0	0	0	0	110.9	R500 I504	R500-V502 PolarHBondContact O-N 2.91Å; V502-I504 VanDerWaalsContact C-N 3.31Å; V502-I504 PolarHBondContact O-N 3.1Å
503	N	45.6	Very low	49.3	Very low	127 Å²	127	115.2 Å²	115.2	68%	0.679	58%	0.58	S	S	*	*			trans	-60	87.5	177.5	-172.5	7.2	0	0	0	110.2	M501 K505	M501-N503 PolarHBondContact O-N 3.22Å; N503-K505 PolarHBondContact O-N 3.09Å
504	I	45.5	Very low	48.9	Very low	98 Å²	98	117.6 Å²	117.6	50%	0.503	59%	0.591	S	S	.	*			trans	-79.3	101.6	171.3	-64.4	169.5	0	0	0	105.8	V502 S506	V502-I504 VanDerWaalsContact C-N 3.31Å; V502-I504 PolarHBondContact O-N 3.1Å; I504-S506 VanDerWaalsContact C-N 3.3Å; I504-S506 PolarHBondContact O-N 2.74Å
505	K	40.9	Very low	48.6	Very low	200 Å²	200	118.9 Å²	118.9	87%	0.87	60%	0.597	S	S	*	*			trans	-40.7	87.6	172.7	-63.3	174	179.3	177.4	0	111.3	N503	N503-K505 PolarHBondContact O-N 3.09Å
506	S	44.1	Very low	48.9	Very low	93 Å²	93	117.5 Å²	117.5	65%	0.65	60%	0.595	S	S	*	*			trans	-123.4	110.8	172.4	-74.4	0	0	0	0	107.4	I504 H508	I504-S506 VanDerWaalsContact C-N 3.3Å; I504-S506 PolarHBondContact O-N 2.74Å; S506-H508 PolarHBondContact O-N 3.45Å
507	S	45.9	Very low	49.4	Very low	123 Å²	123	117.5 Å²	117.5	86%	0.86	60%	0.599	S	S	*	*			trans	-69.7	23.2	-164.5	-173.2	0	0	0	0	115.9
508	H	42.8	Very low	50	Low	166 Å²	166	115.7 Å²	115.7	77%	0.769	59%	0.592	S	S	*	*			trans	-106.9	125.7	-179.7	-78	-81	0	0	0	111.9	S506 D510	S506-H508 PolarHBondContact O-N 3.45Å; H508-D510 PolarHBondContact O-N 3.35Å
509	K	44	Very low	51.1	Low	202 Å²	202	111.2 Å²	111.2	88%	0.878	58%	0.575	S	S	*	*	S	Bend	trans	-72.8	20.3	-155.4	-155.4	175.9	177.1	-178.8	0	115.8
510	D	45.1	Very low	52.3	Low	155 Å²	155	114.4 Å²	114.4	83%	0.829	58%	0.583	S	S	*	*			trans	-113.8	14.6	-170.4	-59.4	-27	0	0	0	113.4	H508	H508-D510 PolarHBondContact O-N 3.35Å
511	F	47.4	Very low	53.3	Low	135 Å²	135	112.7 Å²	112.7	59%	0.592	58%	0.579	S	S	*	*			trans	-106.6	31.3	-172.6	-139	-103.1	0	0	0	114	G513 F514	F511-G513 PolarHBondContact O-N 3.06Å; F511-F514 HydrophobicContact CD1-CB 4.27Å; F511-F514 AromaticContact CD1-CD2 3.61Å; F511-F514 HydrophobicContact CD1-CD2 3.61Å; F511-F514 HydrophobicContact CD1-CE2 4.37Å; F511-F514 HydrophobicContact CD1-CG 4.27Å; F511-F514 HydrophobicContact CE1-CB 4.15Å; F511-F514 AromaticContact CE1-CD2 3.06Å; F511-F514 HydrophobicContact CE1-CD2 3.06Å; F511-F514 AromaticContact CE1-CE2 3.53Å; F511-F514 HydrophobicContact CE1-CE2 3.53Å; F511-F514 AromaticContact CE1-CG 3.73Å; F511-F514 HydrophobicContact CE1-CG 3.73Å; F511-F514 HydrophobicContact CE1-CZ 4.5Å; F511-F514 HydrophobicContact CE2-CD2 4.21Å; F511-F514 HydrophobicContact CE2-CE2 4.04Å; F511-F514 HydrophobicContact CG-CD2 4.38Å; F511-F514 AromaticContact CZ-CD2 3.42Å; F511-F514 HydrophobicContact CZ-CD2 3.42Å; F511-F514 VanDerWaalsContact CZ-CD2 3.42Å; F511-F514 AromaticContact CZ-CE2 3.32Å; F511-F514 HydrophobicContact CZ-CE2 3.32Å; F511-F514 HydrophobicContact CZ-CG 4.39Å; F511-F514 HydrophobicContact CZ-CZ 4.25Å
512	S	51.5	Low	54.7	Low	80 Å²	80	111.2 Å²	111.2	56%	0.559	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-73	-13.2	-179.4	57.6	0	0	0	0	114	F514 E515 F516	S512-F514 PolarHBondContact O-N 2.89Å; S512-E515 PolarHBondContact O-N 2.84Å; S512-F516 WeakPolarHBondContact O-CD2 3.29Å; S512-F516 WeakPolarHBondContact O-CE2 3.3Å
513	G	52.1	Low	56.3	Low	27 Å²	27	110 Å²	110	28%	0.278	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-64.7	-23.8	-179.5	0	0	0	0	0	114.6	F511 Q521	F511-G513 PolarHBondContact O-N 3.06Å; G513-Q521 PolarHBondContact O-NE2 3.23Å; G513-Q521 PolarHBondContact O-OE1 2.99Å
514	F	51.1	Low	58	Low	82 Å²	82	112.6 Å²	112.6	36%	0.36	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-92.9	-8.2	-177.7	-76.1	-85.7	0	0	0	114.5	Y496 F511 S512	Y496-F514 PolarHBondContact OH-O 3.22Å; F511-F514 HydrophobicContact CD1-CB 4.27Å; F511-F514 AromaticContact CD1-CD2 3.61Å; F511-F514 HydrophobicContact CD1-CD2 3.61Å; F511-F514 HydrophobicContact CD1-CE2 4.37Å; F511-F514 HydrophobicContact CD1-CG 4.27Å; F511-F514 HydrophobicContact CE1-CB 4.15Å; F511-F514 AromaticContact CE1-CD2 3.06Å; F511-F514 HydrophobicContact CE1-CD2 3.06Å; F511-F514 AromaticContact CE1-CE2 3.53Å; F511-F514 HydrophobicContact CE1-CE2 3.53Å; F511-F514 AromaticContact CE1-CG 3.73Å; F511-F514 HydrophobicContact CE1-CG 3.73Å; F511-F514 HydrophobicContact CE1-CZ 4.5Å; F511-F514 HydrophobicContact CE2-CD2 4.21Å; F511-F514 HydrophobicContact CE2-CE2 4.04Å; F511-F514 HydrophobicContact CG-CD2 4.38Å; F511-F514 AromaticContact CZ-CD2 3.42Å; F511-F514 HydrophobicContact CZ-CD2 3.42Å; F511-F514 VanDerWaalsContact CZ-CD2 3.42Å; F511-F514 AromaticContact CZ-CE2 3.32Å; F511-F514 HydrophobicContact CZ-CE2 3.32Å; F511-F514 HydrophobicContact CZ-CG 4.39Å; F511-F514 HydrophobicContact CZ-CZ 4.25Å; S512-F514 PolarHBondContact O-N 2.89Å
515	E	52.2	Low	59.7	Low	136 Å²	136	111 Å²	111	64%	0.636	56%	0.558	S	S	*	*	S	Bend	trans	-82.3	-14.9	-178.5	-65.4	-159.3	152.1	0	0	113.6	Y496 S512	Y496-E515 PolarHBondContact OH-O 3.33Å; S512-E515 PolarHBondContact O-N 2.84Å
516	F	60.3	Low	61.7	Low	113 Å²	113	105.1 Å²	105.1	50%	0.496	54%	0.536	S	S	.	.	S	Bend	trans	-95.4	149.4	179.9	-58.6	-73.7	0	0	0	111.6	Y496 S512 I518 K520	Y496-F516 WeakPolarHBondContact CE2-O 3.2Å; S512-F516 WeakPolarHBondContact O-CD2 3.29Å; S512-F516 WeakPolarHBondContact O-CE2 3.3Å; F516-I518 PolarHBondContact O-N 2.93Å; F516-K520 HydrophobicContact CB-CB 4.25Å
517	N	66.2	Low	63.8	Low	53 Å²	53	105.2 Å²	105.2	28%	0.283	54%	0.536	S	S	.	.			trans	-50.9	135.1	165	-178	-20.3	0	0	0	108.4	L519 K520 Q521	N517-L519 PolarHBondContact O-N 3.37Å; N517-L519 PolarHBondContact OD1-N 2.9Å; N517-L519 VanDerWaalsContact OD1-N 3.13Å; N517-K520 HydrophobicContact CB-CB 4.47Å; N517-K520 HydrophobicContact CB-CD 4.37Å; N517-K520 HydrophobicContact CB-CG 4.24Å; N517-K520 WeakPolarHBondContact O-CA 3.26Å; N517-K520 WeakPolarHBondContact O-CB 3.46Å; N517-K520 PolarHBondContact O-N 3.44Å; N517-Q521 PolarHBondContact O-N 2.87Å
518	I	67.8	Low	65.7	Low	71 Å²	71	102.7 Å²	102.7	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-49.2	-38.2	-179.8	-66.2	162.8	0	0	0	110.9	Y496 F516 Q521 I522	Y496-I518 HydrophobicContact CD2-CD1 4.35Å; Y496-I518 HydrophobicContact CD2-CG1 4.12Å; F516-I518 PolarHBondContact O-N 2.93Å; I518-Q521 WeakPolarHBondContact O-CB 3.47Å; I518-Q521 PolarHBondContact O-N 2.95Å; I518-I522 HydrophobicContact CG2-CD1 3.81Å; I518-I522 HydrophobicContact CG2-CG1 4.35Å; I518-I522 VanDerWaalsContact O-CG1 3.27Å; I518-I522 WeakPolarHBondContact O-CG1 3.17Å; I518-I522 PolarHBondContact O-N 3.25Å
519	L	74.8	Confident	67.7	Low	56 Å²	56	103.3 Å²	103.3	29%	0.293	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-46.7	176	-63.2	178.9	0	0	0	112.1	E487 N517 Q521 I522 D523	E487-L519 HydrophobicContact CG-CD1 4.41Å; N517-L519 PolarHBondContact O-N 3.37Å; N517-L519 PolarHBondContact OD1-N 2.9Å; N517-L519 VanDerWaalsContact OD1-N 3.13Å; L519-Q521 VanDerWaalsContact C-N 3.27Å; L519-Q521 PolarHBondContact O-N 3.22Å; L519-I522 PolarHBondContact O-N 2.94Å; L519-D523 VanDerWaalsContact O-CG 3.27Å; L519-D523 PolarHBondContact O-N 2.67Å
520	K	76.4	Confident	69.7	Low	136 Å²	136	98.6 Å²	98.6	59%	0.591	49%	0.493	S	S	*	.	H	α-helix	trans	-63.8	-33.2	175.3	-66.3	-176.9	178.3	-177.8	0	112.3	F516 N517 Y524	F516-K520 HydrophobicContact CB-CB 4.25Å; N517-K520 HydrophobicContact CB-CB 4.47Å; N517-K520 HydrophobicContact CB-CD 4.37Å; N517-K520 HydrophobicContact CB-CG 4.24Å; N517-K520 WeakPolarHBondContact O-CA 3.26Å; N517-K520 WeakPolarHBondContact O-CB 3.46Å; N517-K520 PolarHBondContact O-N 3.44Å; K520-Y524 VanDerWaalsContact O-CB 3.3Å; K520-Y524 WeakPolarHBondContact O-CB 3Å; K520-Y524 PolarHBondContact O-N 3.37Å
521	Q	72.3	Confident	71.6	Confident	73 Å²	73	99.4 Å²	99.4	34%	0.341	49%	0.485	S	S	.	.	H	α-helix	trans	-69.1	-42.9	174.9	-171.8	-177.9	7.1	0	0	111.1	G513 N517 I518 L519 Y524 V525	G513-Q521 PolarHBondContact O-NE2 3.23Å; G513-Q521 PolarHBondContact O-OE1 2.99Å; N517-Q521 PolarHBondContact O-N 2.87Å; I518-Q521 WeakPolarHBondContact O-CB 3.47Å; I518-Q521 PolarHBondContact O-N 2.95Å; L519-Q521 VanDerWaalsContact C-N 3.27Å; L519-Q521 PolarHBondContact O-N 3.22Å; Q521-Y524 PolarHBondContact O-N 3.01Å; Q521-V525 WeakPolarHBondContact O-CB 3.27Å; Q521-V525 VanDerWaalsContact O-CG2 3.26Å; Q521-V525 WeakPolarHBondContact O-CG2 3.39Å; Q521-V525 PolarHBondContact O-N 3.44Å
522	I	75.9	Confident	73.2	Confident	80 Å²	80	95.6 Å²	95.6	41%	0.41	47%	0.47	S	S	.	.	H	α-helix	trans	-60.9	-47.3	174	-70	166.1	0	0	0	109.6	I518 L519 Y524 V525 L526	I518-I522 HydrophobicContact CG2-CD1 3.81Å; I518-I522 HydrophobicContact CG2-CG1 4.35Å; I518-I522 VanDerWaalsContact O-CG1 3.27Å; I518-I522 WeakPolarHBondContact O-CG1 3.17Å; I518-I522 PolarHBondContact O-N 3.25Å; L519-I522 PolarHBondContact O-N 2.94Å; I522-Y524 VanDerWaalsContact C-N 3.32Å; I522-Y524 PolarHBondContact O-N 3.43Å; I522-V525 CarbonylContact O-C 3.42Å; I522-V525 PolarHBondContact O-N 3.25Å; I522-L526 HydrophobicContact CG2-CD1 3.55Å; I522-L526 HydrophobicContact CG2-CG 4.11Å; I522-L526 VanDerWaalsContact O-CB 3.28Å; I522-L526 WeakPolarHBondContact O-CB 3.27Å; I522-L526 VanDerWaalsContact O-CG 3.27Å; I522-L526 WeakPolarHBondContact O-CG 3.28Å; I522-L526 PolarHBondContact O-N 3.28Å
523	D	80.7	Confident	74.9	Confident	104 Å²	104	98.4 Å²	98.4	56%	0.556	47%	0.469	S	S	*	.	H	α-helix	trans	-62.1	-40	178.2	-67.3	-24.8	0	0	0	112.1	L519 L526 S527	L519-D523 VanDerWaalsContact O-CG 3.27Å; L519-D523 PolarHBondContact O-N 2.67Å; D523-L526 CarbonylContact O-C 3.54Å; D523-L526 PolarHBondContact O-N 2.92Å; D523-S527 PolarHBondContact O-N 3.45Å
524	Y	81.8	Confident	76.4	Confident	181 Å²	181	104.1 Å²	104.1	71%	0.71	48%	0.482	S	S	*	.	H	α-helix	trans	-63.4	-45	174.3	178.1	-103.1	0	0	0	111.6	K520 Q521 I522 L526 S527	K520-Y524 VanDerWaalsContact O-CB 3.3Å; K520-Y524 WeakPolarHBondContact O-CB 3Å; K520-Y524 PolarHBondContact O-N 3.37Å; Q521-Y524 PolarHBondContact O-N 3.01Å; I522-Y524 VanDerWaalsContact C-N 3.32Å; I522-Y524 PolarHBondContact O-N 3.43Å; Y524-L526 VanDerWaalsContact C-N 3.32Å; Y524-L526 PolarHBondContact O-N 3.02Å; Y524-S527 WeakPolarHBondContact O-CB 3.36Å; Y524-S527 PolarHBondContact O-N 2.94Å; Y524-S527 PolarHBondContact O-OG 3.25Å
525	V	79.7	Confident	77.9	Confident	64 Å²	64	104.1 Å²	104.1	39%	0.388	48%	0.479	S	S	.	.	H	α-helix	trans	-65.7	-36.8	176.8	171	0	0	0	0	111.3	Q521 I522 S527 L532	Q521-V525 WeakPolarHBondContact O-CB 3.27Å; Q521-V525 VanDerWaalsContact O-CG2 3.26Å; Q521-V525 WeakPolarHBondContact O-CG2 3.39Å; Q521-V525 PolarHBondContact O-N 3.44Å; I522-V525 CarbonylContact O-C 3.42Å; I522-V525 PolarHBondContact O-N 3.25Å; V525-S527 VanDerWaalsContact C-N 3.32Å; V525-L532 HydrophobicContact CG1-CD1 3.87Å; V525-L532 HydrophobicContact CG1-CD2 3.58Å; V525-L532 HydrophobicContact CG1-CG 4.39Å
526	L	84.3	Confident	79.5	Confident	78 Å²	78	98.6 Å²	98.6	41%	0.408	46%	0.455	S	S	.	.	H	α-helix	trans	-79.8	-7.9	176.9	-69.8	178.4	0	0	0	113.7	I522 D523 Y524 D528 R529	I522-L526 HydrophobicContact CG2-CD1 3.55Å; I522-L526 HydrophobicContact CG2-CG 4.11Å; I522-L526 VanDerWaalsContact O-CB 3.28Å; I522-L526 WeakPolarHBondContact O-CB 3.27Å; I522-L526 VanDerWaalsContact O-CG 3.27Å; I522-L526 WeakPolarHBondContact O-CG 3.28Å; I522-L526 PolarHBondContact O-N 3.28Å; D523-L526 CarbonylContact O-C 3.54Å; D523-L526 PolarHBondContact O-N 2.92Å; Y524-L526 VanDerWaalsContact C-N 3.32Å; Y524-L526 PolarHBondContact O-N 3.02Å; L526-D528 PolarHBondContact O-N 2.94Å; L526-R529 HydrophobicContact CD2-CG 4.42Å; L526-R529 WeakPolarHBondContact O-CG 3.25Å
527	S	87.4	Confident	80.6	Confident	94 Å²	94	93.8 Å²	93.8	66%	0.657	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.9	175	70.3	0	0	0	0	112.6	D523 Y524 V525	D523-S527 PolarHBondContact O-N 3.45Å; Y524-S527 WeakPolarHBondContact O-CB 3.36Å; Y524-S527 PolarHBondContact O-N 2.94Å; Y524-S527 PolarHBondContact O-OG 3.25Å; V525-S527 VanDerWaalsContact C-N 3.32Å
528	D	86	Confident	81.4	Confident	71 Å²	71	92.6 Å²	92.6	38%	0.38	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	66.4	177.4	-167.3	-3.8	0	0	0	110.6	L526 D530 R531 L532	L526-D528 PolarHBondContact O-N 2.94Å; D528-D530 VanDerWaalsContact C-N 3.27Å; D528-D530 PolarHBondContact O-N 3.31Å; D528-R531 HydrophobicContact CB-CB 4.27Å; D528-R531 PolarHBondContact O-N 3.5Å; D528-R531 WeakPolarHBondContact OD1-CB 3.49Å; D528-R531 PolarHBondContact OD1-N 3.33Å; D528-R531 WeakPolarHBondContact OD2-CB 3.43Å; D528-R531 WeakPolarHBondContact OD2-CD 3.22Å; D528-L532 PolarHBondContact O-N 2.89Å
529	R	85.9	Confident	81.9	Confident	178 Å²	178	92.9 Å²	92.9	67%	0.672	43%	0.427	S	S	*	.	H	α-helix	trans	-60.5	-37.8	-178	-57.7	-172.1	66	-178.5	-1.9	112.3	L526 L532 R533	L526-R529 HydrophobicContact CD2-CG 4.42Å; L526-R529 WeakPolarHBondContact O-CG 3.25Å; R529-L532 WeakPolarHBondContact O-CB 3.3Å; R529-L532 PolarHBondContact O-N 2.91Å; R529-R533 PolarHBondContact O-N 3.21Å
530	D	85.6	Confident	81.9	Confident	103 Å²	103	94.7 Å²	94.7	55%	0.551	43%	0.43	S	S	*	.	H	α-helix	trans	-66.5	-42.1	-176.9	-66.6	-38.2	0	0	0	111.3	D528 L532 R533 R534	D528-D530 VanDerWaalsContact C-N 3.27Å; D528-D530 PolarHBondContact O-N 3.31Å; D530-L532 VanDerWaalsContact C-N 3.29Å; D530-L532 PolarHBondContact O-N 3.43Å; D530-R533 PolarHBondContact O-N 3.01Å; D530-R534 WeakPolarHBondContact O-CG 3.4Å; D530-R534 PolarHBondContact O-N 3.45Å
531	R	84.1	Confident	81.9	Confident	172 Å²	172	90.6 Å²	90.6	65%	0.649	42%	0.418	S	S	*	.	H	α-helix	trans	-62.3	-38.8	172.9	-177.2	176.9	175.1	-124.1	-3.5	111.9	D528 R535	D528-R531 HydrophobicContact CB-CB 4.27Å; D528-R531 PolarHBondContact O-N 3.5Å; D528-R531 WeakPolarHBondContact OD1-CB 3.49Å; D528-R531 PolarHBondContact OD1-N 3.33Å; D528-R531 WeakPolarHBondContact OD2-CB 3.43Å; D528-R531 WeakPolarHBondContact OD2-CD 3.22Å; R531-R535 WeakPolarHBondContact O-CB 3.44Å; R531-R535 PolarHBondContact O-N 3.05Å
532	L	82	Confident	82.2	Confident	56 Å²	56	95.4 Å²	95.4	29%	0.293	45%	0.446	S	S	.	.	H	α-helix	trans	-64.1	-44	176.8	-125.6	72.9	0	0	0	111.8	V525 D528 R529 D530 R535 T536	V525-L532 HydrophobicContact CG1-CD1 3.87Å; V525-L532 HydrophobicContact CG1-CD2 3.58Å; V525-L532 HydrophobicContact CG1-CG 4.39Å; D528-L532 PolarHBondContact O-N 2.89Å; R529-L532 WeakPolarHBondContact O-CB 3.3Å; R529-L532 PolarHBondContact O-N 2.91Å; D530-L532 VanDerWaalsContact C-N 3.29Å; D530-L532 PolarHBondContact O-N 3.43Å; L532-R535 WeakPolarHBondContact O-CB 3.48Å; L532-R535 PolarHBondContact O-N 3.47Å; L532-T536 PolarHBondContact O-N 3.36Å
533	R	85.4	Confident	82.1	Confident	139 Å²	139	95.5 Å²	95.5	53%	0.525	44%	0.442	S	S	.	.	H	α-helix	trans	-64.5	-45.8	177.5	-171.2	179.7	178.7	-155.7	-4.4	112	R529 D530 R535 T536 Q537	R529-R533 PolarHBondContact O-N 3.21Å; D530-R533 PolarHBondContact O-N 3.01Å; R533-R535 PolarHBondContact O-N 3.46Å; R533-T536 PolarHBondContact O-N 2.93Å; R533-T536 VanDerWaalsContact O-N 3.12Å; R533-T536 PolarHBondContact O-OG1 2.82Å; R533-Q537 WeakPolarHBondContact O-CG 3.43Å; R533-Q537 PolarHBondContact O-N 2.99Å
534	R	84.9	Confident	81.9	Confident	147 Å²	147	95.4 Å²	95.4	56%	0.555	45%	0.45	S	S	*	.	H	α-helix	trans	-60.4	-37.2	174.9	-71.5	-177.2	-171.4	116.1	2.4	111.6	D530 T536 Q537 V538	D530-R534 WeakPolarHBondContact O-CG 3.4Å; D530-R534 PolarHBondContact O-N 3.45Å; R534-T536 VanDerWaalsContact C-N 3.3Å; R534-T536 PolarHBondContact O-N 2.87Å; R534-Q537 PolarHBondContact O-N 3.33Å; R534-V538 WeakPolarHBondContact O-CG2 3.43Å
535	R	82	Confident	81.5	Confident	81 Å²	81	89.3 Å²	89.3	31%	0.306	43%	0.426	S	S	.	.	H	α-helix	trans	-63.6	-34	177	-167.5	177.9	69.3	100.7	5.7	112.3	R531 L532 R533 Q537 R540 D571	R531-R535 WeakPolarHBondContact O-CB 3.44Å; R531-R535 PolarHBondContact O-N 3.05Å; L532-R535 WeakPolarHBondContact O-CB 3.48Å; L532-R535 PolarHBondContact O-N 3.47Å; R533-R535 PolarHBondContact O-N 3.46Å; R535-Q537 VanDerWaalsContact C-N 3.32Å; R535-R540 PolarHBondContact O-NH1 2.92Å; R535-R540 PolarHBondContact O-NH2 3.41Å; R535-D571 IonicContact CZ-OD2 3.69Å; R535-D571 IonicContact NH1-OD2 3.03Å; R535-D571 PolarHBondContact NH1-OD2 3.49Å
536	T	85.5	Confident	80.9	Confident	20 Å²	20	93.3 Å²	93.3	12%	0.123	45%	0.45	C	S	.	.	H	α-helix	trans	-78.3	-18.8	176.9	55.8	0	0	0	0	112.9	L532 R533 R534 V538 F567 D568	L532-T536 PolarHBondContact O-N 3.36Å; R533-T536 PolarHBondContact O-N 2.93Å; R533-T536 VanDerWaalsContact O-N 3.12Å; R533-T536 PolarHBondContact O-OG1 2.82Å; R534-T536 VanDerWaalsContact C-N 3.3Å; R534-T536 PolarHBondContact O-N 2.87Å; T536-V538 VanDerWaalsContact C-N 3.33Å; T536-V538 PolarHBondContact O-N 2.84Å; T536-F567 HydrophobicContact CG2-CD2 4.09Å; T536-F567 HydrophobicContact CG2-CE2 3.6Å; T536-F567 HydrophobicContact CG2-CZ 4.02Å; T536-F567 CarbonylContact O-C 3.51Å; T536-F567 WeakPolarHBondContact O-CA 3.47Å; T536-D568 WeakPolarHBondContact CA-O 3.19Å; T536-D568 PolarHBondContact O-N 3.43Å
537	Q	84.9	Confident	80.1	Confident	13 Å²	13	92.6 Å²	92.6	6%	0.061	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	12.4	-177.1	-73.7	172.3	-23.9	0	0	114	R533 R534 R535 V562 D563 E564 I566	R533-Q537 WeakPolarHBondContact O-CG 3.43Å; R533-Q537 PolarHBondContact O-N 2.99Å; R534-Q537 PolarHBondContact O-N 3.33Å; R535-Q537 VanDerWaalsContact C-N 3.32Å; Q537-V562 HydrophobicContact CB-CG1 3.56Å; Q537-V562 HydrophobicContact CG-CG1 4.46Å; Q537-V562 WeakPolarHBondContact O-CA 3.38Å; Q537-D563 VanDerWaalsContact CB-O 3.25Å; Q537-D563 WeakPolarHBondContact CB-O 3.4Å; Q537-D563 WeakPolarHBondContact CG-O 3.45Å; Q537-D563 PolarHBondContact O-N 3.3Å; Q537-E564 PolarHBondContact NE2-O 3.41Å; Q537-I566 WeakPolarHBondContact CA-O 3.44Å; Q537-I566 VanDerWaalsContact CG-O 3.32Å; Q537-I566 WeakPolarHBondContact CG-O 3.49Å
538	V	82.3	Confident	79	Confident	28 Å²	28	93.5 Å²	93.5	17%	0.17	46%	0.455	C	S	.	.	B	Isolated β-bridge	trans	-97.5	120.2	178.6	178.8	0	0	0	0	110.1	R534 T536 R540 E560	R534-V538 WeakPolarHBondContact O-CG2 3.43Å; T536-V538 VanDerWaalsContact C-N 3.33Å; T536-V538 PolarHBondContact O-N 2.84Å; V538-R540 HydrophobicContact CG1-CG 4.44Å; V538-R540 PolarHBondContact O-N 3.09Å; V538-E560 HydrophobicContact CG2-CB 4.49Å
539	K	77.9	Confident	77.5	Confident	77 Å²	77	93.7 Å²	93.7	34%	0.335	46%	0.46	S	S	.	.			trans	-70.9	106.5	173.8	-171.9	174.8	-175.8	171	0	111.3	Y543 E548 I566	K539-Y543 WeakPolarHBondContact CE-O 3.47Å; K539-Y543 HydrophobicContact CG-CE1 4.25Å; K539-Y543 PolarHBondContact NZ-O 3.45Å; K539-E548 IonicContact NZ-OE1 3.52Å; K539-I566 HydrophobicContact CB-CD1 4.03Å; K539-I566 HydrophobicContact CD-CD1 4.27Å; K539-I566 HydrophobicContact CG-CD1 4.38Å
540	R	75.8	Confident	75.9	Confident	94 Å²	94	91.4 Å²	91.4	36%	0.355	47%	0.472	S	S	.	.			trans	-94.4	-29.1	-177.3	-63.9	-178.9	179.1	80	11.5	114.4	R535 V538 D568	R535-R540 PolarHBondContact O-NH1 2.92Å; R535-R540 PolarHBondContact O-NH2 3.41Å; V538-R540 HydrophobicContact CG1-CG 4.44Å; V538-R540 PolarHBondContact O-N 3.09Å; R540-D568 WeakPolarHBondContact CB-OD2 3.45Å; R540-D568 IonicContact CZ-OD1 3.28Å; R540-D568 PolarHBondContact N-OD2 3.03Å; R540-D568 VanDerWaalsContact N-OD2 3.16Å; R540-D568 VanDerWaalsContact NH1-CG 3.34Å; R540-D568 PolarHBondContact NH1-O 3.18Å; R540-D568 IonicContact NH1-OD1 3.91Å; R540-D568 PolarHBondContact NH1-OD1 3.05Å; R540-D568 IonicContact NH1-OD2 3.61Å
541	S	76	Confident	74.2	Confident	49 Å²	49	94.3 Å²	94.3	34%	0.343	48%	0.482	S	S	.	.	S	Bend	trans	-117.8	156.6	-175.7	56.9	0	0	0	0	112.1	Y543	S541-Y543 WeakPolarHBondContact O-CD1 3.34Å; S541-Y543 PolarHBondContact O-N 2.98Å; S541-Y543 VanDerWaalsContact O-N 3.09Å; S541-Y543 WeakPolarHBondContact OG-CD1 3.39Å; S541-Y543 WeakPolarHBondContact OG-CE1 3.34Å
542	D	77.7	Confident	72.3	Confident	174 Å²	174	90.8 Å²	90.8	93%	0.93	48%	0.484	S	S	*	.			trans	-81.8	82.7	178.4	-76.2	-28.3	0	0	0	109.4
543	Y	74.6	Confident	70.4	Confident	83 Å²	83	100.4 Å²	100.4	33%	0.325	52%	0.516	S	S	.	.			trans	-119.4	155.4	166.7	62.9	-86	0	0	0	111.4	K539 S541 Y545 I566	K539-Y543 WeakPolarHBondContact CE-O 3.47Å; K539-Y543 HydrophobicContact CG-CE1 4.25Å; K539-Y543 PolarHBondContact NZ-O 3.45Å; S541-Y543 WeakPolarHBondContact O-CD1 3.34Å; S541-Y543 PolarHBondContact O-N 2.98Å; S541-Y543 VanDerWaalsContact O-N 3.09Å; S541-Y543 WeakPolarHBondContact OG-CD1 3.39Å; S541-Y543 WeakPolarHBondContact OG-CE1 3.34Å; Y543-Y545 HydrophobicContact CE2-CD1 4.42Å; Y543-I566 VanDerWaalsContact OH-CG2 3.26Å; Y543-I566 WeakPolarHBondContact OH-CG2 3.36Å
544	S	76.6	Confident	68.4	Low	101 Å²	101	96.3 Å²	96.3	71%	0.706	52%	0.517	S	S	*	.			trans	-100.4	129.8	174.7	-170.9	0	0	0	0	108.1
545	Y	72.2	Confident	66.2	Low	53 Å²	53	95 Å²	95	21%	0.208	52%	0.521	C	S	.	.			trans	-111.6	156.3	171.6	61.1	-82.9	0	0	0	110.2	Y543 D563 I566	Y543-Y545 HydrophobicContact CE2-CD1 4.42Å; Y545-D563 PolarHBondContact OH-OD2 3.28Å; Y545-I566 HydrophobicContact CE1-CD1 3.98Å
546	V	67.1	Low	64.5	Low	149 Å²	149	95.4 Å²	95.4	90%	0.903	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	131.7	-178.8	179.3	0	0	0	0	108.7
547	G	67.2	Low	62.7	Low	63 Å²	63	100.7 Å²	100.7	65%	0.649	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	94.7	8.8	-178.8	0	0	0	0	0	114.8	P549	G547-P549 VanDerWaalsContact O-CD 3.25Å; G547-P549 WeakPolarHBondContact O-CD 3.4Å
548	E	64.5	Low	61	Low	112 Å²	112	108.2 Å²	108.2	52%	0.523	61%	0.61	S	S	.	*			trans	-46	110	177.5	-165.6	172.5	-136.4	0	0	109.5	K539 S550	K539-E548 IonicContact NZ-OE1 3.52Å; E548-S550 PolarHBondContact O-N 3.28Å
549	P	56	Low	59.6	Low	75 Å²	75	112.5 Å²	112.5	49%	0.487	63%	0.632	S	S	.	*			trans	-61.2	129.2	-178.8	22.1	-29.9	0	0	0	106.2	G547 Q551	G547-P549 VanDerWaalsContact O-CD 3.25Å; G547-P549 WeakPolarHBondContact O-CD 3.4Å; P549-Q551 PolarHBondContact O-N 3.36Å
550	S	52	Low	58.6	Low	130 Å²	130	115.8 Å²	115.8	91%	0.909	65%	0.648	S	S	*	*			trans	-69.1	41.6	179.9	49.6	0	0	0	0	112.2	E548 S552	E548-S550 PolarHBondContact O-N 3.28Å; S550-S552 PolarHBondContact O-N 3.29Å
551	Q	50.4	Low	58	Low	164 Å²	164	117 Å²	117	77%	0.766	67%	0.666	S	S	*	*			trans	-86	101.7	171.9	-69.3	-164.4	5.8	0	0	108.5	P549	P549-Q551 PolarHBondContact O-N 3.36Å
552	S	44	Very low	57.6	Low	98 Å²	98	117.5 Å²	117.5	69%	0.685	67%	0.667	S	S	*	*			trans	18.3	116.4	142.7	51.1	0	0	0	0	116.3	S550 G554	S550-S552 PolarHBondContact O-N 3.29Å; S552-G554 PolarHBondContact O-N 3.38Å
553	R	41.1	Very low	57.5	Low	259 Å²	259	110.8 Å²	110.8	98%	0.977	63%	0.631	S	S	*	*			trans	-57.4	55.6	156.8	-65.7	174.9	167.9	170.6	-2.9	112.4
554	G	43	Very low	57.6	Low	52 Å²	52	113.6 Å²	113.6	54%	0.536	65%	0.647	S	S	.	*			trans	-85.4	120.8	177.8	0	0	0	0	0	109.4	S552 A556	S552-G554 PolarHBondContact O-N 3.38Å; G554-A556 VanDerWaalsContact C-N 3.26Å; G554-A556 PolarHBondContact O-N 3.46Å
555	D	40.5	Very low	57.7	Low	121 Å²	121	116.4 Å²	116.4	65%	0.647	65%	0.649	S	S	*	*			trans	-55.5	76.2	176.5	-70.6	-38.3	0	0	0	113.5	R615	D555-R615 IonicContact OD1-CZ 3.71Å; D555-R615 IonicContact OD1-NH1 3.63Å; D555-R615 PolarHBondContact OD1-NH1 2.92Å; D555-R615 IonicContact OD1-NH2 3.76Å; D555-R615 PolarHBondContact OD1-NH2 2.97Å; D555-R615 IonicContact OD2-CZ 3.81Å; D555-R615 IonicContact OD2-NH1 2.82Å; D555-R615 IonicContact OD2-NH2 2.72Å; D555-R615 PolarHBondContact OD2-NH2 3.29Å
556	A	45.3	Very low	58.1	Low	89 Å²	89	114.5 Å²	114.5	74%	0.736	64%	0.642	S	S	*	*			trans	-99.9	152.7	163.3	0	0	0	0	0	109	G554	G554-A556 VanDerWaalsContact C-N 3.26Å; G554-A556 PolarHBondContact O-N 3.46Å
557	N	47.7	Very low	58.9	Low	131 Å²	131	114.3 Å²	114.3	70%	0.701	63%	0.629	S	S	*	*			trans	-47.5	161.2	-173.7	-84.9	-41	0	0	0	113.3	D559	N557-D559 PolarHBondContact O-N 3.37Å
558	N	50	Low	59.6	Low	170 Å²	170	111.8 Å²	111.8	91%	0.909	60%	0.601	S	S	*	*	S	Bend	trans	-54.3	22.4	166	-122.3	4.7	0	0	0	114.4	E560	N558-E560 PolarHBondContact O-N 3.41Å
559	D	52.5	Low	60.5	Low	119 Å²	119	109 Å²	109	64%	0.636	59%	0.59	S	S	*	*			trans	-61.5	108.7	164.7	-62.7	-31.2	0	0	0	104.8	N557 V561	N557-D559 PolarHBondContact O-N 3.37Å; D559-V561 PolarHBondContact O-N 3.3Å
560	E	57.4	Low	61.6	Low	146 Å²	146	109 Å²	109	68%	0.682	59%	0.586	S	S	*	*			trans	-44.1	104.2	175.6	-62	172.5	167.3	0	0	106.8	V538 N558 V562	V538-E560 HydrophobicContact CG2-CB 4.49Å; N558-E560 PolarHBondContact O-N 3.41Å; E560-V562 WeakPolarHBondContact O-CG2 3.1Å; E560-V562 PolarHBondContact O-N 3.19Å
561	V	62.7	Low	63	Low	118 Å²	118	104.8 Å²	104.8	72%	0.715	55%	0.553	S	S	*	*			trans	-66.8	95.7	-178.3	179.9	0	0	0	0	105.4	D559 D563	D559-V561 PolarHBondContact O-N 3.3Å; V561-D563 PolarHBondContact O-N 3.27Å
562	V	66.9	Low	64.5	Low	61 Å²	61	101.5 Å²	101.5	37%	0.37	54%	0.536	S	S	.	.	B	Isolated β-bridge	trans	-74.1	105.1	173.3	179.9	0	0	0	0	104.8	Q537 E560	Q537-V562 HydrophobicContact CB-CG1 3.56Å; Q537-V562 HydrophobicContact CG-CG1 4.46Å; Q537-V562 WeakPolarHBondContact O-CA 3.38Å; E560-V562 WeakPolarHBondContact O-CG2 3.1Å; E560-V562 PolarHBondContact O-N 3.19Å
563	D	75	Confident	66.3	Low	32 Å²	32	103.1 Å²	103.1	17%	0.171	53%	0.528	C	S	.	.			trans	-96	116.7	173.6	-173.2	-18.1	0	0	0	107.5	Q537 Y545 V561 E565 I566	Q537-D563 VanDerWaalsContact CB-O 3.25Å; Q537-D563 WeakPolarHBondContact CB-O 3.4Å; Q537-D563 WeakPolarHBondContact CG-O 3.45Å; Q537-D563 PolarHBondContact O-N 3.3Å; Y545-D563 PolarHBondContact OH-OD2 3.28Å; V561-D563 PolarHBondContact O-N 3.27Å; D563-E565 PolarHBondContact O-N 2.9Å; D563-E565 PolarHBondContact OD1-N 2.98Å; D563-I566 HydrophobicContact CB-CB 4.09Å; D563-I566 HydrophobicContact CB-CD1 3.62Å; D563-I566 HydrophobicContact CB-CG1 3.71Å; D563-I566 PolarHBondContact O-N 2.71Å; D563-I566 VanDerWaalsContact O-N 3.09Å
564	E	77.7	Confident	68.1	Low	142 Å²	142	94.8 Å²	94.8	66%	0.664	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-23.9	-176.2	-66.1	-165.6	-178.2	0	0	113.1	Q537	Q537-E564 PolarHBondContact NE2-O 3.41Å
565	E	78.4	Confident	69.7	Low	161 Å²	161	96.6 Å²	96.6	75%	0.752	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-12.6	179.9	-58.1	-169.6	161.4	0	0	113	D563	D563-E565 PolarHBondContact O-N 2.9Å; D563-E565 PolarHBondContact OD1-N 2.98Å
566	I	80.7	Confident	71.5	Confident	13 Å²	13	94.5 Å²	94.5	7%	0.067	48%	0.483	C	S	.	.			trans	-89.9	134.2	-179.6	-65.2	-179.1	0	0	0	111	Q537 K539 Y543 Y545 D563 D568	Q537-I566 WeakPolarHBondContact CA-O 3.44Å; Q537-I566 VanDerWaalsContact CG-O 3.32Å; Q537-I566 WeakPolarHBondContact CG-O 3.49Å; K539-I566 HydrophobicContact CB-CD1 4.03Å; K539-I566 HydrophobicContact CD-CD1 4.27Å; K539-I566 HydrophobicContact CG-CD1 4.38Å; Y543-I566 VanDerWaalsContact OH-CG2 3.26Å; Y543-I566 WeakPolarHBondContact OH-CG2 3.36Å; Y545-I566 HydrophobicContact CE1-CD1 3.98Å; D563-I566 HydrophobicContact CB-CB 4.09Å; D563-I566 HydrophobicContact CB-CD1 3.62Å; D563-I566 HydrophobicContact CB-CG1 3.71Å; D563-I566 PolarHBondContact O-N 2.71Å; D563-I566 VanDerWaalsContact O-N 3.09Å; I566-D568 HydrophobicContact CG2-CB 4.15Å
567	F	83.4	Confident	73.1	Confident	145 Å²	145	95 Å²	95	64%	0.636	47%	0.473	S	S	*	.			trans	-124.4	104.8	165.3	-172.5	-88.9	0	0	0	110	T536 D569	T536-F567 HydrophobicContact CG2-CD2 4.09Å; T536-F567 HydrophobicContact CG2-CE2 3.6Å; T536-F567 HydrophobicContact CG2-CZ 4.02Å; T536-F567 CarbonylContact O-C 3.51Å; T536-F567 WeakPolarHBondContact O-CA 3.47Å; F567-D569 HydrophobicContact CE1-CB 4.01Å; F567-D569 HydrophobicContact CZ-CB 4.46Å
568	D	81.9	Confident	74.3	Confident	9 Å²	9	94.2 Å²	94.2	5%	0.048	46%	0.46	C	S	.	.			trans	-122.3	108.7	-179.2	177	-31.3	0	0	0	108.8	T536 R540 I566 D570	T536-D568 WeakPolarHBondContact CA-O 3.19Å; T536-D568 PolarHBondContact O-N 3.43Å; R540-D568 WeakPolarHBondContact CB-OD2 3.45Å; R540-D568 IonicContact CZ-OD1 3.28Å; R540-D568 PolarHBondContact N-OD2 3.03Å; R540-D568 VanDerWaalsContact N-OD2 3.16Å; R540-D568 VanDerWaalsContact NH1-CG 3.34Å; R540-D568 PolarHBondContact NH1-O 3.18Å; R540-D568 IonicContact NH1-OD1 3.91Å; R540-D568 PolarHBondContact NH1-OD1 3.05Å; R540-D568 IonicContact NH1-OD2 3.61Å; I566-D568 HydrophobicContact CG2-CB 4.15Å; D568-D570 WeakPolarHBondContact OD1-CB 3.29Å; D568-D570 PolarHBondContact OD1-N 3.37Å; D568-D570 VanDerWaalsContact OD1-N 3.09Å
569	D	83	Confident	75.3	Confident	54 Å²	54	90.5 Å²	90.5	29%	0.289	44%	0.438	S	S	.	.			trans	-105.1	15.5	177.3	66.8	-18.7	0	0	0	113.4	F567 D571 F572 Y573	F567-D569 HydrophobicContact CE1-CB 4.01Å; F567-D569 HydrophobicContact CZ-CB 4.46Å; D569-D571 VanDerWaalsContact C-N 3.26Å; D569-D571 PolarHBondContact O-N 2.77Å; D569-D571 VanDerWaalsContact O-N 3.17Å; D569-F572 VanDerWaalsContact O-CB 3.31Å; D569-F572 WeakPolarHBondContact O-CB 3.48Å; D569-F572 PolarHBondContact O-N 3.36Å; D569-Y573 WeakPolarHBondContact OD2-CE2 3.35Å
570	D	80.2	Confident	76.3	Confident	76 Å²	76	89.9 Å²	89.9	41%	0.406	43%	0.433	S	S	.	.	H	α-helix	trans	-58.3	-35.2	-176.3	-81.2	-19.6	0	0	0	112.8	D568 F572 Y573 E574	D568-D570 WeakPolarHBondContact OD1-CB 3.29Å; D568-D570 PolarHBondContact OD1-N 3.37Å; D568-D570 VanDerWaalsContact OD1-N 3.09Å; D570-F572 PolarHBondContact O-N 3.42Å; D570-Y573 PolarHBondContact O-N 3.2Å; D570-E574 WeakPolarHBondContact O-CG 3.46Å; D570-E574 PolarHBondContact O-N 3.34Å
571	D	81.2	Confident	76.7	Confident	40 Å²	40	86.8 Å²	86.8	21%	0.214	42%	0.421	C	S	.	.	H	α-helix	trans	-60.5	-32.7	176.7	175.4	45.3	0	0	0	112.3	R535 D569 E574 Q575	R535-D571 IonicContact CZ-OD2 3.69Å; R535-D571 IonicContact NH1-OD2 3.03Å; R535-D571 PolarHBondContact NH1-OD2 3.49Å; D569-D571 VanDerWaalsContact C-N 3.26Å; D569-D571 PolarHBondContact O-N 2.77Å; D569-D571 VanDerWaalsContact O-N 3.17Å; D571-E574 PolarHBondContact O-N 2.87Å; D571-Q575 WeakPolarHBondContact O-CB 3.5Å; D571-Q575 VanDerWaalsContact O-CG 3.26Å; D571-Q575 WeakPolarHBondContact O-CG 3.44Å; D571-Q575 PolarHBondContact O-N 3.5Å; D571-Q575 PolarHBondContact OD1-NE2 3.14Å; D571-Q575 VanDerWaalsContact OD1-NE2 3.12Å; D571-Q575 PolarHBondContact OD2-NE2 3.41Å; D571-Q575 VanDerWaalsContact OD2-NE2 3.12Å
572	F	82.3	Confident	77.1	Confident	95 Å²	95	86.6 Å²	86.6	42%	0.417	41%	0.412	S	S	.	.	H	α-helix	trans	-65.8	-45.9	176.1	174.4	-108.5	0	0	0	111.4	D569 D570 Q575 L576	D569-F572 VanDerWaalsContact O-CB 3.31Å; D569-F572 WeakPolarHBondContact O-CB 3.48Å; D569-F572 PolarHBondContact O-N 3.36Å; D570-F572 PolarHBondContact O-N 3.42Å; F572-Q575 WeakPolarHBondContact O-CB 3.49Å; F572-Q575 PolarHBondContact O-N 2.99Å; F572-L576 HydrophobicContact CD1-CD1 4.16Å; F572-L576 HydrophobicContact CE1-CD1 3.58Å; F572-L576 HydrophobicContact CE1-CG 4.38Å; F572-L576 HydrophobicContact CE2-CD1 4.41Å; F572-L576 HydrophobicContact CE2-CG 4.44Å; F572-L576 HydrophobicContact CZ-CD1 3.72Å; F572-L576 HydrophobicContact CZ-CG 4.21Å; F572-L576 PolarHBondContact O-N 2.9Å
573	Y	80.4	Confident	76.8	Confident	132 Å²	132	89.7 Å²	89.7	52%	0.518	42%	0.417	S	S	.	.	H	α-helix	trans	-68.1	-35.7	175.9	-63.4	-71.6	0	0	0	112.3	D569 D570 Q575 L576 L577	D569-Y573 WeakPolarHBondContact OD2-CE2 3.35Å; D570-Y573 PolarHBondContact O-N 3.2Å; Y573-Q575 VanDerWaalsContact C-N 3.29Å; Y573-Q575 PolarHBondContact O-N 3.23Å; Y573-L576 HydrophobicContact CD1-CD1 4.48Å; Y573-L576 PolarHBondContact O-N 3.09Å; Y573-L577 WeakPolarHBondContact O-CB 3.37Å; Y573-L577 PolarHBondContact O-N 3.41Å
574	E	79.6	Confident	76.1	Confident	84 Å²	84	92.2 Å²	92.2	39%	0.393	44%	0.437	S	S	.	.	H	α-helix	trans	-61.3	-38.8	172.6	-75.2	-155.3	167.6	0	0	111.9	D570 D571 R578	D570-E574 WeakPolarHBondContact O-CG 3.46Å; D570-E574 PolarHBondContact O-N 3.34Å; D571-E574 PolarHBondContact O-N 2.87Å; E574-R578 WeakPolarHBondContact O-CB 3.36Å; E574-R578 WeakPolarHBondContact O-CD 3.43Å; E574-R578 WeakPolarHBondContact O-CG 3.43Å; E574-R578 PolarHBondContact O-N 2.82Å
575	Q	77	Confident	75.2	Confident	90 Å²	90	86.6 Å²	86.6	42%	0.421	41%	0.412	S	S	.	.	H	α-helix	trans	-65.9	-48.1	175.4	-74.3	171.8	21.8	0	0	111.4	D571 F572 Y573 L577 R578 E579	D571-Q575 WeakPolarHBondContact O-CB 3.5Å; D571-Q575 VanDerWaalsContact O-CG 3.26Å; D571-Q575 WeakPolarHBondContact O-CG 3.44Å; D571-Q575 PolarHBondContact O-N 3.5Å; D571-Q575 PolarHBondContact OD1-NE2 3.14Å; D571-Q575 VanDerWaalsContact OD1-NE2 3.12Å; D571-Q575 PolarHBondContact OD2-NE2 3.41Å; D571-Q575 VanDerWaalsContact OD2-NE2 3.12Å; F572-Q575 WeakPolarHBondContact O-CB 3.49Å; F572-Q575 PolarHBondContact O-N 2.99Å; Y573-Q575 VanDerWaalsContact C-N 3.29Å; Y573-Q575 PolarHBondContact O-N 3.23Å; Q575-L577 VanDerWaalsContact C-N 3.3Å; Q575-L577 PolarHBondContact O-N 3.39Å; Q575-R578 WeakPolarHBondContact O-CB 3.49Å; Q575-R578 PolarHBondContact O-N 3.19Å; Q575-R578 VanDerWaalsContact O-N 3.13Å; Q575-E579 WeakPolarHBondContact O-CG 3.42Å; Q575-E579 PolarHBondContact O-N 2.94Å
576	L	78.1	Confident	74.2	Confident	77 Å²	77	81.7 Å²	81.7	40%	0.403	41%	0.405	S	S	.	.	H	α-helix	trans	-58.3	-41.5	175.3	-71	178.6	0	0	0	112.2	F572 Y573 E579 L580	F572-L576 HydrophobicContact CD1-CD1 4.16Å; F572-L576 HydrophobicContact CE1-CD1 3.58Å; F572-L576 HydrophobicContact CE1-CG 4.38Å; F572-L576 HydrophobicContact CE2-CD1 4.41Å; F572-L576 HydrophobicContact CE2-CG 4.44Å; F572-L576 HydrophobicContact CZ-CD1 3.72Å; F572-L576 HydrophobicContact CZ-CG 4.21Å; F572-L576 PolarHBondContact O-N 2.9Å; Y573-L576 HydrophobicContact CD1-CD1 4.48Å; Y573-L576 PolarHBondContact O-N 3.09Å; L576-E579 PolarHBondContact O-N 3.41Å; L576-L580 WeakPolarHBondContact O-CB 3.49Å; L576-L580 PolarHBondContact O-N 3Å
577	L	78.2	Confident	73.1	Confident	99 Å²	99	86.9 Å²	86.9	52%	0.518	43%	0.433	S	S	.	.	H	α-helix	trans	-66.5	-38.8	177.7	-176.6	60.3	0	0	0	111.5	Y573 Q575 L580 I581	Y573-L577 WeakPolarHBondContact O-CB 3.37Å; Y573-L577 PolarHBondContact O-N 3.41Å; Q575-L577 VanDerWaalsContact C-N 3.3Å; Q575-L577 PolarHBondContact O-N 3.39Å; L577-L580 PolarHBondContact O-N 3.47Å; L577-I581 HydrophobicContact CD1-CD1 4.21Å; L577-I581 HydrophobicContact CD1-CG1 4.38Å; L577-I581 HydrophobicContact CG-CD1 3.96Å; L577-I581 WeakPolarHBondContact O-CB 3.33Å; L577-I581 VanDerWaalsContact O-CG1 3.23Å; L577-I581 WeakPolarHBondContact O-CG1 3.39Å; L577-I581 PolarHBondContact O-N 2.85Å
578	R	74.4	Confident	71.4	Confident	115 Å²	115	83 Å²	83	43%	0.434	42%	0.423	S	S	.	.	H	α-helix	trans	-63.7	-43.6	174.6	-75.6	163.1	177.8	-130.3	7.1	111.7	E574 Q575 L580 I581 H582	E574-R578 WeakPolarHBondContact O-CB 3.36Å; E574-R578 WeakPolarHBondContact O-CD 3.43Å; E574-R578 WeakPolarHBondContact O-CG 3.43Å; E574-R578 PolarHBondContact O-N 2.82Å; Q575-R578 WeakPolarHBondContact O-CB 3.49Å; Q575-R578 PolarHBondContact O-N 3.19Å; Q575-R578 VanDerWaalsContact O-N 3.13Å; R578-L580 VanDerWaalsContact C-N 3.35Å; R578-I581 PolarHBondContact O-N 2.93Å; R578-H582 WeakPolarHBondContact O-CB 3.35Å; R578-H582 PolarHBondContact O-CD2 3.21Å; R578-H582 PolarHBondContact O-N 3.43Å
579	E	69.5	Low	70.2	Confident	93 Å²	93	89.4 Å²	89.4	44%	0.435	46%	0.463	S	S	.	.	H	α-helix	trans	-61.5	-44.7	174.5	-73.2	-173.8	171.9	0	0	111.3	Q575 L576 I581 H582 R583	Q575-E579 WeakPolarHBondContact O-CG 3.42Å; Q575-E579 PolarHBondContact O-N 2.94Å; L576-E579 PolarHBondContact O-N 3.41Å; E579-I581 PolarHBondContact O-N 3.2Å; E579-H582 PolarHBondContact O-N 3.36Å; E579-R583 VanDerWaalsContact O-CB 3.27Å; E579-R583 WeakPolarHBondContact O-CB 3.35Å; E579-R583 PolarHBondContact O-N 3.06Å
580	L	74.3	Confident	69.1	Low	105 Å²	105	90.3 Å²	90.3	55%	0.55	47%	0.468	S	S	.	.	H	α-helix	trans	-60.9	-44.1	177.4	-175.2	65.9	0	0	0	111.8	L576 L577 R578 R583 S584	L576-L580 WeakPolarHBondContact O-CB 3.49Å; L576-L580 PolarHBondContact O-N 3Å; L577-L580 PolarHBondContact O-N 3.47Å; R578-L580 VanDerWaalsContact C-N 3.35Å; L580-R583 PolarHBondContact O-N 3.01Å; L580-S584 VanDerWaalsContact O-CB 3.28Å; L580-S584 WeakPolarHBondContact O-CB 3.43Å; L580-S584 PolarHBondContact O-N 3.42Å
581	I	66.7	Low	68.4	Low	81 Å²	81	91.3 Å²	91.3	42%	0.415	48%	0.478	S	S	.	.	H	α-helix	trans	-66.1	-43.7	177	-68.8	166.3	0	0	0	110.8	L577 R578 E579 R583 S584 T585	L577-I581 HydrophobicContact CD1-CD1 4.21Å; L577-I581 HydrophobicContact CD1-CG1 4.38Å; L577-I581 HydrophobicContact CG-CD1 3.96Å; L577-I581 WeakPolarHBondContact O-CB 3.33Å; L577-I581 VanDerWaalsContact O-CG1 3.23Å; L577-I581 WeakPolarHBondContact O-CG1 3.39Å; L577-I581 PolarHBondContact O-N 2.85Å; R578-I581 PolarHBondContact O-N 2.93Å; E579-I581 PolarHBondContact O-N 3.2Å; I581-R583 VanDerWaalsContact C-N 3.27Å; I581-R583 PolarHBondContact O-N 3.4Å; I581-S584 PolarHBondContact O-N 3.44Å; I581-T585 WeakPolarHBondContact O-CB 3.28Å; I581-T585 PolarHBondContact O-N 3.36Å; I581-T585 PolarHBondContact O-OG1 3.43Å
582	H	69.6	Low	67.8	Low	114 Å²	114	95 Å²	95	53%	0.528	50%	0.497	S	S	.	.	H	α-helix	trans	-60.3	-39.2	176.5	-97.1	-85.3	0	0	0	111.8	R578 E579 T585 G586	R578-H582 WeakPolarHBondContact O-CB 3.35Å; R578-H582 PolarHBondContact O-CD2 3.21Å; R578-H582 PolarHBondContact O-N 3.43Å; E579-H582 PolarHBondContact O-N 3.36Å; H582-T585 WeakPolarHBondContact CA-OG1 3.28Å; H582-T585 PolarHBondContact O-OG1 2.91Å; H582-T585 VanDerWaalsContact O-OG1 3.13Å; H582-G586 PolarHBondContact O-N 2.97Å
583	R	62.1	Low	66.9	Low	126 Å²	126	93.3 Å²	93.3	48%	0.475	50%	0.495	S	S	.	.	H	α-helix	trans	-73.4	-39.4	178.2	-159.9	170.2	159.1	-120.3	-2.9	112.4	M501 E579 L580 I581 T585 G586	M501-R583 VanDerWaalsContact CE-CZ 3.43Å; M501-R583 PolarHBondContact SD-NH2 3.48Å; E579-R583 VanDerWaalsContact O-CB 3.27Å; E579-R583 WeakPolarHBondContact O-CB 3.35Å; E579-R583 PolarHBondContact O-N 3.06Å; L580-R583 PolarHBondContact O-N 3.01Å; I581-R583 VanDerWaalsContact C-N 3.27Å; I581-R583 PolarHBondContact O-N 3.4Å; R583-T585 VanDerWaalsContact C-N 3.35Å; R583-G586 PolarHBondContact O-N 2.81Å
584	S	59.1	Low	65.8	Low	85 Å²	85	90.5 Å²	90.5	59%	0.594	49%	0.486	S	S	*	.	H	α-helix	trans	-64.2	-39.3	173.3	178.3	0	0	0	0	111.9	L580 I581 N587	L580-S584 VanDerWaalsContact O-CB 3.28Å; L580-S584 WeakPolarHBondContact O-CB 3.43Å; L580-S584 PolarHBondContact O-N 3.42Å; I581-S584 PolarHBondContact O-N 3.44Å; S584-N587 PolarHBondContact O-N 2.95Å
585	T	59.2	Low	65.2	Low	24 Å²	24	88.5 Å²	88.5	15%	0.147	49%	0.488	C	S	.	.	H	α-helix	trans	-75.2	-28.9	177.3	42.3	0	0	0	0	113.4	I581 H582 R583 N587 C588	I581-T585 WeakPolarHBondContact O-CB 3.28Å; I581-T585 PolarHBondContact O-N 3.36Å; I581-T585 PolarHBondContact O-OG1 3.43Å; H582-T585 WeakPolarHBondContact CA-OG1 3.28Å; H582-T585 PolarHBondContact O-OG1 2.91Å; H582-T585 VanDerWaalsContact O-OG1 3.13Å; R583-T585 VanDerWaalsContact C-N 3.35Å; T585-N587 PolarHBondContact O-N 3.08Å; T585-C588 PolarHBondContact O-N 3.2Å; T585-C588 VanDerWaalsContact O-N 3.16Å
586	G	58.1	Low	64.8	Low	58 Å²	58	92.5 Å²	92.5	60%	0.598	50%	0.499	S	S	*	.	H	α-helix	trans	-61.6	-24.4	173.1	0	0	0	0	0	114.3	H582 R583	H582-G586 PolarHBondContact O-N 2.97Å; R583-G586 PolarHBondContact O-N 2.81Å
587	N	56.5	Low	64.1	Low	123 Å²	123	93.9 Å²	93.9	66%	0.658	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	0.3	178.3	-68.9	3.3	0	0	0	113.6	S584 T585	S584-N587 PolarHBondContact O-N 2.95Å; T585-N587 PolarHBondContact O-N 3.08Å
588	C	47.7	Very low	63.3	Low	64 Å²	64	95.7 Å²	95.7	43%	0.432	50%	0.504	S	S	.	.			trans	-86.8	117.4	-179.7	-166.4	0	0	0	0	109.9	T585 D590	T585-C588 PolarHBondContact O-N 3.2Å; T585-C588 VanDerWaalsContact O-N 3.16Å; C588-D590 PolarHBondContact O-N 3.08Å; C588-D590 VanDerWaalsContact O-N 3.09Å
589	T	56.3	Low	62.8	Low	142 Å²	142	92.1 Å²	92.1	87%	0.871	50%	0.499	S	S	*	.	S	Bend	trans	-65.1	-9.6	-172.7	48.3	0	0	0	0	115.5	P591	T589-P591 WeakPolarHBondContact O-CD 3.41Å
590	D	61.6	Low	62.7	Low	74 Å²	74	94.9 Å²	94.9	40%	0.396	51%	0.509	S	S	.	.			trans	-113.9	100	-174.7	-166.3	-10	0	0	0	112.8	C588 L592 V593 Q594	C588-D590 PolarHBondContact O-N 3.08Å; C588-D590 VanDerWaalsContact O-N 3.09Å; D590-L592 PolarHBondContact O-N 2.97Å; D590-L592 VanDerWaalsContact O-N 3.14Å; D590-L592 WeakPolarHBondContact OD1-CB 3.31Å; D590-L592 PolarHBondContact OD1-N 3.25Å; D590-L592 VanDerWaalsContact OD1-N 3.1Å; D590-V593 HydrophobicContact CB-CB 4.39Å; D590-V593 HydrophobicContact CB-CG2 4.19Å; D590-V593 PolarHBondContact O-N 3.23Å; D590-V593 WeakPolarHBondContact OD2-CG2 3.49Å; D590-Q594 PolarHBondContact O-N 3.35Å
591	P	65.2	Low	62.2	Low	96 Å²	96	93.5 Å²	93.5	62%	0.623	50%	0.502	S	S	*	.	H	α-helix	trans	-56.7	-26.3	177.4	-26.5	35	0	0	0	114.3	T589 G595	T589-P591 WeakPolarHBondContact O-CD 3.41Å; P591-G595 PolarHBondContact O-N 2.96Å
592	L	67.6	Low	62.2	Low	118 Å²	118	94.7 Å²	94.7	62%	0.618	51%	0.506	S	S	*	.	H	α-helix	trans	-76.9	-37.4	-176.5	-157.3	78.4	0	0	0	111.7	D590 G595 R596	D590-L592 PolarHBondContact O-N 2.97Å; D590-L592 VanDerWaalsContact O-N 3.14Å; D590-L592 WeakPolarHBondContact OD1-CB 3.31Å; D590-L592 PolarHBondContact OD1-N 3.25Å; D590-L592 VanDerWaalsContact OD1-N 3.1Å; L592-G595 PolarHBondContact O-N 3.45Å; L592-R596 WeakPolarHBondContact O-CG 3.47Å; L592-R596 PolarHBondContact O-N 2.96Å; L592-R596 VanDerWaalsContact O-N 3.1Å
593	V	63.8	Low	62.1	Low	59 Å²	59	95.9 Å²	95.9	36%	0.358	51%	0.509	S	S	.	.	H	α-helix	trans	-68.3	-39.8	173.2	178.3	0	0	0	0	110	D590 R596 Q597	D590-V593 HydrophobicContact CB-CB 4.39Å; D590-V593 HydrophobicContact CB-CG2 4.19Å; D590-V593 PolarHBondContact O-N 3.23Å; D590-V593 WeakPolarHBondContact OD2-CG2 3.49Å; V593-R596 PolarHBondContact O-N 2.95Å; V593-Q597 WeakPolarHBondContact O-CG 3.29Å; V593-Q597 PolarHBondContact O-N 2.9Å
594	Q	58.2	Low	61.8	Low	74 Å²	74	94.9 Å²	94.9	35%	0.346	51%	0.513	S	S	.	.	H	α-helix	trans	-58.5	-49.7	173.7	-170.1	-176.5	16.6	0	0	111.2	D590 R596 Q597 W598	D590-Q594 PolarHBondContact O-N 3.35Å; Q594-R596 VanDerWaalsContact C-N 3.3Å; Q594-R596 PolarHBondContact O-N 3.02Å; Q594-Q597 PolarHBondContact O-N 3.2Å; Q594-W598 WeakPolarHBondContact O-CB 3.41Å; Q594-W598 PolarHBondContact O-N 3.42Å
595	G	65.1	Low	61.8	Low	41 Å²	41	96.2 Å²	96.2	42%	0.423	51%	0.505	S	S	.	.	H	α-helix	trans	-58.7	-38.4	176.4	0	0	0	0	0	113.1	P591 L592 A599	P591-G595 PolarHBondContact O-N 2.96Å; L592-G595 PolarHBondContact O-N 3.45Å; G595-A599 WeakPolarHBondContact O-CB 3.33Å; G595-A599 PolarHBondContact O-N 3.31Å
596	R	70.5	Confident	61.6	Low	174 Å²	174	99.6 Å²	99.6	66%	0.657	53%	0.526	S	S	*	.	H	α-helix	trans	-67.1	-41.7	175.4	-73.6	178.9	-173.6	-141.3	2.6	112.7	L592 V593 Q594 K600	L592-R596 WeakPolarHBondContact O-CG 3.47Å; L592-R596 PolarHBondContact O-N 2.96Å; L592-R596 VanDerWaalsContact O-N 3.1Å; V593-R596 PolarHBondContact O-N 2.95Å; Q594-R596 VanDerWaalsContact C-N 3.3Å; Q594-R596 PolarHBondContact O-N 3.02Å; R596-K600 WeakPolarHBondContact O-CG 3.5Å; R596-K600 PolarHBondContact O-N 3.35Å
597	Q	62.4	Low	61.5	Low	106 Å²	106	104.8 Å²	104.8	50%	0.495	53%	0.532	S	S	.	.	H	α-helix	trans	-68.6	-43.9	177.9	-71.3	-177.8	1.6	0	0	111.3	V593 Q594 A599 K600 L601	V593-Q597 WeakPolarHBondContact O-CG 3.29Å; V593-Q597 PolarHBondContact O-N 2.9Å; Q594-Q597 PolarHBondContact O-N 3.2Å; Q597-A599 VanDerWaalsContact C-N 3.34Å; Q597-A599 PolarHBondContact O-N 2.84Å; Q597-K600 WeakPolarHBondContact O-CB 3.23Å; Q597-K600 PolarHBondContact O-N 3.09Å; Q597-L601 WeakPolarHBondContact O-CB 3.26Å; Q597-L601 PolarHBondContact O-N 3.45Å
598	W	60.9	Low	61.4	Low	138 Å²	138	108.2 Å²	108.2	52%	0.523	54%	0.536	S	S	.	.	H	α-helix	trans	-62	-42.7	175.9	-138.8	81	0	0	0	111.2	Q594 L601 Q602	Q594-W598 WeakPolarHBondContact O-CB 3.41Å; Q594-W598 PolarHBondContact O-N 3.42Å; W598-L601 PolarHBondContact O-N 2.97Å; W598-Q602 WeakPolarHBondContact O-CB 3.5Å; W598-Q602 PolarHBondContact O-N 3.18Å
599	A	65.4	Low	61.5	Low	40 Å²	40	113.9 Å²	113.9	33%	0.331	55%	0.553	S	S	.	*	H	α-helix	trans	-64	-39.2	173.8	0	0	0	0	0	113	G595 Q597 L601 Q602 K603	G595-A599 WeakPolarHBondContact O-CB 3.33Å; G595-A599 PolarHBondContact O-N 3.31Å; Q597-A599 VanDerWaalsContact C-N 3.34Å; Q597-A599 PolarHBondContact O-N 2.84Å; A599-L601 VanDerWaalsContact C-N 3.34Å; A599-Q602 PolarHBondContact O-N 3Å; A599-K603 WeakPolarHBondContact O-CB 3.46Å; A599-K603 VanDerWaalsContact O-CG 3.25Å; A599-K603 WeakPolarHBondContact O-CG 3.41Å; A599-K603 PolarHBondContact O-N 3.18Å
600	K	67.3	Low	61.3	Low	151 Å²	151	118 Å²	118	66%	0.657	55%	0.552	S	S	*	*	H	α-helix	trans	-62.2	-42.7	172.5	-81.7	-177.9	179	-178.8	0	111.2	R596 Q597 K603 L604	R596-K600 WeakPolarHBondContact O-CG 3.5Å; R596-K600 PolarHBondContact O-N 3.35Å; Q597-K600 WeakPolarHBondContact O-CB 3.23Å; Q597-K600 PolarHBondContact O-N 3.09Å; K600-K603 WeakPolarHBondContact O-CB 3.39Å; K600-K603 PolarHBondContact O-N 3.42Å; K600-L604 PolarHBondContact O-N 2.96Å; K600-L604 VanDerWaalsContact O-N 3.1Å
601	L	62.6	Low	60.7	Low	75 Å²	75	123.1 Å²	123.1	39%	0.393	57%	0.571	S	S	.	*	H	α-helix	trans	-68.4	-39.1	178.9	-158.6	73	0	0	0	111.9	Q597 W598 A599 K603 L604 R605	Q597-L601 WeakPolarHBondContact O-CB 3.26Å; Q597-L601 PolarHBondContact O-N 3.45Å; W598-L601 PolarHBondContact O-N 2.97Å; A599-L601 VanDerWaalsContact C-N 3.34Å; L601-K603 VanDerWaalsContact C-N 3.32Å; L601-K603 PolarHBondContact O-N 3Å; L601-L604 WeakPolarHBondContact O-CB 3.24Å; L601-L604 PolarHBondContact O-N 3.46Å; L601-L604 VanDerWaalsContact O-N 3.1Å; L601-R605 WeakPolarHBondContact O-CG 3.43Å; L601-R605 PolarHBondContact O-N 3.31Å
602	Q	67.4	Low	60.3	Low	106 Å²	106	125.6 Å²	125.6	50%	0.495	59%	0.585	S	S	.	*	H	α-helix	trans	-66.7	-35.3	175.8	-144.4	-168.1	-5.1	0	0	111.6	W598 A599 L604 R605 T606	W598-Q602 WeakPolarHBondContact O-CB 3.5Å; W598-Q602 PolarHBondContact O-N 3.18Å; A599-Q602 PolarHBondContact O-N 3Å; Q602-L604 VanDerWaalsContact C-N 3.31Å; Q602-L604 PolarHBondContact O-N 3Å; Q602-R605 PolarHBondContact O-N 3.15Å; Q602-T606 WeakPolarHBondContact O-CG2 3.29Å; Q602-T606 PolarHBondContact O-N 2.88Å; Q602-T606 PolarHBondContact O-OG1 2.91Å
603	K	67.6	Low	59.8	Low	139 Å²	139	125.5 Å²	125.5	60%	0.604	59%	0.589	S	S	*	*	H	α-helix	trans	-64.5	-32.3	170	-74.2	175.8	-176.4	-175.3	0	112.6	A599 K600 L601 T606 K607	A599-K603 WeakPolarHBondContact O-CB 3.46Å; A599-K603 VanDerWaalsContact O-CG 3.25Å; A599-K603 WeakPolarHBondContact O-CG 3.41Å; A599-K603 PolarHBondContact O-N 3.18Å; K600-K603 WeakPolarHBondContact O-CB 3.39Å; K600-K603 PolarHBondContact O-N 3.42Å; L601-K603 VanDerWaalsContact C-N 3.32Å; L601-K603 PolarHBondContact O-N 3Å; K603-T606 WeakPolarHBondContact CA-OG1 3.42Å; K603-T606 PolarHBondContact O-OG1 3.25Å; K603-T606 VanDerWaalsContact O-OG1 3.14Å; K603-K607 WeakPolarHBondContact O-CD 3.39Å; K603-K607 WeakPolarHBondContact O-CG 3.26Å; K603-K607 PolarHBondContact O-N 3.16Å
604	L	55.6	Low	59.2	Low	106 Å²	106	128.3 Å²	128.3	56%	0.555	60%	0.602	S	S	*	*	H	α-helix	trans	-73.7	-37.4	172.5	-69.1	168.3	0	0	0	111.9	K600 L601 Q602 K607 R608	K600-L604 PolarHBondContact O-N 2.96Å; K600-L604 VanDerWaalsContact O-N 3.1Å; L601-L604 WeakPolarHBondContact O-CB 3.24Å; L601-L604 PolarHBondContact O-N 3.46Å; L601-L604 VanDerWaalsContact O-N 3.1Å; Q602-L604 VanDerWaalsContact C-N 3.31Å; Q602-L604 PolarHBondContact O-N 3Å; L604-K607 WeakPolarHBondContact O-CB 3.37Å; L604-K607 PolarHBondContact O-N 3.42Å; L604-R608 PolarHBondContact O-N 3.25Å
605	R	59.2	Low	59	Low	112 Å²	112	132.5 Å²	132.5	42%	0.423	61%	0.614	S	S	.	*	H	α-helix	trans	-66.9	-43.1	176.6	-72	169.9	119.8	119.2	-5.9	113.1	L601 Q602 K607 R608 K609	L601-R605 WeakPolarHBondContact O-CG 3.43Å; L601-R605 PolarHBondContact O-N 3.31Å; Q602-R605 PolarHBondContact O-N 3.15Å; R605-K607 PolarHBondContact O-N 2.98Å; R605-R608 PolarHBondContact O-N 3.16Å; R605-K609 PolarHBondContact O-N 2.75Å
606	T	55.5	Low	58.5	Low	95 Å²	95	140.8 Å²	140.8	58%	0.583	63%	0.633	S	S	*	*	H	α-helix	trans	-65.9	-28.3	175	47.1	0	0	0	0	112.2	Q602 K603	Q602-T606 WeakPolarHBondContact O-CG2 3.29Å; Q602-T606 PolarHBondContact O-N 2.88Å; Q602-T606 PolarHBondContact O-OG1 2.91Å; K603-T606 WeakPolarHBondContact CA-OG1 3.42Å; K603-T606 PolarHBondContact O-OG1 3.25Å; K603-T606 VanDerWaalsContact O-OG1 3.14Å
607	K	55.4	Low	57.5	Low	167 Å²	167	135.2 Å²	135.2	73%	0.726	62%	0.624	S	S	*	*	H	α-helix	trans	-72.7	-30	169.3	-72.6	174.7	179.9	-170.1	0	113.2	K603 L604 R605	K603-K607 WeakPolarHBondContact O-CD 3.39Å; K603-K607 WeakPolarHBondContact O-CG 3.26Å; K603-K607 PolarHBondContact O-N 3.16Å; L604-K607 WeakPolarHBondContact O-CB 3.37Å; L604-K607 PolarHBondContact O-N 3.42Å; R605-K607 PolarHBondContact O-N 2.98Å
608	R	53.7	Low	57.1	Low	196 Å²	196	134.1 Å²	134.1	74%	0.74	63%	0.628	S	S	*	*	H	α-helix	trans	-79.8	-28.6	178.6	-93.4	-170.6	176.1	-171.6	0.3	114.4	L604 R605 R610	L604-R608 PolarHBondContact O-N 3.25Å; R605-R608 PolarHBondContact O-N 3.16Å; R608-R610 PolarHBondContact O-N 2.9Å
609	K	49.4	Very low	56.5	Low	182 Å²	182	137.6 Å²	137.6	79%	0.791	65%	0.647	S	S	*	*	S	Bend	trans	-68.1	82.3	166.5	-71.3	-151.7	177.9	-168.3	0	108.1	R605 K611	R605-K609 PolarHBondContact O-N 2.75Å; K609-K611 PolarHBondContact O-N 2.81Å
610	R	52.9	Low	55.6	Low	229 Å²	229	137.9 Å²	137.9	86%	0.864	65%	0.654	S	S	*	*			trans	-51.2	111.2	176.1	-74.4	176.9	171.8	168.3	-2.4	107	R608 T612	R608-R610 PolarHBondContact O-N 2.9Å; R610-T612 PolarHBondContact O-N 3.03Å
611	K	49.4	Very low	54.9	Low	181 Å²	181	141.3 Å²	141.3	79%	0.787	66%	0.663	S	S	*	*			trans	-54.8	130.3	163.2	-75	179.9	175.2	-177.5	0	106.1	K609 V613	K609-K611 PolarHBondContact O-N 2.81Å; K611-V613 VanDerWaalsContact C-N 3.32Å; K611-V613 VanDerWaalsContact O-CG2 3.29Å; K611-V613 WeakPolarHBondContact O-CG2 3.34Å; K611-V613 PolarHBondContact O-N 3.32Å
612	T	56.8	Low	54.4	Low	149 Å²	149	142 Å²	142	91%	0.914	68%	0.679	S	S	*	*			trans	-44.9	98.8	170.3	-17.1	0	0	0	0	107.7	R610 D614	R610-T612 PolarHBondContact O-N 3.03Å; T612-D614 PolarHBondContact O-N 3.44Å
613	V	56	Low	54.1	Low	116 Å²	116	143.6 Å²	143.6	70%	0.703	69%	0.689	S	S	*	*			trans	-78.3	114.6	-178.9	176.9	0	0	0	0	105.1	K611 R615	K611-V613 VanDerWaalsContact C-N 3.32Å; K611-V613 VanDerWaalsContact O-CG2 3.29Å; K611-V613 WeakPolarHBondContact O-CG2 3.34Å; K611-V613 PolarHBondContact O-N 3.32Å; V613-R615 PolarHBondContact O-N 3.14Å
614	D	51.8	Low	54	Low	117 Å²	117	148.7 Å²	148.7	63%	0.626	71%	0.705	S	S	*	*			trans	-52.8	109.3	176.9	-169.2	-9.3	0	0	0	109.5	T612 R616 A617	T612-D614 PolarHBondContact O-N 3.44Å; D614-R616 PolarHBondContact O-N 3.36Å; D614-R616 WeakPolarHBondContact OD1-CB 3.29Å; D614-R616 PolarHBondContact OD1-N 3.32Å; D614-A617 PolarHBondContact O-N 2.89Å; D614-A617 VanDerWaalsContact O-N 3.12Å
615	R	54.5	Low	54.9	Low	162 Å²	162	152.1 Å²	152.1	61%	0.611	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-66.3	-10.2	-174.6	-68.9	177.8	70.1	175.2	-3.1	111.9	D555 V613 A617 S618	D555-R615 IonicContact OD1-CZ 3.71Å; D555-R615 IonicContact OD1-NH1 3.63Å; D555-R615 PolarHBondContact OD1-NH1 2.92Å; D555-R615 IonicContact OD1-NH2 3.76Å; D555-R615 PolarHBondContact OD1-NH2 2.97Å; D555-R615 IonicContact OD2-CZ 3.81Å; D555-R615 IonicContact OD2-NH1 2.82Å; D555-R615 IonicContact OD2-NH2 2.72Å; D555-R615 PolarHBondContact OD2-NH2 3.29Å; V613-R615 PolarHBondContact O-N 3.14Å; R615-A617 PolarHBondContact O-N 3.45Å; R615-S618 VanDerWaalsContact C-OG 3.26Å; R615-S618 VanDerWaalsContact CA-OG 3.22Å; R615-S618 WeakPolarHBondContact CA-OG 3.46Å; R615-S618 WeakPolarHBondContact O-CB 3.35Å; R615-S618 PolarHBondContact O-N 3.28Å; R615-S618 PolarHBondContact O-OG 3.44Å
616	R	55	Low	55.9	Low	216 Å²	216	155.7 Å²	155.7	82%	0.815	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-63.8	-26.9	173	-156.8	172	174.7	-166.8	-2	112.4	D614 S618	D614-R616 PolarHBondContact O-N 3.36Å; D614-R616 WeakPolarHBondContact OD1-CB 3.29Å; D614-R616 PolarHBondContact OD1-N 3.32Å; R616-S618 VanDerWaalsContact C-N 3.34Å
617	A	49.8	Very low	56.9	Low	56 Å²	56	155.2 Å²	155.2	46%	0.463	73%	0.729	S	S	.	*	G	3₁₀ helix	trans	-75.6	-19.4	172.5	0	0	0	0	0	113.5	D614 R615 K619 G620 R621	D614-A617 PolarHBondContact O-N 2.89Å; D614-A617 VanDerWaalsContact O-N 3.12Å; R615-A617 PolarHBondContact O-N 3.45Å; A617-K619 VanDerWaalsContact C-N 3.27Å; A617-K619 PolarHBondContact O-N 3.44Å; A617-G620 CarbonylContact O-C 3.57Å; A617-G620 PolarHBondContact O-N 2.67Å; A617-G620 VanDerWaalsContact O-N 3.17Å; A617-R621 PolarHBondContact O-N 3.31Å; A617-R621 VanDerWaalsContact O-N 3.13Å
618	S	53.2	Low	58.3	Low	83 Å²	83	152.4 Å²	152.4	58%	0.58	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-69.6	-24.4	178.4	-10.7	0	0	0	0	112.8	R615 R616	R615-S618 VanDerWaalsContact C-OG 3.26Å; R615-S618 VanDerWaalsContact CA-OG 3.22Å; R615-S618 WeakPolarHBondContact CA-OG 3.46Å; R615-S618 WeakPolarHBondContact O-CB 3.35Å; R615-S618 PolarHBondContact O-N 3.28Å; R615-S618 PolarHBondContact O-OG 3.44Å; R616-S618 VanDerWaalsContact C-N 3.34Å
619	K	48.9	Very low	59.6	Low	211 Å²	211	147.9 Å²	147.9	92%	0.917	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-104.7	15.4	171.7	-80.1	-171.8	174.1	-179.9	0	113.5	A617	A617-K619 VanDerWaalsContact C-N 3.27Å; A617-K619 PolarHBondContact O-N 3.44Å
620	G	45.5	Very low	61.2	Low	47 Å²	47	147.5 Å²	147.5	49%	0.485	72%	0.718	S	S	.	*			trans	-159.1	44.3	-174.2	0	0	0	0	0	112.6	A617 A622	A617-G620 CarbonylContact O-C 3.57Å; A617-G620 PolarHBondContact O-N 2.67Å; A617-G620 VanDerWaalsContact O-N 3.17Å; G620-A622 PolarHBondContact O-N 3.48Å
621	R	52.5	Low	62.2	Low	223 Å²	223	141.6 Å²	141.6	84%	0.842	70%	0.703	S	S	*	*			trans	-56.8	97.5	161.4	-72.4	-174.8	176.1	-178.7	0.4	106.2	A617 I623	A617-R621 PolarHBondContact O-N 3.31Å; A617-R621 VanDerWaalsContact O-N 3.13Å; R621-I623 PolarHBondContact O-N 3.15Å
622	A	53.5	Low	63.4	Low	89 Å²	89	136.2 Å²	136.2	74%	0.736	69%	0.685	S	S	*	*			trans	-53.2	107	-179.9	0	0	0	0	0	107.4	G620 R624	G620-A622 PolarHBondContact O-N 3.48Å; A622-R624 PolarHBondContact O-N 2.86Å
623	I	59.9	Low	64.3	Low	139 Å²	139	136.7 Å²	136.7	71%	0.713	68%	0.682	S	S	*	*			trans	-63	113.6	176.7	-60.5	174.4	0	0	0	105.1	R621 Y625	R621-I623 PolarHBondContact O-N 3.15Å; I623-Y625 HydrophobicContact CB-CD1 4.41Å; I623-Y625 HydrophobicContact CG2-CD1 4.13Å; I623-Y625 WeakPolarHBondContact O-CD1 3.5Å; I623-Y625 PolarHBondContact O-N 3.03Å
624	R	65.4	Low	65.2	Low	247 Å²	247	138.7 Å²	138.7	93%	0.932	68%	0.682	S	S	*	*			trans	-80.2	94.8	167.3	-63.6	-175.2	-173.3	-173.8	1.7	106	A622	A622-R624 PolarHBondContact O-N 2.86Å
625	Y	74.2	Confident	66.1	Low	177 Å²	177	140.2 Å²	140.2	69%	0.694	69%	0.687	S	S	*	*			trans	-104	141.2	173.2	60.6	-82.3	0	0	0	109.8	I623 V627	I623-Y625 HydrophobicContact CB-CD1 4.41Å; I623-Y625 HydrophobicContact CG2-CD1 4.13Å; I623-Y625 WeakPolarHBondContact O-CD1 3.5Å; I623-Y625 PolarHBondContact O-N 3.03Å; Y625-V627 HydrophobicContact CD2-CG2 3.53Å; Y625-V627 HydrophobicContact CE2-CG2 3.28Å
626	H	80.1	Confident	66.9	Low	187 Å²	187	136.3 Å²	136.3	87%	0.866	69%	0.69	S	S	*	*			trans	-90	117.2	167.8	-124.6	-73.7	0	0	0	107.6	I628	H626-I628 PolarHBondContact O-N 3.2Å
627	V	78.2	Confident	67.9	Low	85 Å²	85	132.2 Å²	132.2	52%	0.515	69%	0.691	S	S	.	*			trans	-74.6	113.2	178.2	-179.2	0	0	0	0	109.4	Y625 S629 V632	Y625-V627 HydrophobicContact CD2-CG2 3.53Å; Y625-V627 HydrophobicContact CE2-CG2 3.28Å; V627-S629 PolarHBondContact O-N 3.38Å; V627-V632 HydrophobicContact CG1-CG2 3.25Å
628	I	83.1	Confident	69.1	Low	109 Å²	109	134.7 Å²	134.7	56%	0.559	70%	0.695	S	S	*	*			trans	-82.5	107.3	168.5	-59	172.4	0	0	0	107.1	H626 K630 L631 V632	H626-I628 PolarHBondContact O-N 3.2Å; I628-K630 PolarHBondContact O-N 2.72Å; I628-L631 HydrophobicContact CB-CB 4.41Å; I628-L631 HydrophobicContact CB-CD1 4.24Å; I628-L631 HydrophobicContact CB-CG 4.46Å; I628-L631 HydrophobicContact CD1-CD1 4.11Å; I628-L631 HydrophobicContact CG2-CB 4.49Å; I628-L631 HydrophobicContact CG2-CD1 4.1Å; I628-L631 HydrophobicContact CG2-CG 4.12Å; I628-L631 PolarHBondContact O-N 3.27Å; I628-V632 PolarHBondContact O-N 3.43Å
629	S	82.4	Confident	69.9	Low	101 Å²	101	136.6 Å²	136.6	71%	0.706	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-53.7	-34.3	-171.4	65.9	0	0	0	0	114.1	V627 L631 V632	V627-S629 PolarHBondContact O-N 3.38Å; S629-L631 VanDerWaalsContact C-N 3.26Å; S629-L631 PolarHBondContact O-N 3.05Å; S629-V632 PolarHBondContact O-N 3.35Å
630	K	83.3	Confident	71.3	Confident	173 Å²	173	136.7 Å²	136.7	75%	0.752	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-72.4	-15.7	179.6	-56.8	-148.1	-173.4	-173.3	0	114.4	I628 F634	I628-K630 PolarHBondContact O-N 2.72Å; K630-F634 WeakPolarHBondContact O-CD2 3.36Å; K630-F634 VanDerWaalsContact O-CE2 3.23Å; K630-F634 WeakPolarHBondContact O-CE2 3.46Å
631	L	73	Confident	72.7	Confident	105 Å²	105	137.2 Å²	137.2	55%	0.55	69%	0.689	S	S	.	*	G	3₁₀ helix	trans	-108.5	0.1	-178.5	-62.5	176.8	0	0	0	112.6	I628 S629 N633 F634	I628-L631 HydrophobicContact CB-CB 4.41Å; I628-L631 HydrophobicContact CB-CD1 4.24Å; I628-L631 HydrophobicContact CB-CG 4.46Å; I628-L631 HydrophobicContact CD1-CD1 4.11Å; I628-L631 HydrophobicContact CG2-CB 4.49Å; I628-L631 HydrophobicContact CG2-CD1 4.1Å; I628-L631 HydrophobicContact CG2-CG 4.12Å; I628-L631 PolarHBondContact O-N 3.27Å; S629-L631 VanDerWaalsContact C-N 3.26Å; S629-L631 PolarHBondContact O-N 3.05Å; L631-N633 PolarHBondContact O-N 2.96Å; L631-F634 PolarHBondContact O-N 3.21Å; L631-F634 VanDerWaalsContact O-N 3.15Å
632	V	75.1	Confident	74.1	Confident	68 Å²	68	136 Å²	136	41%	0.412	69%	0.693	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.5	128.3	173.8	-178.7	0	0	0	0	108.3	V627 I628 S629 F634	V627-V632 HydrophobicContact CG1-CG2 3.25Å; I628-V632 PolarHBondContact O-N 3.43Å; S629-V632 PolarHBondContact O-N 3.35Å; V632-F634 VanDerWaalsContact C-N 3.34Å
633	N	75.2	Confident	75.5	Confident	160 Å²	160	135.5 Å²	135.5	86%	0.856	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.2	4.1	-175.8	-53.1	-22.7	0	0	0	116.9	L631 M635	L631-N633 PolarHBondContact O-N 2.96Å; N633-M635 PolarHBondContact O-N 3Å
634	F	75.7	Confident	76.6	Confident	158 Å²	158	132.3 Å²	132.3	69%	0.693	67%	0.666	S	S	*	*			trans	-83	102.4	167.9	-74.4	-89.7	0	0	0	109.4	K630 L631 V632	K630-F634 WeakPolarHBondContact O-CD2 3.36Å; K630-F634 VanDerWaalsContact O-CE2 3.23Å; K630-F634 WeakPolarHBondContact O-CE2 3.46Å; L631-F634 PolarHBondContact O-N 3.21Å; L631-F634 VanDerWaalsContact O-N 3.15Å; V632-F634 VanDerWaalsContact C-N 3.34Å
635	M	68.9	Low	77.4	Confident	148 Å²	148	126.4 Å²	126.4	73%	0.729	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-80.9	136.5	171.2	-167.6	160.2	68.3	0	0	108.9	N633 I638	N633-M635 PolarHBondContact O-N 3Å; M635-I638 HydrophobicContact CE-CD1 3.77Å; M635-I638 HydrophobicContact CE-CG1 4.4Å; M635-I638 HydrophobicContact SD-CD1 4.44Å
636	A	72.6	Confident	77.8	Confident	81 Å²	81	123.9 Å²	123.9	67%	0.669	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-55.4	133.9	170.7	0	0	0	0	0	108.8	I638	A636-I638 PolarHBondContact O-N 3.38Å; A636-I638 VanDerWaalsContact O-N 3.08Å
637	P	75.9	Confident	78	Confident	130 Å²	130	116.7 Å²	116.7	84%	0.844	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-52.6	119.8	177.1	-26.6	34.7	0	0	0	110.1	D639	P637-D639 PolarHBondContact O-N 2.95Å
638	I	75	Confident	78.1	Confident	107 Å²	107	116 Å²	116	55%	0.549	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-74.6	117.3	173.5	-59.8	171	0	0	0	106	M635 A636 R640	M635-I638 HydrophobicContact CE-CD1 3.77Å; M635-I638 HydrophobicContact CE-CG1 4.4Å; M635-I638 HydrophobicContact SD-CD1 4.44Å; A636-I638 PolarHBondContact O-N 3.38Å; A636-I638 VanDerWaalsContact O-N 3.08Å; I638-R640 HydrophobicContact CG2-CG 4.34Å; I638-R640 PolarHBondContact O-N 3.31Å
639	D	70.3	Confident	78	Confident	123 Å²	123	114 Å²	114	66%	0.658	61%	0.606	S	S	*	*			trans	-67.3	97	176	-127.3	-16.6	0	0	0	108.3	P637 C641 R648	P637-D639 PolarHBondContact O-N 2.95Å; D639-C641 PolarHBondContact O-N 2.93Å; D639-R648 IonicContact OD1-NH1 3.7Å; D639-R648 IonicContact OD1-NH2 2.62Å; D639-R648 IonicContact OD2-NH1 3.75Å
640	R	77.2	Confident	78	Confident	214 Å²	214	114.3 Å²	114.3	81%	0.808	60%	0.596	S	S	*	*			trans	-86.3	13.2	175	-61.9	-175.9	-175.7	-132.7	1.4	111.9	I638 Q642	I638-R640 HydrophobicContact CG2-CG 4.34Å; I638-R640 PolarHBondContact O-N 3.31Å; R640-Q642 PolarHBondContact O-N 3.47Å
641	C	76.4	Confident	78	Confident	57 Å²	57	110 Å²	110	39%	0.385	58%	0.581	S	S	.	*			trans	-68.6	119.8	-177.5	-165.4	0	0	0	0	109.3	D639 M643 R648	D639-C641 PolarHBondContact O-N 2.93Å; C641-M643 PolarHBondContact O-N 3.25Å; C641-R648 PolarHBondContact SG-NH1 3.47Å
642	Q	81.6	Confident	78.4	Confident	199 Å²	199	110.2 Å²	110.2	93%	0.93	58%	0.578	S	S	*	*			trans	-77.7	-8.4	175	-66.2	-170.7	-13.4	0	0	112.7	R640	R640-Q642 PolarHBondContact O-N 3.47Å
643	M	82.3	Confident	78.7	Confident	77 Å²	77	109.7 Å²	109.7	38%	0.379	58%	0.577	S	S	.	*	S	Bend	trans	-78.5	123.7	-178.1	-141.5	165.1	77.7	0	0	109.1	C641 A647 R648 L651	C641-M643 PolarHBondContact O-N 3.25Å; M643-A647 HydrophobicContact CG-CB 3.73Å; M643-R648 HydrophobicContact CB-CG 4.14Å; M643-R648 HydrophobicContact CE-CB 4.05Å; M643-R648 HydrophobicContact CE-CG 3.47Å; M643-R648 VanDerWaalsContact CE-CG 3.47Å; M643-R648 HydrophobicContact CG-CG 4.49Å; M643-L651 HydrophobicContact CE-CB 4.1Å; M643-L651 HydrophobicContact CE-CD2 3.72Å
644	S	82.5	Confident	79	Confident	73 Å²	73	106.8 Å²	106.8	51%	0.51	57%	0.569	S	S	.	*			trans	-60.2	154.7	175.4	59	0	0	0	0	110.7	D646 A647 R648	S644-D646 VanDerWaalsContact C-N 3.27Å; S644-D646 PolarHBondContact O-N 2.95Å; S644-A647 PolarHBondContact O-N 3.5Å; S644-A647 WeakPolarHBondContact OG-CB 3.46Å; S644-A647 PolarHBondContact OG-N 3.4Å; S644-R648 WeakPolarHBondContact O-CG 3.38Å; S644-R648 PolarHBondContact O-N 2.86Å
645	D	82.2	Confident	79.4	Confident	123 Å²	123	104.2 Å²	104.2	66%	0.658	56%	0.561	S	S	*	*	H	α-helix	trans	-59.2	-39.8	-177.6	-159.7	41.4	0	0	0	111.6	A647 R648 T649	D645-A647 PolarHBondContact O-N 2.95Å; D645-R648 WeakPolarHBondContact O-CB 3.34Å; D645-R648 PolarHBondContact O-N 2.92Å; D645-R648 VanDerWaalsContact O-N 3.09Å; D645-T649 WeakPolarHBondContact O-CG2 3.44Å; D645-T649 PolarHBondContact O-N 3.36Å; D645-T649 PolarHBondContact O-OG1 3.44Å
646	D	83.3	Confident	80.1	Confident	124 Å²	124	105 Å²	105	66%	0.663	56%	0.561	S	S	*	*	H	α-helix	trans	-60	-40.5	172.7	-78.3	-6.6	0	0	0	113.3	S644 R648 T649 E650	S644-D646 VanDerWaalsContact C-N 3.27Å; S644-D646 PolarHBondContact O-N 2.95Å; D646-R648 VanDerWaalsContact C-N 3.3Å; D646-R648 PolarHBondContact O-N 3.35Å; D646-T649 WeakPolarHBondContact CA-OG1 3.44Å; D646-T649 PolarHBondContact O-N 3.43Å; D646-T649 PolarHBondContact O-OG1 3.48Å; D646-E650 WeakPolarHBondContact O-CB 3.41Å; D646-E650 PolarHBondContact O-N 3.37Å
647	A	84.3	Confident	80.1	Confident	35 Å²	35	104.2 Å²	104.2	29%	0.289	56%	0.561	S	S	.	*	H	α-helix	trans	-69.7	-30.6	176.4	0	0	0	0	0	111.7	M643 S644 D645 L651	M643-A647 HydrophobicContact CG-CB 3.73Å; S644-A647 PolarHBondContact O-N 3.5Å; S644-A647 WeakPolarHBondContact OG-CB 3.46Å; S644-A647 PolarHBondContact OG-N 3.4Å; D645-A647 PolarHBondContact O-N 2.95Å; A647-L651 WeakPolarHBondContact O-CB 3.27Å; A647-L651 PolarHBondContact O-N 3.03Å
648	R	79.8	Confident	79.5	Confident	70 Å²	70	100 Å²	100	26%	0.264	54%	0.542	S	S	.	.	H	α-helix	trans	-68.7	-46.2	173.6	-65.7	174.7	97.7	148.2	-0.3	110.6	D639 C641 M643 S644 D645 D646 E650 L651 F652	D639-R648 IonicContact OD1-NH1 3.7Å; D639-R648 IonicContact OD1-NH2 2.62Å; D639-R648 IonicContact OD2-NH1 3.75Å; C641-R648 PolarHBondContact SG-NH1 3.47Å; M643-R648 HydrophobicContact CB-CG 4.14Å; M643-R648 HydrophobicContact CE-CB 4.05Å; M643-R648 HydrophobicContact CE-CG 3.47Å; M643-R648 VanDerWaalsContact CE-CG 3.47Å; M643-R648 HydrophobicContact CG-CG 4.49Å; S644-R648 WeakPolarHBondContact O-CG 3.38Å; S644-R648 PolarHBondContact O-N 2.86Å; D645-R648 WeakPolarHBondContact O-CB 3.34Å; D645-R648 PolarHBondContact O-N 2.92Å; D645-R648 VanDerWaalsContact O-N 3.09Å; D646-R648 VanDerWaalsContact C-N 3.3Å; D646-R648 PolarHBondContact O-N 3.35Å; R648-E650 VanDerWaalsContact C-N 3.34Å; R648-E650 PolarHBondContact O-N 2.93Å; R648-L651 PolarHBondContact O-N 3.29Å; R648-F652 HydrophobicContact CB-CD2 4.43Å; R648-F652 HydrophobicContact CB-CE2 4.37Å; R648-F652 WeakPolarHBondContact O-CD2 3.46Å; R648-F652 PolarHBondContact O-N 3.11Å
649	T	81.5	Confident	78.4	Confident	67 Å²	67	100.8 Å²	100.8	41%	0.411	56%	0.556	S	S	.	*	H	α-helix	trans	-65.7	-37.3	179.1	58.3	0	0	0	0	111.7	D645 D646 F652 S653	D645-T649 WeakPolarHBondContact O-CG2 3.44Å; D645-T649 PolarHBondContact O-N 3.36Å; D645-T649 PolarHBondContact O-OG1 3.44Å; D646-T649 WeakPolarHBondContact CA-OG1 3.44Å; D646-T649 PolarHBondContact O-N 3.43Å; D646-T649 PolarHBondContact O-OG1 3.48Å; T649-F652 PolarHBondContact O-N 3.24Å; T649-S653 VanDerWaalsContact O-CB 3.28Å; T649-S653 WeakPolarHBondContact O-CB 3.48Å; T649-S653 PolarHBondContact O-N 3.11Å; T649-S653 PolarHBondContact O-OG 3.09Å
650	E	81.2	Confident	77.6	Confident	109 Å²	109	101.7 Å²	101.7	51%	0.509	55%	0.554	S	S	.	*	H	α-helix	trans	-63.6	-44.5	171	-79.2	-150.6	136.1	0	0	112.2	D646 R648 F652 S653 S654 K660	D646-E650 WeakPolarHBondContact O-CB 3.41Å; D646-E650 PolarHBondContact O-N 3.37Å; R648-E650 VanDerWaalsContact C-N 3.34Å; R648-E650 PolarHBondContact O-N 2.93Å; E650-F652 PolarHBondContact O-N 3.14Å; E650-S653 PolarHBondContact O-N 3.32Å; E650-S654 VanDerWaalsContact O-CB 3.32Å; E650-S654 WeakPolarHBondContact O-CB 3.38Å; E650-S654 PolarHBondContact O-N 3.47Å; E650-K660 IonicContact OE1-NZ 2.97Å; E650-K660 PolarHBondContact OE1-NZ 2.82Å
651	L	83.1	Confident	76.3	Confident	81 Å²	81	98.7 Å²	98.7	42%	0.424	55%	0.554	S	S	.	*	H	α-helix	trans	-60.6	-46.3	176.8	-178.4	71.6	0	0	0	111.2	M643 A647 R648 S654 I655	M643-L651 HydrophobicContact CE-CB 4.1Å; M643-L651 HydrophobicContact CE-CD2 3.72Å; A647-L651 WeakPolarHBondContact O-CB 3.27Å; A647-L651 PolarHBondContact O-N 3.03Å; R648-L651 PolarHBondContact O-N 3.29Å; L651-S654 PolarHBondContact O-N 3.04Å; L651-I655 HydrophobicContact CD1-CD1 4.15Å; L651-I655 HydrophobicContact CD2-CD1 4.43Å; L651-I655 HydrophobicContact CG-CD1 3.92Å; L651-I655 WeakPolarHBondContact O-CB 3.34Å; L651-I655 WeakPolarHBondContact O-CG1 3.1Å; L651-I655 PolarHBondContact O-N 2.92Å
652	F	83.1	Confident	74.9	Confident	111 Å²	111	100.7 Å²	100.7	49%	0.487	57%	0.565	S	S	.	*	H	α-helix	trans	-67.1	-39.5	178.8	-75.9	-60.8	0	0	0	112.3	R648 T649 E650 S654 I655 F656	R648-F652 HydrophobicContact CB-CD2 4.43Å; R648-F652 HydrophobicContact CB-CE2 4.37Å; R648-F652 WeakPolarHBondContact O-CD2 3.46Å; R648-F652 PolarHBondContact O-N 3.11Å; T649-F652 PolarHBondContact O-N 3.24Å; E650-F652 PolarHBondContact O-N 3.14Å; F652-S654 VanDerWaalsContact C-N 3.29Å; F652-S654 PolarHBondContact O-N 3.23Å; F652-I655 PolarHBondContact O-N 2.92Å; F652-F656 HydrophobicContact CD1-CD2 4.26Å; F652-F656 AromaticContact CD1-CE2 3.87Å; F652-F656 HydrophobicContact CD1-CE2 3.87Å; F652-F656 HydrophobicContact CE1-CE2 4.5Å; F652-F656 WeakPolarHBondContact O-CB 3.37Å; F652-F656 WeakPolarHBondContact O-CD2 3.33Å; F652-F656 PolarHBondContact O-N 3.41Å
653	S	80.8	Confident	73	Confident	57 Å²	57	98.2 Å²	98.2	40%	0.399	56%	0.558	S	S	.	*	H	α-helix	trans	-62.7	-39.8	174	-58.8	0	0	0	0	110.7	T649 E650 G657 G658	T649-S653 VanDerWaalsContact O-CB 3.28Å; T649-S653 WeakPolarHBondContact O-CB 3.48Å; T649-S653 PolarHBondContact O-N 3.11Å; T649-S653 PolarHBondContact O-OG 3.09Å; E650-S653 PolarHBondContact O-N 3.32Å; S653-G657 CarbonylContact O-C 3.52Å; S653-G657 PolarHBondContact O-N 3.14Å; S653-G657 VanDerWaalsContact O-N 3.12Å; S653-G658 PolarHBondContact O-N 3.43Å
654	S	81.2	Confident	71.1	Confident	98 Å²	98	99.7 Å²	99.7	69%	0.685	57%	0.571	S	S	*	*	H	α-helix	trans	-66.6	-41.6	175.6	-177.8	0	0	0	0	112.9	E650 L651 F652	E650-S654 VanDerWaalsContact O-CB 3.32Å; E650-S654 WeakPolarHBondContact O-CB 3.38Å; E650-S654 PolarHBondContact O-N 3.47Å; L651-S654 PolarHBondContact O-N 3.04Å; F652-S654 VanDerWaalsContact C-N 3.29Å; F652-S654 PolarHBondContact O-N 3.23Å
655	I	84.3	Confident	69	Low	105 Å²	105	100.8 Å²	100.8	54%	0.538	59%	0.585	S	S	.	*	H	α-helix	trans	-70.1	-42.1	-179.9	-74.3	172.2	0	0	0	111.9	L651 F652	L651-I655 HydrophobicContact CD1-CD1 4.15Å; L651-I655 HydrophobicContact CD2-CD1 4.43Å; L651-I655 HydrophobicContact CG-CD1 3.92Å; L651-I655 WeakPolarHBondContact O-CB 3.34Å; L651-I655 WeakPolarHBondContact O-CG1 3.1Å; L651-I655 PolarHBondContact O-N 2.92Å; F652-I655 PolarHBondContact O-N 2.92Å
656	F	82.6	Confident	66.8	Low	163 Å²	163	102.1 Å²	102.1	72%	0.715	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	10.7	-175.2	-66.9	-67.3	0	0	0	113.9	F652 G658	F652-F656 HydrophobicContact CD1-CD2 4.26Å; F652-F656 AromaticContact CD1-CE2 3.87Å; F652-F656 HydrophobicContact CD1-CE2 3.87Å; F652-F656 HydrophobicContact CE1-CE2 4.5Å; F652-F656 WeakPolarHBondContact O-CB 3.37Å; F652-F656 WeakPolarHBondContact O-CD2 3.33Å; F652-F656 PolarHBondContact O-N 3.41Å; F656-G658 PolarHBondContact O-N 3.21Å
657	G	74	Confident	64.5	Low	66 Å²	66	106.3 Å²	106.3	68%	0.68	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.6	22.9	173.4	0	0	0	0	0	114.7	S653 S659	S653-G657 CarbonylContact O-C 3.52Å; S653-G657 PolarHBondContact O-N 3.14Å; S653-G657 VanDerWaalsContact O-N 3.12Å; G657-S659 PolarHBondContact O-N 2.91Å; G657-S659 VanDerWaalsContact O-N 3.1Å
658	G	61.9	Low	63.6	Low	42 Å²	42	109.9 Å²	109.9	43%	0.433	64%	0.639	S	S	.	*			trans	-68.6	101.7	173.8	0	0	0	0	0	110.9	S653 F656 K660	S653-G658 PolarHBondContact O-N 3.43Å; F656-G658 PolarHBondContact O-N 3.21Å; G658-K660 PolarHBondContact O-N 2.95Å
659	S	53.3	Low	62.7	Low	122 Å²	122	111.9 Å²	111.9	85%	0.853	66%	0.658	S	S	*	*			trans	-60	127.9	178	-156	0	0	0	0	110.9	G657 N661	G657-S659 PolarHBondContact O-N 2.91Å; G657-S659 VanDerWaalsContact O-N 3.1Å; S659-N661 PolarHBondContact O-N 3.2Å; S659-N661 VanDerWaalsContact O-N 3.07Å
660	K	52.9	Low	61.7	Low	142 Å²	142	114.4 Å²	114.4	62%	0.617	67%	0.672	S	S	*	*			trans	-62.4	106.4	178.5	-69.4	-169.4	172.5	-153.3	0	110	E650 G658 V662	E650-K660 IonicContact OE1-NZ 2.97Å; E650-K660 PolarHBondContact OE1-NZ 2.82Å; G658-K660 PolarHBondContact O-N 2.95Å; K660-V662 HydrophobicContact CB-CG2 3.87Å; K660-V662 PolarHBondContact O-N 3.43Å; K660-V662 VanDerWaalsContact O-N 3.08Å
661	N	49	Very low	60.5	Low	152 Å²	152	114.8 Å²	114.8	81%	0.813	68%	0.682	S	S	*	*			trans	-77.7	87.4	156.7	-108.4	3.4	0	0	0	107.4	S659 N663	S659-N661 PolarHBondContact O-N 3.2Å; S659-N661 VanDerWaalsContact O-N 3.07Å; N661-N663 PolarHBondContact O-N 3.33Å
662	V	48.3	Very low	59.1	Low	99 Å²	99	116.9 Å²	116.9	60%	0.6	70%	0.698	S	S	*	*			trans	-69.3	81.5	170.7	-176.9	0	0	0	0	107.6	K660 T664	K660-V662 HydrophobicContact CB-CG2 3.87Å; K660-V662 PolarHBondContact O-N 3.43Å; K660-V662 VanDerWaalsContact O-N 3.08Å; V662-T664 VanDerWaalsContact C-N 3.31Å; V662-T664 HydrophobicContact CG1-CG2 3.73Å; V662-T664 PolarHBondContact O-N 3.4Å
663	N	41.3	Very low	57.5	Low	147 Å²	147	117.3 Å²	117.3	79%	0.786	71%	0.712	S	S	*	*			trans	-92	79.7	157	-80.6	-8.8	0	0	0	106.6	N661 A665	N661-N663 PolarHBondContact O-N 3.33Å; N663-A665 PolarHBondContact O-N 3.31Å
664	T	41.7	Very low	55.8	Low	108 Å²	108	121.6 Å²	121.6	66%	0.663	73%	0.734	S	S	*	*			trans	-59.6	104.3	159.9	41.7	0	0	0	0	107.5	V662 N666	V662-T664 VanDerWaalsContact C-N 3.31Å; V662-T664 HydrophobicContact CG1-CG2 3.73Å; V662-T664 PolarHBondContact O-N 3.4Å; T664-N666 VanDerWaalsContact C-N 3.26Å; T664-N666 PolarHBondContact O-N 3.43Å
665	A	39.3	Very low	53.9	Low	96 Å²	96	123.4 Å²	123.4	79%	0.793	74%	0.738	S	S	*	*			trans	-62.5	93.1	159.8	0	0	0	0	0	107.9	N663	N663-A665 PolarHBondContact O-N 3.31Å
666	N	36	Very low	51.3	Low	150 Å²	150	124.9 Å²	124.9	80%	0.802	76%	0.755	S	S	*	*			trans	-112.5	79.8	158.7	-95.1	-2.4	0	0	0	106.3	T664	T664-N666 VanDerWaalsContact C-N 3.26Å; T664-N666 PolarHBondContact O-N 3.43Å
667	T	35.8	Very low	48.5	Very low	212 Å²	212	121.5 Å²	121.5	100%	1.301	76%	0.758	S	S	*	*			trans	-171.1	0	145	34.3	0	0	0	0	109.3

Retrieved 667 of 667 residues in 2314.5 ms (Link to these results)

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