A0A077Z8C9_TRITR Loading...

Rho guanine nucleotide exchange factor 7

AlphaFold DB , UniProt , Accession A0A077Z8C9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 650 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.8	Very low	44.6	Very low	234 Å²	234	146.8 Å²	146.8	100%	1.153	79%	0.788	S	S	*	*				0	82	0	-72.2	164.3	174.1	0	0	107.5	R3	M1-R3 PolarHBondContact O-N 3.33Å; M1-R3 VanDerWaalsContact O-N 3.17Å
2	N	36.6	Very low	48.1	Very low	165 Å²	165	140.1 Å²	140.1	88%	0.882	75%	0.751	S	S	*	*			trans	-76.8	102.9	174.1	-88.1	2.3	0	0	0	107.3	Q4	N2-Q4 VanDerWaalsContact C-N 3.27Å; N2-Q4 PolarHBondContact O-N 2.7Å
3	R	34.9	Very low	51.4	Low	239 Å²	239	132.6 Å²	132.6	90%	0.902	71%	0.71	S	S	*	*			trans	-64	97.6	160.6	-80.7	179.9	175	178.7	-2.7	105.9	M1 T5	M1-R3 PolarHBondContact O-N 3.33Å; M1-R3 VanDerWaalsContact O-N 3.17Å; R3-T5 VanDerWaalsContact C-N 3.34Å; R3-T5 PolarHBondContact O-N 2.99Å
4	Q	34	Very low	54.3	Low	185 Å²	185	123.1 Å²	123.1	86%	0.864	66%	0.66	S	S	*	*			trans	-64.7	104.6	165.7	-147.6	135.1	18.1	0	0	104.9	N2 A6	N2-Q4 VanDerWaalsContact C-N 3.27Å; N2-Q4 PolarHBondContact O-N 2.7Å; Q4-A6 PolarHBondContact O-N 2.91Å; Q4-A6 VanDerWaalsContact O-N 3.08Å
5	T	36.7	Very low	57.1	Low	120 Å²	120	120.7 Å²	120.7	74%	0.736	64%	0.643	S	S	*	*			trans	-53.3	114.3	171.4	44.7	0	0	0	0	106	R3 D7	R3-T5 VanDerWaalsContact C-N 3.34Å; R3-T5 PolarHBondContact O-N 2.99Å; T5-D7 PolarHBondContact O-N 3.02Å
6	A	38.2	Very low	59.5	Low	87 Å²	87	113.3 Å²	113.3	72%	0.719	60%	0.604	S	S	*	*			trans	-55.2	111	167.5	0	0	0	0	0	105.4	Q4 D8	Q4-A6 PolarHBondContact O-N 2.91Å; Q4-A6 VanDerWaalsContact O-N 3.08Å; A6-D8 VanDerWaalsContact C-N 3.26Å; A6-D8 PolarHBondContact O-N 2.99Å
7	D	42	Very low	61.5	Low	157 Å²	157	111.6 Å²	111.6	84%	0.84	59%	0.59	S	S	*	*			trans	-59.5	101.1	167.4	-119.8	-11.8	0	0	0	104.2	T5	T5-D7 PolarHBondContact O-N 3.02Å
8	D	42.8	Very low	63.3	Low	133 Å²	133	113.2 Å²	113.2	71%	0.711	59%	0.588	S	S	*	*			trans	-52	127.1	171	-84.3	-38.6	0	0	0	106.2	A6 A10	A6-D8 VanDerWaalsContact C-N 3.26Å; A6-D8 PolarHBondContact O-N 2.99Å; D8-A10 VanDerWaalsContact C-N 3.34Å; D8-A10 PolarHBondContact O-N 2.74Å
9	P	49.8	Very low	65	Low	89 Å²	89	112.7 Å²	112.7	58%	0.578	59%	0.586	S	S	*	*			trans	-61.8	100.6	-176	23.8	-31.9	0	0	0	108	F11	P9-F11 VanDerWaalsContact C-N 3.35Å; P9-F11 WeakPolarHBondContact O-CD1 3.48Å; P9-F11 PolarHBondContact O-N 3.23Å
10	A	62.3	Low	66.5	Low	99 Å²	99	108.2 Å²	108.2	82%	0.818	56%	0.562	S	S	*	*			trans	-67.5	94.5	-176	0	0	0	0	0	108.6	D8	D8-A10 VanDerWaalsContact C-N 3.34Å; D8-A10 PolarHBondContact O-N 2.74Å
11	F	74.1	Confident	67.8	Low	107 Å²	107	108.4 Å²	108.4	47%	0.469	57%	0.568	S	S	.	*			trans	-79.1	148.9	167.6	55.9	-89.5	0	0	0	109.3	P9 L13 V37	P9-F11 VanDerWaalsContact C-N 3.35Å; P9-F11 WeakPolarHBondContact O-CD1 3.48Å; P9-F11 PolarHBondContact O-N 3.23Å; F11-L13 HydrophobicContact CD2-CD2 4.23Å; F11-L13 HydrophobicContact CD2-CG 3.94Å; F11-L13 HydrophobicContact CE2-CD1 3.86Å; F11-L13 HydrophobicContact CE2-CD2 4.05Å; F11-L13 HydrophobicContact CE2-CG 3.76Å; F11-V37 HydrophobicContact CD2-CG1 4.48Å
12	I	86.9	Confident	70.2	Confident	66 Å²	66	98.4 Å²	98.4	34%	0.338	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	115.5	-175.2	-60.9	174.7	0	0	0	108	V38 L65	I12-V38 HydrophobicContact CB-CB 4.05Å; I12-V38 HydrophobicContact CG2-CB 4.06Å; I12-V38 HydrophobicContact CG2-CG2 4.09Å; I12-V38 PolarHBondContact O-N 2.82Å; I12-L65 HydrophobicContact CG2-CD2 3.27Å
13	L	91	Very high	72.6	Confident	43 Å²	43	101.6 Å²	101.6	23%	0.225	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	135.3	171	-74.2	172.1	0	0	0	110.5	F11 M35 V37 E66	F11-L13 HydrophobicContact CD2-CD2 4.23Å; F11-L13 HydrophobicContact CD2-CG 3.94Å; F11-L13 HydrophobicContact CE2-CD1 3.86Å; F11-L13 HydrophobicContact CE2-CD2 4.05Å; F11-L13 HydrophobicContact CE2-CG 3.76Å; L13-M35 HydrophobicContact CB-CE 4.35Å; L13-V37 HydrophobicContact CD2-CG2 3.88Å; L13-E66 PolarHBondContact O-N 2.72Å
14	A	92	Very high	75.2	Confident	0 Å²	0	94.8 Å²	94.8	0%	0	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	127.8	178.5	0	0	0	0	0	110.3	I36 V38 V63 S64 L65	A14-I36 PolarHBondContact N-O 3.26Å; A14-I36 PolarHBondContact O-N 3.17Å; A14-V38 HydrophobicContact CB-CG2 3.62Å; A14-V63 HydrophobicContact CB-CB 3.88Å; A14-V63 HydrophobicContact CB-CG1 4.36Å; A14-V63 HydrophobicContact CB-CG2 3.85Å; A14-S64 CarbonylContact C-O 3.54Å; A14-S64 WeakPolarHBondContact CA-O 3.26Å; A14-L65 HydrophobicContact CB-CD2 4.4Å
15	Q	96	Very high	77.6	Confident	86 Å²	86	94.5 Å²	94.5	40%	0.402	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	130.9	176.1	-174.9	177	43.2	0	0	110.7	K17 D34 M35 V63 S64	Q15-K17 PolarHBondContact O-N 3.24Å; Q15-D34 WeakPolarHBondContact CA-O 3.15Å; Q15-M35 HydrophobicContact CB-CE 4.2Å; Q15-M35 HydrophobicContact CB-SD 3.63Å; Q15-M35 HydrophobicContact CG-SD 3.68Å; Q15-V63 CarbonylContact O-C 3.51Å; Q15-V63 WeakPolarHBondContact O-CA 2.93Å; Q15-V63 WeakPolarHBondContact O-CB 3.03Å; Q15-S64 PolarHBondContact N-O 3.46Å; Q15-S64 PolarHBondContact O-N 2.76Å; Q15-S64 PolarHBondContact O-OG 2.83Å
16	A	95.4	Very high	80	Confident	3 Å²	3	91.9 Å²	91.9	3%	0.025	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	118.2	175.3	0	0	0	0	0	112.4	F30 K31 G33 D34	A16-F30 HydrophobicContact CB-CD2 3.39Å; A16-F30 HydrophobicContact CB-CE2 3.57Å; A16-F30 HydrophobicContact CB-CG 4.42Å; A16-K31 WeakPolarHBondContact CB-O 3.29Å; A16-G33 PolarHBondContact O-N 2.97Å; A16-D34 HydrophobicContact CB-CB 4.33Å; A16-D34 PolarHBondContact N-O 2.86Å
17	K	93.6	Very high	82.6	Confident	84 Å²	84	89.2 Å²	89.2	37%	0.365	47%	0.465	S	S	.	.	S	Bend	trans	-79.4	-30.6	174.1	-67.2	172.2	176.5	153	0	112.5	Q15 K32 Y62 V63 S64	Q15-K17 PolarHBondContact O-N 3.24Å; K17-K32 VanDerWaalsContact O-CD 3.23Å; K17-K32 WeakPolarHBondContact O-CD 3.46Å; K17-K32 WeakPolarHBondContact O-CE 3.28Å; K17-K32 VanDerWaalsContact O-CG 3.28Å; K17-K32 WeakPolarHBondContact O-CG 3.23Å; K17-Y62 WeakPolarHBondContact CB-O 3.38Å; K17-Y62 PolarHBondContact N-O 3.35Å; K17-V63 VanDerWaalsContact CE-O 3.29Å; K17-V63 WeakPolarHBondContact CE-O 3.38Å; K17-V63 PolarHBondContact NZ-O 2.84Å; K17-S64 WeakPolarHBondContact CE-OG 3.07Å
18	Y	94.1	Very high	85.1	Confident	140 Å²	140	82.1 Å²	82.1	55%	0.549	43%	0.427	S	S	.	.	S	Bend	trans	-137.3	162.8	-176.3	-51.4	-68.7	0	0	0	109.8	F30 Y62	Y18-F30 WeakPolarHBondContact O-CE2 3.18Å; Y18-Y62 HydrophobicContact CD2-CD1 4.5Å
19	N	96	Very high	87.6	Confident	104 Å²	104	79.5 Å²	79.5	56%	0.556	42%	0.417	S	S	*	.			trans	-70.5	141.9	168.2	-58.6	-8.1	0	0	0	108.9	F30 K32 Y62	N19-F30 WeakPolarHBondContact CA-O 3.16Å; N19-K32 WeakPolarHBondContact OD1-CB 3.04Å; N19-K32 PolarHBondContact OD1-N 2.81Å; N19-Y62 WeakPolarHBondContact O-CE1 3.36Å
20	F	94.2	Very high	89.8	Confident	23 Å²	23	75.7 Å²	75.7	10%	0.101	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-129.3	127.9	170.9	-176.8	-114.7	0	0	0	110	E27 L28 C29 F30 W46 F58 P59 Y62	F20-E27 HydrophobicContact CE1-CB 4.31Å; F20-L28 WeakPolarHBondContact CD1-O 3.03Å; F20-C29 WeakPolarHBondContact O-CA 3.49Å; F20-F30 HydrophobicContact CB-CD1 4.23Å; F20-F30 HydrophobicContact CB-CD2 4.14Å; F20-F30 HydrophobicContact CB-CE1 3.76Å; F20-F30 HydrophobicContact CB-CE2 3.66Å; F20-F30 HydrophobicContact CB-CG 4.41Å; F20-F30 HydrophobicContact CB-CZ 3.46Å; F20-F30 VanDerWaalsContact CB-CZ 3.46Å; F20-F30 HydrophobicContact CD1-CD1 4.47Å; F20-F30 AromaticContact CD1-CE1 3.88Å; F20-F30 HydrophobicContact CD1-CE1 3.88Å; F20-F30 HydrophobicContact CD1-CZ 4.27Å; F20-F30 HydrophobicContact CG-CE1 4.23Å; F20-F30 HydrophobicContact CG-CZ 4.18Å; F20-F30 PolarHBondContact N-O 2.8Å; F20-F30 PolarHBondContact O-N 2.81Å; F20-W46 HydrophobicContact CZ-CH2 4.24Å; F20-W46 HydrophobicContact CZ-CZ3 4.17Å; F20-F58 HydrophobicContact CD1-CB 3.81Å; F20-F58 HydrophobicContact CE1-CB 3.88Å; F20-P59 HydrophobicContact CD2-CG 4.4Å; F20-P59 HydrophobicContact CE2-CG 3.89Å; F20-P59 HydrophobicContact CZ-CG 4.19Å; F20-Y62 HydrophobicContact CB-CD1 3.78Å; F20-Y62 HydrophobicContact CB-CE1 4.2Å; F20-Y62 HydrophobicContact CD2-CD1 4.04Å; F20-Y62 AromaticContact CD2-CE1 3.87Å; F20-Y62 HydrophobicContact CD2-CE1 3.87Å; F20-Y62 HydrophobicContact CG-CD1 4.26Å; F20-Y62 HydrophobicContact CG-CE1 4.47Å
21	T	93.9	Very high	91.4	Very high	112 Å²	112	78 Å²	78	69%	0.687	38%	0.383	S	S	*	.			trans	-114.2	109.2	176.3	51.1	0	0	0	0	108.3
22	G	88.7	Confident	92.4	Very high	24 Å²	24	79.7 Å²	79.7	25%	0.247	39%	0.391	C	S	.	.			trans	-59.4	141.7	176.5	0	0	0	0	0	111.8	E27 C29	G22-E27 WeakPolarHBondContact CA-OE2 3.09Å; G22-C29 PolarHBondContact N-SG 3.4Å
23	R	88.7	Confident	92.7	Very high	232 Å²	232	78.3 Å²	78.3	88%	0.875	39%	0.392	S	S	*	.	S	Bend	trans	-97.3	-27.8	174.6	-62.8	-179	-178.5	179.9	0.7	111.8	E27	R23-E27 PolarHBondContact N-OE2 2.73Å
24	N	87.7	Confident	92.9	Very high	96 Å²	96	78.6 Å²	78.6	51%	0.513	39%	0.394	S	S	.	.	S	Bend	trans	-110.9	157.9	-179.3	-59.4	-48.9	0	0	0	110.6	D26 E27	N24-D26 WeakPolarHBondContact CB-OD1 3.21Å; N24-D26 PolarHBondContact O-N 2.76Å; N24-E27 HydrophobicContact CB-CG 4.17Å; N24-E27 PolarHBondContact ND2-OE1 2.64Å; N24-E27 WeakPolarHBondContact O-CB 3.43Å; N24-E27 PolarHBondContact O-N 2.78Å; N24-E27 VanDerWaalsContact O-N 3.12Å
25	N	84.9	Confident	93	Very high	180 Å²	180	81.9 Å²	81.9	96%	0.963	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.3	-176	-64.5	-25.4	0	0	0	113.5
26	D	87.4	Confident	92.9	Very high	65 Å²	65	77.8 Å²	77.8	35%	0.348	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-0.4	176.4	63.2	-34.4	0	0	0	113.1	N24 G56 W57	N24-D26 WeakPolarHBondContact CB-OD1 3.21Å; N24-D26 PolarHBondContact O-N 2.76Å; D26-G56 CarbonylContact O-C 3.59Å; D26-G56 VanDerWaalsContact O-CA 3.25Å; D26-G56 WeakPolarHBondContact O-CA 3.46Å; D26-W57 PolarHBondContact O-N 2.88Å
27	E	93.3	Very high	92.8	Very high	31 Å²	31	78.6 Å²	78.6	15%	0.145	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-95.2	140.7	-179.8	-68.4	173.6	-159.8	0	0	112.5	F20 G22 R23 N24 W46 W57	F20-E27 HydrophobicContact CE1-CB 4.31Å; G22-E27 WeakPolarHBondContact CA-OE2 3.09Å; R23-E27 PolarHBondContact N-OE2 2.73Å; N24-E27 HydrophobicContact CB-CG 4.17Å; N24-E27 PolarHBondContact ND2-OE1 2.64Å; N24-E27 WeakPolarHBondContact O-CB 3.43Å; N24-E27 PolarHBondContact O-N 2.78Å; N24-E27 VanDerWaalsContact O-N 3.12Å; E27-W46 HydrophobicContact CG-CZ3 4.3Å; E27-W57 CarbonylContact C-O 3.5Å; E27-W57 VanDerWaalsContact CA-O 3.25Å; E27-W57 WeakPolarHBondContact CA-O 3.3Å
28	L	94.7	Very high	92.8	Very high	8 Å²	8	75 Å²	75	4%	0.042	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-89.2	118	-178.9	-176.4	70.4	0	0	0	111.5	F20 F30 I36 L51 K54 W57 F58	F20-L28 WeakPolarHBondContact CD1-O 3.03Å; L28-F30 HydrophobicContact CD2-CD1 4.19Å; L28-F30 HydrophobicContact CG-CD1 4.23Å; L28-F30 WeakPolarHBondContact O-CD1 3.48Å; L28-I36 HydrophobicContact CD2-CD1 4.25Å; L28-I36 HydrophobicContact CD2-CG1 4.45Å; L28-I36 HydrophobicContact CD2-CG2 3.91Å; L28-L51 HydrophobicContact CD1-CB 4.25Å; L28-L51 HydrophobicContact CD2-CB 4.03Å; L28-K54 HydrophobicContact CD1-CB 4.28Å; L28-K54 WeakPolarHBondContact CD1-O 3.37Å; L28-W57 PolarHBondContact N-O 2.68Å; L28-F58 HydrophobicContact CB-CD1 4.25Å; L28-F58 HydrophobicContact CD2-CD1 4.05Å; L28-F58 HydrophobicContact CD2-CE1 4.22Å
29	C	94.8	Very high	92.5	Very high	77 Å²	77	69.2 Å²	69.2	52%	0.52	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-83.2	134.7	172.3	-61.1	0	0	0	0	112	F20 G22	F20-C29 WeakPolarHBondContact O-CA 3.49Å; G22-C29 PolarHBondContact N-SG 3.4Å
30	F	96.2	Very high	92.3	Very high	10 Å²	10	66 Å²	66	4%	0.044	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-153.3	161.9	176.3	55.7	-99.2	0	0	0	112.9	A16 Y18 N19 F20 L28 D34 I36 L51 F58 V63	A16-F30 HydrophobicContact CB-CD2 3.39Å; A16-F30 HydrophobicContact CB-CE2 3.57Å; A16-F30 HydrophobicContact CB-CG 4.42Å; Y18-F30 WeakPolarHBondContact O-CE2 3.18Å; N19-F30 WeakPolarHBondContact CA-O 3.16Å; F20-F30 HydrophobicContact CB-CD1 4.23Å; F20-F30 HydrophobicContact CB-CD2 4.14Å; F20-F30 HydrophobicContact CB-CE1 3.76Å; F20-F30 HydrophobicContact CB-CE2 3.66Å; F20-F30 HydrophobicContact CB-CG 4.41Å; F20-F30 HydrophobicContact CB-CZ 3.46Å; F20-F30 VanDerWaalsContact CB-CZ 3.46Å; F20-F30 HydrophobicContact CD1-CD1 4.47Å; F20-F30 AromaticContact CD1-CE1 3.88Å; F20-F30 HydrophobicContact CD1-CE1 3.88Å; F20-F30 HydrophobicContact CD1-CZ 4.27Å; F20-F30 HydrophobicContact CG-CE1 4.23Å; F20-F30 HydrophobicContact CG-CZ 4.18Å; F20-F30 PolarHBondContact N-O 2.8Å; F20-F30 PolarHBondContact O-N 2.81Å; L28-F30 HydrophobicContact CD2-CD1 4.19Å; L28-F30 HydrophobicContact CG-CD1 4.23Å; L28-F30 WeakPolarHBondContact O-CD1 3.48Å; F30-D34 HydrophobicContact CB-CB 4.22Å; F30-I36 HydrophobicContact CB-CD1 4.33Å; F30-I36 HydrophobicContact CD1-CD1 3.47Å; F30-I36 VanDerWaalsContact CD1-CD1 3.47Å; F30-I36 HydrophobicContact CD2-CD1 4.11Å; F30-I36 HydrophobicContact CE1-CD1 3.61Å; F30-I36 HydrophobicContact CE2-CD1 4.23Å; F30-I36 HydrophobicContact CG-CD1 3.72Å; F30-I36 HydrophobicContact CZ-CD1 3.99Å; F30-L51 HydrophobicContact CB-CD2 3.54Å; F30-F58 HydrophobicContact CE1-CB 3.58Å; F30-F58 HydrophobicContact CE1-CD1 4.16Å; F30-F58 AromaticContact CE1-CD2 4Å; F30-F58 HydrophobicContact CE1-CD2 4Å; F30-F58 AromaticContact CE1-CG 3.65Å; F30-F58 HydrophobicContact CE1-CG 3.65Å; F30-F58 HydrophobicContact CZ-CB 4.15Å; F30-F58 HydrophobicContact CZ-CD2 4.1Å; F30-F58 HydrophobicContact CZ-CG 4.19Å; F30-V63 HydrophobicContact CE2-CG1 4.47Å; F30-V63 HydrophobicContact CZ-CG1 4.17Å
31	K	96	Very high	92	Very high	146 Å²	146	69.3 Å²	69.3	64%	0.635	36%	0.358	S	S	*	.			trans	-102.4	156.2	175.8	-65.4	178.4	-177	174.4	0	110.2	A16 G33 D34	A16-K31 WeakPolarHBondContact CB-O 3.29Å; K31-G33 PolarHBondContact O-N 2.74Å; K31-D34 PolarHBondContact N-OD2 3.12Å; K31-D34 VanDerWaalsContact O-CB 3.28Å; K31-D34 WeakPolarHBondContact O-CB 3.34Å; K31-D34 PolarHBondContact O-N 3.42Å; K31-D34 VanDerWaalsContact O-N 3.11Å
32	K	94.6	Very high	91.6	Very high	144 Å²	144	67.9 Å²	67.9	63%	0.626	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	131.1	172.8	175.5	177.6	-177.3	-176.9	0	109.7	K17 N19	K17-K32 VanDerWaalsContact O-CD 3.23Å; K17-K32 WeakPolarHBondContact O-CD 3.46Å; K17-K32 WeakPolarHBondContact O-CE 3.28Å; K17-K32 VanDerWaalsContact O-CG 3.28Å; K17-K32 WeakPolarHBondContact O-CG 3.23Å; N19-K32 WeakPolarHBondContact OD1-CB 3.04Å; N19-K32 PolarHBondContact OD1-N 2.81Å
33	G	92.7	Very high	91.1	Very high	36 Å²	36	72.9 Å²	72.9	37%	0.371	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.4	-15	-178.6	0	0	0	0	0	114.1	A16 K31	A16-G33 PolarHBondContact O-N 2.97Å; K31-G33 PolarHBondContact O-N 2.74Å
34	D	95.7	Very high	90.9	Very high	49 Å²	49	69.8 Å²	69.8	26%	0.262	37%	0.372	S	S	.	.			trans	-62.6	143.7	177.8	-68.5	-10	0	0	0	111.1	Q15 A16 F30 K31 L51	Q15-D34 WeakPolarHBondContact CA-O 3.15Å; A16-D34 HydrophobicContact CB-CB 4.33Å; A16-D34 PolarHBondContact N-O 2.86Å; F30-D34 HydrophobicContact CB-CB 4.22Å; K31-D34 PolarHBondContact N-OD2 3.12Å; K31-D34 VanDerWaalsContact O-CB 3.28Å; K31-D34 WeakPolarHBondContact O-CB 3.34Å; K31-D34 PolarHBondContact O-N 3.42Å; K31-D34 VanDerWaalsContact O-N 3.11Å; D34-L51 HydrophobicContact CB-CD1 4.28Å; D34-L51 HydrophobicContact CB-CD2 3.98Å
35	M	93.5	Very high	90.9	Very high	70 Å²	70	66.2 Å²	66.2	35%	0.345	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.7	178.8	-63.2	-55.7	-64.3	0	0	109.8	L13 Q15 L51 E66	L13-M35 HydrophobicContact CB-CE 4.35Å; Q15-M35 HydrophobicContact CB-CE 4.2Å; Q15-M35 HydrophobicContact CB-SD 3.63Å; Q15-M35 HydrophobicContact CG-SD 3.68Å; M35-L51 WeakPolarHBondContact O-CD1 3.39Å; M35-E66 VanDerWaalsContact CE-OE2 3.26Å; M35-E66 WeakPolarHBondContact CE-OE2 3.23Å
36	I	94.9	Very high	91.3	Very high	0 Å²	0	62 Å²	62	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	130.8	-173.8	-55.5	169.6	0	0	0	108.8	A14 L28 F30 V38 L51 F58 V63	A14-I36 PolarHBondContact N-O 3.26Å; A14-I36 PolarHBondContact O-N 3.17Å; L28-I36 HydrophobicContact CD2-CD1 4.25Å; L28-I36 HydrophobicContact CD2-CG1 4.45Å; L28-I36 HydrophobicContact CD2-CG2 3.91Å; F30-I36 HydrophobicContact CB-CD1 4.33Å; F30-I36 HydrophobicContact CD1-CD1 3.47Å; F30-I36 VanDerWaalsContact CD1-CD1 3.47Å; F30-I36 HydrophobicContact CD2-CD1 4.11Å; F30-I36 HydrophobicContact CE1-CD1 3.61Å; F30-I36 HydrophobicContact CE2-CD1 4.23Å; F30-I36 HydrophobicContact CG-CD1 3.72Å; F30-I36 HydrophobicContact CZ-CD1 3.99Å; I36-V38 PolarHBondContact O-N 3.09Å; I36-L51 HydrophobicContact CG1-CB 4.44Å; I36-F58 HydrophobicContact CD1-CE1 4.38Å; I36-F58 HydrophobicContact CD1-CZ 4.3Å; I36-F58 HydrophobicContact CG2-CE1 3.76Å; I36-F58 HydrophobicContact CG2-CZ 3.94Å; I36-V63 HydrophobicContact CD1-CG1 4.08Å
37	V	93.5	Very high	91.6	Very high	19 Å²	19	60.6 Å²	60.6	12%	0.115	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	110.2	171.4	-177.7	0	0	0	0	108	F11 L13 T39 G49 T50	F11-V37 HydrophobicContact CD2-CG1 4.48Å; L13-V37 HydrophobicContact CD2-CG2 3.88Å; V37-T39 PolarHBondContact O-N 3.37Å; V37-G49 CarbonylContact O-C 3.58Å; V37-G49 WeakPolarHBondContact O-CA 3.41Å; V37-T50 PolarHBondContact N-O 3.22Å; V37-T50 PolarHBondContact O-N 3.39Å
38	V	92.3	Very high	91.6	Very high	10 Å²	10	59.1 Å²	59.1	6%	0.061	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	125.7	-179.3	-179.3	0	0	0	0	109.6	I12 A14 I36 Q41 W47 F58	I12-V38 HydrophobicContact CB-CB 4.05Å; I12-V38 HydrophobicContact CG2-CB 4.06Å; I12-V38 HydrophobicContact CG2-CG2 4.09Å; I12-V38 PolarHBondContact O-N 2.82Å; A14-V38 HydrophobicContact CB-CG2 3.62Å; I36-V38 PolarHBondContact O-N 3.09Å; V38-Q41 HydrophobicContact CG1-CG 3.73Å; V38-W47 HydrophobicContact CG1-CB 4.45Å; V38-W47 HydrophobicContact CG1-CE3 4.3Å; V38-W47 HydrophobicContact CG2-CE3 4.06Å; V38-W47 HydrophobicContact CG2-CZ3 4.48Å; V38-F58 HydrophobicContact CG2-CZ 4.46Å
39	T	89.3	Confident	91.6	Very high	18 Å²	18	58.8 Å²	58.8	11%	0.11	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-38.7	179.8	54	0	0	0	0	112.1	V37 E48 E260	V37-T39 PolarHBondContact O-N 3.37Å; T39-E48 PolarHBondContact N-O 2.79Å; T39-E48 VanDerWaalsContact OG1-C 3.27Å; T39-E48 WeakPolarHBondContact OG1-CB 3.05Å; T39-E48 WeakPolarHBondContact OG1-CG 3.47Å; T39-E48 PolarHBondContact OG1-O 3.05Å; T39-E48 VanDerWaalsContact OG1-O 3.12Å; T39-E48 PolarHBondContact OG1-OE2 2.83Å; T39-E260 WeakPolarHBondContact CG2-O 3.33Å
40	Q	90.5	Very high	91.5	Very high	36 Å²	36	55.1 Å²	55.1	17%	0.168	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	147.6	-179.3	-62.6	-177.3	91.2	0	0	111.2	W47 E48 W57 R170 P263	Q40-W47 CarbonylContact O-C 3.59Å; Q40-W47 WeakPolarHBondContact O-CA 3.47Å; Q40-E48 HydrophobicContact CB-CB 3.99Å; Q40-E48 PolarHBondContact N-O 3.43Å; Q40-E48 PolarHBondContact NE2-OE2 2.77Å; Q40-E48 PolarHBondContact O-N 2.85Å; Q40-W57 HydrophobicContact CB-CH2 4.14Å; Q40-R170 VanDerWaalsContact OE1-NH1 3.13Å; Q40-R170 VanDerWaalsContact OE1-NH2 3.12Å; Q40-P263 HydrophobicContact CG-CB 3.95Å; Q40-P263 PolarHBondContact NE2-O 3.42Å; Q40-P263 VanDerWaalsContact NE2-O 3.12Å
41	Q	88.8	Confident	91.4	Very high	92 Å²	92	55.7 Å²	55.7	43%	0.43	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	109.3	177.4	-64.7	-178.6	-26.6	0	0	109.4	V38 W47	V38-Q41 HydrophobicContact CG1-CG 3.73Å; Q41-W47 HydrophobicContact CB-CG 4.39Å; Q41-W47 HydrophobicContact CG-CD2 3.98Å; Q41-W47 HydrophobicContact CG-CG 4.02Å; Q41-W47 HydrophobicContact CG-CZ2 4.49Å
42	L	86.2	Confident	91.1	Very high	83 Å²	83	55.7 Å²	55.7	44%	0.435	30%	0.295	S	S	.	.			trans	-84.8	147.5	171.7	-60	173.4	0	0	0	110.5	E44 G45 W46 W57	L42-E44 PolarHBondContact O-N 2.76Å; L42-G45 PolarHBondContact O-N 2.79Å; L42-W46 VanDerWaalsContact CB-O 3.26Å; L42-W46 WeakPolarHBondContact CB-O 3.3Å; L42-W46 PolarHBondContact N-O 2.98Å; L42-W57 HydrophobicContact CD1-CE3 4.13Å; L42-W57 HydrophobicContact CD1-CH2 3.54Å; L42-W57 HydrophobicContact CD1-CZ2 4.31Å; L42-W57 HydrophobicContact CD1-CZ3 3.43Å; L42-W57 VanDerWaalsContact CD1-CZ3 3.43Å; L42-W57 HydrophobicContact CD2-CH2 4.24Å; L42-W57 HydrophobicContact CG-CH2 3.69Å; L42-W57 HydrophobicContact CG-CZ3 3.57Å
43	S	78	Confident	90.8	Very high	128 Å²	128	50 Å²	50	90%	0.895	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.4	177.9	50.2	0	0	0	0	113.6	G45	S43-G45 PolarHBondContact O-N 2.78Å
44	E	83.8	Confident	90.7	Very high	167 Å²	167	55.6 Å²	55.6	78%	0.78	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	1	179.2	-58	-171.8	175.9	0	0	113.3	L42	L42-E44 PolarHBondContact O-N 2.76Å
45	G	87.8	Confident	90.6	Very high	22 Å²	22	54.2 Å²	54.2	23%	0.227	29%	0.285	C	S	.	.	S	Bend	trans	88.5	6.7	177.1	0	0	0	0	0	114.2	L42 S43 S60	L42-G45 PolarHBondContact O-N 2.79Å; S43-G45 PolarHBondContact O-N 2.78Å; G45-S60 WeakPolarHBondContact CA-OG 3.38Å; G45-S60 WeakPolarHBondContact O-CB 3.39Å; G45-S60 PolarHBondContact O-N 3.49Å; G45-S60 PolarHBondContact O-OG 2.86Å
46	W	92.7	Very high	90.7	Very high	90 Å²	90	50.9 Å²	50.9	34%	0.341	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	128.7	167.5	-74.5	89.1	0	0	0	110.8	F20 E27 L42 W57 P59	F20-W46 HydrophobicContact CZ-CH2 4.24Å; F20-W46 HydrophobicContact CZ-CZ3 4.17Å; E27-W46 HydrophobicContact CG-CZ3 4.3Å; L42-W46 VanDerWaalsContact CB-O 3.26Å; L42-W46 WeakPolarHBondContact CB-O 3.3Å; L42-W46 PolarHBondContact N-O 2.98Å; W46-W57 HydrophobicContact CB-CE3 4.24Å; W46-W57 HydrophobicContact CE3-CB 4.07Å; W46-W57 HydrophobicContact CZ3-CB 4.48Å; W46-P59 HydrophobicContact CE3-CG 4.37Å; W46-P59 HydrophobicContact CH2-CG 3.94Å; W46-P59 HydrophobicContact CZ2-CG 4.24Å; W46-P59 HydrophobicContact CZ3-CG 4.01Å
47	W	93.8	Very high	90.7	Very high	37 Å²	37	52.6 Å²	52.6	14%	0.14	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	147.8	176.7	-67.2	-2.2	0	0	0	109.6	V38 Q40 Q41 W57 F58 V63 L65	V38-W47 HydrophobicContact CG1-CB 4.45Å; V38-W47 HydrophobicContact CG1-CE3 4.3Å; V38-W47 HydrophobicContact CG2-CE3 4.06Å; V38-W47 HydrophobicContact CG2-CZ3 4.48Å; Q40-W47 CarbonylContact O-C 3.59Å; Q40-W47 WeakPolarHBondContact O-CA 3.47Å; Q41-W47 HydrophobicContact CB-CG 4.39Å; Q41-W47 HydrophobicContact CG-CD2 3.98Å; Q41-W47 HydrophobicContact CG-CG 4.02Å; Q41-W47 HydrophobicContact CG-CZ2 4.49Å; W47-W57 CarbonylContact O-C 3.45Å; W47-W57 VanDerWaalsContact O-CA 3.31Å; W47-W57 WeakPolarHBondContact O-CA 3.17Å; W47-F58 HydrophobicContact CB-CE1 4.49Å; W47-F58 HydrophobicContact CB-CE2 4.07Å; W47-F58 HydrophobicContact CB-CZ 4Å; W47-F58 HydrophobicContact CE3-CE2 4.39Å; W47-F58 PolarHBondContact N-O 2.91Å; W47-F58 WeakPolarHBondContact O-CD1 3.32Å; W47-F58 PolarHBondContact O-N 3.15Å; W47-V63 HydrophobicContact CE3-CG2 3.89Å; W47-V63 HydrophobicContact CZ3-CG2 3.74Å; W47-L65 HydrophobicContact CH2-CD1 3.81Å; W47-L65 HydrophobicContact CH2-CD2 3.6Å; W47-L65 HydrophobicContact CH2-CG 3.66Å; W47-L65 HydrophobicContact CZ3-CD2 3.44Å; W47-L65 VanDerWaalsContact CZ3-CD2 3.44Å; W47-L65 HydrophobicContact CZ3-CG 3.93Å
48	E	93.9	Very high	90.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	140.6	169.6	-162.6	-171.8	-128	0	0	107.8	T39 Q40 T55 G56 W57 R270	T39-E48 PolarHBondContact N-O 2.79Å; T39-E48 VanDerWaalsContact OG1-C 3.27Å; T39-E48 WeakPolarHBondContact OG1-CB 3.05Å; T39-E48 WeakPolarHBondContact OG1-CG 3.47Å; T39-E48 PolarHBondContact OG1-O 3.05Å; T39-E48 VanDerWaalsContact OG1-O 3.12Å; T39-E48 PolarHBondContact OG1-OE2 2.83Å; Q40-E48 HydrophobicContact CB-CB 3.99Å; Q40-E48 PolarHBondContact N-O 3.43Å; Q40-E48 PolarHBondContact NE2-OE2 2.77Å; Q40-E48 PolarHBondContact O-N 2.85Å; E48-T55 HydrophobicContact CG-CG2 3.74Å; E48-G56 WeakPolarHBondContact CA-O 3.48Å; E48-W57 HydrophobicContact CB-CD2 3.9Å; E48-W57 HydrophobicContact CB-CE3 3.72Å; E48-W57 HydrophobicContact CB-CH2 3.83Å; E48-W57 HydrophobicContact CB-CZ2 4.02Å; E48-W57 HydrophobicContact CB-CZ3 3.68Å; E48-W57 HydrophobicContact CG-CD2 4.22Å; E48-W57 HydrophobicContact CG-CZ2 4.37Å; E48-R270 IonicContact OE1-NH2 2.76Å; E48-R270 PolarHBondContact OE1-NH2 3.35Å
49	G	93.8	Very high	90.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	168.2	174.2	0	0	0	0	0	112.8	V37 T55 G56	V37-G49 CarbonylContact O-C 3.58Å; V37-G49 WeakPolarHBondContact O-CA 3.41Å; G49-T55 VanDerWaalsContact O-CA 3.29Å; G49-T55 WeakPolarHBondContact O-CA 3.22Å; G49-G56 PolarHBondContact N-O 3.48Å; G49-G56 PolarHBondContact O-N 3.45Å
50	T	94.5	Very high	91	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.006	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.9	-177.1	-53.6	0	0	0	0	109.8	V37 K54 T55 E260	V37-T50 PolarHBondContact N-O 3.22Å; V37-T50 PolarHBondContact O-N 3.39Å; T50-K54 CarbonylContact C-O 3.52Å; T50-K54 VanDerWaalsContact CA-O 3.29Å; T50-K54 WeakPolarHBondContact CA-O 3.13Å; T50-T55 PolarHBondContact OG1-OG1 2.67Å; T50-E260 WeakPolarHBondContact CB-O 3.44Å; T50-E260 HydrophobicContact CG2-CB 3.97Å; T50-E260 HydrophobicContact CG2-CG 4.04Å; T50-E260 PolarHBondContact OG1-O 2.93Å
51	L	93.7	Very high	91.1	Very high	21 Å²	21	56 Å²	56	11%	0.11	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	128.3	172.5	174.4	67.1	0	0	0	108.6	L28 F30 D34 M35 I36 G53 K54	L28-L51 HydrophobicContact CD1-CB 4.25Å; L28-L51 HydrophobicContact CD2-CB 4.03Å; F30-L51 HydrophobicContact CB-CD2 3.54Å; D34-L51 HydrophobicContact CB-CD1 4.28Å; D34-L51 HydrophobicContact CB-CD2 3.98Å; M35-L51 WeakPolarHBondContact O-CD1 3.39Å; I36-L51 HydrophobicContact CG1-CB 4.44Å; L51-G53 PolarHBondContact O-N 2.99Å; L51-K54 PolarHBondContact N-O 2.8Å; L51-K54 PolarHBondContact O-N 2.84Å
52	N	89.7	Confident	91.4	Very high	146 Å²	146	55.2 Å²	55.2	78%	0.781	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	44.1	179.6	-59.1	-33.2	0	0	0	112.5	K54	N52-K54 PolarHBondContact O-N 3.19Å; N52-K54 VanDerWaalsContact O-N 3.14Å
53	G	86.9	Confident	91.7	Very high	24 Å²	24	51.5 Å²	51.5	25%	0.247	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	-14.2	-179	0	0	0	0	0	115.8	L51 R265 Q269	L51-G53 PolarHBondContact O-N 2.99Å; G53-R265 PolarHBondContact O-NH2 3.44Å; G53-R265 VanDerWaalsContact O-NH2 3.12Å; G53-Q269 PolarHBondContact O-NE2 2.68Å
54	K	91.7	Very high	92.3	Very high	155 Å²	155	47.1 Å²	47.1	67%	0.674	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	133	178.3	-66.3	-177.3	178.8	-179.6	0	110.9	L28 T50 L51 N52	L28-K54 HydrophobicContact CD1-CB 4.28Å; L28-K54 WeakPolarHBondContact CD1-O 3.37Å; T50-K54 CarbonylContact C-O 3.52Å; T50-K54 VanDerWaalsContact CA-O 3.29Å; T50-K54 WeakPolarHBondContact CA-O 3.13Å; L51-K54 PolarHBondContact N-O 2.8Å; L51-K54 PolarHBondContact O-N 2.84Å; N52-K54 PolarHBondContact O-N 3.19Å; N52-K54 VanDerWaalsContact O-N 3.14Å
55	T	94.1	Very high	92.5	Very high	19 Å²	19	43.3 Å²	43.3	12%	0.117	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	135.8	178.1	-55	0	0	0	0	110.5	E48 G49 T50 G266	E48-T55 HydrophobicContact CG-CG2 3.74Å; G49-T55 VanDerWaalsContact O-CA 3.29Å; G49-T55 WeakPolarHBondContact O-CA 3.22Å; T50-T55 PolarHBondContact OG1-OG1 2.67Å; T55-G266 VanDerWaalsContact CG2-CA 3.47Å
56	G	94.5	Very high	91.9	Very high	1 Å²	1	47 Å²	47	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.5	173.1	178.1	0	0	0	0	0	113.9	D26 E48 G49	D26-G56 CarbonylContact O-C 3.59Å; D26-G56 VanDerWaalsContact O-CA 3.25Å; D26-G56 WeakPolarHBondContact O-CA 3.46Å; E48-G56 WeakPolarHBondContact CA-O 3.48Å; G49-G56 PolarHBondContact N-O 3.48Å; G49-G56 PolarHBondContact O-N 3.45Å
57	W	94.9	Very high	90.1	Very high	35 Å²	35	50.5 Å²	50.5	13%	0.133	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	144.4	-176.9	-65.9	101.7	0	0	0	112.8	D26 E27 L28 Q40 L42 W46 W47 E48	D26-W57 PolarHBondContact O-N 2.88Å; E27-W57 CarbonylContact C-O 3.5Å; E27-W57 VanDerWaalsContact CA-O 3.25Å; E27-W57 WeakPolarHBondContact CA-O 3.3Å; L28-W57 PolarHBondContact N-O 2.68Å; Q40-W57 HydrophobicContact CB-CH2 4.14Å; L42-W57 HydrophobicContact CD1-CE3 4.13Å; L42-W57 HydrophobicContact CD1-CH2 3.54Å; L42-W57 HydrophobicContact CD1-CZ2 4.31Å; L42-W57 HydrophobicContact CD1-CZ3 3.43Å; L42-W57 VanDerWaalsContact CD1-CZ3 3.43Å; L42-W57 HydrophobicContact CD2-CH2 4.24Å; L42-W57 HydrophobicContact CG-CH2 3.69Å; L42-W57 HydrophobicContact CG-CZ3 3.57Å; W46-W57 HydrophobicContact CB-CE3 4.24Å; W46-W57 HydrophobicContact CE3-CB 4.07Å; W46-W57 HydrophobicContact CZ3-CB 4.48Å; W47-W57 CarbonylContact O-C 3.45Å; W47-W57 VanDerWaalsContact O-CA 3.31Å; W47-W57 WeakPolarHBondContact O-CA 3.17Å; E48-W57 HydrophobicContact CB-CD2 3.9Å; E48-W57 HydrophobicContact CB-CE3 3.72Å; E48-W57 HydrophobicContact CB-CH2 3.83Å; E48-W57 HydrophobicContact CB-CZ2 4.02Å; E48-W57 HydrophobicContact CB-CZ3 3.68Å; E48-W57 HydrophobicContact CG-CD2 4.22Å; E48-W57 HydrophobicContact CG-CZ2 4.37Å
58	F	95.4	Very high	88.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	158	173.6	60.4	-89.3	0	0	0	112.5	F20 L28 F30 I36 V38 W47 S60 V63	F20-F58 HydrophobicContact CD1-CB 3.81Å; F20-F58 HydrophobicContact CE1-CB 3.88Å; L28-F58 HydrophobicContact CB-CD1 4.25Å; L28-F58 HydrophobicContact CD2-CD1 4.05Å; L28-F58 HydrophobicContact CD2-CE1 4.22Å; F30-F58 HydrophobicContact CE1-CB 3.58Å; F30-F58 HydrophobicContact CE1-CD1 4.16Å; F30-F58 AromaticContact CE1-CD2 4Å; F30-F58 HydrophobicContact CE1-CD2 4Å; F30-F58 AromaticContact CE1-CG 3.65Å; F30-F58 HydrophobicContact CE1-CG 3.65Å; F30-F58 HydrophobicContact CZ-CB 4.15Å; F30-F58 HydrophobicContact CZ-CD2 4.1Å; F30-F58 HydrophobicContact CZ-CG 4.19Å; I36-F58 HydrophobicContact CD1-CE1 4.38Å; I36-F58 HydrophobicContact CD1-CZ 4.3Å; I36-F58 HydrophobicContact CG2-CE1 3.76Å; I36-F58 HydrophobicContact CG2-CZ 3.94Å; V38-F58 HydrophobicContact CG2-CZ 4.46Å; W47-F58 HydrophobicContact CB-CE1 4.49Å; W47-F58 HydrophobicContact CB-CE2 4.07Å; W47-F58 HydrophobicContact CB-CZ 4Å; W47-F58 HydrophobicContact CE3-CE2 4.39Å; W47-F58 PolarHBondContact N-O 2.91Å; W47-F58 WeakPolarHBondContact O-CD1 3.32Å; W47-F58 PolarHBondContact O-N 3.15Å; F58-S60 PolarHBondContact O-N 3.39Å; F58-V63 HydrophobicContact CD2-CG1 3.99Å; F58-V63 HydrophobicContact CE2-CB 4.32Å; F58-V63 HydrophobicContact CE2-CG1 3.53Å; F58-V63 HydrophobicContact CE2-CG2 3.76Å; F58-V63 HydrophobicContact CZ-CG1 4.36Å
59	P	94.1	Very high	85.6	Confident	19 Å²	19	62.3 Å²	62.3	12%	0.123	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	127.3	177.2	-19.1	32.9	0	0	0	111.9	F20 W46 N61 Y62	F20-P59 HydrophobicContact CD2-CG 4.4Å; F20-P59 HydrophobicContact CE2-CG 3.89Å; F20-P59 HydrophobicContact CZ-CG 4.19Å; W46-P59 HydrophobicContact CE3-CG 4.37Å; W46-P59 HydrophobicContact CH2-CG 3.94Å; W46-P59 HydrophobicContact CZ2-CG 4.24Å; W46-P59 HydrophobicContact CZ3-CG 4.01Å; P59-N61 WeakPolarHBondContact CB-OD1 3.4Å; P59-N61 PolarHBondContact O-N 3.34Å; P59-N61 VanDerWaalsContact O-N 3.14Å; P59-Y62 HydrophobicContact CB-CD2 3.81Å; P59-Y62 HydrophobicContact CB-CE2 4.26Å; P59-Y62 HydrophobicContact CG-CD2 4.16Å; P59-Y62 HydrophobicContact CG-CE2 4.31Å; P59-Y62 WeakPolarHBondContact O-CB 3.14Å; P59-Y62 PolarHBondContact O-N 3.03Å
60	S	91.8	Very high	83.1	Confident	29 Å²	29	68 Å²	68	20%	0.203	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-58.7	-26.9	-179.1	58	0	0	0	0	114.2	G45 F58 Y62 V63	G45-S60 WeakPolarHBondContact CA-OG 3.38Å; G45-S60 WeakPolarHBondContact O-CB 3.39Å; G45-S60 PolarHBondContact O-N 3.49Å; G45-S60 PolarHBondContact O-OG 2.86Å; F58-S60 PolarHBondContact O-N 3.39Å; S60-Y62 PolarHBondContact O-N 3.28Å; S60-V63 VanDerWaalsContact O-CG2 3.27Å; S60-V63 WeakPolarHBondContact O-CG2 3.43Å; S60-V63 PolarHBondContact O-N 3.27Å
61	N	93.2	Very high	80.3	Confident	107 Å²	107	70.7 Å²	70.7	57%	0.572	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-71.5	-13.8	176.2	64	-38.1	0	0	0	113.5	P59 V63	P59-N61 WeakPolarHBondContact CB-OD1 3.4Å; P59-N61 PolarHBondContact O-N 3.34Å; P59-N61 VanDerWaalsContact O-N 3.14Å; N61-V63 VanDerWaalsContact C-N 3.25Å
62	Y	94.7	Very high	77.7	Confident	76 Å²	76	77.3 Å²	77.3	30%	0.298	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-80.5	-8.8	176.2	-82.2	-120.8	0	0	0	112.8	K17 Y18 N19 F20 P59 S60	K17-Y62 WeakPolarHBondContact CB-O 3.38Å; K17-Y62 PolarHBondContact N-O 3.35Å; Y18-Y62 HydrophobicContact CD2-CD1 4.5Å; N19-Y62 WeakPolarHBondContact O-CE1 3.36Å; F20-Y62 HydrophobicContact CB-CD1 3.78Å; F20-Y62 HydrophobicContact CB-CE1 4.2Å; F20-Y62 HydrophobicContact CD2-CD1 4.04Å; F20-Y62 AromaticContact CD2-CE1 3.87Å; F20-Y62 HydrophobicContact CD2-CE1 3.87Å; F20-Y62 HydrophobicContact CG-CD1 4.26Å; F20-Y62 HydrophobicContact CG-CE1 4.47Å; P59-Y62 HydrophobicContact CB-CD2 3.81Å; P59-Y62 HydrophobicContact CB-CE2 4.26Å; P59-Y62 HydrophobicContact CG-CD2 4.16Å; P59-Y62 HydrophobicContact CG-CE2 4.31Å; P59-Y62 WeakPolarHBondContact O-CB 3.14Å; P59-Y62 PolarHBondContact O-N 3.03Å; S60-Y62 PolarHBondContact O-N 3.28Å
63	V	93.3	Very high	75.1	Confident	4 Å²	4	80.1 Å²	80.1	2%	0.024	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	160	-178.2	-59.3	0	0	0	0	112.3	A14 Q15 K17 F30 I36 W47 F58 S60 N61	A14-V63 HydrophobicContact CB-CB 3.88Å; A14-V63 HydrophobicContact CB-CG1 4.36Å; A14-V63 HydrophobicContact CB-CG2 3.85Å; Q15-V63 CarbonylContact O-C 3.51Å; Q15-V63 WeakPolarHBondContact O-CA 2.93Å; Q15-V63 WeakPolarHBondContact O-CB 3.03Å; K17-V63 VanDerWaalsContact CE-O 3.29Å; K17-V63 WeakPolarHBondContact CE-O 3.38Å; K17-V63 PolarHBondContact NZ-O 2.84Å; F30-V63 HydrophobicContact CE2-CG1 4.47Å; F30-V63 HydrophobicContact CZ-CG1 4.17Å; I36-V63 HydrophobicContact CD1-CG1 4.08Å; W47-V63 HydrophobicContact CE3-CG2 3.89Å; W47-V63 HydrophobicContact CZ3-CG2 3.74Å; F58-V63 HydrophobicContact CD2-CG1 3.99Å; F58-V63 HydrophobicContact CE2-CB 4.32Å; F58-V63 HydrophobicContact CE2-CG1 3.53Å; F58-V63 HydrophobicContact CE2-CG2 3.76Å; F58-V63 HydrophobicContact CZ-CG1 4.36Å; S60-V63 VanDerWaalsContact O-CG2 3.27Å; S60-V63 WeakPolarHBondContact O-CG2 3.43Å; S60-V63 PolarHBondContact O-N 3.27Å; N61-V63 VanDerWaalsContact C-N 3.25Å
64	S	90.9	Very high	72.7	Confident	36 Å²	36	84.1 Å²	84.1	25%	0.252	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.2	164	14.8	0	0	0	0	108.7	A14 Q15 K17 E66	A14-S64 CarbonylContact C-O 3.54Å; A14-S64 WeakPolarHBondContact CA-O 3.26Å; Q15-S64 PolarHBondContact N-O 3.46Å; Q15-S64 PolarHBondContact O-N 2.76Å; Q15-S64 PolarHBondContact O-OG 2.83Å; K17-S64 WeakPolarHBondContact CE-OG 3.07Å; S64-E66 PolarHBondContact O-N 2.95Å
65	L	87	Confident	70	Confident	87 Å²	87	88.2 Å²	88.2	46%	0.455	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	123.4	166.6	-68.4	178	0	0	0	109.1	I12 A14 W47 K67	I12-L65 HydrophobicContact CG2-CD2 3.27Å; A14-L65 HydrophobicContact CB-CD2 4.4Å; W47-L65 HydrophobicContact CH2-CD1 3.81Å; W47-L65 HydrophobicContact CH2-CD2 3.6Å; W47-L65 HydrophobicContact CH2-CG 3.66Å; W47-L65 HydrophobicContact CZ3-CD2 3.44Å; W47-L65 VanDerWaalsContact CZ3-CD2 3.44Å; W47-L65 HydrophobicContact CZ3-CG 3.93Å; L65-K67 PolarHBondContact O-N 3.48Å
66	E	75.6	Confident	67.1	Low	101 Å²	101	95.2 Å²	95.2	47%	0.472	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	93.8	163.1	-164.1	168.3	-156.3	0	0	105.7	L13 M35 S64 Q68	L13-E66 PolarHBondContact O-N 2.72Å; M35-E66 VanDerWaalsContact CE-OE2 3.26Å; M35-E66 WeakPolarHBondContact CE-OE2 3.23Å; S64-E66 PolarHBondContact O-N 2.95Å; E66-Q68 PolarHBondContact O-N 3.01Å
67	K	54.9	Low	64.3	Low	162 Å²	162	101 Å²	101	70%	0.704	53%	0.529	S	S	*	.			trans	-59.3	126.3	160.2	-85.7	-176.1	174.3	-178	0	104.9	L65 D69	L65-K67 PolarHBondContact O-N 3.48Å; K67-D69 PolarHBondContact O-N 3.28Å
68	Q	51	Low	61.8	Low	169 Å²	169	105 Å²	105	79%	0.79	56%	0.556	S	S	*	*			trans	-62.7	72.8	157.4	-74.8	-174.9	1.9	0	0	107.3	E66 A70	E66-Q68 PolarHBondContact O-N 3.01Å; Q68-A70 PolarHBondContact O-N 3.46Å; Q68-A70 VanDerWaalsContact O-N 3.15Å
69	D	42.1	Very low	59	Low	116 Å²	116	114 Å²	114	62%	0.62	60%	0.599	S	S	*	*			trans	-62	116.3	159.6	-80.1	-24.3	0	0	0	103.9	K67 G71 M72	K67-D69 PolarHBondContact O-N 3.28Å; D69-G71 PolarHBondContact O-N 3.12Å; D69-M72 PolarHBondContact O-N 2.95Å
70	A	40.8	Very low	56.5	Low	119 Å²	119	120.2 Å²	120.2	98%	0.983	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	21.6	-175.1	0	0	0	0	0	115	Q68	Q68-A70 PolarHBondContact O-N 3.46Å; Q68-A70 VanDerWaalsContact O-N 3.15Å
71	G	35.9	Very low	54.2	Low	59 Å²	59	125.2 Å²	125.2	61%	0.608	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.5	-20.3	-174.7	0	0	0	0	0	116.9	D69 K73	D69-G71 PolarHBondContact O-N 3.12Å; G71-K73 PolarHBondContact O-N 2.79Å
72	M	38.8	Very low	51.9	Low	160 Å²	160	127.5 Å²	127.5	79%	0.788	67%	0.665	S	S	*	*			trans	-92.3	86.8	-178.8	-96.3	79.1	-179.5	0	0	111.3	D69 T74	D69-M72 PolarHBondContact O-N 2.95Å; M72-T74 PolarHBondContact O-N 3.46Å
73	K	35.3	Very low	49.7	Very low	204 Å²	204	128.8 Å²	128.8	89%	0.887	68%	0.677	S	S	*	*			trans	-65.6	74.8	160.7	-66	176.8	178.1	179	0	109.2	G71 R75	G71-K73 PolarHBondContact O-N 2.79Å; K73-R75 PolarHBondContact O-N 3.29Å; K73-R75 VanDerWaalsContact O-N 3.1Å
74	T	36.6	Very low	47.6	Very low	109 Å²	109	134.5 Å²	134.5	67%	0.669	71%	0.708	S	S	*	*			trans	-69.8	105.5	160.3	41.6	0	0	0	0	106.5	M72 M76	M72-T74 PolarHBondContact O-N 3.46Å; T74-M76 VanDerWaalsContact C-N 3.28Å; T74-M76 PolarHBondContact O-N 3.22Å
75	R	34.9	Very low	45.9	Very low	240 Å²	240	136.1 Å²	136.1	91%	0.906	72%	0.719	S	S	*	*			trans	-67.7	77.5	-170.2	-161	179.5	-175.6	180	-0.2	109.7	K73	K73-R75 PolarHBondContact O-N 3.29Å; K73-R75 VanDerWaalsContact O-N 3.1Å
76	M	33.6	Very low	44.6	Very low	167 Å²	167	136.1 Å²	136.1	82%	0.823	73%	0.726	S	S	*	*			trans	-77	119.5	153.5	-70	-152.1	86.7	0	0	107	T74 V78	T74-M76 VanDerWaalsContact C-N 3.28Å; T74-M76 PolarHBondContact O-N 3.22Å; M76-V78 VanDerWaalsContact C-N 3.25Å; M76-V78 PolarHBondContact O-N 3.34Å
77	P	36.4	Very low	43.8	Very low	123 Å²	123	136 Å²	136	80%	0.799	73%	0.728	S	S	*	*			trans	-80.4	80.1	179.9	32.4	-29.9	0	0	0	108.5
78	V	40.7	Very low	43.9	Very low	117 Å²	117	132.6 Å²	132.6	71%	0.709	72%	0.716	S	S	*	*			trans	-130.7	110.1	151.8	-175	0	0	0	0	103.8	M76 L80	M76-V78 VanDerWaalsContact C-N 3.25Å; M76-V78 PolarHBondContact O-N 3.34Å; V78-L80 PolarHBondContact O-N 3.4Å
79	E	37.6	Very low	44.8	Very low	189 Å²	189	127.2 Å²	127.2	88%	0.883	70%	0.695	S	S	*	*			trans	-47.6	110.3	168.7	-88.4	165	139.6	0	0	107.8	D81	E79-D81 PolarHBondContact O-N 3.21Å
80	L	42	Very low	46.5	Very low	151 Å²	151	123.3 Å²	123.3	79%	0.791	68%	0.677	S	S	*	*			trans	-71.9	77.3	177.3	-75.9	144	0	0	0	107.9	V78 I82	V78-L80 PolarHBondContact O-N 3.4Å; L80-I82 HydrophobicContact CB-CG1 4.3Å; L80-I82 PolarHBondContact O-N 3.26Å
81	D	42.2	Very low	48.4	Very low	134 Å²	134	121.9 Å²	121.9	72%	0.717	65%	0.653	S	S	*	*			trans	-63.4	98.6	141	-76.9	-31.9	0	0	0	104.7	E79 D83	E79-D81 PolarHBondContact O-N 3.21Å; D81-D83 PolarHBondContact O-N 3.14Å
82	I	46.5	Very low	50.8	Low	154 Å²	154	127.2 Å²	127.2	79%	0.79	65%	0.654	S	S	*	*			trans	-65.4	76.8	167.3	-60.4	171.8	0	0	0	104.5	L80 N84	L80-I82 HydrophobicContact CB-CG1 4.3Å; L80-I82 PolarHBondContact O-N 3.26Å; I82-N84 PolarHBondContact O-N 3.32Å
83	D	48.1	Very low	53.1	Low	104 Å²	104	126.3 Å²	126.3	56%	0.556	64%	0.642	S	S	*	*			trans	-65.4	126.7	-170.6	-110.3	-18.1	0	0	0	106.2	D81 S85 S86	D81-D83 PolarHBondContact O-N 3.14Å; D83-S85 PolarHBondContact O-N 3.3Å; D83-S86 PolarHBondContact O-N 3.15Å
84	N	49.4	Very low	55.6	Low	123 Å²	123	118.5 Å²	118.5	66%	0.658	61%	0.61	S	S	*	*	H	α-helix	trans	-44.3	-21.7	162.8	-80.1	-39.9	0	0	0	111.5	I82 S86 L87 M88	I82-N84 PolarHBondContact O-N 3.32Å; N84-S86 PolarHBondContact O-N 3.46Å; N84-L87 PolarHBondContact O-N 3.4Å; N84-M88 VanDerWaalsContact O-CB 3.23Å; N84-M88 WeakPolarHBondContact O-CB 3.21Å; N84-M88 WeakPolarHBondContact O-CG 3.24Å; N84-M88 PolarHBondContact O-N 2.97Å
85	S	55.1	Low	58.1	Low	71 Å²	71	116.2 Å²	116.2	50%	0.497	60%	0.602	S	S	.	*	H	α-helix	trans	-47.4	-48.5	169.3	-162.8	0	0	0	0	114.1	D83 M88 T89	D83-S85 PolarHBondContact O-N 3.3Å; S85-M88 PolarHBondContact O-N 3.43Å; S85-T89 WeakPolarHBondContact O-CB 3.38Å; S85-T89 WeakPolarHBondContact O-CG2 3.31Å; S85-T89 PolarHBondContact O-N 3.1Å; S85-T89 PolarHBondContact O-OG1 2.79Å
86	S	59.1	Low	60.8	Low	86 Å²	86	110 Å²	110	60%	0.601	58%	0.581	S	S	*	*	H	α-helix	trans	-64.9	-48.9	-176.9	-176.3	0	0	0	0	111.6	D83 N84 M88 T89 S90	D83-S86 PolarHBondContact O-N 3.15Å; N84-S86 PolarHBondContact O-N 3.46Å; S86-M88 VanDerWaalsContact C-N 3.33Å; S86-M88 PolarHBondContact O-N 3.18Å; S86-T89 PolarHBondContact O-N 2.9Å; S86-T89 PolarHBondContact O-OG1 3.48Å; S86-S90 PolarHBondContact O-N 3.41Å
87	L	58.7	Low	63.7	Low	98 Å²	98	102.1 Å²	102.1	51%	0.513	54%	0.543	S	S	.	.	H	α-helix	trans	-62.4	-40.4	176	-164	81.3	0	0	0	111.8	N84 T89 S90 D91	N84-L87 PolarHBondContact O-N 3.4Å; L87-T89 VanDerWaalsContact C-N 3.26Å; L87-T89 PolarHBondContact O-N 3.09Å; L87-S90 PolarHBondContact O-N 3.32Å; L87-S90 PolarHBondContact O-OG 2.7Å; L87-D91 PolarHBondContact O-N 2.97Å
88	M	56.7	Low	66.4	Low	92 Å²	92	99.3 Å²	99.3	45%	0.453	52%	0.521	S	S	.	.	H	α-helix	trans	-65.5	-30.5	175.1	-67.8	-71.8	127.9	0	0	111.8	N84 S85 S86 R92	N84-M88 VanDerWaalsContact O-CB 3.23Å; N84-M88 WeakPolarHBondContact O-CB 3.21Å; N84-M88 WeakPolarHBondContact O-CG 3.24Å; N84-M88 PolarHBondContact O-N 2.97Å; S85-M88 PolarHBondContact O-N 3.43Å; S86-M88 VanDerWaalsContact C-N 3.33Å; S86-M88 PolarHBondContact O-N 3.18Å; M88-R92 WeakPolarHBondContact O-CB 3.37Å; M88-R92 VanDerWaalsContact O-CG 3.24Å; M88-R92 WeakPolarHBondContact O-CG 3.29Å; M88-R92 PolarHBondContact O-N 2.86Å
89	T	70.7	Confident	69	Low	56 Å²	56	98 Å²	98	34%	0.344	51%	0.508	S	S	.	.	H	α-helix	trans	-75	-39.1	176.3	66.6	0	0	0	0	112.2	S85 S86 L87 R92 R93	S85-T89 WeakPolarHBondContact O-CB 3.38Å; S85-T89 WeakPolarHBondContact O-CG2 3.31Å; S85-T89 PolarHBondContact O-N 3.1Å; S85-T89 PolarHBondContact O-OG1 2.79Å; S86-T89 PolarHBondContact O-N 2.9Å; S86-T89 PolarHBondContact O-OG1 3.48Å; L87-T89 VanDerWaalsContact C-N 3.26Å; L87-T89 PolarHBondContact O-N 3.09Å; T89-R92 PolarHBondContact O-N 3.46Å; T89-R93 WeakPolarHBondContact O-CG 3.46Å; T89-R93 PolarHBondContact O-N 2.94Å
90	S	76.5	Confident	71.7	Confident	34 Å²	34	90.1 Å²	90.1	24%	0.238	47%	0.473	C	S	.	.	H	α-helix	trans	-64.8	-45.5	175.5	56.8	0	0	0	0	111.3	S86 L87 R92 R93 L94	S86-S90 PolarHBondContact O-N 3.41Å; L87-S90 PolarHBondContact O-N 3.32Å; L87-S90 PolarHBondContact O-OG 2.7Å; S90-R92 VanDerWaalsContact C-N 3.31Å; S90-R92 PolarHBondContact O-N 3.49Å; S90-R93 PolarHBondContact O-N 3.38Å; S90-L94 WeakPolarHBondContact O-CG 3.41Å; S90-L94 PolarHBondContact O-N 3.02Å
91	D	82.2	Confident	74.3	Confident	89 Å²	89	83.3 Å²	83.3	48%	0.476	44%	0.437	S	S	.	.	H	α-helix	trans	-62.1	-38.6	178.4	-81	-16.6	0	0	0	112.2	L87 L94 A95	L87-D91 PolarHBondContact O-N 2.97Å; D91-L94 PolarHBondContact O-N 2.93Å; D91-A95 PolarHBondContact O-N 3.33Å
92	R	85.5	Confident	76.8	Confident	170 Å²	170	85.3 Å²	85.3	64%	0.642	44%	0.435	S	S	*	.	H	α-helix	trans	-65.5	-45.8	174.6	-75.6	177	-173.9	-175.6	6.7	111.9	M88 T89 S90 L94 A95 F96	M88-R92 WeakPolarHBondContact O-CB 3.37Å; M88-R92 VanDerWaalsContact O-CG 3.24Å; M88-R92 WeakPolarHBondContact O-CG 3.29Å; M88-R92 PolarHBondContact O-N 2.86Å; T89-R92 PolarHBondContact O-N 3.46Å; S90-R92 VanDerWaalsContact C-N 3.31Å; S90-R92 PolarHBondContact O-N 3.49Å; R92-L94 VanDerWaalsContact C-N 3.31Å; R92-L94 PolarHBondContact O-N 3.43Å; R92-A95 WeakPolarHBondContact O-CB 3.28Å; R92-A95 PolarHBondContact O-N 2.97Å; R92-F96 HydrophobicContact CB-CE2 4.43Å; R92-F96 WeakPolarHBondContact O-CD2 3.34Å; R92-F96 PolarHBondContact O-N 3.09Å
93	R	86.2	Confident	79.2	Confident	142 Å²	142	83.1 Å²	83.1	54%	0.536	43%	0.425	S	S	.	.	H	α-helix	trans	-59.9	-42.1	177.1	-75.2	178.1	-176.8	172	1.1	111.4	T89 S90 A95 F96 R97	T89-R93 WeakPolarHBondContact O-CG 3.46Å; T89-R93 PolarHBondContact O-N 2.94Å; S90-R93 PolarHBondContact O-N 3.38Å; R93-A95 PolarHBondContact O-N 3.14Å; R93-F96 PolarHBondContact O-N 2.91Å; R93-R97 WeakPolarHBondContact O-CB 2.92Å; R93-R97 PolarHBondContact O-N 2.74Å
94	L	88	Confident	81.5	Confident	40 Å²	40	78.4 Å²	78.4	21%	0.209	40%	0.4	C	S	.	.	H	α-helix	trans	-62.4	-41	175.1	-70.6	173.3	0	0	0	112.2	S90 D91 R92 R97 N98	S90-L94 WeakPolarHBondContact O-CG 3.41Å; S90-L94 PolarHBondContact O-N 3.02Å; D91-L94 PolarHBondContact O-N 2.93Å; R92-L94 VanDerWaalsContact C-N 3.31Å; R92-L94 PolarHBondContact O-N 3.43Å; L94-R97 PolarHBondContact O-N 3.22Å; L94-N98 WeakPolarHBondContact O-CB 3.37Å; L94-N98 VanDerWaalsContact O-CG 3.31Å; L94-N98 PolarHBondContact O-N 3.32Å; L94-N98 PolarHBondContact O-ND2 2.9Å
95	A	90.2	Very high	83.8	Confident	61 Å²	61	73.6 Å²	73.6	50%	0.504	37%	0.374	S	S	.	.	H	α-helix	trans	-63.3	-44	174.8	0	0	0	0	0	112.2	D91 R92 R93 N98 M99	D91-A95 PolarHBondContact O-N 3.33Å; R92-A95 WeakPolarHBondContact O-CB 3.28Å; R92-A95 PolarHBondContact O-N 2.97Å; R93-A95 PolarHBondContact O-N 3.14Å; A95-N98 PolarHBondContact O-N 2.97Å; A95-M99 PolarHBondContact O-N 2.97Å
96	F	92	Very high	85.8	Confident	108 Å²	108	76 Å²	76	47%	0.474	38%	0.377	S	S	.	.	H	α-helix	trans	-63.6	-45.2	175	-75	-65.5	0	0	0	111.8	R92 R93 N98 M99 V100	R92-F96 HydrophobicContact CB-CE2 4.43Å; R92-F96 WeakPolarHBondContact O-CD2 3.34Å; R92-F96 PolarHBondContact O-N 3.09Å; R93-F96 PolarHBondContact O-N 2.91Å; F96-N98 VanDerWaalsContact C-N 3.32Å; F96-N98 PolarHBondContact O-N 2.75Å; F96-M99 HydrophobicContact CD1-CE 3.91Å; F96-M99 HydrophobicContact CE1-CE 4.41Å; F96-M99 WeakPolarHBondContact O-CB 3.43Å; F96-M99 PolarHBondContact O-N 3.09Å; F96-M99 VanDerWaalsContact O-N 3.08Å; F96-V100 WeakPolarHBondContact O-CG2 3.43Å; F96-V100 PolarHBondContact O-N 2.59Å
97	R	93.6	Very high	87.5	Confident	3 Å²	3	74.8 Å²	74.8	1%	0.011	36%	0.364	C	S	.	.	H	α-helix	trans	-53.3	-49.1	174	179.2	-168.6	165.4	-167.1	-2.2	111.6	R93 L94 M99 V100 L101 S166 Y254 N257 H262	R93-R97 WeakPolarHBondContact O-CB 2.92Å; R93-R97 PolarHBondContact O-N 2.74Å; L94-R97 PolarHBondContact O-N 3.22Å; R97-M99 VanDerWaalsContact C-N 3.28Å; R97-M99 PolarHBondContact O-N 2.85Å; R97-V100 PolarHBondContact O-N 2.99Å; R97-L101 WeakPolarHBondContact O-CB 3.34Å; R97-L101 PolarHBondContact O-N 3.36Å; R97-S166 PolarHBondContact NH1-O 3.18Å; R97-S166 PolarHBondContact NH1-OG 3.32Å; R97-S166 PolarHBondContact NH2-O 3.38Å; R97-Y254 HydrophobicContact CG-CD2 4.09Å; R97-Y254 HydrophobicContact CG-CE2 3.57Å; R97-Y254 PolarHBondContact NE-OH 3.21Å; R97-Y254 VanDerWaalsContact NE-OH 3.15Å; R97-Y254 PolarHBondContact NH2-OH 2.95Å; R97-N257 HydrophobicContact CB-CB 3.88Å; R97-H262 PolarHBondContact NH1-NE2 2.68Å; R97-H262 PolarHBondContact NH2-NE2 3.29Å; R97-H262 VanDerWaalsContact NH2-NE2 3.13Å
98	N	93.4	Very high	89.3	Confident	64 Å²	64	70.2 Å²	70.2	34%	0.342	34%	0.34	S	S	.	.	H	α-helix	trans	-64.6	-34.1	179.5	-73.7	-31.6	0	0	0	112.3	L94 A95 F96 R102	L94-N98 WeakPolarHBondContact O-CB 3.37Å; L94-N98 VanDerWaalsContact O-CG 3.31Å; L94-N98 PolarHBondContact O-N 3.32Å; L94-N98 PolarHBondContact O-ND2 2.9Å; A95-N98 PolarHBondContact O-N 2.97Å; F96-N98 VanDerWaalsContact C-N 3.32Å; F96-N98 PolarHBondContact O-N 2.75Å; N98-R102 VanDerWaalsContact O-CG 3.28Å; N98-R102 WeakPolarHBondContact O-CG 3.5Å; N98-R102 PolarHBondContact O-N 3.16Å; N98-R102 VanDerWaalsContact O-N 3.09Å
99	M	94.7	Very high	91.2	Very high	89 Å²	89	69.4 Å²	69.4	44%	0.438	34%	0.335	S	S	.	.	H	α-helix	trans	-66.7	-47.3	173.8	-173.3	-177.9	77	0	0	111.4	A95 F96 R97 L101 R102 D103 L547	A95-M99 PolarHBondContact O-N 2.97Å; F96-M99 HydrophobicContact CD1-CE 3.91Å; F96-M99 HydrophobicContact CE1-CE 4.41Å; F96-M99 WeakPolarHBondContact O-CB 3.43Å; F96-M99 PolarHBondContact O-N 3.09Å; F96-M99 VanDerWaalsContact O-N 3.08Å; R97-M99 VanDerWaalsContact C-N 3.28Å; R97-M99 PolarHBondContact O-N 2.85Å; M99-L101 VanDerWaalsContact C-N 3.33Å; M99-L101 PolarHBondContact O-N 3.08Å; M99-R102 PolarHBondContact O-N 3.45Å; M99-D103 PolarHBondContact O-N 2.93Å; M99-L547 HydrophobicContact CE-CD2 4.02Å
100	V	94.6	Very high	92.4	Very high	24 Å²	24	72.2 Å²	72.2	15%	0.145	34%	0.343	C	S	.	.	H	α-helix	trans	-61.5	-42.1	176.4	178.3	0	0	0	0	111.2	F96 R97 R102 D103 L104 E253	F96-V100 WeakPolarHBondContact O-CG2 3.43Å; F96-V100 PolarHBondContact O-N 2.59Å; R97-V100 PolarHBondContact O-N 2.99Å; V100-R102 VanDerWaalsContact C-N 3.34Å; V100-R102 PolarHBondContact O-N 3.27Å; V100-D103 PolarHBondContact O-N 3.27Å; V100-L104 WeakPolarHBondContact O-CB 3.37Å; V100-L104 PolarHBondContact O-N 2.83Å; V100-E253 HydrophobicContact CG1-CB 4.18Å
101	L	96.3	Very high	93.4	Very high	8 Å²	8	70.9 Å²	70.9	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-62.7	-40.8	177.5	-179.8	57.3	0	0	0	111.9	R97 M99 L104 L105 A162 I171 Y254	R97-L101 WeakPolarHBondContact O-CB 3.34Å; R97-L101 PolarHBondContact O-N 3.36Å; M99-L101 VanDerWaalsContact C-N 3.33Å; M99-L101 PolarHBondContact O-N 3.08Å; L101-L104 PolarHBondContact O-N 3.49Å; L101-L105 HydrophobicContact CD1-CD1 4.28Å; L101-L105 HydrophobicContact CD1-CG 4.25Å; L101-L105 HydrophobicContact CG-CD1 4.2Å; L101-L105 VanDerWaalsContact O-CG 3.26Å; L101-L105 WeakPolarHBondContact O-CG 3.34Å; L101-L105 PolarHBondContact O-N 2.8Å; L101-A162 HydrophobicContact CD2-CB 4.02Å; L101-A162 HydrophobicContact CG-CB 4.48Å; L101-I171 HydrophobicContact CD1-CD1 3.93Å; L101-I171 HydrophobicContact CD1-CG1 3.89Å; L101-I171 HydrophobicContact CD1-CG2 4.21Å; L101-I171 HydrophobicContact CD2-CD1 4.5Å; L101-I171 HydrophobicContact CD2-CG1 4.43Å; L101-Y254 HydrophobicContact CB-CD2 4.37Å; L101-Y254 HydrophobicContact CB-CE2 4.03Å; L101-Y254 HydrophobicContact CD1-CE2 4.37Å; L101-Y254 HydrophobicContact CD2-CE2 4.49Å
102	R	96	Very high	94.1	Very high	175 Å²	175	68 Å²	68	66%	0.66	32%	0.317	S	S	*	.	H	α-helix	trans	-63.6	-46.7	176.1	-75.7	178.2	-174.5	-155.6	1.5	111.9	N98 M99 V100 L104 L105 E106	N98-R102 VanDerWaalsContact O-CG 3.28Å; N98-R102 WeakPolarHBondContact O-CG 3.5Å; N98-R102 PolarHBondContact O-N 3.16Å; N98-R102 VanDerWaalsContact O-N 3.09Å; M99-R102 PolarHBondContact O-N 3.45Å; V100-R102 VanDerWaalsContact C-N 3.34Å; V100-R102 PolarHBondContact O-N 3.27Å; R102-L104 VanDerWaalsContact C-N 3.31Å; R102-L104 PolarHBondContact O-N 3.1Å; R102-L105 PolarHBondContact O-N 2.9Å; R102-E106 WeakPolarHBondContact O-CB 3.29Å; R102-E106 VanDerWaalsContact O-CG 3.3Å; R102-E106 WeakPolarHBondContact O-CG 3.3Å; R102-E106 PolarHBondContact O-N 3.48Å
103	D	95.9	Very high	94.6	Very high	108 Å²	108	66.3 Å²	66.3	58%	0.578	32%	0.316	S	S	*	.	H	α-helix	trans	-59	-43.6	177.1	-176	67	0	0	0	111.6	M99 V100 L105 E106 N107	M99-D103 PolarHBondContact O-N 2.93Å; V100-D103 PolarHBondContact O-N 3.27Å; D103-L105 PolarHBondContact O-N 2.81Å; D103-E106 PolarHBondContact O-N 3.38Å; D103-N107 VanDerWaalsContact O-CB 3.31Å; D103-N107 WeakPolarHBondContact O-CB 3.22Å; D103-N107 PolarHBondContact O-N 2.79Å
104	L	96.8	Very high	95.1	Very high	6 Å²	6	62.3 Å²	62.3	3%	0.031	30%	0.304	C	S	.	.	H	α-helix	trans	-57.5	-50.4	174.1	-175.6	159.7	0	0	0	111.4	V100 L101 R102 N107 E108 L158 F175 A250	V100-L104 WeakPolarHBondContact O-CB 3.37Å; V100-L104 PolarHBondContact O-N 2.83Å; L101-L104 PolarHBondContact O-N 3.49Å; R102-L104 VanDerWaalsContact C-N 3.31Å; R102-L104 PolarHBondContact O-N 3.1Å; L104-N107 PolarHBondContact O-N 3.32Å; L104-E108 HydrophobicContact CD2-CG 4.21Å; L104-E108 WeakPolarHBondContact O-CG 3.31Å; L104-E108 PolarHBondContact O-N 2.84Å; L104-L158 HydrophobicContact CD2-CD1 4.39Å; L104-F175 HydrophobicContact CD1-CE2 4.26Å; L104-F175 HydrophobicContact CD1-CZ 4.33Å; L104-F175 HydrophobicContact CD2-CE2 4.11Å; L104-F175 HydrophobicContact CD2-CZ 4.05Å; L104-A250 HydrophobicContact CD1-CB 4.08Å; L104-A250 HydrophobicContact CG-CB 4.42Å
105	L	97.3	Very high	95.4	Very high	22 Å²	22	60.5 Å²	60.5	12%	0.115	29%	0.294	C	S	.	.	H	α-helix	trans	-66.2	-39.4	-179.5	-67.1	172.6	0	0	0	112.8	L101 R102 D103 N107 E108 Q109 L158 I159 A162	L101-L105 HydrophobicContact CD1-CD1 4.28Å; L101-L105 HydrophobicContact CD1-CG 4.25Å; L101-L105 HydrophobicContact CG-CD1 4.2Å; L101-L105 VanDerWaalsContact O-CG 3.26Å; L101-L105 WeakPolarHBondContact O-CG 3.34Å; L101-L105 PolarHBondContact O-N 2.8Å; R102-L105 PolarHBondContact O-N 2.9Å; D103-L105 PolarHBondContact O-N 2.81Å; L105-N107 VanDerWaalsContact C-N 3.33Å; L105-E108 PolarHBondContact O-N 3.39Å; L105-Q109 WeakPolarHBondContact O-CG 3.43Å; L105-Q109 PolarHBondContact O-N 3.28Å; L105-L158 HydrophobicContact CD2-CB 3.68Å; L105-I159 HydrophobicContact CD2-CG1 4.37Å; L105-A162 HydrophobicContact CD1-CB 3.6Å
106	E	97	Very high	95.7	Very high	121 Å²	121	60.5 Å²	60.5	57%	0.565	29%	0.288	S	S	*	.	H	α-helix	trans	-64.4	-40.3	176.3	-74.6	173.9	-167.5	0	0	110.7	R102 D103 Q109 K110	R102-E106 WeakPolarHBondContact O-CB 3.29Å; R102-E106 VanDerWaalsContact O-CG 3.3Å; R102-E106 WeakPolarHBondContact O-CG 3.3Å; R102-E106 PolarHBondContact O-N 3.48Å; D103-E106 PolarHBondContact O-N 3.38Å; E106-Q109 PolarHBondContact O-N 3.34Å; E106-K110 VanDerWaalsContact O-CB 3.27Å; E106-K110 WeakPolarHBondContact O-CB 3.15Å; E106-K110 PolarHBondContact O-N 2.94Å
107	N	95	Very high	95.8	Very high	60 Å²	60	56.9 Å²	56.9	32%	0.321	28%	0.281	S	S	.	.	H	α-helix	trans	-65.4	-39.6	174.5	-171.1	54.6	0	0	0	112.1	D103 L104 L105 K110 H111 H243	D103-N107 VanDerWaalsContact O-CB 3.31Å; D103-N107 WeakPolarHBondContact O-CB 3.22Å; D103-N107 PolarHBondContact O-N 2.79Å; L104-N107 PolarHBondContact O-N 3.32Å; L105-N107 VanDerWaalsContact C-N 3.33Å; N107-K110 PolarHBondContact O-N 3.01Å; N107-H111 WeakPolarHBondContact O-CB 3.2Å; N107-H111 PolarHBondContact O-N 2.7Å; N107-H243 PolarHBondContact ND2-CE1 3.47Å
108	E	96.4	Very high	95.7	Very high	2 Å²	2	57 Å²	57	1%	0.009	28%	0.281	C	S	.	.	H	α-helix	trans	-64.6	-45.6	174.4	-73.6	-45.3	108.6	0	0	113.1	L104 L105 K110 H111 L112 Q151 L158 H243 Y247	L104-E108 HydrophobicContact CD2-CG 4.21Å; L104-E108 WeakPolarHBondContact O-CG 3.31Å; L104-E108 PolarHBondContact O-N 2.84Å; L105-E108 PolarHBondContact O-N 3.39Å; E108-K110 VanDerWaalsContact C-N 3.34Å; E108-H111 PolarHBondContact O-N 3.05Å; E108-L112 PolarHBondContact O-N 3.34Å; E108-Q151 PolarHBondContact OE2-NE2 2.82Å; E108-L158 HydrophobicContact CG-CD1 4.14Å; E108-H243 IonicContact OE1-CD2 3.86Å; E108-H243 IonicContact OE1-CE1 3.98Å; E108-H243 PolarHBondContact OE1-CE1 3.15Å; E108-H243 VanDerWaalsContact OE1-CE1 3.29Å; E108-H243 IonicContact OE1-NE2 2.75Å; E108-H243 PolarHBondContact OE1-NE2 3.33Å; E108-H243 IonicContact OE2-NE2 3.29Å; E108-H243 PolarHBondContact OE2-NE2 3.15Å; E108-Y247 VanDerWaalsContact CD-CE1 3.48Å; E108-Y247 WeakPolarHBondContact OE1-CE1 3.5Å; E108-Y247 PolarHBondContact OE2-OH 3Å
109	Q	97.1	Very high	95.6	Very high	75 Å²	75	57 Å²	57	35%	0.35	28%	0.276	S	S	.	.	H	α-helix	trans	-61.1	-46.5	176.7	-75.5	176.3	4.8	0	0	110.7	L105 E106 H111 L112 E113 I159	L105-Q109 WeakPolarHBondContact O-CG 3.43Å; L105-Q109 PolarHBondContact O-N 3.28Å; E106-Q109 PolarHBondContact O-N 3.34Å; Q109-H111 VanDerWaalsContact C-N 3.32Å; Q109-H111 PolarHBondContact O-N 3.44Å; Q109-L112 PolarHBondContact O-N 2.81Å; Q109-E113 WeakPolarHBondContact O-CG 3.22Å; Q109-E113 PolarHBondContact O-N 3.12Å; Q109-I159 HydrophobicContact CG-CD1 4.27Å
110	K	96.5	Very high	95.5	Very high	116 Å²	116	56.8 Å²	56.8	50%	0.504	28%	0.275	S	S	.	.	H	α-helix	trans	-59.9	-42.6	176.1	-176.9	-179	176.6	-175.5	0	111.7	E106 N107 E108 L112 E113 E114	E106-K110 VanDerWaalsContact O-CB 3.27Å; E106-K110 WeakPolarHBondContact O-CB 3.15Å; E106-K110 PolarHBondContact O-N 2.94Å; N107-K110 PolarHBondContact O-N 3.01Å; E108-K110 VanDerWaalsContact C-N 3.34Å; K110-L112 PolarHBondContact O-N 3.4Å; K110-E113 PolarHBondContact O-N 2.9Å; K110-E114 WeakPolarHBondContact CE-OE1 3.26Å; K110-E114 WeakPolarHBondContact O-CB 3.43Å; K110-E114 VanDerWaalsContact O-CG 3.31Å; K110-E114 WeakPolarHBondContact O-CG 3.29Å; K110-E114 PolarHBondContact O-N 3.43Å
111	H	96.2	Very high	95.2	Very high	6 Å²	6	59 Å²	59	3%	0.028	29%	0.288	C	S	.	.	H	α-helix	trans	-60.2	-46.3	176.2	177.3	42.9	0	0	0	111.7	N107 E108 Q109 E114 L115 Q239 H243	N107-H111 WeakPolarHBondContact O-CB 3.2Å; N107-H111 PolarHBondContact O-N 2.7Å; E108-H111 PolarHBondContact O-N 3.05Å; Q109-H111 VanDerWaalsContact C-N 3.32Å; Q109-H111 PolarHBondContact O-N 3.44Å; H111-E114 PolarHBondContact O-N 2.99Å; H111-L115 VanDerWaalsContact CE1-CD1 3.5Å; H111-L115 WeakPolarHBondContact CE1-CD1 3.38Å; H111-L115 WeakPolarHBondContact NE2-CD1 3.49Å; H111-L115 WeakPolarHBondContact O-CG 3.19Å; H111-L115 PolarHBondContact O-N 2.87Å; H111-Q239 PolarHBondContact ND1-NE2 2.88Å; H111-H243 AromaticContact CD2-CD2 3.1Å; H111-H243 PolarHBondContact CD2-CD2 3.13Å; H111-H243 AromaticContact CD2-CE1 3.94Å; H111-H243 AromaticContact CD2-CG 3.39Å; H111-H243 AromaticContact CD2-ND1 3.93Å; H111-H243 AromaticContact CD2-NE2 3.48Å; H111-H243 PolarHBondContact CD2-NE2 3.28Å; H111-H243 AromaticContact CE1-CG 3.89Å; H111-H243 AromaticContact CG-CD2 3.64Å; H111-H243 AromaticContact CG-CE1 3.74Å; H111-H243 AromaticContact CG-CG 3.54Å; H111-H243 AromaticContact CG-ND1 3.64Å; H111-H243 AromaticContact CG-NE2 3.75Å; H111-H243 AromaticContact ND1-CG 3.87Å; H111-H243 AromaticContact NE2-CD2 3.59Å; H111-H243 AromaticContact NE2-CG 3.63Å
112	L	97.1	Very high	94.8	Very high	28 Å²	28	60.5 Å²	60.5	15%	0.147	29%	0.293	C	S	.	.	H	α-helix	trans	-61.9	-46	176.9	178.7	62.7	0	0	0	111.9	E108 Q109 K110 E114 L115 V116 Q151 C155	E108-L112 PolarHBondContact O-N 3.34Å; Q109-L112 PolarHBondContact O-N 2.81Å; K110-L112 PolarHBondContact O-N 3.4Å; L112-E114 VanDerWaalsContact C-N 3.29Å; L112-E114 PolarHBondContact O-N 3.35Å; L112-L115 PolarHBondContact O-N 3.16Å; L112-V116 HydrophobicContact CD1-CG2 3.92Å; L112-V116 HydrophobicContact CG-CG2 4.27Å; L112-V116 WeakPolarHBondContact O-CB 3.21Å; L112-V116 WeakPolarHBondContact O-CG2 3.48Å; L112-V116 PolarHBondContact O-N 3.05Å; L112-Q151 HydrophobicContact CB-CG 4.38Å; L112-Q151 HydrophobicContact CD1-CB 4.21Å; L112-Q151 HydrophobicContact CD1-CG 4.14Å; L112-C155 HydrophobicContact CD2-CB 4.11Å
113	E	97.2	Very high	94.4	Very high	135 Å²	135	52.5 Å²	52.5	63%	0.631	26%	0.263	S	S	*	.	H	α-helix	trans	-58	-41.7	176.5	-75.3	177.3	-177.9	0	0	111.8	Q109 K110 G117	Q109-E113 WeakPolarHBondContact O-CG 3.22Å; Q109-E113 PolarHBondContact O-N 3.12Å; K110-E113 PolarHBondContact O-N 2.9Å; E113-G117 WeakPolarHBondContact O-CA 3.43Å; E113-G117 PolarHBondContact O-N 3.34Å
114	E	95	Very high	94	Very high	58 Å²	58	51.5 Å²	51.5	27%	0.271	25%	0.254	S	S	.	.	H	α-helix	trans	-66.6	-38.7	176.8	-74.1	-175.4	-161.9	0	0	112.4	K110 H111 L112 F118 R236 Q239	K110-E114 WeakPolarHBondContact CE-OE1 3.26Å; K110-E114 WeakPolarHBondContact O-CB 3.43Å; K110-E114 VanDerWaalsContact O-CG 3.31Å; K110-E114 WeakPolarHBondContact O-CG 3.29Å; K110-E114 PolarHBondContact O-N 3.43Å; H111-E114 PolarHBondContact O-N 2.99Å; L112-E114 VanDerWaalsContact C-N 3.29Å; L112-E114 PolarHBondContact O-N 3.35Å; E114-F118 VanDerWaalsContact O-CB 3.25Å; E114-F118 WeakPolarHBondContact O-CB 3.25Å; E114-F118 PolarHBondContact O-N 2.91Å; E114-R236 IonicContact OE2-CZ 2.7Å; E114-R236 IonicContact OE2-NH1 4Å; E114-R236 PolarHBondContact OE2-NH1 3.41Å; E114-Q239 PolarHBondContact OE2-NE2 2.85Å
115	L	95.6	Very high	93.6	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-69.1	-46.3	176.2	-71	-178.8	0	0	0	112.6	H111 L112 F118 W119 I148 Q151 P240	H111-L115 VanDerWaalsContact CE1-CD1 3.5Å; H111-L115 WeakPolarHBondContact CE1-CD1 3.38Å; H111-L115 WeakPolarHBondContact NE2-CD1 3.49Å; H111-L115 WeakPolarHBondContact O-CG 3.19Å; H111-L115 PolarHBondContact O-N 2.87Å; L112-L115 PolarHBondContact O-N 3.16Å; L115-F118 PolarHBondContact O-N 2.88Å; L115-W119 PolarHBondContact O-N 3.45Å; L115-I148 HydrophobicContact CB-CG1 4.06Å; L115-I148 HydrophobicContact CD1-CG1 4.48Å; L115-Q151 HydrophobicContact CD1-CB 4.49Å; L115-Q151 HydrophobicContact CD1-CG 4.32Å; L115-P240 HydrophobicContact CD2-CG 3.84Å
116	V	96.1	Very high	92.9	Very high	62 Å²	62	52 Å²	52	38%	0.376	26%	0.258	S	S	.	.	H	α-helix	trans	-64.7	-43.8	177.4	172.8	0	0	0	0	110.1	L112 F118 W119 E120 I148	L112-V116 HydrophobicContact CD1-CG2 3.92Å; L112-V116 HydrophobicContact CG-CG2 4.27Å; L112-V116 WeakPolarHBondContact O-CB 3.21Å; L112-V116 WeakPolarHBondContact O-CG2 3.48Å; L112-V116 PolarHBondContact O-N 3.05Å; V116-F118 VanDerWaalsContact C-N 3.33Å; V116-F118 PolarHBondContact O-N 2.93Å; V116-W119 WeakPolarHBondContact O-CB 3.17Å; V116-W119 PolarHBondContact O-N 2.94Å; V116-E120 PolarHBondContact O-N 3.41Å; V116-I148 HydrophobicContact CG2-CG2 3.88Å
117	G	93.4	Very high	92.3	Very high	31 Å²	31	52.5 Å²	52.5	32%	0.32	26%	0.259	S	S	.	.	H	α-helix	trans	-59.6	-42.9	174.2	0	0	0	0	0	112	E113 V121	E113-G117 WeakPolarHBondContact O-CA 3.43Å; E113-G117 PolarHBondContact O-N 3.34Å; G117-V121 WeakPolarHBondContact O-CB 3.32Å; G117-V121 VanDerWaalsContact O-CG2 3.22Å; G117-V121 WeakPolarHBondContact O-CG2 3.14Å; G117-V121 PolarHBondContact O-N 2.87Å
118	F	92	Very high	91.8	Very high	5 Å²	5	55.5 Å²	55.5	2%	0.022	28%	0.275	C	S	.	.	H	α-helix	trans	-61.3	-44.1	174.5	171.4	-113.3	0	0	0	112.3	E114 L115 V116 Y122 V123 I144 L233 R236 L237	E114-F118 VanDerWaalsContact O-CB 3.25Å; E114-F118 WeakPolarHBondContact O-CB 3.25Å; E114-F118 PolarHBondContact O-N 2.91Å; L115-F118 PolarHBondContact O-N 2.88Å; V116-F118 VanDerWaalsContact C-N 3.33Å; V116-F118 PolarHBondContact O-N 2.93Å; F118-Y122 AromaticContact CD2-CD2 3.77Å; F118-Y122 HydrophobicContact CD2-CD2 3.77Å; F118-Y122 HydrophobicContact CD2-CG 4.15Å; F118-Y122 HydrophobicContact CE2-CD2 4.35Å; F118-Y122 HydrophobicContact CE2-CG 4.28Å; F118-Y122 WeakPolarHBondContact O-CB 3.35Å; F118-Y122 PolarHBondContact O-N 3.41Å; F118-V123 HydrophobicContact CD1-CG2 4.02Å; F118-V123 HydrophobicContact CE1-CG2 3.49Å; F118-V123 VanDerWaalsContact CE1-CG2 3.49Å; F118-V123 HydrophobicContact CE2-CG2 4.3Å; F118-V123 HydrophobicContact CZ-CG2 3.65Å; F118-V123 PolarHBondContact O-N 2.88Å; F118-I144 HydrophobicContact CD1-CD1 4Å; F118-I144 HydrophobicContact CE1-CD1 3.76Å; F118-L233 HydrophobicContact CE2-CD1 3.56Å; F118-L233 HydrophobicContact CZ-CD1 3.52Å; F118-R236 HydrophobicContact CD1-CB 4.33Å; F118-R236 HydrophobicContact CD2-CB 3.5Å; F118-R236 VanDerWaalsContact CD2-CB 3.5Å; F118-R236 HydrophobicContact CD2-CG 3.84Å; F118-R236 HydrophobicContact CE1-CB 4.42Å; F118-R236 HydrophobicContact CE2-CB 3.62Å; F118-R236 HydrophobicContact CE2-CG 4.28Å; F118-R236 HydrophobicContact CG-CB 3.89Å; F118-R236 HydrophobicContact CG-CG 4.38Å; F118-R236 HydrophobicContact CZ-CB 4.09Å; F118-L237 HydrophobicContact CE1-CD2 4Å; F118-L237 HydrophobicContact CZ-CD2 3.99Å; F118-L237 HydrophobicContact CZ-CG 4.17Å
119	W	91.7	Very high	91	Very high	64 Å²	64	57.8 Å²	57.8	24%	0.242	29%	0.294	C	S	.	.	I	π-helix	trans	-61	-50	177.8	178.5	-95.5	0	0	0	112.4	L115 V116 V123 K124 V141 I144 S145 I148	L115-W119 PolarHBondContact O-N 3.45Å; V116-W119 WeakPolarHBondContact O-CB 3.17Å; V116-W119 PolarHBondContact O-N 2.94Å; W119-V123 HydrophobicContact CD2-CB 4.29Å; W119-V123 HydrophobicContact CD2-CG1 4.3Å; W119-V123 HydrophobicContact CE3-CB 3.87Å; W119-V123 HydrophobicContact CE3-CG1 3.61Å; W119-V123 HydrophobicContact CE3-CG2 4.27Å; W119-V123 HydrophobicContact CH2-CG1 4.11Å; W119-V123 HydrophobicContact CZ3-CB 4.29Å; W119-V123 HydrophobicContact CZ3-CG1 3.5Å; W119-V123 PolarHBondContact O-N 3.33Å; W119-K124 WeakPolarHBondContact O-CB 3.23Å; W119-K124 PolarHBondContact O-N 3.28Å; W119-V141 HydrophobicContact CH2-CG1 4.45Å; W119-V141 HydrophobicContact CZ3-CG1 3.77Å; W119-I144 HydrophobicContact CE3-CG2 3.74Å; W119-I144 HydrophobicContact CZ3-CG2 3.54Å; W119-S145 WeakPolarHBondContact CH2-OG 3.4Å; W119-S145 WeakPolarHBondContact CZ3-OG 2.94Å; W119-I148 HydrophobicContact CB-CD1 3.77Å; W119-I148 HydrophobicContact CD2-CD1 4.33Å; W119-I148 HydrophobicContact CE3-CD1 4.18Å; W119-I148 HydrophobicContact CG-CD1 4.18Å
120	E	92.8	Very high	90	Very high	86 Å²	86	60.3 Å²	60.3	40%	0.402	31%	0.31	S	S	.	.	I	π-helix	trans	-74.4	-35.1	-176.1	-71.3	-63.6	136	0	0	113.2	V116 K124 P125	V116-E120 PolarHBondContact O-N 3.41Å; E120-K124 IonicContact OE1-NZ 3.92Å; E120-K124 PolarHBondContact OE1-NZ 2.93Å; E120-K124 VanDerWaalsContact OE2-CD 3.29Å; E120-K124 WeakPolarHBondContact OE2-CD 3.4Å; E120-K124 IonicContact OE2-NZ 3.31Å; E120-K124 PolarHBondContact OE2-NZ 3.39Å; E120-P125 WeakPolarHBondContact O-CD 3.45Å; E120-P125 WeakPolarHBondContact O-CG 3.47Å
121	V	88.8	Confident	88.9	Confident	69 Å²	69	55.9 Å²	55.9	42%	0.418	29%	0.292	S	S	.	.	I	π-helix	trans	-84.4	-35.4	-176.2	177.2	0	0	0	0	112.7	G117 P125	G117-V121 WeakPolarHBondContact O-CB 3.32Å; G117-V121 VanDerWaalsContact O-CG2 3.22Å; G117-V121 WeakPolarHBondContact O-CG2 3.14Å; G117-V121 PolarHBondContact O-N 2.87Å; V121-P125 WeakPolarHBondContact O-CG 3.37Å
122	Y	86.6	Confident	87.7	Confident	41 Å²	41	56 Å²	56	16%	0.161	29%	0.293	C	S	.	.	I	π-helix	trans	-114.5	-57.4	-172.8	-62.6	-86.6	0	0	0	112.8	F118 L126 M223 K226 L232	F118-Y122 AromaticContact CD2-CD2 3.77Å; F118-Y122 HydrophobicContact CD2-CD2 3.77Å; F118-Y122 HydrophobicContact CD2-CG 4.15Å; F118-Y122 HydrophobicContact CE2-CD2 4.35Å; F118-Y122 HydrophobicContact CE2-CG 4.28Å; F118-Y122 WeakPolarHBondContact O-CB 3.35Å; F118-Y122 PolarHBondContact O-N 3.41Å; Y122-L126 WeakPolarHBondContact O-CB 3.4Å; Y122-L126 PolarHBondContact O-N 3.11Å; Y122-M223 HydrophobicContact CD1-CE 3.9Å; Y122-M223 HydrophobicContact CD1-SD 3.97Å; Y122-M223 HydrophobicContact CE1-CE 3.88Å; Y122-M223 HydrophobicContact CE1-SD 4.36Å; Y122-K226 HydrophobicContact CE1-CB 4.37Å; Y122-L232 HydrophobicContact CE1-CD2 4.27Å; Y122-L232 HydrophobicContact CE2-CD2 4.3Å; Y122-L232 VanDerWaalsContact OH-CD2 3.25Å; Y122-L232 WeakPolarHBondContact OH-CD2 3.49Å
123	V	87.3	Confident	86.7	Confident	6 Å²	6	56.9 Å²	56.9	4%	0.036	30%	0.302	C	S	.	.	I	π-helix	trans	-68.3	-48.3	-168.6	-179.4	0	0	0	0	112.2	F118 W119 L126 K127 F137 V141	F118-V123 HydrophobicContact CD1-CG2 4.02Å; F118-V123 HydrophobicContact CE1-CG2 3.49Å; F118-V123 VanDerWaalsContact CE1-CG2 3.49Å; F118-V123 HydrophobicContact CE2-CG2 4.3Å; F118-V123 HydrophobicContact CZ-CG2 3.65Å; F118-V123 PolarHBondContact O-N 2.88Å; W119-V123 HydrophobicContact CD2-CB 4.29Å; W119-V123 HydrophobicContact CD2-CG1 4.3Å; W119-V123 HydrophobicContact CE3-CB 3.87Å; W119-V123 HydrophobicContact CE3-CG1 3.61Å; W119-V123 HydrophobicContact CE3-CG2 4.27Å; W119-V123 HydrophobicContact CH2-CG1 4.11Å; W119-V123 HydrophobicContact CZ3-CB 4.29Å; W119-V123 HydrophobicContact CZ3-CG1 3.5Å; W119-V123 PolarHBondContact O-N 3.33Å; V123-L126 PolarHBondContact O-N 3.3Å; V123-K127 PolarHBondContact O-N 2.79Å; V123-F137 HydrophobicContact CG1-CE2 4.05Å; V123-F137 HydrophobicContact CG1-CZ 3.72Å; V123-V141 HydrophobicContact CG1-CG1 4.21Å; V123-V141 HydrophobicContact CG1-CG2 3.64Å
124	K	88.2	Confident	85.9	Confident	88 Å²	88	59.8 Å²	59.8	38%	0.383	31%	0.312	S	S	.	.	H	α-helix	trans	-64.8	-48.1	-179.7	175.5	-176.3	-175.4	178.4	0	111.9	W119 E120 L126 K127 D128	W119-K124 WeakPolarHBondContact O-CB 3.23Å; W119-K124 PolarHBondContact O-N 3.28Å; E120-K124 IonicContact OE1-NZ 3.92Å; E120-K124 PolarHBondContact OE1-NZ 2.93Å; E120-K124 VanDerWaalsContact OE2-CD 3.29Å; E120-K124 WeakPolarHBondContact OE2-CD 3.4Å; E120-K124 IonicContact OE2-NZ 3.31Å; E120-K124 PolarHBondContact OE2-NZ 3.39Å; K124-L126 VanDerWaalsContact C-N 3.28Å; K124-L126 PolarHBondContact O-N 2.96Å; K124-K127 WeakPolarHBondContact O-CB 3.21Å; K124-K127 PolarHBondContact O-N 3.4Å; K124-K127 VanDerWaalsContact O-N 3.15Å; K124-D128 PolarHBondContact O-N 3.47Å
125	P	87.8	Confident	84.9	Confident	29 Å²	29	63.8 Å²	63.8	19%	0.188	33%	0.329	C	S	.	.	H	α-helix	trans	-64.9	-28.7	174.3	-26.2	38.6	0	0	0	114	E120 V121 K127 D128 A129 F222	E120-P125 WeakPolarHBondContact O-CD 3.45Å; E120-P125 WeakPolarHBondContact O-CG 3.47Å; V121-P125 WeakPolarHBondContact O-CG 3.37Å; P125-K127 VanDerWaalsContact C-N 3.34Å; P125-D128 PolarHBondContact O-N 2.83Å; P125-A129 WeakPolarHBondContact O-CB 3.38Å; P125-A129 PolarHBondContact O-N 3.48Å; P125-F222 HydrophobicContact CB-CZ 3.98Å
126	L	83	Confident	84	Confident	8 Å²	8	64.8 Å²	64.8	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-36.9	174.6	-176.4	65.7	0	0	0	111.8	Y122 V123 K124 V131 I132 L140 L219 F222	Y122-L126 WeakPolarHBondContact O-CB 3.4Å; Y122-L126 PolarHBondContact O-N 3.11Å; V123-L126 PolarHBondContact O-N 3.3Å; K124-L126 VanDerWaalsContact C-N 3.28Å; K124-L126 PolarHBondContact O-N 2.96Å; L126-V131 HydrophobicContact CD1-CB 4.16Å; L126-V131 HydrophobicContact CD1-CG1 4.49Å; L126-I132 HydrophobicContact CD1-CD1 4Å; L126-I132 HydrophobicContact CD1-CG1 4.26Å; L126-I132 HydrophobicContact CD2-CD1 3.88Å; L126-I132 HydrophobicContact CG-CD1 4.16Å; L126-L140 HydrophobicContact CD2-CD2 3.5Å; L126-L140 VanDerWaalsContact CD2-CD2 3.5Å; L126-L219 HydrophobicContact CD1-CD1 3.84Å; L126-L219 HydrophobicContact CD2-CD1 4.39Å; L126-F222 HydrophobicContact CB-CE1 4.21Å; L126-F222 HydrophobicContact CB-CZ 4.27Å; L126-F222 HydrophobicContact CD1-CD1 4.03Å; L126-F222 HydrophobicContact CD1-CE1 4.11Å; L126-F222 HydrophobicContact CD1-CG 4.4Å
127	K	84.3	Confident	83.4	Confident	133 Å²	133	63.2 Å²	63.2	58%	0.578	32%	0.322	S	S	*	.	H	α-helix	trans	-65.1	-44.2	172.7	-168.2	-177.6	175.7	-176.4	0	111.7	V123 K124 P125 D130 F137	V123-K127 PolarHBondContact O-N 2.79Å; K124-K127 WeakPolarHBondContact O-CB 3.21Å; K124-K127 PolarHBondContact O-N 3.4Å; K124-K127 VanDerWaalsContact O-N 3.15Å; P125-K127 VanDerWaalsContact C-N 3.34Å; K127-D130 PolarHBondContact O-N 2.8Å; K127-F137 HydrophobicContact CB-CD2 4.38Å; K127-F137 HydrophobicContact CB-CE1 4.33Å; K127-F137 HydrophobicContact CB-CE2 3.67Å; K127-F137 HydrophobicContact CB-CZ 3.63Å; K127-F137 HydrophobicContact CD-CE1 4.08Å; K127-F137 HydrophobicContact CD-CZ 4.05Å; K127-F137 HydrophobicContact CG-CE1 4.13Å; K127-F137 HydrophobicContact CG-CE2 4.27Å; K127-F137 HydrophobicContact CG-CZ 3.94Å
128	D	84.9	Confident	82.9	Confident	122 Å²	122	63.6 Å²	63.6	65%	0.652	33%	0.326	S	S	*	.	H	α-helix	trans	-72.2	-31.1	-177.3	-62.5	-24.7	0	0	0	112.5	K124 P125 D130	K124-D128 PolarHBondContact O-N 3.47Å; P125-D128 PolarHBondContact O-N 2.83Å; D128-D130 PolarHBondContact O-N 3.38Å
129	A	80.2	Confident	82.4	Confident	50 Å²	50	64.2 Å²	64.2	41%	0.413	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-8.4	178.8	0	0	0	0	0	113.7	P125 V131 F222	P125-A129 WeakPolarHBondContact O-CB 3.38Å; P125-A129 PolarHBondContact O-N 3.48Å; A129-V131 HydrophobicContact CB-CG2 3.72Å; A129-V131 PolarHBondContact O-N 2.91Å; A129-F222 HydrophobicContact CB-CD2 4.22Å; A129-F222 HydrophobicContact CB-CE2 3.94Å
130	D	75.3	Confident	82	Confident	128 Å²	128	61.4 Å²	61.4	68%	0.684	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.7	37.5	-179.1	-159.4	38.8	0	0	0	112.8	K127 D128 I132	K127-D130 PolarHBondContact O-N 2.8Å; D128-D130 PolarHBondContact O-N 3.38Å; D130-I132 VanDerWaalsContact C-N 3.25Å; D130-I132 PolarHBondContact O-N 2.93Å
131	V	72.7	Confident	81.7	Confident	23 Å²	23	57.7 Å²	57.7	14%	0.139	30%	0.303	C	S	.	.			trans	-70.9	-30.5	-178.5	169.4	0	0	0	0	110.7	L126 A129 L215 K218 F222	L126-V131 HydrophobicContact CD1-CB 4.16Å; L126-V131 HydrophobicContact CD1-CG1 4.49Å; A129-V131 HydrophobicContact CB-CG2 3.72Å; A129-V131 PolarHBondContact O-N 2.91Å; V131-L215 WeakPolarHBondContact O-CD1 3.08Å; V131-K218 HydrophobicContact CG1-CB 3.53Å; V131-F222 HydrophobicContact CG2-CD2 4.39Å
132	I	72.8	Confident	81.6	Confident	9 Å²	9	56 Å²	56	5%	0.046	30%	0.3	C	S	.	.	S	Bend	trans	-125.7	143.4	-168.5	-55.9	-172.9	0	0	0	108.1	L126 D130 E136 F137 L140 L215 L219	L126-I132 HydrophobicContact CD1-CD1 4Å; L126-I132 HydrophobicContact CD1-CG1 4.26Å; L126-I132 HydrophobicContact CD2-CD1 3.88Å; L126-I132 HydrophobicContact CG-CD1 4.16Å; D130-I132 VanDerWaalsContact C-N 3.25Å; D130-I132 PolarHBondContact O-N 2.93Å; I132-E136 HydrophobicContact CG2-CB 3.16Å; I132-E136 HydrophobicContact CG2-CG 4.26Å; I132-F137 HydrophobicContact CG2-CB 4.45Å; I132-L140 HydrophobicContact CD1-CD2 4.23Å; I132-L215 HydrophobicContact CB-CD1 4.17Å; I132-L215 HydrophobicContact CG1-CD1 3.92Å; I132-L215 HydrophobicContact CG2-CD1 4.26Å; I132-L219 HydrophobicContact CD1-CD1 4.22Å; I132-L219 HydrophobicContact CD1-CD2 4.37Å
133	S	74.7	Confident	81.9	Confident	46 Å²	46	54.6 Å²	54.6	32%	0.322	30%	0.295	S	S	.	.			trans	-60.5	155.3	176.4	68.1	0	0	0	0	111.7	F135 E136 F137	S133-F135 PolarHBondContact O-N 3.34Å; S133-F135 VanDerWaalsContact O-N 3.12Å; S133-E136 WeakPolarHBondContact CB-OE2 3.5Å; S133-E136 PolarHBondContact N-OE2 2.87Å; S133-E136 PolarHBondContact O-N 2.79Å; S133-E136 WeakPolarHBondContact OG-CB 3.46Å; S133-E136 VanDerWaalsContact OG-CG 3.23Å; S133-E136 WeakPolarHBondContact OG-CG 3.32Å; S133-E136 PolarHBondContact OG-N 2.92Å; S133-E136 PolarHBondContact OG-OE2 3.31Å; S133-F137 WeakPolarHBondContact O-CB 3.49Å; S133-F137 PolarHBondContact O-N 3.4Å
134	K	79.9	Confident	82.2	Confident	196 Å²	196	54.3 Å²	54.3	85%	0.852	29%	0.294	S	S	*	.	H	α-helix	trans	-54.6	-34.2	176.7	-172.3	179.7	178.2	-175.8	0	112.6	G138	K134-G138 PolarHBondContact O-N 3.44Å; K134-G138 VanDerWaalsContact O-N 3.13Å
135	F	75.6	Confident	82.4	Confident	142 Å²	142	52.8 Å²	52.8	62%	0.623	29%	0.294	S	S	*	.	H	α-helix	trans	-68.9	-54.3	177.6	178.5	-101.2	0	0	0	111.6	S133 F137 G138 C139	S133-F135 PolarHBondContact O-N 3.34Å; S133-F135 VanDerWaalsContact O-N 3.12Å; F135-F137 VanDerWaalsContact C-N 3.29Å; F135-F137 PolarHBondContact O-N 3.04Å; F135-G138 CarbonylContact O-C 3.42Å; F135-G138 WeakPolarHBondContact O-CA 3.48Å; F135-G138 PolarHBondContact O-N 2.79Å; F135-C139 PolarHBondContact O-N 3.26Å; F135-C139 PolarHBondContact O-SG 2.91Å; F135-C139 VanDerWaalsContact O-SG 3.4Å
136	E	76	Confident	82.8	Confident	22 Å²	22	56.4 Å²	56.4	10%	0.103	31%	0.309	C	S	.	.	H	α-helix	trans	-62.3	-35.8	178.9	-70.8	161.9	150.2	0	0	112	I132 S133 G138 C139 L140 V199 T209 L215	I132-E136 HydrophobicContact CG2-CB 3.16Å; I132-E136 HydrophobicContact CG2-CG 4.26Å; S133-E136 WeakPolarHBondContact CB-OE2 3.5Å; S133-E136 PolarHBondContact N-OE2 2.87Å; S133-E136 PolarHBondContact O-N 2.79Å; S133-E136 WeakPolarHBondContact OG-CB 3.46Å; S133-E136 VanDerWaalsContact OG-CG 3.23Å; S133-E136 WeakPolarHBondContact OG-CG 3.32Å; S133-E136 PolarHBondContact OG-N 2.92Å; S133-E136 PolarHBondContact OG-OE2 3.31Å; E136-G138 VanDerWaalsContact C-N 3.33Å; E136-C139 CarbonylContact O-C 3.51Å; E136-C139 WeakPolarHBondContact O-CB 3.31Å; E136-C139 PolarHBondContact O-N 2.82Å; E136-L140 WeakPolarHBondContact O-CB 3.16Å; E136-L140 PolarHBondContact O-N 3.14Å; E136-V199 HydrophobicContact CB-CG1 4.41Å; E136-T209 VanDerWaalsContact OE1-CG2 3.32Å; E136-T209 WeakPolarHBondContact OE1-CG2 3.4Å; E136-T209 PolarHBondContact OE1-OG1 3.18Å; E136-L215 VanDerWaalsContact OE1-CD2 3.29Å; E136-L215 WeakPolarHBondContact OE1-CD2 3.42Å
137	F	83.6	Confident	83.4	Confident	29 Å²	29	56.2 Å²	56.2	13%	0.127	31%	0.308	C	S	.	.	H	α-helix	trans	-61.9	-42.6	172.2	-178.3	-92.5	0	0	0	111.2	V123 K127 I132 S133 F135 C139 L140 V141	V123-F137 HydrophobicContact CG1-CE2 4.05Å; V123-F137 HydrophobicContact CG1-CZ 3.72Å; K127-F137 HydrophobicContact CB-CD2 4.38Å; K127-F137 HydrophobicContact CB-CE1 4.33Å; K127-F137 HydrophobicContact CB-CE2 3.67Å; K127-F137 HydrophobicContact CB-CZ 3.63Å; K127-F137 HydrophobicContact CD-CE1 4.08Å; K127-F137 HydrophobicContact CD-CZ 4.05Å; K127-F137 HydrophobicContact CG-CE1 4.13Å; K127-F137 HydrophobicContact CG-CE2 4.27Å; K127-F137 HydrophobicContact CG-CZ 3.94Å; I132-F137 HydrophobicContact CG2-CB 4.45Å; S133-F137 WeakPolarHBondContact O-CB 3.49Å; S133-F137 PolarHBondContact O-N 3.4Å; F135-F137 VanDerWaalsContact C-N 3.29Å; F135-F137 PolarHBondContact O-N 3.04Å; F137-C139 VanDerWaalsContact C-N 3.35Å; F137-L140 PolarHBondContact O-N 3.37Å; F137-V141 HydrophobicContact CD1-CG2 4.27Å; F137-V141 HydrophobicContact CD2-CG2 4.2Å; F137-V141 HydrophobicContact CE1-CB 4.43Å; F137-V141 HydrophobicContact CE1-CG2 3.89Å; F137-V141 HydrophobicContact CE2-CG2 3.81Å; F137-V141 HydrophobicContact CG-CG2 4.42Å; F137-V141 HydrophobicContact CZ-CG2 3.65Å; F137-V141 WeakPolarHBondContact O-CB 3.35Å; F137-V141 WeakPolarHBondContact O-CG2 3.46Å; F137-V141 PolarHBondContact O-N 3.45Å
138	G	83.3	Confident	84	Confident	39 Å²	39	50.9 Å²	50.9	40%	0.402	29%	0.285	S	S	.	.	H	α-helix	trans	-58.8	-44.3	171.8	0	0	0	0	0	112.4	K134 F135 E136 L140 G142	K134-G138 PolarHBondContact O-N 3.44Å; K134-G138 VanDerWaalsContact O-N 3.13Å; F135-G138 CarbonylContact O-C 3.42Å; F135-G138 WeakPolarHBondContact O-CA 3.48Å; F135-G138 PolarHBondContact O-N 2.79Å; E136-G138 VanDerWaalsContact C-N 3.33Å; G138-L140 VanDerWaalsContact C-N 3.33Å; G138-L140 PolarHBondContact O-N 3.17Å; G138-G142 WeakPolarHBondContact O-CA 3.31Å; G138-G142 PolarHBondContact O-N 2.84Å
139	C	81.5	Confident	84.6	Confident	19 Å²	19	50.1 Å²	50.1	13%	0.128	28%	0.278	C	S	.	.	H	α-helix	trans	-66.6	-29.9	175.7	-63.8	0	0	0	0	113.5	F135 E136 F137 N192 V195 A196 V199	F135-C139 PolarHBondContact O-N 3.26Å; F135-C139 PolarHBondContact O-SG 2.91Å; F135-C139 VanDerWaalsContact O-SG 3.4Å; E136-C139 CarbonylContact O-C 3.51Å; E136-C139 WeakPolarHBondContact O-CB 3.31Å; E136-C139 PolarHBondContact O-N 2.82Å; F137-C139 VanDerWaalsContact C-N 3.35Å; C139-N192 PolarHBondContact O-ND2 2.86Å; C139-N192 PolarHBondContact O-OD1 2.9Å; C139-V195 HydrophobicContact CB-CG1 4.08Å; C139-A196 WeakPolarHBondContact O-CB 3.41Å; C139-V199 HydrophobicContact CB-CG2 4.16Å
140	L	82.5	Confident	85.4	Confident	4 Å²	4	49 Å²	49	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-75.5	-45.5	178.4	-177.9	68	0	0	0	111.7	L126 I132 E136 F137 G138 A196 I200 L233 L237	L126-L140 HydrophobicContact CD2-CD2 3.5Å; L126-L140 VanDerWaalsContact CD2-CD2 3.5Å; I132-L140 HydrophobicContact CD1-CD2 4.23Å; E136-L140 WeakPolarHBondContact O-CB 3.16Å; E136-L140 PolarHBondContact O-N 3.14Å; F137-L140 PolarHBondContact O-N 3.37Å; G138-L140 VanDerWaalsContact C-N 3.33Å; G138-L140 PolarHBondContact O-N 3.17Å; L140-A196 HydrophobicContact CD1-CB 4.27Å; L140-A196 WeakPolarHBondContact O-CB 3.36Å; L140-I200 HydrophobicContact CD1-CD1 3.75Å; L140-I200 HydrophobicContact CD1-CG1 3.68Å; L140-L233 HydrophobicContact CD1-CD2 4.22Å; L140-L233 HydrophobicContact CD2-CD2 4.34Å; L140-L237 HydrophobicContact CD1-CD1 3.72Å; L140-L237 HydrophobicContact CG-CD1 4.39Å
141	V	86.6	Confident	86.4	Confident	8 Å²	8	43.1 Å²	43.1	5%	0.048	23%	0.232	C	C	.	.	H	α-helix	trans	-89.1	-36.1	-168.5	175.5	0	0	0	0	111.9	W119 V123 F137 N143 I144	W119-V141 HydrophobicContact CH2-CG1 4.45Å; W119-V141 HydrophobicContact CZ3-CG1 3.77Å; V123-V141 HydrophobicContact CG1-CG1 4.21Å; V123-V141 HydrophobicContact CG1-CG2 3.64Å; F137-V141 HydrophobicContact CD1-CG2 4.27Å; F137-V141 HydrophobicContact CD2-CG2 4.2Å; F137-V141 HydrophobicContact CE1-CB 4.43Å; F137-V141 HydrophobicContact CE1-CG2 3.89Å; F137-V141 HydrophobicContact CE2-CG2 3.81Å; F137-V141 HydrophobicContact CG-CG2 4.42Å; F137-V141 HydrophobicContact CZ-CG2 3.65Å; F137-V141 WeakPolarHBondContact O-CB 3.35Å; F137-V141 WeakPolarHBondContact O-CG2 3.46Å; F137-V141 PolarHBondContact O-N 3.45Å; V141-N143 PolarHBondContact O-N 3.02Å; V141-I144 HydrophobicContact CG1-CB 4.41Å; V141-I144 HydrophobicContact CG1-CG2 3.36Å; V141-I144 WeakPolarHBondContact O-CB 3.19Å; V141-I144 PolarHBondContact O-N 2.85Å
142	G	87.5	Confident	87.6	Confident	34 Å²	34	44.3 Å²	44.3	35%	0.351	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	-137.1	-174.2	0	0	0	0	0	111.9	G138 N192	G138-G142 WeakPolarHBondContact O-CA 3.31Å; G138-G142 PolarHBondContact O-N 2.84Å; G142-N192 WeakPolarHBondContact CA-ND2 3.42Å; G142-N192 PolarHBondContact N-ND2 2.74Å
143	N	92.2	Very high	88.8	Confident	12 Å²	12	47.9 Å²	47.9	6%	0.064	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	24.7	178.3	69.7	-32.5	0	0	0	113.7	V141 S145 Q146 V147 L185 E188 Y189	V141-N143 PolarHBondContact O-N 3.02Å; N143-S145 PolarHBondContact O-N 2.85Å; N143-S145 VanDerWaalsContact O-N 3.11Å; N143-Q146 WeakPolarHBondContact O-CB 3.36Å; N143-Q146 PolarHBondContact O-N 3.03Å; N143-V147 PolarHBondContact O-N 3.35Å; N143-L185 PolarHBondContact ND2-O 3.2Å; N143-E188 HydrophobicContact CB-CG 4.14Å; N143-E188 WeakPolarHBondContact ND2-CG 3.46Å; N143-Y189 WeakPolarHBondContact OD1-CA 3.21Å; N143-Y189 WeakPolarHBondContact OD1-CB 3.43Å; N143-Y189 WeakPolarHBondContact OD1-CD2 3.39Å; N143-Y189 PolarHBondContact OD1-N 3.04Å
144	I	92.8	Very high	89.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-56.7	-32.6	-176.2	-156.9	175.5	0	0	0	113.1	F118 W119 V141 Q146 V147 I148 Y189	F118-I144 HydrophobicContact CD1-CD1 4Å; F118-I144 HydrophobicContact CE1-CD1 3.76Å; W119-I144 HydrophobicContact CE3-CG2 3.74Å; W119-I144 HydrophobicContact CZ3-CG2 3.54Å; V141-I144 HydrophobicContact CG1-CB 4.41Å; V141-I144 HydrophobicContact CG1-CG2 3.36Å; V141-I144 WeakPolarHBondContact O-CB 3.19Å; V141-I144 PolarHBondContact O-N 2.85Å; I144-Q146 VanDerWaalsContact C-N 3.26Å; I144-Q146 PolarHBondContact O-N 3.29Å; I144-V147 WeakPolarHBondContact O-CB 3.16Å; I144-V147 PolarHBondContact O-N 2.87Å; I144-V147 VanDerWaalsContact O-N 3.14Å; I144-I148 HydrophobicContact CG1-CD1 4.25Å; I144-I148 HydrophobicContact CG1-CG1 4.41Å; I144-I148 VanDerWaalsContact O-CG1 3.31Å; I144-I148 WeakPolarHBondContact O-CG1 3.32Å; I144-I148 PolarHBondContact O-N 3.36Å; I144-Y189 HydrophobicContact CB-CD2 4.35Å; I144-Y189 HydrophobicContact CB-CE2 3.75Å; I144-Y189 HydrophobicContact CD1-CE2 4.27Å; I144-Y189 HydrophobicContact CG1-CE2 3.92Å
145	S	93	Very high	90.7	Very high	56 Å²	56	37 Å²	37	39%	0.392	21%	0.208	S	C	.	.	H	α-helix	trans	-61.1	-38	178.3	-48.2	0	0	0	0	111.8	W119 N143 Q149	W119-S145 WeakPolarHBondContact CH2-OG 3.4Å; W119-S145 WeakPolarHBondContact CZ3-OG 2.94Å; N143-S145 PolarHBondContact O-N 2.85Å; N143-S145 VanDerWaalsContact O-N 3.11Å; S145-Q149 WeakPolarHBondContact O-CB 3.35Å; S145-Q149 PolarHBondContact O-N 3.36Å
146	Q	96.1	Very high	91.8	Very high	105 Å²	105	36.2 Å²	36.2	49%	0.491	21%	0.206	S	C	.	.	H	α-helix	trans	-71.7	-36.9	176.6	-60.1	175.6	19.8	0	0	111	N143 I144 Q149 F150 L185	N143-Q146 WeakPolarHBondContact O-CB 3.36Å; N143-Q146 PolarHBondContact O-N 3.03Å; I144-Q146 VanDerWaalsContact C-N 3.26Å; I144-Q146 PolarHBondContact O-N 3.29Å; Q146-Q149 PolarHBondContact O-N 2.81Å; Q146-F150 WeakPolarHBondContact O-CB 3.46Å; Q146-F150 PolarHBondContact O-N 3.49Å; Q146-L185 HydrophobicContact CB-CD2 3.97Å
147	V	96.3	Very high	92.8	Very high	4 Å²	4	38 Å²	38	2%	0.024	22%	0.216	C	C	.	.	H	α-helix	trans	-62.8	-43.9	174.6	178.7	0	0	0	0	111	N143 I144 F150 Q151 L185 L186 Y189 P240	N143-V147 PolarHBondContact O-N 3.35Å; I144-V147 WeakPolarHBondContact O-CB 3.16Å; I144-V147 PolarHBondContact O-N 2.87Å; I144-V147 VanDerWaalsContact O-N 3.14Å; V147-F150 PolarHBondContact O-N 2.83Å; V147-Q151 VanDerWaalsContact O-CB 3.29Å; V147-Q151 WeakPolarHBondContact O-CB 3.49Å; V147-Q151 PolarHBondContact O-N 2.86Å; V147-L185 HydrophobicContact CG2-CB 4.44Å; V147-L186 HydrophobicContact CG1-CD2 4.15Å; V147-L186 HydrophobicContact CG2-CD2 4.41Å; V147-Y189 HydrophobicContact CG2-CG 4.48Å; V147-P240 HydrophobicContact CG1-CB 4.03Å; V147-P240 HydrophobicContact CG1-CG 4.43Å
148	I	96.4	Very high	93.5	Very high	21 Å²	21	36.6 Å²	36.6	11%	0.108	21%	0.21	C	C	.	.	H	α-helix	trans	-63.1	-45.7	176.5	-67.4	170.3	0	0	0	110.7	L115 V116 W119 I144 Q151 S152	L115-I148 HydrophobicContact CB-CG1 4.06Å; L115-I148 HydrophobicContact CD1-CG1 4.48Å; V116-I148 HydrophobicContact CG2-CG2 3.88Å; W119-I148 HydrophobicContact CB-CD1 3.77Å; W119-I148 HydrophobicContact CD2-CD1 4.33Å; W119-I148 HydrophobicContact CE3-CD1 4.18Å; W119-I148 HydrophobicContact CG-CD1 4.18Å; I144-I148 HydrophobicContact CG1-CD1 4.25Å; I144-I148 HydrophobicContact CG1-CG1 4.41Å; I144-I148 VanDerWaalsContact O-CG1 3.31Å; I144-I148 WeakPolarHBondContact O-CG1 3.32Å; I144-I148 PolarHBondContact O-N 3.36Å; I148-Q151 PolarHBondContact O-N 3.14Å; I148-S152 WeakPolarHBondContact O-CB 3.36Å; I148-S152 PolarHBondContact O-N 3.01Å
149	Q	97.1	Very high	94.2	Very high	105 Å²	105	37 Å²	37	49%	0.491	20%	0.203	S	C	.	.	H	α-helix	trans	-60.2	-49.4	177.9	-177.6	58.4	49.8	0	0	111.1	S145 Q146 Q151 S152 D153	S145-Q149 WeakPolarHBondContact O-CB 3.35Å; S145-Q149 PolarHBondContact O-N 3.36Å; Q146-Q149 PolarHBondContact O-N 2.81Å; Q149-Q151 VanDerWaalsContact C-N 3.33Å; Q149-Q151 PolarHBondContact O-N 2.9Å; Q149-S152 WeakPolarHBondContact O-CB 3.39Å; Q149-S152 PolarHBondContact O-N 2.94Å; Q149-D153 VanDerWaalsContact NE2-CG 3.27Å; Q149-D153 PolarHBondContact NE2-OD1 2.71Å; Q149-D153 PolarHBondContact NE2-OD2 3.36Å; Q149-D153 VanDerWaalsContact O-CG 3.29Å; Q149-D153 PolarHBondContact O-N 3.5Å
150	F	97.7	Very high	94.9	Very high	28 Å²	28	41.1 Å²	41.1	12%	0.123	22%	0.22	C	C	.	.	H	α-helix	trans	-57.4	-46.1	176.1	174.2	-86.5	0	0	0	111.8	Q146 V147 S152 D153 F154 T181 L182 L185	Q146-F150 WeakPolarHBondContact O-CB 3.46Å; Q146-F150 PolarHBondContact O-N 3.49Å; V147-F150 PolarHBondContact O-N 2.83Å; F150-S152 VanDerWaalsContact C-N 3.29Å; F150-S152 PolarHBondContact O-N 3.44Å; F150-D153 PolarHBondContact O-N 3.2Å; F150-F154 HydrophobicContact CE1-CB 4.13Å; F150-F154 HydrophobicContact CE1-CG 4.38Å; F150-F154 HydrophobicContact CZ-CB 4.49Å; F150-F154 VanDerWaalsContact O-CB 3.22Å; F150-F154 WeakPolarHBondContact O-CB 3.42Å; F150-F154 PolarHBondContact O-N 3.01Å; F150-T181 HydrophobicContact CD2-CG2 3.83Å; F150-T181 HydrophobicContact CE2-CG2 3.72Å; F150-L182 HydrophobicContact CD1-CD1 3.81Å; F150-L182 HydrophobicContact CE1-CB 3.74Å; F150-L182 HydrophobicContact CE1-CD1 3.58Å; F150-L182 HydrophobicContact CE1-CD2 4.21Å; F150-L182 HydrophobicContact CE1-CG 4.03Å; F150-L182 HydrophobicContact CE2-CB 4.47Å; F150-L182 HydrophobicContact CZ-CB 3.64Å; F150-L182 HydrophobicContact CZ-CD1 4.36Å; F150-L182 HydrophobicContact CZ-CG 4.43Å; F150-L185 HydrophobicContact CB-CD1 3.6Å; F150-L185 HydrophobicContact CD2-CD1 3.84Å; F150-L185 HydrophobicContact CG-CD1 3.73Å
151	Q	97	Very high	95.6	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.019	22%	0.22	C	C	.	.	H	α-helix	trans	-65.1	-35	-179.2	-171.1	60.4	39.9	0	0	111.8	E108 L112 L115 V147 I148 Q149 C155 Y247	E108-Q151 PolarHBondContact OE2-NE2 2.82Å; L112-Q151 HydrophobicContact CB-CG 4.38Å; L112-Q151 HydrophobicContact CD1-CB 4.21Å; L112-Q151 HydrophobicContact CD1-CG 4.14Å; L115-Q151 HydrophobicContact CD1-CB 4.49Å; L115-Q151 HydrophobicContact CD1-CG 4.32Å; V147-Q151 VanDerWaalsContact O-CB 3.29Å; V147-Q151 WeakPolarHBondContact O-CB 3.49Å; V147-Q151 PolarHBondContact O-N 2.86Å; I148-Q151 PolarHBondContact O-N 3.14Å; Q149-Q151 VanDerWaalsContact C-N 3.33Å; Q149-Q151 PolarHBondContact O-N 2.9Å; Q151-C155 WeakPolarHBondContact O-CB 3.5Å; Q151-C155 PolarHBondContact O-N 3.21Å; Q151-Y247 PolarHBondContact OE1-OH 3.32Å
152	S	97.6	Very high	96.1	Very high	48 Å²	48	41.8 Å²	41.8	34%	0.336	23%	0.226	S	C	.	.	H	α-helix	trans	-63.2	-50.3	173.6	-177.3	0	0	0	0	111.5	I148 Q149 F150 C155 H156	I148-S152 WeakPolarHBondContact O-CB 3.36Å; I148-S152 PolarHBondContact O-N 3.01Å; Q149-S152 WeakPolarHBondContact O-CB 3.39Å; Q149-S152 PolarHBondContact O-N 2.94Å; F150-S152 VanDerWaalsContact C-N 3.29Å; F150-S152 PolarHBondContact O-N 3.44Å; S152-C155 PolarHBondContact O-N 3.21Å; S152-H156 PolarHBondContact O-N 3.12Å
153	D	98.2	Very high	96.4	Very high	83 Å²	83	47.7 Å²	47.7	44%	0.444	25%	0.245	S	C	.	.	H	α-helix	trans	-64.8	-42.9	-179.4	-62	-26.4	0	0	0	110.6	Q149 F150 H156 D157	Q149-D153 VanDerWaalsContact NE2-CG 3.27Å; Q149-D153 PolarHBondContact NE2-OD1 2.71Å; Q149-D153 PolarHBondContact NE2-OD2 3.36Å; Q149-D153 VanDerWaalsContact O-CG 3.29Å; Q149-D153 PolarHBondContact O-N 3.5Å; F150-D153 PolarHBondContact O-N 3.2Å; D153-H156 PolarHBondContact O-N 2.87Å; D153-D157 WeakPolarHBondContact O-CB 3.44Å; D153-D157 PolarHBondContact O-N 3.06Å
154	F	97.5	Very high	96.6	Very high	10 Å²	10	51.5 Å²	51.5	4%	0.044	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-44.2	177.4	-177.8	-119.3	0	0	0	112.6	F150 H156 D157 L158 F175 S178	F150-F154 HydrophobicContact CE1-CB 4.13Å; F150-F154 HydrophobicContact CE1-CG 4.38Å; F150-F154 HydrophobicContact CZ-CB 4.49Å; F150-F154 VanDerWaalsContact O-CB 3.22Å; F150-F154 WeakPolarHBondContact O-CB 3.42Å; F150-F154 PolarHBondContact O-N 3.01Å; F154-H156 VanDerWaalsContact C-N 3.33Å; F154-H156 PolarHBondContact O-N 3.48Å; F154-D157 WeakPolarHBondContact O-CB 3.38Å; F154-D157 PolarHBondContact O-N 3.16Å; F154-L158 HydrophobicContact CD1-CD1 4.04Å; F154-L158 HydrophobicContact CD2-CG 4.44Å; F154-L158 HydrophobicContact CE1-CD1 3.5Å; F154-L158 VanDerWaalsContact CE1-CD1 3.5Å; F154-L158 HydrophobicContact CE1-CG 4.25Å; F154-L158 HydrophobicContact CE2-CD1 4.17Å; F154-L158 HydrophobicContact CE2-CD2 4.21Å; F154-L158 HydrophobicContact CE2-CG 4.04Å; F154-L158 HydrophobicContact CZ-CD1 3.57Å; F154-L158 HydrophobicContact CZ-CD2 4.13Å; F154-L158 HydrophobicContact CZ-CG 3.93Å; F154-L158 WeakPolarHBondContact O-CG 3.2Å; F154-L158 PolarHBondContact O-N 3.31Å; F154-F175 HydrophobicContact CE1-CD1 4.34Å; F154-F175 AromaticContact CE1-CE1 3.86Å; F154-F175 HydrophobicContact CE1-CE1 3.86Å; F154-F175 HydrophobicContact CE1-CZ 4.08Å; F154-F175 AromaticContact CZ-CD1 3.66Å; F154-F175 HydrophobicContact CZ-CD1 3.66Å; F154-F175 HydrophobicContact CZ-CD2 4.17Å; F154-F175 AromaticContact CZ-CE1 3.58Å; F154-F175 HydrophobicContact CZ-CE1 3.58Å; F154-F175 HydrophobicContact CZ-CE2 4.12Å; F154-F175 AromaticContact CZ-CG 3.96Å; F154-F175 HydrophobicContact CZ-CG 3.96Å; F154-F175 AromaticContact CZ-CZ 3.83Å; F154-F175 HydrophobicContact CZ-CZ 3.83Å; F154-S178 WeakPolarHBondContact CE2-OG 3.33Å
155	C	97.1	Very high	96.5	Very high	5 Å²	5	54.4 Å²	54.4	3%	0.034	28%	0.281	C	S	.	.	H	α-helix	trans	-62.7	-41.6	176.8	-173.5	0	0	0	0	111.5	L112 Q151 S152 L158 I159	L112-C155 HydrophobicContact CD2-CB 4.11Å; Q151-C155 WeakPolarHBondContact O-CB 3.5Å; Q151-C155 PolarHBondContact O-N 3.21Å; S152-C155 PolarHBondContact O-N 3.21Å; C155-L158 PolarHBondContact O-N 3.31Å; C155-I159 WeakPolarHBondContact O-CD1 3.33Å; C155-I159 VanDerWaalsContact O-CG1 3.24Å; C155-I159 WeakPolarHBondContact O-CG1 3.46Å; C155-I159 PolarHBondContact O-N 3.42Å; C155-I159 VanDerWaalsContact O-N 3.11Å
156	H	97.5	Very high	96.3	Very high	125 Å²	125	53.8 Å²	53.8	58%	0.579	28%	0.276	S	S	*	.	H	α-helix	trans	-61.6	-47.6	176.4	-175.7	66.4	0	0	0	111.6	S152 D153 F154 L158 I159 E160	S152-H156 PolarHBondContact O-N 3.12Å; D153-H156 PolarHBondContact O-N 2.87Å; F154-H156 VanDerWaalsContact C-N 3.33Å; F154-H156 PolarHBondContact O-N 3.48Å; H156-L158 VanDerWaalsContact C-N 3.32Å; H156-L158 PolarHBondContact O-N 2.93Å; H156-I159 PolarHBondContact O-N 3.42Å; H156-E160 PolarHBondContact O-N 3.34Å
157	D	97.7	Very high	95.9	Very high	59 Å²	59	52.7 Å²	52.7	32%	0.316	27%	0.268	S	S	.	.	H	α-helix	trans	-57.8	-40.3	177.1	-99.2	34	0	0	0	113.2	D153 F154 E161 K174	D153-D157 WeakPolarHBondContact O-CB 3.44Å; D153-D157 PolarHBondContact O-N 3.06Å; F154-D157 WeakPolarHBondContact O-CB 3.38Å; F154-D157 PolarHBondContact O-N 3.16Å; D157-E161 WeakPolarHBondContact O-CB 3.33Å; D157-E161 PolarHBondContact O-N 3.07Å; D157-K174 HydrophobicContact CB-CD 4.23Å; D157-K174 IonicContact OD2-NZ 4Å; D157-K174 PolarHBondContact OD2-NZ 3.2Å
158	L	97.9	Very high	95.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-69.1	-40.4	177.7	-76	179.8	0	0	0	112.3	L104 L105 E108 F154 C155 H156 E161 A162 I171 K174 F175	L104-L158 HydrophobicContact CD2-CD1 4.39Å; L105-L158 HydrophobicContact CD2-CB 3.68Å; E108-L158 HydrophobicContact CG-CD1 4.14Å; F154-L158 HydrophobicContact CD1-CD1 4.04Å; F154-L158 HydrophobicContact CD2-CG 4.44Å; F154-L158 HydrophobicContact CE1-CD1 3.5Å; F154-L158 VanDerWaalsContact CE1-CD1 3.5Å; F154-L158 HydrophobicContact CE1-CG 4.25Å; F154-L158 HydrophobicContact CE2-CD1 4.17Å; F154-L158 HydrophobicContact CE2-CD2 4.21Å; F154-L158 HydrophobicContact CE2-CG 4.04Å; F154-L158 HydrophobicContact CZ-CD1 3.57Å; F154-L158 HydrophobicContact CZ-CD2 4.13Å; F154-L158 HydrophobicContact CZ-CG 3.93Å; F154-L158 WeakPolarHBondContact O-CG 3.2Å; F154-L158 PolarHBondContact O-N 3.31Å; C155-L158 PolarHBondContact O-N 3.31Å; H156-L158 VanDerWaalsContact C-N 3.32Å; H156-L158 PolarHBondContact O-N 2.93Å; L158-E161 PolarHBondContact O-N 2.78Å; L158-A162 WeakPolarHBondContact O-CB 3.49Å; L158-A162 PolarHBondContact O-N 3.24Å; L158-I171 HydrophobicContact CD2-CG2 4.28Å; L158-K174 HydrophobicContact CD2-CB 3.84Å; L158-F175 HydrophobicContact CD1-CE2 3.95Å; L158-F175 HydrophobicContact CD1-CZ 3.99Å; L158-F175 HydrophobicContact CD2-CD2 4.04Å; L158-F175 HydrophobicContact CD2-CE2 3.77Å
159	I	97.3	Very high	95.8	Very high	48 Å²	48	56.9 Å²	56.9	25%	0.246	29%	0.29	C	S	.	.	H	α-helix	trans	-64.9	-44.4	177.2	-66.6	161.2	0	0	0	110.2	L105 Q109 C155 H156 A162 Q163	L105-I159 HydrophobicContact CD2-CG1 4.37Å; Q109-I159 HydrophobicContact CG-CD1 4.27Å; C155-I159 WeakPolarHBondContact O-CD1 3.33Å; C155-I159 VanDerWaalsContact O-CG1 3.24Å; C155-I159 WeakPolarHBondContact O-CG1 3.46Å; C155-I159 PolarHBondContact O-N 3.42Å; C155-I159 VanDerWaalsContact O-N 3.11Å; H156-I159 PolarHBondContact O-N 3.42Å; I159-A162 PolarHBondContact O-N 2.92Å; I159-Q163 WeakPolarHBondContact O-CG 3.44Å; I159-Q163 PolarHBondContact O-N 3.41Å
160	E	97.3	Very high	95.7	Very high	104 Å²	104	54.8 Å²	54.8	49%	0.486	28%	0.278	S	S	.	.	H	α-helix	trans	-61.3	-44.7	175.9	-170.2	-169.6	179.8	0	0	111.1	H156 A162 Q163	H156-E160 PolarHBondContact O-N 3.34Å; E160-A162 VanDerWaalsContact C-N 3.3Å; E160-A162 PolarHBondContact O-N 3.48Å; E160-Q163 PolarHBondContact O-N 3.44Å
161	E	97.2	Very high	95.7	Very high	5 Å²	5	53.5 Å²	53.5	2%	0.023	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-38.9	178.1	-164.4	65.6	-141.3	0	0	111.8	D157 L158 Q163 K164 Q169 R170 I171 K174	D157-E161 WeakPolarHBondContact O-CB 3.33Å; D157-E161 PolarHBondContact O-N 3.07Å; L158-E161 PolarHBondContact O-N 2.78Å; E161-Q163 VanDerWaalsContact C-N 3.27Å; E161-Q163 PolarHBondContact O-N 2.89Å; E161-K164 WeakPolarHBondContact O-CB 3.3Å; E161-K164 PolarHBondContact O-N 2.91Å; E161-K164 WeakPolarHBondContact OE1-CD 3.46Å; E161-K164 IonicContact OE1-NZ 3.9Å; E161-K164 PolarHBondContact OE1-NZ 3.48Å; E161-K164 IonicContact OE2-NZ 2.7Å; E161-K164 PolarHBondContact OE2-NZ 2.86Å; E161-Q169 WeakPolarHBondContact O-CG 3.45Å; E161-R170 WeakPolarHBondContact OE1-CB 3.29Å; E161-R170 PolarHBondContact OE1-N 3.07Å; E161-I171 HydrophobicContact CB-CD1 3.99Å; E161-I171 HydrophobicContact CG-CD1 3.89Å; E161-K174 HydrophobicContact CB-CG 4.09Å; E161-K174 HydrophobicContact CG-CG 3.91Å; E161-K174 WeakPolarHBondContact OE2-CE 3.46Å
162	A	95.9	Very high	95.7	Very high	22 Å²	22	53.3 Å²	53.3	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-69	-20.6	178.6	0	0	0	0	0	114	L101 L105 L158 I159 E160 K164 Q169 I171	L101-A162 HydrophobicContact CD2-CB 4.02Å; L101-A162 HydrophobicContact CG-CB 4.48Å; L105-A162 HydrophobicContact CD1-CB 3.6Å; L158-A162 WeakPolarHBondContact O-CB 3.49Å; L158-A162 PolarHBondContact O-N 3.24Å; I159-A162 PolarHBondContact O-N 2.92Å; E160-A162 VanDerWaalsContact C-N 3.3Å; E160-A162 PolarHBondContact O-N 3.48Å; A162-K164 VanDerWaalsContact C-N 3.27Å; A162-K164 PolarHBondContact O-N 2.98Å; A162-Q169 PolarHBondContact O-NE2 3.42Å; A162-I171 HydrophobicContact CB-CD1 4.33Å
163	Q	95.5	Very high	95.7	Very high	158 Å²	158	51 Å²	51	74%	0.738	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-13.7	175.4	-71	177.8	4.2	0	0	113.3	I159 E160 E161	I159-Q163 WeakPolarHBondContact O-CG 3.44Å; I159-Q163 PolarHBondContact O-N 3.41Å; E160-Q163 PolarHBondContact O-N 3.44Å; E161-Q163 VanDerWaalsContact C-N 3.27Å; E161-Q163 PolarHBondContact O-N 2.89Å
164	K	95.3	Very high	95.6	Very high	92 Å²	92	48.5 Å²	48.5	40%	0.4	24%	0.24	S	C	.	.	S	Bend	trans	-69.6	166.7	176.3	-61.2	-179.5	-173.4	170.5	0	111.6	E161 A162 D168 Q169	E161-K164 WeakPolarHBondContact O-CB 3.3Å; E161-K164 PolarHBondContact O-N 2.91Å; E161-K164 WeakPolarHBondContact OE1-CD 3.46Å; E161-K164 IonicContact OE1-NZ 3.9Å; E161-K164 PolarHBondContact OE1-NZ 3.48Å; E161-K164 IonicContact OE2-NZ 2.7Å; E161-K164 PolarHBondContact OE2-NZ 2.86Å; A162-K164 VanDerWaalsContact C-N 3.27Å; A162-K164 PolarHBondContact O-N 2.98Å; K164-D168 HydrophobicContact CB-CB 4.24Å; K164-Q169 HydrophobicContact CB-CG 4.25Å; K164-Q169 PolarHBondContact O-NE2 3Å; K164-Q169 VanDerWaalsContact O-NE2 3.16Å
165	S	92	Very high	95.7	Very high	60 Å²	60	48 Å²	48	42%	0.42	24%	0.238	S	C	.	.			trans	-60.1	151.2	176.2	94.9	0	0	0	0	110.8	R167 D168 Q169	S165-R167 PolarHBondContact O-N 3.19Å; S165-D168 WeakPolarHBondContact CB-OD2 3.3Å; S165-D168 PolarHBondContact O-N 3.12Å; S165-D168 PolarHBondContact OG-N 3.07Å; S165-D168 PolarHBondContact OG-OD2 3.34Å; S165-Q169 WeakPolarHBondContact O-CG 3.35Å; S165-Q169 PolarHBondContact O-N 2.98Å
166	S	87.9	Confident	95.6	Very high	43 Å²	43	49.6 Å²	49.6	30%	0.301	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-35.8	-177.7	173.6	0	0	0	0	113.8	R97 H262	R97-S166 PolarHBondContact NH1-O 3.18Å; R97-S166 PolarHBondContact NH1-OG 3.32Å; R97-S166 PolarHBondContact NH2-O 3.38Å; S166-H262 PolarHBondContact O-NE2 2.96Å
167	R	88.1	Confident	95.6	Very high	82 Å²	82	50.7 Å²	50.7	31%	0.309	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-23.8	179.6	-71.4	-71	-171.9	-177.9	-5.1	113.7	S165 E259 S261 P263	S165-R167 PolarHBondContact O-N 3.19Å; R167-E259 IonicContact CZ-OE2 3.27Å; R167-E259 VanDerWaalsContact CZ-OE2 3.27Å; R167-E259 IonicContact NH1-OE2 3.41Å; R167-E259 PolarHBondContact NH1-OE2 3.27Å; R167-E259 IonicContact NH2-OE2 2.62Å; R167-E259 PolarHBondContact NH2-OE2 3.32Å; R167-S261 PolarHBondContact NH1-OG 2.78Å; R167-P263 VanDerWaalsContact O-CG 3.29Å; R167-P263 WeakPolarHBondContact O-CG 3.46Å
168	D	93.5	Very high	95.5	Very high	103 Å²	103	48.4 Å²	48.4	55%	0.551	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-11.5	-178.3	-60.7	-41.9	0	0	0	112.9	K164 S165 R170	K164-D168 HydrophobicContact CB-CB 4.24Å; S165-D168 WeakPolarHBondContact CB-OD2 3.3Å; S165-D168 PolarHBondContact O-N 3.12Å; S165-D168 PolarHBondContact OG-N 3.07Å; S165-D168 PolarHBondContact OG-OD2 3.34Å; D168-R170 PolarHBondContact O-N 3.14Å
169	Q	95.9	Very high	95.5	Very high	10 Å²	10	48.6 Å²	48.6	5%	0.047	24%	0.235	C	C	.	.			trans	-63.4	122.2	176.8	-78.4	172.3	1.1	0	0	111.5	E161 A162 K164 S165 H262 D264	E161-Q169 WeakPolarHBondContact O-CG 3.45Å; A162-Q169 PolarHBondContact O-NE2 3.42Å; K164-Q169 HydrophobicContact CB-CG 4.25Å; K164-Q169 PolarHBondContact O-NE2 3Å; K164-Q169 VanDerWaalsContact O-NE2 3.16Å; S165-Q169 WeakPolarHBondContact O-CG 3.35Å; S165-Q169 PolarHBondContact O-N 2.98Å; Q169-H262 PolarHBondContact O-CE1 3.41Å; Q169-D264 WeakPolarHBondContact O-CB 3.2Å
170	R	96.1	Very high	95.4	Very high	62 Å²	62	50.9 Å²	50.9	23%	0.234	25%	0.245	C	C	.	.			trans	-116.2	58.7	176	-59.3	-63.3	-70.9	-98.5	2.6	112.6	Q40 E161 D168 G173 K174 D264 D267	Q40-R170 VanDerWaalsContact OE1-NH1 3.13Å; Q40-R170 VanDerWaalsContact OE1-NH2 3.12Å; E161-R170 WeakPolarHBondContact OE1-CB 3.29Å; E161-R170 PolarHBondContact OE1-N 3.07Å; D168-R170 PolarHBondContact O-N 3.14Å; R170-G173 PolarHBondContact O-N 2.81Å; R170-K174 WeakPolarHBondContact O-CG 3.35Å; R170-K174 PolarHBondContact O-N 2.84Å; R170-D264 VanDerWaalsContact CA-OD1 3.29Å; R170-D264 WeakPolarHBondContact CA-OD1 3.26Å; R170-D264 IonicContact NE-OD1 3.06Å; R170-D267 IonicContact CZ-OD2 3.6Å; R170-D267 IonicContact NE-OD2 2.92Å; R170-D267 PolarHBondContact NE-OD2 2.7Å; R170-D267 IonicContact NH2-OD2 2.7Å; R170-D267 PolarHBondContact NH2-OD2 2.9Å
171	I	97.7	Very high	95.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.5	-54.5	-177.5	-56.3	-60.5	0	0	0	110.5	L101 L158 E161 A162 G173 K174 F175 Y254 D264	L101-I171 HydrophobicContact CD1-CD1 3.93Å; L101-I171 HydrophobicContact CD1-CG1 3.89Å; L101-I171 HydrophobicContact CD1-CG2 4.21Å; L101-I171 HydrophobicContact CD2-CD1 4.5Å; L101-I171 HydrophobicContact CD2-CG1 4.43Å; L158-I171 HydrophobicContact CD2-CG2 4.28Å; E161-I171 HydrophobicContact CB-CD1 3.99Å; E161-I171 HydrophobicContact CG-CD1 3.89Å; A162-I171 HydrophobicContact CB-CD1 4.33Å; I171-G173 PolarHBondContact O-N 3.39Å; I171-K174 WeakPolarHBondContact O-CB 3.38Å; I171-K174 PolarHBondContact O-N 2.63Å; I171-F175 HydrophobicContact CG2-CD2 4.06Å; I171-F175 HydrophobicContact CG2-CE2 3.99Å; I171-F175 WeakPolarHBondContact O-CD2 3.24Å; I171-F175 PolarHBondContact O-N 3.31Å; I171-Y254 HydrophobicContact CB-CE1 3.95Å; I171-Y254 HydrophobicContact CG1-CE1 4.36Å; I171-Y254 HydrophobicContact CG2-CE1 4.36Å; I171-D264 PolarHBondContact N-OD2 3.49Å
172	G	96.9	Very high	95.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-56.4	-39.1	174.9	0	0	0	0	0	111.8	K174 F175 L176 D264	G172-K174 PolarHBondContact O-N 2.79Å; G172-F175 WeakPolarHBondContact O-CB 3.3Å; G172-F175 PolarHBondContact O-N 3.48Å; G172-L176 PolarHBondContact O-N 3.48Å; G172-D264 PolarHBondContact N-OD1 2.96Å; G172-D264 PolarHBondContact N-OD2 3.42Å
173	G	96.8	Very high	95.2	Very high	1 Å²	1	52 Å²	52	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-61.4	-40.3	173.6	0	0	0	0	0	113.7	R170 I171 L176 R177 D264	R170-G173 PolarHBondContact O-N 2.81Å; I171-G173 PolarHBondContact O-N 3.39Å; G173-L176 PolarHBondContact O-N 2.94Å; G173-R177 WeakPolarHBondContact O-CG 3.43Å; G173-R177 PolarHBondContact O-N 2.93Å; G173-R177 VanDerWaalsContact O-N 3.08Å; G173-R177 PolarHBondContact O-NH1 3.31Å; G173-D264 PolarHBondContact N-OD1 3.06Å
174	K	97.4	Very high	95.1	Very high	30 Å²	30	50 Å²	50	13%	0.13	24%	0.241	C	C	.	.	H	α-helix	trans	-63.9	-45.6	174.9	-76.2	-75.1	-172.1	173.7	0	111.1	D157 L158 E161 R170 I171 G172 L176 R177 S178	D157-K174 HydrophobicContact CB-CD 4.23Å; D157-K174 IonicContact OD2-NZ 4Å; D157-K174 PolarHBondContact OD2-NZ 3.2Å; L158-K174 HydrophobicContact CD2-CB 3.84Å; E161-K174 HydrophobicContact CB-CG 4.09Å; E161-K174 HydrophobicContact CG-CG 3.91Å; E161-K174 WeakPolarHBondContact OE2-CE 3.46Å; R170-K174 WeakPolarHBondContact O-CG 3.35Å; R170-K174 PolarHBondContact O-N 2.84Å; I171-K174 WeakPolarHBondContact O-CB 3.38Å; I171-K174 PolarHBondContact O-N 2.63Å; G172-K174 PolarHBondContact O-N 2.79Å; K174-L176 PolarHBondContact O-N 3.18Å; K174-R177 VanDerWaalsContact CD-NH2 3.31Å; K174-R177 PolarHBondContact O-N 3.44Å; K174-S178 WeakPolarHBondContact O-CB 3.34Å; K174-S178 PolarHBondContact O-N 2.97Å; K174-S178 VanDerWaalsContact O-N 3.13Å; K174-S178 PolarHBondContact O-OG 3.44Å
175	F	98.3	Very high	95.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-55.6	-51.8	174	-87.8	-85.6	0	0	0	111.5	L104 F154 L158 I171 G172 R177 S178 A179 Y247 L251 A271 Y275	L104-F175 HydrophobicContact CD1-CE2 4.26Å; L104-F175 HydrophobicContact CD1-CZ 4.33Å; L104-F175 HydrophobicContact CD2-CE2 4.11Å; L104-F175 HydrophobicContact CD2-CZ 4.05Å; F154-F175 HydrophobicContact CE1-CD1 4.34Å; F154-F175 AromaticContact CE1-CE1 3.86Å; F154-F175 HydrophobicContact CE1-CE1 3.86Å; F154-F175 HydrophobicContact CE1-CZ 4.08Å; F154-F175 AromaticContact CZ-CD1 3.66Å; F154-F175 HydrophobicContact CZ-CD1 3.66Å; F154-F175 HydrophobicContact CZ-CD2 4.17Å; F154-F175 AromaticContact CZ-CE1 3.58Å; F154-F175 HydrophobicContact CZ-CE1 3.58Å; F154-F175 HydrophobicContact CZ-CE2 4.12Å; F154-F175 AromaticContact CZ-CG 3.96Å; F154-F175 HydrophobicContact CZ-CG 3.96Å; F154-F175 AromaticContact CZ-CZ 3.83Å; F154-F175 HydrophobicContact CZ-CZ 3.83Å; L158-F175 HydrophobicContact CD1-CE2 3.95Å; L158-F175 HydrophobicContact CD1-CZ 3.99Å; L158-F175 HydrophobicContact CD2-CD2 4.04Å; L158-F175 HydrophobicContact CD2-CE2 3.77Å; I171-F175 HydrophobicContact CG2-CD2 4.06Å; I171-F175 HydrophobicContact CG2-CE2 3.99Å; I171-F175 WeakPolarHBondContact O-CD2 3.24Å; I171-F175 PolarHBondContact O-N 3.31Å; G172-F175 WeakPolarHBondContact O-CB 3.3Å; G172-F175 PolarHBondContact O-N 3.48Å; F175-R177 PolarHBondContact O-N 2.96Å; F175-S178 PolarHBondContact O-N 3.41Å; F175-S178 VanDerWaalsContact O-N 3.15Å; F175-S178 PolarHBondContact O-OG 3.24Å; F175-A179 PolarHBondContact O-N 2.95Å; F175-Y247 AromaticContact CE1-CD1 3.45Å; F175-Y247 HydrophobicContact CE1-CD1 3.45Å; F175-Y247 VanDerWaalsContact CE1-CD1 3.45Å; F175-Y247 AromaticContact CE1-CE1 3.63Å; F175-Y247 HydrophobicContact CE1-CE1 3.63Å; F175-Y247 AromaticContact CE1-CG 3.92Å; F175-Y247 HydrophobicContact CE1-CG 3.92Å; F175-Y247 HydrophobicContact CZ-CD1 4.03Å; F175-Y247 HydrophobicContact CZ-CE1 4.12Å; F175-L251 HydrophobicContact CB-CD1 4.31Å; F175-L251 HydrophobicContact CD1-CD1 3.92Å; F175-L251 HydrophobicContact CD2-CD1 4.49Å; F175-L251 HydrophobicContact CD2-CD2 3.69Å; F175-L251 HydrophobicContact CE1-CD1 4.39Å; F175-L251 HydrophobicContact CE2-CD2 3.94Å; F175-L251 HydrophobicContact CG-CD1 3.98Å; F175-L251 HydrophobicContact CG-CD2 4.01Å; F175-L251 HydrophobicContact CG-CG 4.48Å; F175-L251 HydrophobicContact CZ-CD2 4.48Å; F175-A271 HydrophobicContact CB-CB 4.02Å; F175-Y275 HydrophobicContact CB-CE2 3.81Å; F175-Y275 HydrophobicContact CD1-CD2 4.27Å; F175-Y275 HydrophobicContact CD1-CE1 4.4Å; F175-Y275 AromaticContact CD1-CE2 3.63Å; F175-Y275 HydrophobicContact CD1-CE2 3.63Å; F175-Y275 AromaticContact CD1-CZ 3.68Å; F175-Y275 HydrophobicContact CG-CE2 4.22Å; F175-Y275 PolarHBondContact O-OH 3.17Å
176	L	96	Very high	95.2	Very high	38 Å²	38	44 Å²	44	20%	0.199	21%	0.209	C	C	.	.	H	α-helix	trans	-58.4	-45.7	179.6	-81.5	179.4	0	0	0	114	G172 G173 K174 S178 A179 D267 R270 A271 V274	G172-L176 PolarHBondContact O-N 3.48Å; G173-L176 PolarHBondContact O-N 2.94Å; K174-L176 PolarHBondContact O-N 3.18Å; L176-S178 PolarHBondContact O-N 2.93Å; L176-A179 WeakPolarHBondContact O-CB 3.12Å; L176-A179 PolarHBondContact O-N 3.11Å; L176-D267 HydrophobicContact CD1-CB 3.89Å; L176-D267 VanDerWaalsContact CD1-O 3.24Å; L176-D267 WeakPolarHBondContact CD1-O 3.31Å; L176-R270 HydrophobicContact CD1-CB 3.88Å; L176-R270 HydrophobicContact CD2-CB 4.08Å; L176-A271 HydrophobicContact CD2-CB 4.13Å; L176-A271 HydrophobicContact CG-CB 3.92Å; L176-V274 HydrophobicContact CD2-CB 4.29Å; L176-V274 HydrophobicContact CD2-CG2 3.91Å
177	R	96.8	Very high	95.3	Very high	147 Å²	147	44 Å²	44	56%	0.555	21%	0.211	S	C	*	.	H	α-helix	trans	-63.2	-32.8	179.2	-73.8	-173.3	-65.5	-86.5	3.8	112.2	G173 K174 F175	G173-R177 WeakPolarHBondContact O-CG 3.43Å; G173-R177 PolarHBondContact O-N 2.93Å; G173-R177 VanDerWaalsContact O-N 3.08Å; G173-R177 PolarHBondContact O-NH1 3.31Å; K174-R177 VanDerWaalsContact CD-NH2 3.31Å; K174-R177 PolarHBondContact O-N 3.44Å; F175-R177 PolarHBondContact O-N 2.96Å
178	S	96.4	Very high	95.3	Very high	12 Å²	12	43.8 Å²	43.8	8%	0.084	21%	0.214	C	C	.	.	H	α-helix	trans	-82.5	-20.5	-178.5	82.3	0	0	0	0	113.4	F154 K174 F175 L176 E180 T181 L182 Y275	F154-S178 WeakPolarHBondContact CE2-OG 3.33Å; K174-S178 WeakPolarHBondContact O-CB 3.34Å; K174-S178 PolarHBondContact O-N 2.97Å; K174-S178 VanDerWaalsContact O-N 3.13Å; K174-S178 PolarHBondContact O-OG 3.44Å; F175-S178 PolarHBondContact O-N 3.41Å; F175-S178 VanDerWaalsContact O-N 3.15Å; F175-S178 PolarHBondContact O-OG 3.24Å; L176-S178 PolarHBondContact O-N 2.93Å; S178-E180 PolarHBondContact O-N 3.31Å; S178-T181 PolarHBondContact O-N 2.89Å; S178-L182 WeakPolarHBondContact O-CB 3.43Å; S178-L182 PolarHBondContact O-N 2.96Å; S178-Y275 PolarHBondContact OG-OH 2.91Å
179	A	96.4	Very high	95.2	Very high	3 Å²	3	39.1 Å²	39.1	3%	0.025	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-47.1	-167.5	0	0	0	0	0	113.8	F175 L176 L182 K183 V274 Y275 I278	F175-A179 PolarHBondContact O-N 2.95Å; L176-A179 WeakPolarHBondContact O-CB 3.12Å; L176-A179 PolarHBondContact O-N 3.11Å; A179-L182 PolarHBondContact O-N 2.82Å; A179-K183 VanDerWaalsContact O-CB 3.28Å; A179-K183 WeakPolarHBondContact O-CB 3.49Å; A179-K183 PolarHBondContact O-N 2.81Å; A179-V274 HydrophobicContact CB-CG1 3.62Å; A179-Y275 HydrophobicContact CB-CE2 3.91Å; A179-I278 HydrophobicContact CB-CD1 3.99Å
180	E	95.2	Very high	94.9	Very high	96 Å²	96	38.7 Å²	38.7	45%	0.449	19%	0.186	S	C	.	.	H	α-helix	trans	-67.2	-41.4	-177.6	-169.1	61.5	-162	0	0	111.7	S178 K183 H184	S178-E180 PolarHBondContact O-N 3.31Å; E180-K183 WeakPolarHBondContact O-CB 3.48Å; E180-K183 PolarHBondContact O-N 3.18Å; E180-K183 IonicContact OE1-NZ 3.41Å; E180-K183 IonicContact OE2-NZ 2.62Å; E180-H184 PolarHBondContact O-CD2 2.78Å; E180-H184 PolarHBondContact O-N 3.46Å; E180-H184 VanDerWaalsContact O-N 3.12Å; E180-H184 IonicContact OE1-CD2 2.72Å; E180-H184 IonicContact OE1-CE1 3.4Å; E180-H184 IonicContact OE1-NE2 2.66Å; E180-H184 PolarHBondContact OE1-NE2 3.23Å; E180-H184 VanDerWaalsContact OE1-NE2 3.14Å
181	T	96.4	Very high	94.2	Very high	75 Å²	75	40.2 Å²	40.2	46%	0.46	19%	0.194	S	C	.	.	H	α-helix	trans	-61.7	-47.1	175.4	-54.2	0	0	0	0	111.1	F150 S178 K183 H184 L185	F150-T181 HydrophobicContact CD2-CG2 3.83Å; F150-T181 HydrophobicContact CE2-CG2 3.72Å; S178-T181 PolarHBondContact O-N 2.89Å; T181-K183 VanDerWaalsContact C-N 3.34Å; T181-K183 PolarHBondContact O-N 3.2Å; T181-H184 PolarHBondContact O-N 2.84Å; T181-L185 HydrophobicContact CG2-CD1 4.22Å; T181-L185 WeakPolarHBondContact O-CG 3.25Å; T181-L185 PolarHBondContact O-N 2.86Å; T181-L185 VanDerWaalsContact O-N 3.1Å
182	L	95.9	Very high	93.6	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-62.5	-41.8	178.3	-178.9	59	0	0	0	111.8	F150 S178 A179 H184 L185 L186 V244 Y247 Y275	F150-L182 HydrophobicContact CD1-CD1 3.81Å; F150-L182 HydrophobicContact CE1-CB 3.74Å; F150-L182 HydrophobicContact CE1-CD1 3.58Å; F150-L182 HydrophobicContact CE1-CD2 4.21Å; F150-L182 HydrophobicContact CE1-CG 4.03Å; F150-L182 HydrophobicContact CE2-CB 4.47Å; F150-L182 HydrophobicContact CZ-CB 3.64Å; F150-L182 HydrophobicContact CZ-CD1 4.36Å; F150-L182 HydrophobicContact CZ-CG 4.43Å; S178-L182 WeakPolarHBondContact O-CB 3.43Å; S178-L182 PolarHBondContact O-N 2.96Å; A179-L182 PolarHBondContact O-N 2.82Å; L182-H184 VanDerWaalsContact C-N 3.34Å; L182-H184 PolarHBondContact O-N 2.81Å; L182-L185 PolarHBondContact O-N 3.47Å; L182-L186 HydrophobicContact CD1-CD1 3.58Å; L182-L186 HydrophobicContact CD1-CG 3.72Å; L182-L186 HydrophobicContact CD2-CD1 4.37Å; L182-L186 HydrophobicContact CG-CD1 3.77Å; L182-L186 HydrophobicContact CG-CG 4.25Å; L182-L186 WeakPolarHBondContact O-CB 3.46Å; L182-L186 WeakPolarHBondContact O-CG 3.5Å; L182-L186 PolarHBondContact O-N 3.25Å; L182-V244 HydrophobicContact CD2-CG2 4.24Å; L182-Y247 HydrophobicContact CD2-CE2 4.04Å; L182-Y275 HydrophobicContact CD2-CE1 3.77Å
183	K	94.1	Very high	93.1	Very high	76 Å²	76	42 Å²	42	33%	0.33	20%	0.204	S	C	.	.	H	α-helix	trans	-56.3	-47.8	177.1	177.4	-174	176.3	-175.2	0	111.2	A179 E180 T181 A187 I278	A179-K183 VanDerWaalsContact O-CB 3.28Å; A179-K183 WeakPolarHBondContact O-CB 3.49Å; A179-K183 PolarHBondContact O-N 2.81Å; E180-K183 WeakPolarHBondContact O-CB 3.48Å; E180-K183 PolarHBondContact O-N 3.18Å; E180-K183 IonicContact OE1-NZ 3.41Å; E180-K183 IonicContact OE2-NZ 2.62Å; T181-K183 VanDerWaalsContact C-N 3.34Å; T181-K183 PolarHBondContact O-N 3.2Å; K183-A187 WeakPolarHBondContact O-CB 3.22Å; K183-A187 PolarHBondContact O-N 3.15Å; K183-I278 HydrophobicContact CB-CD1 4.05Å; K183-I278 HydrophobicContact CB-CG1 4.15Å; K183-I278 HydrophobicContact CB-CG2 4.48Å; K183-I278 HydrophobicContact CD-CG1 4.25Å; K183-I278 HydrophobicContact CG-CG1 4.24Å
184	H	93.9	Very high	92.2	Very high	118 Å²	118	42.3 Å²	42.3	55%	0.546	21%	0.205	S	C	.	.	H	α-helix	trans	-64	-46.9	178	-74.6	-59	0	0	0	112.6	E180 T181 L182 L186 A187 E188	E180-H184 PolarHBondContact O-CD2 2.78Å; E180-H184 PolarHBondContact O-N 3.46Å; E180-H184 VanDerWaalsContact O-N 3.12Å; E180-H184 IonicContact OE1-CD2 2.72Å; E180-H184 IonicContact OE1-CE1 3.4Å; E180-H184 IonicContact OE1-NE2 2.66Å; E180-H184 PolarHBondContact OE1-NE2 3.23Å; E180-H184 VanDerWaalsContact OE1-NE2 3.14Å; T181-H184 PolarHBondContact O-N 2.84Å; L182-H184 VanDerWaalsContact C-N 3.34Å; L182-H184 PolarHBondContact O-N 2.81Å; H184-L186 PolarHBondContact O-N 3.45Å; H184-A187 PolarHBondContact O-N 2.89Å; H184-E188 PolarHBondContact O-N 3.3Å; H184-E188 VanDerWaalsContact O-N 3.1Å
185	L	95.6	Very high	91.2	Very high	25 Å²	25	42.8 Å²	42.8	13%	0.131	21%	0.211	C	C	.	.	H	α-helix	trans	-60.6	-45.8	179.1	-71.2	173.8	0	0	0	111.8	N143 Q146 V147 F150 T181 L182 E188 Y189	N143-L185 PolarHBondContact ND2-O 3.2Å; Q146-L185 HydrophobicContact CB-CD2 3.97Å; V147-L185 HydrophobicContact CG2-CB 4.44Å; F150-L185 HydrophobicContact CB-CD1 3.6Å; F150-L185 HydrophobicContact CD2-CD1 3.84Å; F150-L185 HydrophobicContact CG-CD1 3.73Å; T181-L185 HydrophobicContact CG2-CD1 4.22Å; T181-L185 WeakPolarHBondContact O-CG 3.25Å; T181-L185 PolarHBondContact O-N 2.86Å; T181-L185 VanDerWaalsContact O-N 3.1Å; L182-L185 PolarHBondContact O-N 3.47Å; L185-E188 PolarHBondContact O-N 2.81Å; L185-Y189 WeakPolarHBondContact O-CB 3.37Å; L185-Y189 PolarHBondContact O-N 3.41Å
186	L	94	Very high	90.5	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-74.6	-31.8	-179.9	-71.7	179.2	0	0	0	113.1	V147 L182 H184 E188 Y189 C190 P240 V244 L282	V147-L186 HydrophobicContact CG1-CD2 4.15Å; V147-L186 HydrophobicContact CG2-CD2 4.41Å; L182-L186 HydrophobicContact CD1-CD1 3.58Å; L182-L186 HydrophobicContact CD1-CG 3.72Å; L182-L186 HydrophobicContact CD2-CD1 4.37Å; L182-L186 HydrophobicContact CG-CD1 3.77Å; L182-L186 HydrophobicContact CG-CG 4.25Å; L182-L186 WeakPolarHBondContact O-CB 3.46Å; L182-L186 WeakPolarHBondContact O-CG 3.5Å; L182-L186 PolarHBondContact O-N 3.25Å; H184-L186 PolarHBondContact O-N 3.45Å; L186-E188 VanDerWaalsContact C-N 3.29Å; L186-E188 PolarHBondContact O-N 2.89Å; L186-Y189 PolarHBondContact O-N 3.44Å; L186-C190 WeakPolarHBondContact O-CB 3.37Å; L186-C190 PolarHBondContact O-N 3.47Å; L186-C190 PolarHBondContact O-SG 3.08Å; L186-P240 HydrophobicContact CD2-CB 3.8Å; L186-V244 HydrophobicContact CD1-CB 4.37Å; L186-V244 HydrophobicContact CD1-CG2 3.22Å; L186-L282 HydrophobicContact CB-CD1 3.83Å; L186-L282 HydrophobicContact CB-CD2 4.1Å; L186-L282 HydrophobicContact CD1-CD1 3.9Å
187	A	90	Very high	89.8	Confident	42 Å²	42	42.3 Å²	42.3	35%	0.347	21%	0.21	S	C	.	.	H	α-helix	trans	-60.9	-43.4	172.6	0	0	0	0	0	110.6	K183 H184 K191 L282	K183-A187 WeakPolarHBondContact O-CB 3.22Å; K183-A187 PolarHBondContact O-N 3.15Å; H184-A187 PolarHBondContact O-N 2.89Å; A187-K191 WeakPolarHBondContact O-CB 3.19Å; A187-K191 PolarHBondContact O-N 2.96Å; A187-L282 HydrophobicContact CB-CD2 4.45Å
188	E	88.9	Confident	88.7	Confident	78 Å²	78	38.3 Å²	38.3	36%	0.364	20%	0.199	S	C	.	.	H	α-helix	trans	-63.6	-42.2	172.7	170.6	154.6	-122.7	0	0	112.7	N143 H184 L185 L186 K191	N143-E188 HydrophobicContact CB-CG 4.14Å; N143-E188 WeakPolarHBondContact ND2-CG 3.46Å; H184-E188 PolarHBondContact O-N 3.3Å; H184-E188 VanDerWaalsContact O-N 3.1Å; L185-E188 PolarHBondContact O-N 2.81Å; L186-E188 VanDerWaalsContact C-N 3.29Å; L186-E188 PolarHBondContact O-N 2.89Å; E188-K191 VanDerWaalsContact O-CG 3.23Å; E188-K191 WeakPolarHBondContact O-CG 3.4Å; E188-K191 PolarHBondContact O-N 2.9Å; E188-K191 IonicContact OE1-NZ 2.68Å; E188-K191 PolarHBondContact OE1-NZ 3.27Å
189	Y	91.6	Very high	87.7	Confident	5 Å²	5	38.8 Å²	38.8	2%	0.02	20%	0.202	C	C	.	.	H	α-helix	trans	-64.1	-46.8	178	-173.3	-109.4	0	0	0	112.1	N143 I144 V147 L185 L186 K191 N192 H193 L237 P240 F241	N143-Y189 WeakPolarHBondContact OD1-CA 3.21Å; N143-Y189 WeakPolarHBondContact OD1-CB 3.43Å; N143-Y189 WeakPolarHBondContact OD1-CD2 3.39Å; N143-Y189 PolarHBondContact OD1-N 3.04Å; I144-Y189 HydrophobicContact CB-CD2 4.35Å; I144-Y189 HydrophobicContact CB-CE2 3.75Å; I144-Y189 HydrophobicContact CD1-CE2 4.27Å; I144-Y189 HydrophobicContact CG1-CE2 3.92Å; V147-Y189 HydrophobicContact CG2-CG 4.48Å; L185-Y189 WeakPolarHBondContact O-CB 3.37Å; L185-Y189 PolarHBondContact O-N 3.41Å; L186-Y189 PolarHBondContact O-N 3.44Å; Y189-K191 VanDerWaalsContact C-N 3.32Å; Y189-K191 PolarHBondContact O-N 3.38Å; Y189-N192 PolarHBondContact O-N 3.22Å; Y189-N192 VanDerWaalsContact O-N 3.16Å; Y189-H193 PolarHBondContact O-N 2.83Å; Y189-H193 VanDerWaalsContact O-N 3.15Å; Y189-L237 WeakPolarHBondContact CE1-O 2.94Å; Y189-L237 WeakPolarHBondContact OH-CA 3.15Å; Y189-L237 WeakPolarHBondContact OH-CD2 3.39Å; Y189-L237 PolarHBondContact OH-O 3.17Å; Y189-P240 HydrophobicContact CD1-CB 4.29Å; Y189-P240 HydrophobicContact CD1-CG 4.35Å; Y189-P240 HydrophobicContact CE1-CB 4.09Å; Y189-P240 HydrophobicContact CE1-CG 3.7Å; Y189-F241 HydrophobicContact CD1-CD1 4.28Å; Y189-F241 HydrophobicContact CE1-CD1 4.25Å
190	C	87.7	Confident	86.7	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-65.6	-33.6	-178.9	-69.2	0	0	0	0	112.2	L186 N192 H193 P194 F241 L282 L286	L186-C190 WeakPolarHBondContact O-CB 3.37Å; L186-C190 PolarHBondContact O-N 3.47Å; L186-C190 PolarHBondContact O-SG 3.08Å; C190-N192 PolarHBondContact O-N 2.97Å; C190-H193 PolarHBondContact O-N 3.32Å; C190-P194 VanDerWaalsContact O-CD 3.3Å; C190-P194 WeakPolarHBondContact O-CD 3.48Å; C190-F241 VanDerWaalsContact SG-CB 3.57Å; C190-L282 HydrophobicContact CB-CD2 4.36Å; C190-L286 HydrophobicContact CB-CD2 3.79Å; C190-L286 HydrophobicContact CB-CG 4.05Å; C190-L286 WeakPolarHBondContact O-CD2 3.39Å
191	K	82.8	Confident	85.6	Confident	93 Å²	93	38.6 Å²	38.6	40%	0.404	20%	0.203	S	C	.	.	H	α-helix	trans	-61.8	-33.9	176.1	95	-162.6	164.1	-169.2	0	111.6	A187 E188 Y189 R289	A187-K191 WeakPolarHBondContact O-CB 3.19Å; A187-K191 PolarHBondContact O-N 2.96Å; E188-K191 VanDerWaalsContact O-CG 3.23Å; E188-K191 WeakPolarHBondContact O-CG 3.4Å; E188-K191 PolarHBondContact O-N 2.9Å; E188-K191 IonicContact OE1-NZ 2.68Å; E188-K191 PolarHBondContact OE1-NZ 3.27Å; Y189-K191 VanDerWaalsContact C-N 3.32Å; Y189-K191 PolarHBondContact O-N 3.38Å; K191-R289 PolarHBondContact O-NE 3.46Å; K191-R289 PolarHBondContact O-NH2 3.5Å; K191-R289 VanDerWaalsContact O-NH2 3.12Å
192	N	84.1	Confident	84	Confident	27 Å²	27	35.7 Å²	35.7	14%	0.144	19%	0.186	C	C	.	.	H	α-helix	trans	-83.7	-25.4	-179.1	-173.3	57	0	0	0	112.6	C139 G142 Y189 C190 V195 A196	C139-N192 PolarHBondContact O-ND2 2.86Å; C139-N192 PolarHBondContact O-OD1 2.9Å; G142-N192 WeakPolarHBondContact CA-ND2 3.42Å; G142-N192 PolarHBondContact N-ND2 2.74Å; Y189-N192 PolarHBondContact O-N 3.22Å; Y189-N192 VanDerWaalsContact O-N 3.16Å; C190-N192 PolarHBondContact O-N 2.97Å; N192-V195 WeakPolarHBondContact O-CA 3.49Å; N192-V195 WeakPolarHBondContact O-CB 3.38Å; N192-V195 PolarHBondContact O-N 2.83Å; N192-A196 PolarHBondContact O-N 3.46Å
193	H	86.4	Confident	81.6	Confident	12 Å²	12	40.9 Å²	40.9	6%	0.056	21%	0.214	C	C	.	.	H	α-helix	trans	-53.8	-44.7	-172.8	-175.8	79.9	0	0	0	114.9	Y189 C190 V195 A196 V197 L237 F241 L286	Y189-H193 PolarHBondContact O-N 2.83Å; Y189-H193 VanDerWaalsContact O-N 3.15Å; C190-H193 PolarHBondContact O-N 3.32Å; H193-V195 VanDerWaalsContact C-N 3.27Å; H193-V195 PolarHBondContact O-N 2.97Å; H193-A196 WeakPolarHBondContact O-CB 3.33Å; H193-A196 PolarHBondContact O-N 3.4Å; H193-V197 WeakPolarHBondContact O-CG2 3.26Å; H193-V197 PolarHBondContact O-N 3.3Å; H193-L237 PolarHBondContact CE1-O 3.24Å; H193-L237 PolarHBondContact ND1-O 2.83Å; H193-L237 VanDerWaalsContact ND1-O 3.15Å; H193-F241 HydrophobicContact CB-CE1 4.34Å; H193-F241 AromaticContact CD2-CE1 3.98Å; H193-F241 AromaticContact CD2-CZ 3.97Å; H193-F241 AromaticContact CE1-CE1 3.95Å; H193-F241 AromaticContact CG-CE1 3.78Å; H193-F241 AromaticContact ND1-CE1 3.75Å; H193-F241 AromaticContact NE2-CZ 3.83Å; H193-L286 HydrophobicContact CB-CD2 4.28Å
194	P	78.7	Confident	79.3	Confident	6 Å²	6	39.7 Å²	39.7	4%	0.039	22%	0.215	C	C	.	.	H	α-helix	trans	-66	-29.8	177.6	-24.4	37.4	0	0	0	113.6	C190 N198 R289 L293	C190-P194 VanDerWaalsContact O-CD 3.3Å; C190-P194 WeakPolarHBondContact O-CD 3.48Å; P194-N198 VanDerWaalsContact O-CG 3.24Å; P194-N198 PolarHBondContact O-N 3.09Å; P194-N198 PolarHBondContact O-OD1 3.46Å; P194-R289 HydrophobicContact CB-CG 4.3Å; P194-R289 HydrophobicContact CG-CB 4.17Å; P194-R289 HydrophobicContact CG-CG 3.85Å; P194-L293 HydrophobicContact CB-CD1 3.44Å; P194-L293 VanDerWaalsContact CB-CD1 3.44Å
195	V	76.8	Confident	76.7	Confident	40 Å²	40	38.4 Å²	38.4	24%	0.242	21%	0.212	C	C	.	.	H	α-helix	trans	-70.2	-44.9	174.2	-176.1	0	0	0	0	109.3	C139 N192 H193 V197 N198 V199	C139-V195 HydrophobicContact CB-CG1 4.08Å; N192-V195 WeakPolarHBondContact O-CA 3.49Å; N192-V195 WeakPolarHBondContact O-CB 3.38Å; N192-V195 PolarHBondContact O-N 2.83Å; H193-V195 VanDerWaalsContact C-N 3.27Å; H193-V195 PolarHBondContact O-N 2.97Å; V195-V197 VanDerWaalsContact C-N 3.31Å; V195-V197 PolarHBondContact O-N 3.38Å; V195-N198 WeakPolarHBondContact O-CB 3.43Å; V195-N198 PolarHBondContact O-N 3.1Å; V195-N198 VanDerWaalsContact O-N 3.08Å; V195-V199 WeakPolarHBondContact O-CG2 3.49Å; V195-V199 PolarHBondContact O-N 2.7Å
196	A	83.6	Confident	74	Confident	2 Å²	2	40.4 Å²	40.4	2%	0.017	23%	0.228	C	C	.	.	H	α-helix	trans	-56	-45.2	173.5	0	0	0	0	0	111.9	C139 L140 N192 H193 N198 V199 I200 L237	C139-A196 WeakPolarHBondContact O-CB 3.41Å; L140-A196 HydrophobicContact CD1-CB 4.27Å; L140-A196 WeakPolarHBondContact O-CB 3.36Å; N192-A196 PolarHBondContact O-N 3.46Å; H193-A196 WeakPolarHBondContact O-CB 3.33Å; H193-A196 PolarHBondContact O-N 3.4Å; A196-N198 VanDerWaalsContact C-N 3.34Å; A196-N198 PolarHBondContact O-N 3.47Å; A196-V199 PolarHBondContact O-N 2.8Å; A196-I200 VanDerWaalsContact O-CG1 3.29Å; A196-I200 WeakPolarHBondContact O-CG1 3.47Å; A196-I200 PolarHBondContact O-N 2.92Å; A196-L237 HydrophobicContact CB-CD1 4.29Å
197	V	80	Confident	71.7	Confident	27 Å²	27	42.6 Å²	42.6	16%	0.164	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-39.4	175.7	173.4	0	0	0	0	111.5	H193 V195 I200 N201 V234	H193-V197 WeakPolarHBondContact O-CG2 3.26Å; H193-V197 PolarHBondContact O-N 3.3Å; V195-V197 VanDerWaalsContact C-N 3.31Å; V195-V197 PolarHBondContact O-N 3.38Å; V197-I200 PolarHBondContact O-N 3.32Å; V197-N201 VanDerWaalsContact CG1-ND2 3.26Å; V197-N201 WeakPolarHBondContact CG1-ND2 3.43Å; V197-N201 WeakPolarHBondContact O-CB 3.13Å; V197-N201 VanDerWaalsContact O-CG 3.3Å; V197-N201 PolarHBondContact O-N 2.96Å; V197-N201 PolarHBondContact O-ND2 3.02Å; V197-V234 HydrophobicContact CG2-CG1 4.08Å
198	N	74.2	Confident	69.5	Low	62 Å²	62	47.6 Å²	47.6	33%	0.332	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-45.1	174.1	-74.2	-9.5	0	0	0	111.6	P194 V195 A196 I200 N201 S202	P194-N198 VanDerWaalsContact O-CG 3.24Å; P194-N198 PolarHBondContact O-N 3.09Å; P194-N198 PolarHBondContact O-OD1 3.46Å; V195-N198 WeakPolarHBondContact O-CB 3.43Å; V195-N198 PolarHBondContact O-N 3.1Å; V195-N198 VanDerWaalsContact O-N 3.08Å; A196-N198 VanDerWaalsContact C-N 3.34Å; A196-N198 PolarHBondContact O-N 3.47Å; N198-I200 PolarHBondContact O-N 3.23Å; N198-N201 CarbonylContact O-C 3.56Å; N198-N201 PolarHBondContact O-N 3.04Å; N198-S202 PolarHBondContact O-N 3.35Å; N198-S202 PolarHBondContact O-OG 3.22Å
199	V	75	Confident	67.1	Low	23 Å²	23	46.1 Å²	46.1	14%	0.139	25%	0.252	C	S	.	.	H	α-helix	trans	-57.1	-38.9	176.4	171.9	0	0	0	0	111.3	E136 C139 V195 A196	E136-V199 HydrophobicContact CB-CG1 4.41Å; C139-V199 HydrophobicContact CB-CG2 4.16Å; V195-V199 WeakPolarHBondContact O-CG2 3.49Å; V195-V199 PolarHBondContact O-N 2.7Å; A196-V199 PolarHBondContact O-N 2.8Å
200	I	76.4	Confident	64.8	Low	4 Å²	4	53.8 Å²	53.8	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-69.6	-43.8	174.2	-62.7	164.3	0	0	0	111.1	L140 A196 V197 N198 D230 L233 V234 L237	L140-I200 HydrophobicContact CD1-CD1 3.75Å; L140-I200 HydrophobicContact CD1-CG1 3.68Å; A196-I200 VanDerWaalsContact O-CG1 3.29Å; A196-I200 WeakPolarHBondContact O-CG1 3.47Å; A196-I200 PolarHBondContact O-N 2.92Å; V197-I200 PolarHBondContact O-N 3.32Å; N198-I200 PolarHBondContact O-N 3.23Å; I200-D230 HydrophobicContact CG2-CB 3.89Å; I200-L233 HydrophobicContact CD1-CB 4.35Å; I200-L233 HydrophobicContact CD1-CD2 3.77Å; I200-L233 HydrophobicContact CD1-CG 3.75Å; I200-L233 HydrophobicContact CG1-CD2 3.89Å; I200-L233 HydrophobicContact CG1-CG 4.43Å; I200-V234 HydrophobicContact CB-CG2 4.49Å; I200-V234 HydrophobicContact CD1-CG2 3.69Å; I200-V234 HydrophobicContact CG2-CG2 4.1Å; I200-L237 HydrophobicContact CD1-CD1 3.78Å
201	N	71.3	Confident	62.7	Low	91 Å²	91	58.8 Å²	58.8	49%	0.487	31%	0.314	S	S	.	.	H	α-helix	trans	-85.6	-2.2	-171.9	-76.5	-20.5	0	0	0	114.9	V197 N198 N203	V197-N201 VanDerWaalsContact CG1-ND2 3.26Å; V197-N201 WeakPolarHBondContact CG1-ND2 3.43Å; V197-N201 WeakPolarHBondContact O-CB 3.13Å; V197-N201 VanDerWaalsContact O-CG 3.3Å; V197-N201 PolarHBondContact O-N 2.96Å; V197-N201 PolarHBondContact O-ND2 3.02Å; N198-N201 CarbonylContact O-C 3.56Å; N198-N201 PolarHBondContact O-N 3.04Å; N201-N203 PolarHBondContact O-N 2.92Å
202	S	62.3	Low	61.1	Low	13 Å²	13	55.9 Å²	55.9	9%	0.091	31%	0.305	C	S	.	.			trans	-51.1	76.1	-172.9	-70.7	0	0	0	0	114.5	N198	N198-S202 PolarHBondContact O-N 3.35Å; N198-S202 PolarHBondContact O-OG 3.22Å
203	N	46	Very low	59.5	Low	113 Å²	113	62.9 Å²	62.9	60%	0.604	34%	0.335	S	S	*	.			trans	-95.6	0.9	150.6	-77.8	-16.1	0	0	0	110.1	N201 R216	N201-N203 PolarHBondContact O-N 2.92Å; N203-R216 VanDerWaalsContact CG-NH1 3.33Å; N203-R216 PolarHBondContact ND2-NH1 3.36Å; N203-R216 PolarHBondContact OD1-NH1 3.12Å
204	S	47.1	Very low	57.9	Low	50 Å²	50	65.4 Å²	65.4	35%	0.35	35%	0.348	S	S	.	.	S	Bend	trans	-121.8	85.6	178.9	69.3	0	0	0	0	109.7	S206 K297	S204-S206 PolarHBondContact O-N 3.01Å; S204-K297 PolarHBondContact OG-NZ 3.13Å
205	N	38.6	Very low	56.9	Low	92 Å²	92	66 Å²	66	49%	0.492	35%	0.35	S	S	.	.			trans	42.5	40.5	130.1	-79.4	27.6	0	0	0	117.1	V207 D321	N205-V207 PolarHBondContact O-N 2.88Å; N205-D321 WeakPolarHBondContact CA-OD2 3.21Å; N205-D321 HydrophobicContact CB-CB 4.18Å; N205-D321 VanDerWaalsContact CB-OD1 3.3Å; N205-D321 WeakPolarHBondContact CB-OD1 3.41Å; N205-D321 WeakPolarHBondContact CB-OD2 3.48Å; N205-D321 VanDerWaalsContact CG-OD1 3.23Å; N205-D321 PolarHBondContact ND2-OD1 2.83Å; N205-D321 WeakPolarHBondContact O-CB 3.12Å
206	S	39	Very low	56.3	Low	66 Å²	66	68.9 Å²	68.9	46%	0.462	36%	0.357	S	S	.	.			trans	-96.4	82.7	175.2	52.7	0	0	0	0	109.4	S204 F208	S204-S206 PolarHBondContact O-N 3.01Å; S206-F208 VanDerWaalsContact C-N 3.27Å; S206-F208 PolarHBondContact O-N 3.15Å
207	V	44.6	Very low	55.4	Low	47 Å²	47	70.8 Å²	70.8	29%	0.285	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	16.8	-29.9	156.4	178.4	0	0	0	0	122.9	N205 T209 D321 L323 A346	N205-V207 PolarHBondContact O-N 2.88Å; V207-T209 PolarHBondContact O-N 3.07Å; V207-D321 HydrophobicContact CG2-CB 3.76Å; V207-L323 HydrophobicContact CB-CD2 3.44Å; V207-L323 VanDerWaalsContact CB-CD2 3.44Å; V207-L323 HydrophobicContact CB-CG 4.4Å; V207-L323 HydrophobicContact CG1-CD1 4.42Å; V207-L323 HydrophobicContact CG1-CD2 3.73Å; V207-L323 HydrophobicContact CG1-CG 4.39Å; V207-L323 HydrophobicContact CG2-CD2 3.28Å; V207-L323 HydrophobicContact CG2-CG 3.87Å; V207-A346 HydrophobicContact CG1-CB 3.9Å
208	F	44.1	Very low	55.1	Low	148 Å²	148	74.3 Å²	74.3	65%	0.649	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-7.3	-169.2	-97	-81.1	0	0	0	116.3	S206 A407	S206-F208 VanDerWaalsContact C-N 3.27Å; S206-F208 PolarHBondContact O-N 3.15Å; F208-A407 HydrophobicContact CZ-CB 4.1Å
209	T	39.1	Very low	55.1	Low	47 Å²	47	71.6 Å²	71.6	29%	0.288	38%	0.375	S	S	.	.			trans	-137.1	129.2	174.6	54.4	0	0	0	0	110.3	E136 V207 H211 P212	E136-T209 VanDerWaalsContact OE1-CG2 3.32Å; E136-T209 WeakPolarHBondContact OE1-CG2 3.4Å; E136-T209 PolarHBondContact OE1-OG1 3.18Å; V207-T209 PolarHBondContact O-N 3.07Å; T209-H211 PolarHBondContact O-N 2.95Å; T209-P212 WeakPolarHBondContact O-CD 3.41Å
210	I	42.6	Very low	55.1	Low	166 Å²	166	72 Å²	72	85%	0.851	38%	0.381	S	S	*	.	S	Bend	trans	-58.7	2.9	174.2	-67.8	165.4	0	0	0	112.2
211	H	44.6	Very low	55.2	Low	105 Å²	105	76.7 Å²	76.7	49%	0.486	40%	0.403	S	S	.	.			trans	-144.8	51.9	-169.6	-99.7	-40.6	0	0	0	115.4	T209 F213 I214 L215	T209-H211 PolarHBondContact O-N 2.95Å; H211-F213 PolarHBondContact O-N 2.94Å; H211-I214 HydrophobicContact CB-CB 3.93Å; H211-I214 HydrophobicContact CB-CD1 4.48Å; H211-I214 HydrophobicContact CB-CG1 4.35Å; H211-I214 WeakPolarHBondContact CE1-CD1 3.42Å; H211-I214 WeakPolarHBondContact ND1-CD1 3.07Å; H211-I214 WeakPolarHBondContact ND1-CG1 3.4Å; H211-I214 WeakPolarHBondContact NE2-CD1 3.38Å; H211-I214 PolarHBondContact O-N 3.33Å; H211-I214 VanDerWaalsContact O-N 3.12Å; H211-L215 PolarHBondContact O-N 3.47Å
212	P	48.7	Very low	55.6	Low	32 Å²	32	73.5 Å²	73.5	21%	0.208	39%	0.385	C	S	.	.	H	α-helix	trans	-60.3	-38.8	176.4	-6.7	19.2	0	0	0	111.3	T209 I214 L215 R216	T209-P212 WeakPolarHBondContact O-CD 3.41Å; P212-I214 PolarHBondContact O-N 3.03Å; P212-L215 PolarHBondContact O-N 3.36Å; P212-R216 PolarHBondContact O-N 3.42Å
213	F	51	Low	56.4	Low	175 Å²	175	73 Å²	73	77%	0.768	38%	0.381	S	S	*	.	H	α-helix	trans	-63.3	-39.3	177.2	-169.7	-96.3	0	0	0	112.7	H211 G217	H211-F213 PolarHBondContact O-N 2.94Å; F213-G217 PolarHBondContact O-N 2.68Å
214	I	53.4	Low	58.1	Low	64 Å²	64	74.8 Å²	74.8	33%	0.328	39%	0.386	S	S	.	.	H	α-helix	trans	-71.1	-39.8	176.3	-70.1	-168.3	0	0	0	110.6	H211 P212 G217 K218	H211-I214 HydrophobicContact CB-CB 3.93Å; H211-I214 HydrophobicContact CB-CD1 4.48Å; H211-I214 HydrophobicContact CB-CG1 4.35Å; H211-I214 WeakPolarHBondContact CE1-CD1 3.42Å; H211-I214 WeakPolarHBondContact ND1-CD1 3.07Å; H211-I214 WeakPolarHBondContact ND1-CG1 3.4Å; H211-I214 WeakPolarHBondContact NE2-CD1 3.38Å; H211-I214 PolarHBondContact O-N 3.33Å; H211-I214 VanDerWaalsContact O-N 3.12Å; P212-I214 PolarHBondContact O-N 3.03Å; I214-G217 PolarHBondContact O-N 2.94Å; I214-K218 HydrophobicContact CG2-CD 3.8Å; I214-K218 VanDerWaalsContact CG2-CE 3.41Å; I214-K218 HydrophobicContact CG2-CG 4.09Å; I214-K218 WeakPolarHBondContact O-CB 3.05Å; I214-K218 VanDerWaalsContact O-CG 3.28Å; I214-K218 WeakPolarHBondContact O-CG 3.24Å; I214-K218 PolarHBondContact O-N 3.35Å
215	L	57.8	Low	59.7	Low	18 Å²	18	79.9 Å²	79.9	9%	0.094	40%	0.402	C	S	.	.	H	α-helix	trans	-60.9	-48.8	178.6	-170.6	74.5	0	0	0	111.2	V131 I132 E136 H211 P212 G217 K218 L219	V131-L215 WeakPolarHBondContact O-CD1 3.08Å; I132-L215 HydrophobicContact CB-CD1 4.17Å; I132-L215 HydrophobicContact CG1-CD1 3.92Å; I132-L215 HydrophobicContact CG2-CD1 4.26Å; E136-L215 VanDerWaalsContact OE1-CD2 3.29Å; E136-L215 WeakPolarHBondContact OE1-CD2 3.42Å; H211-L215 PolarHBondContact O-N 3.47Å; P212-L215 PolarHBondContact O-N 3.36Å; L215-G217 PolarHBondContact O-N 3.34Å; L215-K218 PolarHBondContact O-N 2.9Å; L215-L219 WeakPolarHBondContact O-CB 3.34Å; L215-L219 PolarHBondContact O-N 2.9Å
216	R	63	Low	61.6	Low	102 Å²	102	80.3 Å²	80.3	39%	0.385	40%	0.399	S	S	.	.	H	α-helix	trans	-59.6	-46.9	174.3	-175.1	180	178.6	-155.5	-6.7	111.1	N203 P212 K218 L219 A220	N203-R216 VanDerWaalsContact CG-NH1 3.33Å; N203-R216 PolarHBondContact ND2-NH1 3.36Å; N203-R216 PolarHBondContact OD1-NH1 3.12Å; P212-R216 PolarHBondContact O-N 3.42Å; R216-K218 VanDerWaalsContact C-N 3.3Å; R216-K218 PolarHBondContact O-N 3.39Å; R216-L219 PolarHBondContact O-N 3.04Å; R216-A220 WeakPolarHBondContact O-CB 3.5Å; R216-A220 PolarHBondContact O-N 3.4Å
217	G	66.1	Low	63.3	Low	42 Å²	42	80.7 Å²	80.7	43%	0.433	41%	0.414	S	S	.	.	H	α-helix	trans	-55.7	-44.7	177.4	0	0	0	0	0	112.2	F213 I214 L215 Q221	F213-G217 PolarHBondContact O-N 2.68Å; I214-G217 PolarHBondContact O-N 2.94Å; L215-G217 PolarHBondContact O-N 3.34Å; G217-Q221 WeakPolarHBondContact O-CB 3.33Å; G217-Q221 PolarHBondContact O-N 3.48Å
218	K	72.3	Confident	64.8	Low	100 Å²	100	79.4 Å²	79.4	44%	0.435	41%	0.407	S	S	.	.	H	α-helix	trans	-71.9	-41.8	178.5	-67.6	173.9	173.9	179.3	0	112.8	V131 I214 L215 R216 Q221 F222	V131-K218 HydrophobicContact CG1-CB 3.53Å; I214-K218 HydrophobicContact CG2-CD 3.8Å; I214-K218 VanDerWaalsContact CG2-CE 3.41Å; I214-K218 HydrophobicContact CG2-CG 4.09Å; I214-K218 WeakPolarHBondContact O-CB 3.05Å; I214-K218 VanDerWaalsContact O-CG 3.28Å; I214-K218 WeakPolarHBondContact O-CG 3.24Å; I214-K218 PolarHBondContact O-N 3.35Å; L215-K218 PolarHBondContact O-N 2.9Å; R216-K218 VanDerWaalsContact C-N 3.3Å; R216-K218 PolarHBondContact O-N 3.39Å; K218-Q221 PolarHBondContact O-N 2.92Å; K218-F222 VanDerWaalsContact O-CB 3.28Å; K218-F222 WeakPolarHBondContact O-CB 3.3Å; K218-F222 PolarHBondContact O-N 3.05Å
219	L	74.8	Confident	66.4	Low	5 Å²	5	76.6 Å²	76.6	3%	0.026	40%	0.399	C	S	.	.	H	α-helix	trans	-66.6	-49.8	178.2	178.9	57.4	0	0	0	110.8	L126 I132 L215 R216 Q221 F222 M223 L233	L126-L219 HydrophobicContact CD1-CD1 3.84Å; L126-L219 HydrophobicContact CD2-CD1 4.39Å; I132-L219 HydrophobicContact CD1-CD1 4.22Å; I132-L219 HydrophobicContact CD1-CD2 4.37Å; L215-L219 WeakPolarHBondContact O-CB 3.34Å; L215-L219 PolarHBondContact O-N 2.9Å; R216-L219 PolarHBondContact O-N 3.04Å; L219-Q221 VanDerWaalsContact C-N 3.3Å; L219-Q221 PolarHBondContact O-N 3.26Å; L219-F222 WeakPolarHBondContact O-CB 3.28Å; L219-F222 PolarHBondContact O-N 3.27Å; L219-F222 VanDerWaalsContact O-N 3.1Å; L219-M223 HydrophobicContact CD1-CG 4.17Å; L219-M223 HydrophobicContact CG-CG 4.5Å; L219-M223 VanDerWaalsContact O-CG 3.31Å; L219-M223 WeakPolarHBondContact O-CG 3.24Å; L219-M223 PolarHBondContact O-N 2.98Å; L219-L233 HydrophobicContact CD2-CD2 4.45Å
220	A	74.4	Confident	68.1	Low	32 Å²	32	76 Å²	76	26%	0.264	39%	0.394	S	S	.	.	H	α-helix	trans	-60.4	-41	175.9	0	0	0	0	0	111	R216 F222 M223 Q224	R216-A220 WeakPolarHBondContact O-CB 3.5Å; R216-A220 PolarHBondContact O-N 3.4Å; A220-F222 PolarHBondContact O-N 2.88Å; A220-M223 PolarHBondContact O-N 3.16Å; A220-Q224 WeakPolarHBondContact O-CB 3.34Å; A220-Q224 PolarHBondContact O-N 2.98Å
221	Q	78.1	Confident	69.8	Low	102 Å²	102	74.1 Å²	74.1	48%	0.477	39%	0.385	S	S	.	.	H	α-helix	trans	-64.7	-38.9	174.5	-173.9	-176.8	42.1	0	0	112	G217 K218 L219 K225	G217-Q221 WeakPolarHBondContact O-CB 3.33Å; G217-Q221 PolarHBondContact O-N 3.48Å; K218-Q221 PolarHBondContact O-N 2.92Å; L219-Q221 VanDerWaalsContact C-N 3.3Å; L219-Q221 PolarHBondContact O-N 3.26Å; Q221-K225 HydrophobicContact CG-CD 4.46Å; Q221-K225 WeakPolarHBondContact O-CB 3.39Å; Q221-K225 VanDerWaalsContact O-CG 3.24Å; Q221-K225 WeakPolarHBondContact O-CG 3.37Å; Q221-K225 PolarHBondContact O-N 3.44Å
222	F	79.7	Confident	71.7	Confident	24 Å²	24	71.4 Å²	71.4	11%	0.105	37%	0.374	C	S	.	.	H	α-helix	trans	-64.6	-46.1	175.3	175.8	-89.2	0	0	0	111.3	P125 L126 A129 V131 K218 L219 A220 K225 K226	P125-F222 HydrophobicContact CB-CZ 3.98Å; L126-F222 HydrophobicContact CB-CE1 4.21Å; L126-F222 HydrophobicContact CB-CZ 4.27Å; L126-F222 HydrophobicContact CD1-CD1 4.03Å; L126-F222 HydrophobicContact CD1-CE1 4.11Å; L126-F222 HydrophobicContact CD1-CG 4.4Å; A129-F222 HydrophobicContact CB-CD2 4.22Å; A129-F222 HydrophobicContact CB-CE2 3.94Å; V131-F222 HydrophobicContact CG2-CD2 4.39Å; K218-F222 VanDerWaalsContact O-CB 3.28Å; K218-F222 WeakPolarHBondContact O-CB 3.3Å; K218-F222 PolarHBondContact O-N 3.05Å; L219-F222 WeakPolarHBondContact O-CB 3.28Å; L219-F222 PolarHBondContact O-N 3.27Å; L219-F222 VanDerWaalsContact O-N 3.1Å; A220-F222 PolarHBondContact O-N 2.88Å; F222-K225 WeakPolarHBondContact O-CB 3.43Å; F222-K225 PolarHBondContact O-N 3.43Å; F222-K226 HydrophobicContact CE1-CG 4.35Å; F222-K226 PolarHBondContact O-N 2.85Å; F222-K226 VanDerWaalsContact O-N 3.12Å
223	M	80.4	Confident	73.4	Confident	4 Å²	4	70.2 Å²	70.2	2%	0.02	37%	0.365	C	S	.	.	H	α-helix	trans	-62.5	-43.7	176.7	-67.7	-58.5	-70.8	0	0	111	Y122 L219 A220 K225 K226 G227 S228 N229 L233	Y122-M223 HydrophobicContact CD1-CE 3.9Å; Y122-M223 HydrophobicContact CD1-SD 3.97Å; Y122-M223 HydrophobicContact CE1-CE 3.88Å; Y122-M223 HydrophobicContact CE1-SD 4.36Å; L219-M223 HydrophobicContact CD1-CG 4.17Å; L219-M223 HydrophobicContact CG-CG 4.5Å; L219-M223 VanDerWaalsContact O-CG 3.31Å; L219-M223 WeakPolarHBondContact O-CG 3.24Å; L219-M223 PolarHBondContact O-N 2.98Å; A220-M223 PolarHBondContact O-N 3.16Å; M223-K225 PolarHBondContact O-N 3.33Å; M223-K226 CarbonylContact O-C 3.53Å; M223-K226 WeakPolarHBondContact O-CA 3.33Å; M223-K226 WeakPolarHBondContact O-CB 3.43Å; M223-K226 PolarHBondContact O-N 3.16Å; M223-G227 PolarHBondContact O-N 2.65Å; M223-G227 VanDerWaalsContact O-N 3.14Å; M223-S228 CarbonylContact C-O 3.45Å; M223-S228 WeakPolarHBondContact CE-OG 3.47Å; M223-S228 PolarHBondContact O-N 3.1Å; M223-S228 VanDerWaalsContact O-O 3.08Å; M223-N229 WeakPolarHBondContact CE-O 3.25Å; M223-L233 HydrophobicContact CE-CB 4.08Å
224	Q	80.7	Confident	75	Confident	149 Å²	149	63.5 Å²	63.5	70%	0.696	34%	0.339	S	S	*	.	H	α-helix	trans	-63.2	-39.9	176	-170.3	-179	26.2	0	0	112	A220 K226 G227 S228	A220-Q224 WeakPolarHBondContact O-CB 3.34Å; A220-Q224 PolarHBondContact O-N 2.98Å; Q224-K226 PolarHBondContact O-N 2.7Å; Q224-G227 PolarHBondContact O-N 2.82Å; Q224-S228 PolarHBondContact N-O 3.5Å
225	K	81.3	Confident	76.6	Confident	158 Å²	158	63 Å²	63	69%	0.687	34%	0.341	S	S	*	.	H	α-helix	trans	-61.1	-27.6	172.7	-79.1	172.7	179.8	175.8	0	112.5	Q221 F222 M223 G227	Q221-K225 HydrophobicContact CG-CD 4.46Å; Q221-K225 WeakPolarHBondContact O-CB 3.39Å; Q221-K225 VanDerWaalsContact O-CG 3.24Å; Q221-K225 WeakPolarHBondContact O-CG 3.37Å; Q221-K225 PolarHBondContact O-N 3.44Å; F222-K225 WeakPolarHBondContact O-CB 3.43Å; F222-K225 PolarHBondContact O-N 3.43Å; M223-K225 PolarHBondContact O-N 3.33Å; K225-G227 VanDerWaalsContact C-N 3.34Å
226	K	77.8	Confident	78.2	Confident	100 Å²	100	65.4 Å²	65.4	44%	0.435	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	0.9	173.2	-68.4	-71.5	-175.5	169.2	0	113.5	Y122 F222 M223 Q224	Y122-K226 HydrophobicContact CE1-CB 4.37Å; F222-K226 HydrophobicContact CE1-CG 4.35Å; F222-K226 PolarHBondContact O-N 2.85Å; F222-K226 VanDerWaalsContact O-N 3.12Å; M223-K226 CarbonylContact O-C 3.53Å; M223-K226 WeakPolarHBondContact O-CA 3.33Å; M223-K226 WeakPolarHBondContact O-CB 3.43Å; M223-K226 PolarHBondContact O-N 3.16Å; Q224-K226 PolarHBondContact O-N 2.7Å
227	G	74.8	Confident	79.5	Confident	75 Å²	75	60.7 Å²	60.7	77%	0.773	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	28.3	-177.8	0	0	0	0	0	113.5	M223 Q224 K225	M223-G227 PolarHBondContact O-N 2.65Å; M223-G227 VanDerWaalsContact O-N 3.14Å; Q224-G227 PolarHBondContact O-N 2.82Å; K225-G227 VanDerWaalsContact C-N 3.34Å
228	S	76.4	Confident	80.6	Confident	20 Å²	20	59 Å²	59	14%	0.14	31%	0.313	C	S	.	.			trans	-132.6	167.8	-173.1	-170.7	0	0	0	0	112.1	M223 Q224 L232	M223-S228 CarbonylContact C-O 3.45Å; M223-S228 WeakPolarHBondContact CE-OG 3.47Å; M223-S228 PolarHBondContact O-N 3.1Å; M223-S228 VanDerWaalsContact O-O 3.08Å; Q224-S228 PolarHBondContact N-O 3.5Å; S228-L232 WeakPolarHBondContact OG-CB 3.39Å; S228-L232 WeakPolarHBondContact OG-CD2 3.11Å
229	N	78.6	Confident	81.6	Confident	88 Å²	88	55.2 Å²	55.2	47%	0.471	30%	0.297	S	S	.	.			trans	-121.6	164.1	179.3	65.4	-10.8	0	0	0	111.8	M223 L231 L232	M223-N229 WeakPolarHBondContact CE-O 3.25Å; N229-L231 PolarHBondContact O-N 3.01Å; N229-L232 WeakPolarHBondContact O-CB 3.47Å; N229-L232 PolarHBondContact O-N 3.18Å; N229-L232 PolarHBondContact OD1-N 3.26Å; N229-L232 VanDerWaalsContact OD1-N 3.14Å
230	D	73.7	Confident	82.4	Confident	35 Å²	35	55.1 Å²	55.1	19%	0.187	30%	0.296	C	S	.	.	H	α-helix	trans	-59.5	-29.8	-179.1	-57.4	-18.1	0	0	0	112.1	I200 L232 L233 V234	I200-D230 HydrophobicContact CG2-CB 3.89Å; D230-L232 VanDerWaalsContact C-N 3.34Å; D230-L232 PolarHBondContact O-N 2.98Å; D230-L233 WeakPolarHBondContact O-CB 3.48Å; D230-L233 PolarHBondContact O-N 3.11Å; D230-V234 PolarHBondContact O-N 3.39Å; D230-V234 VanDerWaalsContact O-N 3.15Å
231	L	78.4	Confident	83.2	Confident	127 Å²	127	54.7 Å²	54.7	67%	0.665	29%	0.288	S	S	*	.	H	α-helix	trans	-64.3	-35.2	175.8	-63.4	176.4	0	0	0	112.8	N229 L233 V234 S235	N229-L231 PolarHBondContact O-N 3.01Å; L231-L233 VanDerWaalsContact C-N 3.29Å; L231-L233 PolarHBondContact O-N 3.45Å; L231-V234 PolarHBondContact O-N 2.89Å; L231-S235 VanDerWaalsContact O-CB 3.3Å; L231-S235 WeakPolarHBondContact O-CB 3.42Å; L231-S235 PolarHBondContact O-N 3.21Å
232	L	83.7	Confident	83.8	Confident	48 Å²	48	54.4 Å²	54.4	25%	0.251	28%	0.283	S	S	.	.	H	α-helix	trans	-62.5	-41.6	174.8	-175.3	69.9	0	0	0	110.3	Y122 S228 N229 D230 S235 R236	Y122-L232 HydrophobicContact CE1-CD2 4.27Å; Y122-L232 HydrophobicContact CE2-CD2 4.3Å; Y122-L232 VanDerWaalsContact OH-CD2 3.25Å; Y122-L232 WeakPolarHBondContact OH-CD2 3.49Å; S228-L232 WeakPolarHBondContact OG-CB 3.39Å; S228-L232 WeakPolarHBondContact OG-CD2 3.11Å; N229-L232 WeakPolarHBondContact O-CB 3.47Å; N229-L232 PolarHBondContact O-N 3.18Å; N229-L232 PolarHBondContact OD1-N 3.26Å; N229-L232 VanDerWaalsContact OD1-N 3.14Å; D230-L232 VanDerWaalsContact C-N 3.34Å; D230-L232 PolarHBondContact O-N 2.98Å; L232-S235 WeakPolarHBondContact O-CB 3.29Å; L232-S235 PolarHBondContact O-N 2.66Å; L232-R236 HydrophobicContact CD1-CG 4.21Å; L232-R236 HydrophobicContact CG-CG 4.15Å; L232-R236 WeakPolarHBondContact O-CB 3.24Å; L232-R236 VanDerWaalsContact O-CG 3.3Å; L232-R236 WeakPolarHBondContact O-CG 3.45Å; L232-R236 PolarHBondContact O-N 2.78Å
233	L	84.7	Confident	84.4	Confident	6 Å²	6	54.1 Å²	54.1	3%	0.031	28%	0.282	C	S	.	.	H	α-helix	trans	-62.9	-47.4	179.8	-177.2	58.2	0	0	0	110.9	F118 L140 I200 L219 M223 D230 L231 S235 R236 L237	F118-L233 HydrophobicContact CE2-CD1 3.56Å; F118-L233 HydrophobicContact CZ-CD1 3.52Å; L140-L233 HydrophobicContact CD1-CD2 4.22Å; L140-L233 HydrophobicContact CD2-CD2 4.34Å; I200-L233 HydrophobicContact CD1-CB 4.35Å; I200-L233 HydrophobicContact CD1-CD2 3.77Å; I200-L233 HydrophobicContact CD1-CG 3.75Å; I200-L233 HydrophobicContact CG1-CD2 3.89Å; I200-L233 HydrophobicContact CG1-CG 4.43Å; L219-L233 HydrophobicContact CD2-CD2 4.45Å; M223-L233 HydrophobicContact CE-CB 4.08Å; D230-L233 WeakPolarHBondContact O-CB 3.48Å; D230-L233 PolarHBondContact O-N 3.11Å; L231-L233 VanDerWaalsContact C-N 3.29Å; L231-L233 PolarHBondContact O-N 3.45Å; L233-S235 VanDerWaalsContact C-N 3.31Å; L233-S235 PolarHBondContact O-N 2.85Å; L233-R236 PolarHBondContact O-N 3.31Å; L233-L237 HydrophobicContact CD1-CD1 4.11Å; L233-L237 HydrophobicContact CD1-CG 4.21Å; L233-L237 HydrophobicContact CG-CD1 4.01Å; L233-L237 WeakPolarHBondContact O-CB 3.48Å; L233-L237 VanDerWaalsContact O-CG 3.26Å; L233-L237 WeakPolarHBondContact O-CG 3.42Å; L233-L237 PolarHBondContact O-N 3.48Å
234	V	85.1	Confident	85.1	Confident	34 Å²	34	54 Å²	54	21%	0.206	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-44.4	174.5	176.2	0	0	0	0	111	V197 I200 D230 L231 L237 S238	V197-V234 HydrophobicContact CG2-CG1 4.08Å; I200-V234 HydrophobicContact CB-CG2 4.49Å; I200-V234 HydrophobicContact CD1-CG2 3.69Å; I200-V234 HydrophobicContact CG2-CG2 4.1Å; D230-V234 PolarHBondContact O-N 3.39Å; D230-V234 VanDerWaalsContact O-N 3.15Å; L231-V234 PolarHBondContact O-N 2.89Å; V234-L237 PolarHBondContact O-N 2.74Å; V234-S238 WeakPolarHBondContact O-CB 3.43Å; V234-S238 PolarHBondContact O-N 3.22Å; V234-S238 VanDerWaalsContact O-N 3.13Å; V234-S238 PolarHBondContact O-OG 2.78Å
235	S	88	Confident	85.5	Confident	54 Å²	54	51.4 Å²	51.4	38%	0.378	27%	0.27	S	S	.	.	H	α-helix	trans	-61.4	-46.5	177.9	-177.1	0	0	0	0	111.8	L231 L232 L233 S238 Q239 R242	L231-S235 VanDerWaalsContact O-CB 3.3Å; L231-S235 WeakPolarHBondContact O-CB 3.42Å; L231-S235 PolarHBondContact O-N 3.21Å; L232-S235 WeakPolarHBondContact O-CB 3.29Å; L232-S235 PolarHBondContact O-N 2.66Å; L233-S235 VanDerWaalsContact C-N 3.31Å; L233-S235 PolarHBondContact O-N 2.85Å; S235-S238 WeakPolarHBondContact CA-OG 3.37Å; S235-S238 PolarHBondContact O-N 3.27Å; S235-S238 VanDerWaalsContact O-N 3.16Å; S235-S238 PolarHBondContact O-OG 2.63Å; S235-Q239 PolarHBondContact O-N 2.97Å; S235-R242 PolarHBondContact O-NH2 3.16Å
236	R	90	Very high	86.1	Confident	69 Å²	69	46.5 Å²	46.5	26%	0.26	25%	0.253	S	S	.	.	H	α-helix	trans	-68.1	-39.3	179.2	-67.9	-65.3	-179.5	-171.5	0.7	112.4	E114 F118 L232 L233 S238 Q239	E114-R236 IonicContact OE2-CZ 2.7Å; E114-R236 IonicContact OE2-NH1 4Å; E114-R236 PolarHBondContact OE2-NH1 3.41Å; F118-R236 HydrophobicContact CD1-CB 4.33Å; F118-R236 HydrophobicContact CD2-CB 3.5Å; F118-R236 VanDerWaalsContact CD2-CB 3.5Å; F118-R236 HydrophobicContact CD2-CG 3.84Å; F118-R236 HydrophobicContact CE1-CB 4.42Å; F118-R236 HydrophobicContact CE2-CB 3.62Å; F118-R236 HydrophobicContact CE2-CG 4.28Å; F118-R236 HydrophobicContact CG-CB 3.89Å; F118-R236 HydrophobicContact CG-CG 4.38Å; F118-R236 HydrophobicContact CZ-CB 4.09Å; L232-R236 HydrophobicContact CD1-CG 4.21Å; L232-R236 HydrophobicContact CG-CG 4.15Å; L232-R236 WeakPolarHBondContact O-CB 3.24Å; L232-R236 VanDerWaalsContact O-CG 3.3Å; L232-R236 WeakPolarHBondContact O-CG 3.45Å; L232-R236 PolarHBondContact O-N 2.78Å; L233-R236 PolarHBondContact O-N 3.31Å; R236-S238 PolarHBondContact O-N 2.95Å; R236-S238 VanDerWaalsContact O-N 3.17Å; R236-Q239 VanDerWaalsContact O-CB 3.24Å; R236-Q239 WeakPolarHBondContact O-CB 3.29Å; R236-Q239 PolarHBondContact O-N 2.95Å; R236-Q239 VanDerWaalsContact O-N 3.1Å
237	L	89.7	Confident	87	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-66.8	-12.7	173.5	-71.1	173	0	0	0	113.9	F118 L140 Y189 H193 A196 I200 L233 V234	F118-L237 HydrophobicContact CE1-CD2 4Å; F118-L237 HydrophobicContact CZ-CD2 3.99Å; F118-L237 HydrophobicContact CZ-CG 4.17Å; L140-L237 HydrophobicContact CD1-CD1 3.72Å; L140-L237 HydrophobicContact CG-CD1 4.39Å; Y189-L237 WeakPolarHBondContact CE1-O 2.94Å; Y189-L237 WeakPolarHBondContact OH-CA 3.15Å; Y189-L237 WeakPolarHBondContact OH-CD2 3.39Å; Y189-L237 PolarHBondContact OH-O 3.17Å; H193-L237 PolarHBondContact CE1-O 3.24Å; H193-L237 PolarHBondContact ND1-O 2.83Å; H193-L237 VanDerWaalsContact ND1-O 3.15Å; A196-L237 HydrophobicContact CB-CD1 4.29Å; I200-L237 HydrophobicContact CD1-CD1 3.78Å; L233-L237 HydrophobicContact CD1-CD1 4.11Å; L233-L237 HydrophobicContact CD1-CG 4.21Å; L233-L237 HydrophobicContact CG-CD1 4.01Å; L233-L237 WeakPolarHBondContact O-CB 3.48Å; L233-L237 VanDerWaalsContact O-CG 3.26Å; L233-L237 WeakPolarHBondContact O-CG 3.42Å; L233-L237 PolarHBondContact O-N 3.48Å; V234-L237 PolarHBondContact O-N 2.74Å
238	S	90.6	Very high	88	Confident	8 Å²	8	38.6 Å²	38.6	6%	0.056	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-2.1	175.6	41.3	0	0	0	0	113.4	V234 S235 R236 F241 R242	V234-S238 WeakPolarHBondContact O-CB 3.43Å; V234-S238 PolarHBondContact O-N 3.22Å; V234-S238 VanDerWaalsContact O-N 3.13Å; V234-S238 PolarHBondContact O-OG 2.78Å; S235-S238 WeakPolarHBondContact CA-OG 3.37Å; S235-S238 PolarHBondContact O-N 3.27Å; S235-S238 VanDerWaalsContact O-N 3.16Å; S235-S238 PolarHBondContact O-OG 2.63Å; R236-S238 PolarHBondContact O-N 2.95Å; R236-S238 VanDerWaalsContact O-N 3.17Å; S238-F241 VanDerWaalsContact CA-CE1 3.41Å; S238-F241 WeakPolarHBondContact O-CE2 3.37Å; S238-R242 WeakPolarHBondContact O-CG 3.36Å; S238-R242 PolarHBondContact O-N 2.72Å; S238-R242 PolarHBondContact OG-NH1 2.65Å
239	Q	92	Very high	88.8	Confident	20 Å²	20	42 Å²	42	9%	0.093	22%	0.218	C	C	.	.	H	α-helix	trans	-65.3	-44.6	-178	-171.4	174.7	-8.4	0	0	114.1	H111 E114 S235 R236 F241 R242 H243	H111-Q239 PolarHBondContact ND1-NE2 2.88Å; E114-Q239 PolarHBondContact OE2-NE2 2.85Å; S235-Q239 PolarHBondContact O-N 2.97Å; R236-Q239 VanDerWaalsContact O-CB 3.24Å; R236-Q239 WeakPolarHBondContact O-CB 3.29Å; R236-Q239 PolarHBondContact O-N 2.95Å; R236-Q239 VanDerWaalsContact O-N 3.1Å; Q239-F241 PolarHBondContact O-N 2.9Å; Q239-R242 PolarHBondContact O-N 3.1Å; Q239-H243 WeakPolarHBondContact O-CB 3.29Å; Q239-H243 PolarHBondContact O-N 3.25Å
240	P	92.3	Very high	89.6	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.019	21%	0.207	C	C	.	.	H	α-helix	trans	-57.2	-45.5	-176.9	-26.7	34.1	0	0	0	114.2	L115 V147 L186 Y189	L115-P240 HydrophobicContact CD2-CG 3.84Å; V147-P240 HydrophobicContact CG1-CB 4.03Å; V147-P240 HydrophobicContact CG1-CG 4.43Å; L186-P240 HydrophobicContact CD2-CB 3.8Å; Y189-P240 HydrophobicContact CD1-CB 4.29Å; Y189-P240 HydrophobicContact CD1-CG 4.35Å; Y189-P240 HydrophobicContact CE1-CB 4.09Å; Y189-P240 HydrophobicContact CE1-CG 3.7Å
241	F	90.9	Very high	90.7	Very high	22 Å²	22	37.5 Å²	37.5	10%	0.096	20%	0.198	C	C	.	.	H	α-helix	trans	-79.7	-27	-178.6	59.4	-107.4	0	0	0	113.3	Y189 C190 H193 S238 Q239 L282 L286	Y189-F241 HydrophobicContact CD1-CD1 4.28Å; Y189-F241 HydrophobicContact CE1-CD1 4.25Å; C190-F241 VanDerWaalsContact SG-CB 3.57Å; H193-F241 HydrophobicContact CB-CE1 4.34Å; H193-F241 AromaticContact CD2-CE1 3.98Å; H193-F241 AromaticContact CD2-CZ 3.97Å; H193-F241 AromaticContact CE1-CE1 3.95Å; H193-F241 AromaticContact CG-CE1 3.78Å; H193-F241 AromaticContact ND1-CE1 3.75Å; H193-F241 AromaticContact NE2-CZ 3.83Å; S238-F241 VanDerWaalsContact CA-CE1 3.41Å; S238-F241 WeakPolarHBondContact O-CE2 3.37Å; Q239-F241 PolarHBondContact O-N 2.9Å; F241-L282 HydrophobicContact CB-CD1 4.41Å; F241-L286 HydrophobicContact CD1-CD1 4.23Å; F241-L286 HydrophobicContact CD2-CD1 3.68Å; F241-L286 HydrophobicContact CE1-CD1 4.16Å; F241-L286 HydrophobicContact CE2-CD1 3.64Å; F241-L286 HydrophobicContact CG-CD1 3.97Å; F241-L286 HydrophobicContact CZ-CD1 3.86Å
242	R	90.9	Very high	91.5	Very high	97 Å²	97	34 Å²	34	37%	0.366	18%	0.18	S	C	.	.	H	α-helix	trans	-68.8	-37.9	171.9	-78.5	-162.7	-55.9	-95.9	-9.9	112	S235 S238 Q239 V244 E245	S235-R242 PolarHBondContact O-NH2 3.16Å; S238-R242 WeakPolarHBondContact O-CG 3.36Å; S238-R242 PolarHBondContact O-N 2.72Å; S238-R242 PolarHBondContact OG-NH1 2.65Å; Q239-R242 PolarHBondContact O-N 3.1Å; R242-V244 PolarHBondContact O-N 3.17Å; R242-E245 WeakPolarHBondContact O-CB 3.32Å; R242-E245 PolarHBondContact O-N 3.29Å; R242-E245 VanDerWaalsContact O-N 3.13Å
243	H	93.6	Very high	92	Very high	17 Å²	17	35.5 Å²	35.5	8%	0.079	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-38.3	179.7	-172.9	70	0	0	0	111.7	N107 E108 H111 Q239 E245 T246 Y247	N107-H243 PolarHBondContact ND2-CE1 3.47Å; E108-H243 IonicContact OE1-CD2 3.86Å; E108-H243 IonicContact OE1-CE1 3.98Å; E108-H243 PolarHBondContact OE1-CE1 3.15Å; E108-H243 VanDerWaalsContact OE1-CE1 3.29Å; E108-H243 IonicContact OE1-NE2 2.75Å; E108-H243 PolarHBondContact OE1-NE2 3.33Å; E108-H243 IonicContact OE2-NE2 3.29Å; E108-H243 PolarHBondContact OE2-NE2 3.15Å; H111-H243 AromaticContact CD2-CD2 3.1Å; H111-H243 PolarHBondContact CD2-CD2 3.13Å; H111-H243 AromaticContact CD2-CE1 3.94Å; H111-H243 AromaticContact CD2-CG 3.39Å; H111-H243 AromaticContact CD2-ND1 3.93Å; H111-H243 AromaticContact CD2-NE2 3.48Å; H111-H243 PolarHBondContact CD2-NE2 3.28Å; H111-H243 AromaticContact CE1-CG 3.89Å; H111-H243 AromaticContact CG-CD2 3.64Å; H111-H243 AromaticContact CG-CE1 3.74Å; H111-H243 AromaticContact CG-CG 3.54Å; H111-H243 AromaticContact CG-ND1 3.64Å; H111-H243 AromaticContact CG-NE2 3.75Å; H111-H243 AromaticContact ND1-CG 3.87Å; H111-H243 AromaticContact NE2-CD2 3.59Å; H111-H243 AromaticContact NE2-CG 3.63Å; Q239-H243 WeakPolarHBondContact O-CB 3.29Å; Q239-H243 PolarHBondContact O-N 3.25Å; H243-E245 PolarHBondContact O-N 2.96Å; H243-E245 VanDerWaalsContact O-N 3.15Å; H243-T246 WeakPolarHBondContact O-CB 3.46Å; H243-T246 PolarHBondContact O-N 3.12Å; H243-T246 PolarHBondContact O-OG1 2.87Å; H243-Y247 AromaticContact CD2-CZ 3.67Å; H243-Y247 PolarHBondContact CD2-OH 3.47Å; H243-Y247 AromaticContact NE2-CE1 3.77Å; H243-Y247 AromaticContact NE2-CZ 3.82Å
244	V	93.2	Very high	92.5	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-57.5	-29.6	176.5	174.5	0	0	0	0	113.8	L182 L186 R242 T246 Y247 Y275 I278 A279	L182-V244 HydrophobicContact CD2-CG2 4.24Å; L186-V244 HydrophobicContact CD1-CB 4.37Å; L186-V244 HydrophobicContact CD1-CG2 3.22Å; R242-V244 PolarHBondContact O-N 3.17Å; V244-T246 PolarHBondContact O-N 2.92Å; V244-Y247 HydrophobicContact CB-CD2 4.2Å; V244-Y247 HydrophobicContact CB-CE2 4.39Å; V244-Y247 HydrophobicContact CG1-CD2 4.2Å; V244-Y247 HydrophobicContact CG2-CD2 4.22Å; V244-Y247 HydrophobicContact CG2-CE2 3.93Å; V244-Y247 PolarHBondContact O-N 3.46Å; V244-Y275 HydrophobicContact CG1-CD1 4.23Å; V244-I278 HydrophobicContact CG1-CG2 4.03Å; V244-A279 HydrophobicContact CG1-CB 4.39Å
245	E	90.8	Very high	93	Very high	95 Å²	95	34.6 Å²	34.6	44%	0.444	18%	0.179	S	C	.	.	H	α-helix	trans	-63.8	-23.4	177.3	-58	177.2	-170.3	0	0	112.1	R242 H243 A279	R242-E245 WeakPolarHBondContact O-CB 3.32Å; R242-E245 PolarHBondContact O-N 3.29Å; R242-E245 VanDerWaalsContact O-N 3.13Å; H243-E245 PolarHBondContact O-N 2.96Å; H243-E245 VanDerWaalsContact O-N 3.15Å; E245-A279 HydrophobicContact CG-CB 4.32Å
246	T	93.4	Very high	93.1	Very high	55 Å²	55	40 Å²	40	34%	0.337	19%	0.191	S	C	.	.	H	α-helix	trans	-81.2	-26.3	-178.6	73.3	0	0	0	0	113	H243 V244 A248 V249 A250	H243-T246 WeakPolarHBondContact O-CB 3.46Å; H243-T246 PolarHBondContact O-N 3.12Å; H243-T246 PolarHBondContact O-OG1 2.87Å; V244-T246 PolarHBondContact O-N 2.92Å; T246-A248 VanDerWaalsContact C-N 3.35Å; T246-A248 PolarHBondContact O-N 2.94Å; T246-V249 PolarHBondContact O-N 3.23Å; T246-V249 VanDerWaalsContact O-N 3.12Å; T246-A250 PolarHBondContact O-N 3.28Å
247	Y	96.3	Very high	93.2	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-44.1	-174.4	-71.5	-42	0	0	0	113.2	E108 Q151 F175 L182 H243 V244 V249 A250 L251 Y275	E108-Y247 VanDerWaalsContact CD-CE1 3.48Å; E108-Y247 WeakPolarHBondContact OE1-CE1 3.5Å; E108-Y247 PolarHBondContact OE2-OH 3Å; Q151-Y247 PolarHBondContact OE1-OH 3.32Å; F175-Y247 AromaticContact CE1-CD1 3.45Å; F175-Y247 HydrophobicContact CE1-CD1 3.45Å; F175-Y247 VanDerWaalsContact CE1-CD1 3.45Å; F175-Y247 AromaticContact CE1-CE1 3.63Å; F175-Y247 HydrophobicContact CE1-CE1 3.63Å; F175-Y247 AromaticContact CE1-CG 3.92Å; F175-Y247 HydrophobicContact CE1-CG 3.92Å; F175-Y247 HydrophobicContact CZ-CD1 4.03Å; F175-Y247 HydrophobicContact CZ-CE1 4.12Å; L182-Y247 HydrophobicContact CD2-CE2 4.04Å; H243-Y247 AromaticContact CD2-CZ 3.67Å; H243-Y247 PolarHBondContact CD2-OH 3.47Å; H243-Y247 AromaticContact NE2-CE1 3.77Å; H243-Y247 AromaticContact NE2-CZ 3.82Å; V244-Y247 HydrophobicContact CB-CD2 4.2Å; V244-Y247 HydrophobicContact CB-CE2 4.39Å; V244-Y247 HydrophobicContact CG1-CD2 4.2Å; V244-Y247 HydrophobicContact CG2-CD2 4.22Å; V244-Y247 HydrophobicContact CG2-CE2 3.93Å; V244-Y247 PolarHBondContact O-N 3.46Å; Y247-V249 VanDerWaalsContact C-N 3.26Å; Y247-V249 PolarHBondContact O-N 2.83Å; Y247-A250 PolarHBondContact O-N 3.31Å; Y247-L251 VanDerWaalsContact O-CB 3.29Å; Y247-L251 WeakPolarHBondContact O-CB 3.26Å; Y247-L251 VanDerWaalsContact O-CG 3.27Å; Y247-L251 WeakPolarHBondContact O-CG 3.33Å; Y247-L251 PolarHBondContact O-N 2.73Å; Y247-Y275 AromaticContact CD2-CD1 3.43Å; Y247-Y275 HydrophobicContact CD2-CD1 3.43Å; Y247-Y275 VanDerWaalsContact CD2-CD1 3.43Å; Y247-Y275 AromaticContact CD2-CE1 3.37Å; Y247-Y275 HydrophobicContact CD2-CE1 3.37Å; Y247-Y275 HydrophobicContact CD2-CG 4.43Å; Y247-Y275 HydrophobicContact CE2-CD1 4.33Å; Y247-Y275 AromaticContact CE2-CE1 3.83Å; Y247-Y275 HydrophobicContact CE2-CE1 3.83Å; Y247-Y275 HydrophobicContact CG-CD1 4.02Å; Y247-Y275 HydrophobicContact CG-CE1 4.14Å
248	A	95.1	Very high	93.3	Very high	7 Å²	7	38.3 Å²	38.3	6%	0.058	19%	0.187	C	C	.	.	H	α-helix	trans	-60.9	-36.6	-179.4	0	0	0	0	0	112.7	T246 L252 R276	T246-A248 VanDerWaalsContact C-N 3.35Å; T246-A248 PolarHBondContact O-N 2.94Å; A248-L252 WeakPolarHBondContact O-CB 3.49Å; A248-L252 PolarHBondContact O-N 2.84Å; A248-L252 VanDerWaalsContact O-N 3.16Å; A248-R276 HydrophobicContact CB-CG 3.43Å; A248-R276 VanDerWaalsContact CB-CG 3.43Å
249	V	94	Very high	93.3	Very high	91 Å²	91	40 Å²	40	55%	0.552	19%	0.194	S	C	*	.	H	α-helix	trans	-75.6	-46	179.7	-179.5	0	0	0	0	110.1	T246 Y247 L251 L252 E253	T246-V249 PolarHBondContact O-N 3.23Å; T246-V249 VanDerWaalsContact O-N 3.12Å; Y247-V249 VanDerWaalsContact C-N 3.26Å; Y247-V249 PolarHBondContact O-N 2.83Å; V249-L251 VanDerWaalsContact C-N 3.35Å; V249-L251 PolarHBondContact O-N 3.39Å; V249-L252 WeakPolarHBondContact O-CB 3.26Å; V249-L252 PolarHBondContact O-N 3.08Å; V249-E253 PolarHBondContact O-N 3.43Å
250	A	94.9	Very high	93.1	Very high	29 Å²	29	43.5 Å²	43.5	24%	0.24	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-43.7	178	0	0	0	0	0	112.1	L104 T246 Y247 E253 Y254	L104-A250 HydrophobicContact CD1-CB 4.08Å; L104-A250 HydrophobicContact CG-CB 4.42Å; T246-A250 PolarHBondContact O-N 3.28Å; Y247-A250 PolarHBondContact O-N 3.31Å; A250-E253 PolarHBondContact O-N 2.83Å; A250-Y254 WeakPolarHBondContact O-CB 3.38Å; A250-Y254 PolarHBondContact O-N 3.47Å
251	L	97.6	Very high	92.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.9	-33.5	176.9	-72.1	168.9	0	0	0	112.7	F175 Y247 V249 Y254 E255 T268 A271 V272 Y275	F175-L251 HydrophobicContact CB-CD1 4.31Å; F175-L251 HydrophobicContact CD1-CD1 3.92Å; F175-L251 HydrophobicContact CD2-CD1 4.49Å; F175-L251 HydrophobicContact CD2-CD2 3.69Å; F175-L251 HydrophobicContact CE1-CD1 4.39Å; F175-L251 HydrophobicContact CE2-CD2 3.94Å; F175-L251 HydrophobicContact CG-CD1 3.98Å; F175-L251 HydrophobicContact CG-CD2 4.01Å; F175-L251 HydrophobicContact CG-CG 4.48Å; F175-L251 HydrophobicContact CZ-CD2 4.48Å; Y247-L251 VanDerWaalsContact O-CB 3.29Å; Y247-L251 WeakPolarHBondContact O-CB 3.26Å; Y247-L251 VanDerWaalsContact O-CG 3.27Å; Y247-L251 WeakPolarHBondContact O-CG 3.33Å; Y247-L251 PolarHBondContact O-N 2.73Å; V249-L251 VanDerWaalsContact C-N 3.35Å; V249-L251 PolarHBondContact O-N 3.39Å; L251-Y254 PolarHBondContact O-N 2.94Å; L251-E255 VanDerWaalsContact O-CB 3.3Å; L251-E255 WeakPolarHBondContact O-CB 3.06Å; L251-E255 PolarHBondContact O-N 2.91Å; L251-T268 HydrophobicContact CB-CG2 4.46Å; L251-T268 HydrophobicContact CD2-CG2 4.28Å; L251-A271 HydrophobicContact CD1-CB 3.76Å; L251-V272 HydrophobicContact CB-CG2 3.49Å; L251-V272 VanDerWaalsContact CB-CG2 3.49Å; L251-Y275 HydrophobicContact CD1-CD2 4.22Å
252	L	95.5	Very high	93	Very high	53 Å²	53	43.4 Å²	43.4	28%	0.277	21%	0.213	S	C	.	.	H	α-helix	trans	-65	-47	175	-173.7	79	0	0	0	110.5	A248 V249 Y254 E255 R256 V272	A248-L252 WeakPolarHBondContact O-CB 3.49Å; A248-L252 PolarHBondContact O-N 2.84Å; A248-L252 VanDerWaalsContact O-N 3.16Å; V249-L252 WeakPolarHBondContact O-CB 3.26Å; V249-L252 PolarHBondContact O-N 3.08Å; L252-Y254 VanDerWaalsContact C-N 3.27Å; L252-Y254 PolarHBondContact O-N 3.19Å; L252-E255 PolarHBondContact O-N 3.45Å; L252-R256 VanDerWaalsContact O-CG 3.28Å; L252-R256 WeakPolarHBondContact O-CG 3.38Å; L252-R256 PolarHBondContact O-N 3.3Å; L252-V272 HydrophobicContact CB-CG2 4.41Å; L252-V272 HydrophobicContact CD1-CG1 4.35Å
253	E	93.9	Very high	93	Very high	79 Å²	79	40 Å²	40	37%	0.369	20%	0.203	S	C	.	.	H	α-helix	trans	-64.8	-33.9	177	-69.1	-54.1	131.2	0	0	112.1	V100 V249 A250 N257	V100-E253 HydrophobicContact CG1-CB 4.18Å; V249-E253 PolarHBondContact O-N 3.43Å; A250-E253 PolarHBondContact O-N 2.83Å; E253-N257 PolarHBondContact O-ND2 3.11Å
254	Y	95.6	Very high	93.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.3	-47.2	172.1	-175.9	-111.4	0	0	0	111.4	R97 L101 I171 A250 L251 L252 R256 N257 L258 T268	R97-Y254 HydrophobicContact CG-CD2 4.09Å; R97-Y254 HydrophobicContact CG-CE2 3.57Å; R97-Y254 PolarHBondContact NE-OH 3.21Å; R97-Y254 VanDerWaalsContact NE-OH 3.15Å; R97-Y254 PolarHBondContact NH2-OH 2.95Å; L101-Y254 HydrophobicContact CB-CD2 4.37Å; L101-Y254 HydrophobicContact CB-CE2 4.03Å; L101-Y254 HydrophobicContact CD1-CE2 4.37Å; L101-Y254 HydrophobicContact CD2-CE2 4.49Å; I171-Y254 HydrophobicContact CB-CE1 3.95Å; I171-Y254 HydrophobicContact CG1-CE1 4.36Å; I171-Y254 HydrophobicContact CG2-CE1 4.36Å; A250-Y254 WeakPolarHBondContact O-CB 3.38Å; A250-Y254 PolarHBondContact O-N 3.47Å; L251-Y254 PolarHBondContact O-N 2.94Å; L252-Y254 VanDerWaalsContact C-N 3.27Å; L252-Y254 PolarHBondContact O-N 3.19Å; Y254-R256 PolarHBondContact O-N 3.41Å; Y254-N257 PolarHBondContact O-N 3.05Å; Y254-N257 VanDerWaalsContact O-N 3.12Å; Y254-L258 HydrophobicContact CD1-CD1 4.11Å; Y254-L258 HydrophobicContact CD1-CG 4.35Å; Y254-L258 HydrophobicContact CE1-CD1 3.92Å; Y254-L258 HydrophobicContact CE1-CD2 3.95Å; Y254-L258 HydrophobicContact CE1-CG 4.14Å; Y254-L258 PolarHBondContact O-N 3.45Å; Y254-T268 HydrophobicContact CD1-CG2 3.89Å
255	E	94.6	Very high	93.1	Very high	22 Å²	22	40 Å²	40	10%	0.103	20%	0.202	C	C	.	.	H	α-helix	trans	-60.4	-40	179.1	-173.7	-82.1	153.8	0	0	113.3	L251 L252 N257 L258 R265 T268 Q269	L251-E255 VanDerWaalsContact O-CB 3.3Å; L251-E255 WeakPolarHBondContact O-CB 3.06Å; L251-E255 PolarHBondContact O-N 2.91Å; L252-E255 PolarHBondContact O-N 3.45Å; E255-N257 PolarHBondContact O-N 3.39Å; E255-N257 VanDerWaalsContact O-N 3.14Å; E255-L258 WeakPolarHBondContact O-CB 3.46Å; E255-L258 PolarHBondContact O-N 2.85Å; E255-R265 PolarHBondContact O-NH1 3.27Å; E255-R265 IonicContact OE1-CZ 2.76Å; E255-R265 IonicContact OE1-NE 3.45Å; E255-R265 IonicContact OE1-NH1 2.67Å; E255-R265 PolarHBondContact OE1-NH1 3.5Å; E255-R265 IonicContact OE1-NH2 3.11Å; E255-R265 PolarHBondContact OE1-NH2 2.72Å; E255-T268 HydrophobicContact CB-CG2 3.77Å; E255-T268 HydrophobicContact CG-CG2 4.36Å; E255-Q269 HydrophobicContact CG-CG 3.65Å; E255-Q269 PolarHBondContact OE1-NE2 3.33Å
256	R	91.3	Very high	93.2	Very high	167 Å²	167	35.5 Å²	35.5	63%	0.63	18%	0.181	S	C	*	.	H	α-helix	trans	-59.6	-25.4	177	-71.9	174	74.5	114.3	8.9	113.2	L252 Y254	L252-R256 VanDerWaalsContact O-CG 3.28Å; L252-R256 WeakPolarHBondContact O-CG 3.38Å; L252-R256 PolarHBondContact O-N 3.3Å; Y254-R256 PolarHBondContact O-N 3.41Å
257	N	91.5	Very high	93.3	Very high	29 Å²	29	33.6 Å²	33.6	16%	0.155	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-0.1	179	-64.9	-73.4	0	0	0	113.1	R97 E253 Y254 E255	R97-N257 HydrophobicContact CB-CB 3.88Å; E253-N257 PolarHBondContact O-ND2 3.11Å; Y254-N257 PolarHBondContact O-N 3.05Å; Y254-N257 VanDerWaalsContact O-N 3.12Å; E255-N257 PolarHBondContact O-N 3.39Å; E255-N257 VanDerWaalsContact O-N 3.14Å
258	L	91.4	Very high	93.4	Very high	7 Å²	7	33.5 Å²	33.5	4%	0.037	17%	0.169	C	C	.	.	S	Bend	trans	-78.2	136.5	171.5	-72.2	176.9	0	0	0	110.8	Y254 E255 H262 R265 T268	Y254-L258 HydrophobicContact CD1-CD1 4.11Å; Y254-L258 HydrophobicContact CD1-CG 4.35Å; Y254-L258 HydrophobicContact CE1-CD1 3.92Å; Y254-L258 HydrophobicContact CE1-CD2 3.95Å; Y254-L258 HydrophobicContact CE1-CG 4.14Å; Y254-L258 PolarHBondContact O-N 3.45Å; E255-L258 WeakPolarHBondContact O-CB 3.46Å; E255-L258 PolarHBondContact O-N 2.85Å; L258-H262 HydrophobicContact CD2-CB 4.48Å; L258-R265 HydrophobicContact CD1-CB 4.42Å; L258-R265 PolarHBondContact O-NH1 2.92Å; L258-T268 HydrophobicContact CD1-CG2 4.24Å
259	E	89.5	Confident	93.4	Very high	44 Å²	44	35.5 Å²	35.5	21%	0.206	18%	0.177	C	C	.	.			trans	-66.8	149.9	170.9	-63.2	177.6	-164.4	0	0	111.4	R167 S261 H262 R265	R167-E259 IonicContact CZ-OE2 3.27Å; R167-E259 VanDerWaalsContact CZ-OE2 3.27Å; R167-E259 IonicContact NH1-OE2 3.41Å; R167-E259 PolarHBondContact NH1-OE2 3.27Å; R167-E259 IonicContact NH2-OE2 2.62Å; R167-E259 PolarHBondContact NH2-OE2 3.32Å; E259-S261 PolarHBondContact O-N 3.13Å; E259-H262 WeakPolarHBondContact O-CB 3.43Å; E259-H262 PolarHBondContact O-N 3.08Å; E259-R265 WeakPolarHBondContact O-CD 3.49Å
260	E	87.8	Confident	93.4	Very high	92 Å²	92	34.2 Å²	34.2	43%	0.43	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-26.3	-178.5	-65.9	-173.2	173.2	0	0	113.7	T39 T50 H262	T39-E260 WeakPolarHBondContact CG2-O 3.33Å; T50-E260 WeakPolarHBondContact CB-O 3.44Å; T50-E260 HydrophobicContact CG2-CB 3.97Å; T50-E260 HydrophobicContact CG2-CG 4.04Å; T50-E260 PolarHBondContact OG1-O 2.93Å; E260-H262 VanDerWaalsContact C-N 3.34Å
261	S	89	Confident	93.5	Very high	23 Å²	23	32.9 Å²	32.9	16%	0.161	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	0.9	176.8	59	0	0	0	0	113.8	R167 E259	R167-S261 PolarHBondContact NH1-OG 2.78Å; E259-S261 PolarHBondContact O-N 3.13Å
262	H	92.3	Very high	93.5	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	15%	0.153	C	C	.	.			trans	-74.7	130.2	-176.7	-166.4	-84.1	0	0	0	111.5	R97 S166 Q169 L258 E259 E260 D264 R265	R97-H262 PolarHBondContact NH1-NE2 2.68Å; R97-H262 PolarHBondContact NH2-NE2 3.29Å; R97-H262 VanDerWaalsContact NH2-NE2 3.13Å; S166-H262 PolarHBondContact O-NE2 2.96Å; Q169-H262 PolarHBondContact O-CE1 3.41Å; L258-H262 HydrophobicContact CD2-CB 4.48Å; E259-H262 WeakPolarHBondContact O-CB 3.43Å; E259-H262 PolarHBondContact O-N 3.08Å; E260-H262 VanDerWaalsContact C-N 3.34Å; H262-D264 WeakPolarHBondContact CE1-CB 3.21Å; H262-D264 VanDerWaalsContact ND1-CB 3.29Å; H262-D264 WeakPolarHBondContact ND1-CB 3.44Å; H262-D264 PolarHBondContact ND1-N 2.97Å; H262-D264 PolarHBondContact O-N 3.14Å; H262-R265 HydrophobicContact CB-CB 4.49Å; H262-R265 VanDerWaalsContact O-CB 3.27Å; H262-R265 WeakPolarHBondContact O-CB 3.2Å; H262-R265 PolarHBondContact O-N 3.22Å; H262-R265 VanDerWaalsContact O-N 3.11Å
263	P	91.9	Very high	93.4	Very high	26 Å²	26	33.5 Å²	33.5	17%	0.169	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-24.5	-175.6	26	-35.2	0	0	0	113.8	Q40 R167 R265	Q40-P263 HydrophobicContact CG-CB 3.95Å; Q40-P263 PolarHBondContact NE2-O 3.42Å; Q40-P263 VanDerWaalsContact NE2-O 3.12Å; R167-P263 VanDerWaalsContact O-CG 3.29Å; R167-P263 WeakPolarHBondContact O-CG 3.46Å; P263-R265 VanDerWaalsContact C-N 3.34Å
264	D	95.4	Very high	93.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-3.8	177.8	-159.2	44.9	0	0	0	113.8	Q169 R170 I171 G172 G173 H262 D267 T268	Q169-D264 WeakPolarHBondContact O-CB 3.2Å; R170-D264 VanDerWaalsContact CA-OD1 3.29Å; R170-D264 WeakPolarHBondContact CA-OD1 3.26Å; R170-D264 IonicContact NE-OD1 3.06Å; I171-D264 PolarHBondContact N-OD2 3.49Å; G172-D264 PolarHBondContact N-OD1 2.96Å; G172-D264 PolarHBondContact N-OD2 3.42Å; G173-D264 PolarHBondContact N-OD1 3.06Å; H262-D264 WeakPolarHBondContact CE1-CB 3.21Å; H262-D264 VanDerWaalsContact ND1-CB 3.29Å; H262-D264 WeakPolarHBondContact ND1-CB 3.44Å; H262-D264 PolarHBondContact ND1-N 2.97Å; H262-D264 PolarHBondContact O-N 3.14Å; D264-D267 PolarHBondContact O-N 2.84Å; D264-T268 WeakPolarHBondContact O-CB 3.46Å; D264-T268 PolarHBondContact O-N 2.68Å; D264-T268 PolarHBondContact O-OG1 3.4Å; D264-T268 PolarHBondContact OD2-OG1 3.27Å
265	R	94	Very high	93.6	Very high	18 Å²	18	32 Å²	32	7%	0.068	16%	0.159	C	C	.	.	H	α-helix	trans	-62.3	-48	-174.2	-174.7	175.6	176.4	73.4	15.6	111.7	G53 E255 L258 E259 H262 P263 T268 Q269	G53-R265 PolarHBondContact O-NH2 3.44Å; G53-R265 VanDerWaalsContact O-NH2 3.12Å; E255-R265 PolarHBondContact O-NH1 3.27Å; E255-R265 IonicContact OE1-CZ 2.76Å; E255-R265 IonicContact OE1-NE 3.45Å; E255-R265 IonicContact OE1-NH1 2.67Å; E255-R265 PolarHBondContact OE1-NH1 3.5Å; E255-R265 IonicContact OE1-NH2 3.11Å; E255-R265 PolarHBondContact OE1-NH2 2.72Å; L258-R265 HydrophobicContact CD1-CB 4.42Å; L258-R265 PolarHBondContact O-NH1 2.92Å; E259-R265 WeakPolarHBondContact O-CD 3.49Å; H262-R265 HydrophobicContact CB-CB 4.49Å; H262-R265 VanDerWaalsContact O-CB 3.27Å; H262-R265 WeakPolarHBondContact O-CB 3.2Å; H262-R265 PolarHBondContact O-N 3.22Å; H262-R265 VanDerWaalsContact O-N 3.11Å; P263-R265 VanDerWaalsContact C-N 3.34Å; R265-T268 PolarHBondContact O-N 3.39Å; R265-Q269 WeakPolarHBondContact O-CG 3.43Å; R265-Q269 PolarHBondContact O-N 3.11Å
266	G	92.9	Very high	93.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.5	-42.3	177.4	0	0	0	0	0	112.7	T55 T268 Q269 R270	T55-G266 VanDerWaalsContact CG2-CA 3.47Å; G266-T268 VanDerWaalsContact C-N 3.33Å; G266-T268 PolarHBondContact O-N 3.1Å; G266-Q269 PolarHBondContact O-N 2.89Å; G266-R270 WeakPolarHBondContact O-CB 3.42Å; G266-R270 WeakPolarHBondContact O-CG 3.45Å; G266-R270 PolarHBondContact O-N 2.84Å; G266-R270 PolarHBondContact O-NE 3.32Å
267	D	95.6	Very high	93.7	Very high	16 Å²	16	35.2 Å²	35.2	9%	0.086	18%	0.176	C	C	.	.	H	α-helix	trans	-61	-42.5	174.6	-77.3	-22.5	0	0	0	111.6	R170 L176 D264 R270 A271	R170-D267 IonicContact CZ-OD2 3.6Å; R170-D267 IonicContact NE-OD2 2.92Å; R170-D267 PolarHBondContact NE-OD2 2.7Å; R170-D267 IonicContact NH2-OD2 2.7Å; R170-D267 PolarHBondContact NH2-OD2 2.9Å; L176-D267 HydrophobicContact CD1-CB 3.89Å; L176-D267 VanDerWaalsContact CD1-O 3.24Å; L176-D267 WeakPolarHBondContact CD1-O 3.31Å; D264-D267 PolarHBondContact O-N 2.84Å; D267-R270 PolarHBondContact O-N 3.42Å; D267-R270 IonicContact OD1-CZ 2.69Å; D267-R270 IonicContact OD1-NH1 3.82Å; D267-R270 PolarHBondContact OD1-NH1 2.95Å; D267-R270 IonicContact OD1-NH2 3.41Å; D267-R270 PolarHBondContact OD1-NH2 2.77Å; D267-A271 VanDerWaalsContact O-CB 3.31Å; D267-A271 WeakPolarHBondContact O-CB 3.5Å; D267-A271 PolarHBondContact O-N 2.88Å
268	T	96.7	Very high	93.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.7	-44.3	178.1	-54.4	0	0	0	0	111.2	L251 Y254 E255 L258 D264 R265 G266 R270 A271 V272	L251-T268 HydrophobicContact CB-CG2 4.46Å; L251-T268 HydrophobicContact CD2-CG2 4.28Å; Y254-T268 HydrophobicContact CD1-CG2 3.89Å; E255-T268 HydrophobicContact CB-CG2 3.77Å; E255-T268 HydrophobicContact CG-CG2 4.36Å; L258-T268 HydrophobicContact CD1-CG2 4.24Å; D264-T268 WeakPolarHBondContact O-CB 3.46Å; D264-T268 PolarHBondContact O-N 2.68Å; D264-T268 PolarHBondContact O-OG1 3.4Å; D264-T268 PolarHBondContact OD2-OG1 3.27Å; R265-T268 PolarHBondContact O-N 3.39Å; G266-T268 VanDerWaalsContact C-N 3.33Å; G266-T268 PolarHBondContact O-N 3.1Å; T268-R270 PolarHBondContact O-N 3.29Å; T268-A271 WeakPolarHBondContact O-CB 3.41Å; T268-A271 PolarHBondContact O-N 3.12Å; T268-V272 WeakPolarHBondContact O-CG2 3.23Å; T268-V272 PolarHBondContact O-N 2.78Å
269	Q	95.4	Very high	93.9	Very high	48 Å²	48	34.6 Å²	34.6	22%	0.224	17%	0.174	C	C	.	.	H	α-helix	trans	-60.5	-44.7	176.6	-74.2	-177	-5	0	0	112	G53 E255 R265 G266 V272 A273	G53-Q269 PolarHBondContact O-NE2 2.68Å; E255-Q269 HydrophobicContact CG-CG 3.65Å; E255-Q269 PolarHBondContact OE1-NE2 3.33Å; R265-Q269 WeakPolarHBondContact O-CG 3.43Å; R265-Q269 PolarHBondContact O-N 3.11Å; G266-Q269 PolarHBondContact O-N 2.89Å; Q269-V272 PolarHBondContact O-N 3.32Å; Q269-A273 PolarHBondContact O-N 3.03Å
270	R	95.2	Very high	93.9	Very high	65 Å²	65	37.4 Å²	37.4	25%	0.245	19%	0.194	C	C	.	.	H	α-helix	trans	-63.6	-41.3	174.4	-76.8	-177.5	-86	109.7	-3	111.2	E48 L176 G266 D267 T268 V272 A273 V274	E48-R270 IonicContact OE1-NH2 2.76Å; E48-R270 PolarHBondContact OE1-NH2 3.35Å; L176-R270 HydrophobicContact CD1-CB 3.88Å; L176-R270 HydrophobicContact CD2-CB 4.08Å; G266-R270 WeakPolarHBondContact O-CB 3.42Å; G266-R270 WeakPolarHBondContact O-CG 3.45Å; G266-R270 PolarHBondContact O-N 2.84Å; G266-R270 PolarHBondContact O-NE 3.32Å; D267-R270 PolarHBondContact O-N 3.42Å; D267-R270 IonicContact OD1-CZ 2.69Å; D267-R270 IonicContact OD1-NH1 3.82Å; D267-R270 PolarHBondContact OD1-NH1 2.95Å; D267-R270 IonicContact OD1-NH2 3.41Å; D267-R270 PolarHBondContact OD1-NH2 2.77Å; T268-R270 PolarHBondContact O-N 3.29Å; R270-V272 VanDerWaalsContact C-N 3.35Å; R270-V272 PolarHBondContact O-N 3.16Å; R270-A273 PolarHBondContact O-N 3.48Å; R270-V274 WeakPolarHBondContact O-CG2 3.19Å; R270-V274 PolarHBondContact O-N 3.2Å
271	A	97.4	Very high	93.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58.6	-45.7	176.7	0	0	0	0	0	111.4	F175 L176 L251 D267 T268 A273 V274 Y275	F175-A271 HydrophobicContact CB-CB 4.02Å; L176-A271 HydrophobicContact CD2-CB 4.13Å; L176-A271 HydrophobicContact CG-CB 3.92Å; L251-A271 HydrophobicContact CD1-CB 3.76Å; D267-A271 VanDerWaalsContact O-CB 3.31Å; D267-A271 WeakPolarHBondContact O-CB 3.5Å; D267-A271 PolarHBondContact O-N 2.88Å; T268-A271 WeakPolarHBondContact O-CB 3.41Å; T268-A271 PolarHBondContact O-N 3.12Å; A271-A273 VanDerWaalsContact C-N 3.3Å; A271-A273 PolarHBondContact O-N 3.4Å; A271-V274 PolarHBondContact O-N 3.33Å; A271-Y275 WeakPolarHBondContact O-CB 3.46Å; A271-Y275 WeakPolarHBondContact O-CD2 3.09Å; A271-Y275 PolarHBondContact O-N 2.97Å
272	V	96.6	Very high	93.9	Very high	9 Å²	9	34.3 Å²	34.3	6%	0.055	19%	0.188	C	C	.	.	H	α-helix	trans	-54.3	-48.2	175.7	173.3	0	0	0	0	110.8	L251 L252 T268 Q269 R270 R276	L251-V272 HydrophobicContact CB-CG2 3.49Å; L251-V272 VanDerWaalsContact CB-CG2 3.49Å; L252-V272 HydrophobicContact CB-CG2 4.41Å; L252-V272 HydrophobicContact CD1-CG1 4.35Å; T268-V272 WeakPolarHBondContact O-CG2 3.23Å; T268-V272 PolarHBondContact O-N 2.78Å; Q269-V272 PolarHBondContact O-N 3.32Å; R270-V272 VanDerWaalsContact C-N 3.35Å; R270-V272 PolarHBondContact O-N 3.16Å; V272-R276 VanDerWaalsContact O-CG 3.25Å; V272-R276 WeakPolarHBondContact O-CG 3.45Å; V272-R276 PolarHBondContact O-N 3.33Å; V272-R276 VanDerWaalsContact O-N 3.09Å
273	A	94.2	Very high	93.5	Very high	58 Å²	58	36.8 Å²	36.8	48%	0.479	20%	0.203	S	C	.	.	H	α-helix	trans	-64	-47.6	179.8	0	0	0	0	0	112.3	Q269 R270 A271 Y275 R276 E277	Q269-A273 PolarHBondContact O-N 3.03Å; R270-A273 PolarHBondContact O-N 3.48Å; A271-A273 VanDerWaalsContact C-N 3.3Å; A271-A273 PolarHBondContact O-N 3.4Å; A273-Y275 PolarHBondContact O-N 3.02Å; A273-R276 WeakPolarHBondContact O-CB 3.31Å; A273-R276 PolarHBondContact O-N 2.96Å; A273-E277 PolarHBondContact O-N 2.75Å
274	V	96.1	Very high	93	Very high	47 Å²	47	42.4 Å²	42.4	29%	0.285	23%	0.225	S	C	.	.	H	α-helix	trans	-61.6	-45.7	-179.3	170.7	0	0	0	0	111.4	L176 A179 R270 A271 R276 E277 I278	L176-V274 HydrophobicContact CD2-CB 4.29Å; L176-V274 HydrophobicContact CD2-CG2 3.91Å; A179-V274 HydrophobicContact CB-CG1 3.62Å; R270-V274 WeakPolarHBondContact O-CG2 3.19Å; R270-V274 PolarHBondContact O-N 3.2Å; A271-V274 PolarHBondContact O-N 3.33Å; V274-R276 PolarHBondContact O-N 3.38Å; V274-E277 WeakPolarHBondContact O-CB 3.47Å; V274-E277 PolarHBondContact O-N 2.81Å; V274-I278 HydrophobicContact CG1-CD1 3.83Å; V274-I278 HydrophobicContact CG1-CG1 4.43Å; V274-I278 WeakPolarHBondContact O-CG1 3.33Å; V274-I278 PolarHBondContact O-N 2.85Å
275	Y	97.3	Very high	92.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-70.9	-30.5	-179.9	-84.9	-85.4	0	0	0	113.2	F175 S178 A179 L182 V244 Y247 L251 A271 A273 A279	F175-Y275 HydrophobicContact CB-CE2 3.81Å; F175-Y275 HydrophobicContact CD1-CD2 4.27Å; F175-Y275 HydrophobicContact CD1-CE1 4.4Å; F175-Y275 AromaticContact CD1-CE2 3.63Å; F175-Y275 HydrophobicContact CD1-CE2 3.63Å; F175-Y275 AromaticContact CD1-CZ 3.68Å; F175-Y275 HydrophobicContact CG-CE2 4.22Å; F175-Y275 PolarHBondContact O-OH 3.17Å; S178-Y275 PolarHBondContact OG-OH 2.91Å; A179-Y275 HydrophobicContact CB-CE2 3.91Å; L182-Y275 HydrophobicContact CD2-CE1 3.77Å; V244-Y275 HydrophobicContact CG1-CD1 4.23Å; Y247-Y275 AromaticContact CD2-CD1 3.43Å; Y247-Y275 HydrophobicContact CD2-CD1 3.43Å; Y247-Y275 VanDerWaalsContact CD2-CD1 3.43Å; Y247-Y275 AromaticContact CD2-CE1 3.37Å; Y247-Y275 HydrophobicContact CD2-CE1 3.37Å; Y247-Y275 HydrophobicContact CD2-CG 4.43Å; Y247-Y275 HydrophobicContact CE2-CD1 4.33Å; Y247-Y275 AromaticContact CE2-CE1 3.83Å; Y247-Y275 HydrophobicContact CE2-CE1 3.83Å; Y247-Y275 HydrophobicContact CG-CD1 4.02Å; Y247-Y275 HydrophobicContact CG-CE1 4.14Å; L251-Y275 HydrophobicContact CD1-CD2 4.22Å; A271-Y275 WeakPolarHBondContact O-CB 3.46Å; A271-Y275 WeakPolarHBondContact O-CD2 3.09Å; A271-Y275 PolarHBondContact O-N 2.97Å; A273-Y275 PolarHBondContact O-N 3.02Å; Y275-A279 WeakPolarHBondContact O-CB 3.47Å; Y275-A279 PolarHBondContact O-N 3.11Å
276	R	94.8	Very high	91.7	Very high	123 Å²	123	44.5 Å²	44.5	46%	0.464	24%	0.242	S	C	.	.	H	α-helix	trans	-61	-46	167.9	-75	176.6	-178.5	-179.9	1.6	111.1	A248 V272 A273 V274 A279 V280	A248-R276 HydrophobicContact CB-CG 3.43Å; A248-R276 VanDerWaalsContact CB-CG 3.43Å; V272-R276 VanDerWaalsContact O-CG 3.25Å; V272-R276 WeakPolarHBondContact O-CG 3.45Å; V272-R276 PolarHBondContact O-N 3.33Å; V272-R276 VanDerWaalsContact O-N 3.09Å; A273-R276 WeakPolarHBondContact O-CB 3.31Å; A273-R276 PolarHBondContact O-N 2.96Å; V274-R276 PolarHBondContact O-N 3.38Å; R276-A279 PolarHBondContact O-N 3.22Å; R276-V280 WeakPolarHBondContact O-CB 3.36Å; R276-V280 VanDerWaalsContact O-CG2 3.29Å; R276-V280 WeakPolarHBondContact O-CG2 3.36Å; R276-V280 PolarHBondContact O-N 3.14Å
277	E	93.6	Very high	91	Very high	133 Å²	133	49.4 Å²	49.4	62%	0.621	27%	0.267	S	S	*	.	H	α-helix	trans	-62.8	-45.2	178.3	-169.9	-172.3	150.1	0	0	111.7	A273 V274 A279 V280 G281	A273-E277 PolarHBondContact O-N 2.75Å; V274-E277 WeakPolarHBondContact O-CB 3.47Å; V274-E277 PolarHBondContact O-N 2.81Å; E277-A279 PolarHBondContact O-N 2.86Å; E277-V280 PolarHBondContact O-N 3.34Å; E277-G281 PolarHBondContact O-N 3.33Å
278	I	94.3	Very high	90	Very high	11 Å²	11	52.3 Å²	52.3	6%	0.056	28%	0.279	C	S	.	.	H	α-helix	trans	-59.5	-49.7	176.7	-67.8	168.7	0	0	0	110.4	A179 K183 V244 V274 V280 G281 L282	A179-I278 HydrophobicContact CB-CD1 3.99Å; K183-I278 HydrophobicContact CB-CD1 4.05Å; K183-I278 HydrophobicContact CB-CG1 4.15Å; K183-I278 HydrophobicContact CB-CG2 4.48Å; K183-I278 HydrophobicContact CD-CG1 4.25Å; K183-I278 HydrophobicContact CG-CG1 4.24Å; V244-I278 HydrophobicContact CG1-CG2 4.03Å; V274-I278 HydrophobicContact CG1-CD1 3.83Å; V274-I278 HydrophobicContact CG1-CG1 4.43Å; V274-I278 WeakPolarHBondContact O-CG1 3.33Å; V274-I278 PolarHBondContact O-N 2.85Å; I278-V280 PolarHBondContact O-N 3.24Å; I278-G281 PolarHBondContact O-N 2.99Å; I278-L282 HydrophobicContact CG2-CD1 3.96Å; I278-L282 HydrophobicContact CG2-CG 4.3Å; I278-L282 WeakPolarHBondContact O-CG 3.43Å; I278-L282 PolarHBondContact O-N 2.93Å
279	A	91.8	Very high	89.1	Confident	13 Å²	13	54.3 Å²	54.3	11%	0.107	29%	0.287	C	S	.	.	H	α-helix	trans	-58.5	-48.6	179.7	0	0	0	0	0	111.5	V244 E245 Y275 R276 E277 G281 L282 V283	V244-A279 HydrophobicContact CG1-CB 4.39Å; E245-A279 HydrophobicContact CG-CB 4.32Å; Y275-A279 WeakPolarHBondContact O-CB 3.47Å; Y275-A279 PolarHBondContact O-N 3.11Å; R276-A279 PolarHBondContact O-N 3.22Å; E277-A279 PolarHBondContact O-N 2.86Å; A279-G281 PolarHBondContact O-N 3.4Å; A279-L282 PolarHBondContact O-N 3.23Å; A279-V283 VanDerWaalsContact O-CG2 3.29Å; A279-V283 WeakPolarHBondContact O-CG2 3.5Å; A279-V283 PolarHBondContact O-N 2.72Å
280	V	89.4	Confident	88.2	Confident	103 Å²	103	58.1 Å²	58.1	62%	0.624	30%	0.302	S	S	*	.	H	α-helix	trans	-61.6	-43	177.3	171.7	0	0	0	0	111.4	R276 E277 I278 V283 F284	R276-V280 WeakPolarHBondContact O-CB 3.36Å; R276-V280 VanDerWaalsContact O-CG2 3.29Å; R276-V280 WeakPolarHBondContact O-CG2 3.36Å; R276-V280 PolarHBondContact O-N 3.14Å; E277-V280 PolarHBondContact O-N 3.34Å; I278-V280 PolarHBondContact O-N 3.24Å; V280-V283 PolarHBondContact O-N 2.99Å; V280-F284 WeakPolarHBondContact O-CB 3.29Å; V280-F284 PolarHBondContact O-N 3.48Å
281	G	88.7	Confident	87.2	Confident	39 Å²	39	59 Å²	59	40%	0.402	31%	0.312	S	S	.	.	H	α-helix	trans	-62.2	-42.8	178.2	0	0	0	0	0	112.9	E277 I278 A279 F284 S285	E277-G281 PolarHBondContact O-N 3.33Å; I278-G281 PolarHBondContact O-N 2.99Å; A279-G281 PolarHBondContact O-N 3.4Å; G281-F284 PolarHBondContact O-N 2.92Å; G281-S285 WeakPolarHBondContact O-CB 3.35Å; G281-S285 PolarHBondContact O-N 3.2Å
282	L	88.1	Confident	86.1	Confident	11 Å²	11	60 Å²	60	6%	0.058	32%	0.317	C	S	.	.	H	α-helix	trans	-66	-45.2	176	-68.3	176.9	0	0	0	111.5	L186 A187 C190 F241 I278 A279 F284 S285 L286	L186-L282 HydrophobicContact CB-CD1 3.83Å; L186-L282 HydrophobicContact CB-CD2 4.1Å; L186-L282 HydrophobicContact CD1-CD1 3.9Å; A187-L282 HydrophobicContact CB-CD2 4.45Å; C190-L282 HydrophobicContact CB-CD2 4.36Å; F241-L282 HydrophobicContact CB-CD1 4.41Å; I278-L282 HydrophobicContact CG2-CD1 3.96Å; I278-L282 HydrophobicContact CG2-CG 4.3Å; I278-L282 WeakPolarHBondContact O-CG 3.43Å; I278-L282 PolarHBondContact O-N 2.93Å; A279-L282 PolarHBondContact O-N 3.23Å; L282-F284 VanDerWaalsContact C-N 3.34Å; L282-F284 PolarHBondContact O-N 3.32Å; L282-S285 PolarHBondContact O-N 3.01Å; L282-L286 WeakPolarHBondContact O-CB 3.32Å; L282-L286 WeakPolarHBondContact O-CG 3.41Å; L282-L286 PolarHBondContact O-N 3.05Å
283	V	84.2	Confident	85.1	Confident	53 Å²	53	61.5 Å²	61.5	32%	0.321	32%	0.324	S	S	.	.	H	α-helix	trans	-60.3	-44.7	176.1	170.6	0	0	0	0	110.7	A279 V280 S285 L286 L287	A279-V283 VanDerWaalsContact O-CG2 3.29Å; A279-V283 WeakPolarHBondContact O-CG2 3.5Å; A279-V283 PolarHBondContact O-N 2.72Å; V280-V283 PolarHBondContact O-N 2.99Å; V283-S285 PolarHBondContact O-N 2.96Å; V283-L286 PolarHBondContact O-N 3.36Å; V283-L287 HydrophobicContact CG1-CD1 3.71Å; V283-L287 HydrophobicContact CG1-CG 4.16Å; V283-L287 WeakPolarHBondContact O-CB 3.18Å; V283-L287 VanDerWaalsContact O-CG 3.26Å; V283-L287 WeakPolarHBondContact O-CG 3.27Å; V283-L287 PolarHBondContact O-N 3.47Å
284	F	80.9	Confident	84.1	Confident	143 Å²	143	67.2 Å²	67.2	63%	0.627	33%	0.333	S	S	*	.	H	α-helix	trans	-60.2	-47.2	176.3	-178.6	-94.5	0	0	0	111.7	V280 G281 L282 L286 L287 F288	V280-F284 WeakPolarHBondContact O-CB 3.29Å; V280-F284 PolarHBondContact O-N 3.48Å; G281-F284 PolarHBondContact O-N 2.92Å; L282-F284 VanDerWaalsContact C-N 3.34Å; L282-F284 PolarHBondContact O-N 3.32Å; F284-L286 PolarHBondContact O-N 2.88Å; F284-L287 PolarHBondContact O-N 3.36Å; F284-F288 VanDerWaalsContact O-CB 3.26Å; F284-F288 WeakPolarHBondContact O-CB 3.35Å; F284-F288 PolarHBondContact O-N 2.85Å
285	S	81.5	Confident	83.2	Confident	49 Å²	49	70 Å²	70	34%	0.343	34%	0.342	S	S	.	.	H	α-helix	trans	-58.2	-46.2	176.7	-179	0	0	0	0	112	G281 L282 V283 R289	G281-S285 WeakPolarHBondContact O-CB 3.35Å; G281-S285 PolarHBondContact O-N 3.2Å; L282-S285 PolarHBondContact O-N 3.01Å; V283-S285 PolarHBondContact O-N 2.96Å; S285-R289 WeakPolarHBondContact O-CB 3.41Å; S285-R289 PolarHBondContact O-N 3.43Å; S285-R289 VanDerWaalsContact O-N 3.1Å
286	L	81.2	Confident	82.3	Confident	14 Å²	14	71.3 Å²	71.3	7%	0.073	35%	0.348	C	S	.	.	H	α-helix	trans	-64.6	-44.1	177.3	-72.9	171.8	0	0	0	112.4	C190 H193 F241 L282 V283 F284 R289 K290	C190-L286 HydrophobicContact CB-CD2 3.79Å; C190-L286 HydrophobicContact CB-CG 4.05Å; C190-L286 WeakPolarHBondContact O-CD2 3.39Å; H193-L286 HydrophobicContact CB-CD2 4.28Å; F241-L286 HydrophobicContact CD1-CD1 4.23Å; F241-L286 HydrophobicContact CD2-CD1 3.68Å; F241-L286 HydrophobicContact CE1-CD1 4.16Å; F241-L286 HydrophobicContact CE2-CD1 3.64Å; F241-L286 HydrophobicContact CG-CD1 3.97Å; F241-L286 HydrophobicContact CZ-CD1 3.86Å; L282-L286 WeakPolarHBondContact O-CB 3.32Å; L282-L286 WeakPolarHBondContact O-CG 3.41Å; L282-L286 PolarHBondContact O-N 3.05Å; V283-L286 PolarHBondContact O-N 3.36Å; F284-L286 PolarHBondContact O-N 2.88Å; L286-R289 PolarHBondContact O-N 2.85Å; L286-K290 WeakPolarHBondContact O-CG 3.5Å; L286-K290 PolarHBondContact O-N 3.34Å
287	L	77.4	Confident	81.3	Confident	102 Å²	102	69.2 Å²	69.2	53%	0.534	34%	0.342	S	S	.	.	H	α-helix	trans	-65.9	-44.8	178.8	-75.2	175.5	0	0	0	111.7	V283 F284 R289 K290 L291	V283-L287 HydrophobicContact CG1-CD1 3.71Å; V283-L287 HydrophobicContact CG1-CG 4.16Å; V283-L287 WeakPolarHBondContact O-CB 3.18Å; V283-L287 VanDerWaalsContact O-CG 3.26Å; V283-L287 WeakPolarHBondContact O-CG 3.27Å; V283-L287 PolarHBondContact O-N 3.47Å; F284-L287 PolarHBondContact O-N 3.36Å; L287-R289 VanDerWaalsContact C-N 3.28Å; L287-R289 PolarHBondContact O-N 3.46Å; L287-K290 PolarHBondContact O-N 3.45Å; L287-L291 WeakPolarHBondContact O-CB 3.48Å; L287-L291 PolarHBondContact O-N 3.35Å
288	F	75.9	Confident	80.6	Confident	77 Å²	77	68.6 Å²	68.6	34%	0.338	34%	0.339	S	S	.	.	H	α-helix	trans	-57.9	-43.9	176.8	-175.9	-104.3	0	0	0	110.9	F284 L291 N292	F284-F288 VanDerWaalsContact O-CB 3.26Å; F284-F288 WeakPolarHBondContact O-CB 3.35Å; F284-F288 PolarHBondContact O-N 2.85Å; F288-L291 PolarHBondContact O-N 3.31Å; F288-N292 WeakPolarHBondContact CD1-ND2 3.47Å; F288-N292 WeakPolarHBondContact CE1-ND2 3.29Å; F288-N292 WeakPolarHBondContact CZ-ND2 3.44Å; F288-N292 PolarHBondContact O-N 3.29Å
289	R	77.4	Confident	79.9	Confident	43 Å²	43	69.7 Å²	69.7	16%	0.162	34%	0.344	C	S	.	.	H	α-helix	trans	-68.7	-39.9	178.4	-159.5	160.1	178	117.6	-7.3	112.7	K191 P194 S285 L286 L287 L291 N292 L293	K191-R289 PolarHBondContact O-NE 3.46Å; K191-R289 PolarHBondContact O-NH2 3.5Å; K191-R289 VanDerWaalsContact O-NH2 3.12Å; P194-R289 HydrophobicContact CB-CG 4.3Å; P194-R289 HydrophobicContact CG-CB 4.17Å; P194-R289 HydrophobicContact CG-CG 3.85Å; S285-R289 WeakPolarHBondContact O-CB 3.41Å; S285-R289 PolarHBondContact O-N 3.43Å; S285-R289 VanDerWaalsContact O-N 3.1Å; L286-R289 PolarHBondContact O-N 2.85Å; L287-R289 VanDerWaalsContact C-N 3.28Å; L287-R289 PolarHBondContact O-N 3.46Å; R289-L291 VanDerWaalsContact C-N 3.33Å; R289-N292 PolarHBondContact O-N 2.96Å; R289-L293 WeakPolarHBondContact O-CB 3.36Å; R289-L293 WeakPolarHBondContact O-CG 3.49Å; R289-L293 PolarHBondContact O-N 3.28Å
290	K	75.8	Confident	79.4	Confident	127 Å²	127	70.1 Å²	70.1	55%	0.552	34%	0.344	S	S	*	.	H	α-helix	trans	-61.3	-41.5	172.1	-78.1	-178.3	178.7	-179.5	0	111.8	L286 L287 L293 R294	L286-K290 WeakPolarHBondContact O-CG 3.5Å; L286-K290 PolarHBondContact O-N 3.34Å; L287-K290 PolarHBondContact O-N 3.45Å; K290-L293 PolarHBondContact O-N 3.13Å; K290-R294 WeakPolarHBondContact O-CB 3.4Å; K290-R294 PolarHBondContact O-N 2.96Å
291	L	74.8	Confident	78.7	Confident	84 Å²	84	70.7 Å²	70.7	44%	0.44	34%	0.343	S	S	.	.	H	α-helix	trans	-63.8	-46	177.1	-179.6	64.9	0	0	0	111.3	L287 F288 R289 R294 K295	L287-L291 WeakPolarHBondContact O-CB 3.48Å; L287-L291 PolarHBondContact O-N 3.35Å; F288-L291 PolarHBondContact O-N 3.31Å; R289-L291 VanDerWaalsContact C-N 3.33Å; L291-R294 PolarHBondContact O-N 2.91Å; L291-K295 HydrophobicContact CG-CD 4.47Å; L291-K295 WeakPolarHBondContact O-CG 3.48Å; L291-K295 PolarHBondContact O-N 3.1Å
292	N	74.2	Confident	78.2	Confident	22 Å²	22	72.7 Å²	72.7	12%	0.118	35%	0.345	C	S	.	.	H	α-helix	trans	-64.5	-41.4	178.1	-71	-18.1	0	0	0	111.8	F288 R289 R294 K295 Q296	F288-N292 WeakPolarHBondContact CD1-ND2 3.47Å; F288-N292 WeakPolarHBondContact CE1-ND2 3.29Å; F288-N292 WeakPolarHBondContact CZ-ND2 3.44Å; F288-N292 PolarHBondContact O-N 3.29Å; R289-N292 PolarHBondContact O-N 2.96Å; N292-R294 VanDerWaalsContact C-N 3.33Å; N292-R294 PolarHBondContact O-N 3.29Å; N292-K295 PolarHBondContact O-N 3.09Å; N292-Q296 WeakPolarHBondContact O-CB 3.49Å; N292-Q296 WeakPolarHBondContact O-CG 3.44Å; N292-Q296 PolarHBondContact O-N 2.87Å
293	L	74.9	Confident	77.7	Confident	39 Å²	39	72.7 Å²	72.7	20%	0.204	35%	0.345	C	S	.	.	H	α-helix	trans	-59.7	-42.9	172.8	-77.9	171.2	0	0	0	112.1	P194 R289 K290 Q296 K297	P194-L293 HydrophobicContact CB-CD1 3.44Å; P194-L293 VanDerWaalsContact CB-CD1 3.44Å; R289-L293 WeakPolarHBondContact O-CB 3.36Å; R289-L293 WeakPolarHBondContact O-CG 3.49Å; R289-L293 PolarHBondContact O-N 3.28Å; K290-L293 PolarHBondContact O-N 3.13Å; L293-Q296 PolarHBondContact O-N 3.38Å; L293-K297 WeakPolarHBondContact O-CG 3.49Å; L293-K297 PolarHBondContact O-N 3.44Å
294	R	74.9	Confident	77.2	Confident	178 Å²	178	73.2 Å²	73.2	67%	0.672	35%	0.346	S	S	*	.	H	α-helix	trans	-63.4	-45.9	176.1	-177.9	178.4	175	162.4	1.6	111.8	K290 L291 N292 Q296 K297 E298	K290-R294 WeakPolarHBondContact O-CB 3.4Å; K290-R294 PolarHBondContact O-N 2.96Å; L291-R294 PolarHBondContact O-N 2.91Å; N292-R294 VanDerWaalsContact C-N 3.33Å; N292-R294 PolarHBondContact O-N 3.29Å; R294-Q296 VanDerWaalsContact C-N 3.32Å; R294-Q296 PolarHBondContact O-N 3.38Å; R294-K297 PolarHBondContact O-N 3.5Å; R294-E298 WeakPolarHBondContact O-CB 3.3Å; R294-E298 PolarHBondContact O-N 3.5Å
295	K	77	Confident	76.8	Confident	105 Å²	105	70.9 Å²	70.9	46%	0.457	35%	0.347	S	S	.	.	H	α-helix	trans	-58.5	-44.5	176.5	-74.2	177.3	178.1	178.9	0	111.4	L291 N292 E298 M299	L291-K295 HydrophobicContact CG-CD 4.47Å; L291-K295 WeakPolarHBondContact O-CG 3.48Å; L291-K295 PolarHBondContact O-N 3.1Å; N292-K295 PolarHBondContact O-N 3.09Å; K295-E298 PolarHBondContact O-N 2.86Å; K295-M299 VanDerWaalsContact O-CG 3.32Å; K295-M299 WeakPolarHBondContact O-CG 3.26Å; K295-M299 PolarHBondContact O-N 3.21Å
296	Q	77.1	Confident	76.3	Confident	29 Å²	29	70.9 Å²	70.9	14%	0.136	35%	0.347	C	S	.	.	H	α-helix	trans	-58.7	-47.9	174.5	-73.6	-66.2	-39.8	0	0	111.3	N292 L293 R294 M299 Q300 V325	N292-Q296 WeakPolarHBondContact O-CB 3.49Å; N292-Q296 WeakPolarHBondContact O-CG 3.44Å; N292-Q296 PolarHBondContact O-N 2.87Å; L293-Q296 PolarHBondContact O-N 3.38Å; R294-Q296 VanDerWaalsContact C-N 3.32Å; R294-Q296 PolarHBondContact O-N 3.38Å; Q296-M299 VanDerWaalsContact NE2-CE 3.32Å; Q296-M299 PolarHBondContact O-N 3.41Å; Q296-Q300 VanDerWaalsContact O-CG 3.29Å; Q296-Q300 WeakPolarHBondContact O-CG 3.29Å; Q296-Q300 PolarHBondContact O-N 3.49Å; Q296-V325 PolarHBondContact NE2-O 3.24Å; Q296-V325 VanDerWaalsContact OE1-N 3.12Å; Q296-V325 PolarHBondContact OE1-O 3.48Å; Q296-V325 VanDerWaalsContact OE1-O 3.11Å
297	K	74.6	Confident	75.7	Confident	78 Å²	78	76.7 Å²	76.7	34%	0.339	38%	0.383	S	S	.	.	H	α-helix	trans	-66.4	-37	178.3	-71.2	-61.8	-179.4	-169.7	0	113.8	S204 L293 R294 Q300 L301	S204-K297 PolarHBondContact OG-NZ 3.13Å; L293-K297 WeakPolarHBondContact O-CG 3.49Å; L293-K297 PolarHBondContact O-N 3.44Å; R294-K297 PolarHBondContact O-N 3.5Å; K297-Q300 PolarHBondContact O-N 2.93Å; K297-L301 WeakPolarHBondContact O-CB 3.48Å; K297-L301 VanDerWaalsContact O-CG 3.3Å; K297-L301 WeakPolarHBondContact O-CG 3.38Å; K297-L301 PolarHBondContact O-N 2.95Å
298	E	78.9	Confident	75.3	Confident	121 Å²	121	73.7 Å²	73.7	57%	0.565	37%	0.367	S	S	*	.	H	α-helix	trans	-65.6	-42.5	174.9	-173.5	172.2	174.5	0	0	111	R294 K295 L301 D302	R294-E298 WeakPolarHBondContact O-CB 3.3Å; R294-E298 PolarHBondContact O-N 3.5Å; K295-E298 PolarHBondContact O-N 2.86Å; E298-L301 PolarHBondContact O-N 3.26Å; E298-D302 WeakPolarHBondContact O-CB 3.33Å; E298-D302 PolarHBondContact O-N 2.89Å
299	M	80.1	Confident	74.6	Confident	33 Å²	33	74 Å²	74	16%	0.163	38%	0.375	C	S	.	.	H	α-helix	trans	-64.7	-40.6	173.7	-70.7	-173.7	-62.5	0	0	112.4	K295 Q296 D302 L303 V325 K327	K295-M299 VanDerWaalsContact O-CG 3.32Å; K295-M299 WeakPolarHBondContact O-CG 3.26Å; K295-M299 PolarHBondContact O-N 3.21Å; Q296-M299 VanDerWaalsContact NE2-CE 3.32Å; Q296-M299 PolarHBondContact O-N 3.41Å; M299-D302 PolarHBondContact O-N 3.39Å; M299-L303 WeakPolarHBondContact O-CB 3.32Å; M299-L303 WeakPolarHBondContact O-CD1 3.47Å; M299-L303 WeakPolarHBondContact O-CG 3.26Å; M299-L303 PolarHBondContact O-N 2.87Å; M299-V325 HydrophobicContact CB-CB 4.14Å; M299-V325 HydrophobicContact CB-CG1 3.88Å; M299-V325 HydrophobicContact CE-CB 4.21Å; M299-V325 HydrophobicContact CE-CG1 4.36Å; M299-V325 WeakPolarHBondContact CE-O 3.46Å; M299-V325 HydrophobicContact SD-CG1 4.14Å; M299-K327 HydrophobicContact SD-CD 4.37Å; M299-K327 HydrophobicContact SD-CG 4.26Å
300	Q	80.2	Confident	73.9	Confident	23 Å²	23	78 Å²	78	11%	0.107	40%	0.4	C	S	.	.	H	α-helix	trans	-60.7	-47.6	174.5	-72.2	176	8.7	0	0	111.1	Q296 K297 L303 L304 I322 V325	Q296-Q300 VanDerWaalsContact O-CG 3.29Å; Q296-Q300 WeakPolarHBondContact O-CG 3.29Å; Q296-Q300 PolarHBondContact O-N 3.49Å; K297-Q300 PolarHBondContact O-N 2.93Å; Q300-L303 PolarHBondContact O-N 3.47Å; Q300-L304 WeakPolarHBondContact O-CB 3.31Å; Q300-L304 WeakPolarHBondContact O-CG 3.44Å; Q300-L304 PolarHBondContact O-N 2.85Å; Q300-I322 HydrophobicContact CB-CD1 4.41Å; Q300-I322 HydrophobicContact CG-CB 4.04Å; Q300-I322 HydrophobicContact CG-CD1 4.4Å; Q300-I322 HydrophobicContact CG-CG2 3.8Å; Q300-I322 PolarHBondContact NE2-O 2.69Å; Q300-V325 HydrophobicContact CG-CG2 3.84Å
301	L	74.1	Confident	73.3	Confident	115 Å²	115	74.2 Å²	74.2	60%	0.602	38%	0.382	S	S	*	.	H	α-helix	trans	-66.5	-40.2	178.4	-72.6	170.2	0	0	0	112.5	K297 E298 L303 L304 S305	K297-L301 WeakPolarHBondContact O-CB 3.48Å; K297-L301 VanDerWaalsContact O-CG 3.3Å; K297-L301 WeakPolarHBondContact O-CG 3.38Å; K297-L301 PolarHBondContact O-N 2.95Å; E298-L301 PolarHBondContact O-N 3.26Å; L301-L303 VanDerWaalsContact C-N 3.35Å; L301-L304 PolarHBondContact O-N 3.43Å; L301-S305 VanDerWaalsContact O-CB 3.23Å; L301-S305 WeakPolarHBondContact O-CB 3.1Å; L301-S305 PolarHBondContact O-N 2.9Å; L301-S305 PolarHBondContact O-OG 2.89Å
302	D	78.5	Confident	72.6	Confident	80 Å²	80	77.5 Å²	77.5	43%	0.428	40%	0.395	S	S	.	.	H	α-helix	trans	-58.4	-48.4	174.2	-175.4	47.8	0	0	0	109.9	E298 M299 L304 S305 S306 K327	E298-D302 WeakPolarHBondContact O-CB 3.33Å; E298-D302 PolarHBondContact O-N 2.89Å; M299-D302 PolarHBondContact O-N 3.39Å; D302-L304 PolarHBondContact O-N 3.1Å; D302-S305 PolarHBondContact O-N 3.3Å; D302-S305 PolarHBondContact O-OG 2.89Å; D302-S306 WeakPolarHBondContact O-CA 3.46Å; D302-S306 WeakPolarHBondContact O-CB 3.28Å; D302-S306 PolarHBondContact O-N 3.39Å; D302-S306 PolarHBondContact O-OG 2.96Å; D302-K327 IonicContact OD2-NZ 2.67Å
303	L	78.3	Confident	72.2	Confident	12 Å²	12	79 Å²	79	6%	0.063	42%	0.416	C	S	.	.	H	α-helix	trans	-61.1	-47.5	177.3	-73.3	168.7	0	0	0	112.9	M299 Q300 L301 S305 S306 L316 I322 V325 I343 L352	M299-L303 WeakPolarHBondContact O-CB 3.32Å; M299-L303 WeakPolarHBondContact O-CD1 3.47Å; M299-L303 WeakPolarHBondContact O-CG 3.26Å; M299-L303 PolarHBondContact O-N 2.87Å; Q300-L303 PolarHBondContact O-N 3.47Å; L301-L303 VanDerWaalsContact C-N 3.35Å; L303-S305 VanDerWaalsContact C-N 3.32Å; L303-S305 PolarHBondContact O-N 3.45Å; L303-S306 PolarHBondContact O-N 3.03Å; L303-S306 PolarHBondContact O-OG 2.62Å; L303-L316 HydrophobicContact CB-CD2 3.99Å; L303-I322 HydrophobicContact CB-CD1 4.36Å; L303-I322 HydrophobicContact CD1-CD1 4.43Å; L303-V325 HydrophobicContact CD1-CB 4.38Å; L303-V325 HydrophobicContact CD1-CG1 3.64Å; L303-V325 HydrophobicContact CD1-CG2 3.76Å; L303-I343 HydrophobicContact CD1-CD1 3.57Å; L303-I343 HydrophobicContact CD1-CG1 3.71Å; L303-I343 HydrophobicContact CD2-CD1 3.79Å; L303-I343 HydrophobicContact CG-CD1 4.26Å; L303-L352 HydrophobicContact CD2-CD1 3.94Å
304	L	73.5	Confident	71.9	Confident	64 Å²	64	81.8 Å²	81.8	34%	0.335	43%	0.428	S	S	.	.	H	α-helix	trans	-70.1	-26.5	-179.7	-64.9	169.1	0	0	0	113.1	Q300 L301 D302 L316 E317 I322	Q300-L304 WeakPolarHBondContact O-CB 3.31Å; Q300-L304 WeakPolarHBondContact O-CG 3.44Å; Q300-L304 PolarHBondContact O-N 2.85Å; L301-L304 PolarHBondContact O-N 3.43Å; D302-L304 PolarHBondContact O-N 3.1Å; L304-L316 HydrophobicContact CD2-CD2 4.44Å; L304-E317 HydrophobicContact CD2-CG 4.02Å; L304-I322 HydrophobicContact CD1-CD1 4.42Å; L304-I322 HydrophobicContact CD2-CD1 4.03Å; L304-I322 HydrophobicContact CG-CD1 3.99Å
305	S	72.7	Confident	71.7	Confident	94 Å²	94	76.3 Å²	76.3	66%	0.657	42%	0.415	S	S	*	.	H	α-helix	trans	-94.1	-18.2	178	63.7	0	0	0	0	113.5	L301 D302 L303	L301-S305 VanDerWaalsContact O-CB 3.23Å; L301-S305 WeakPolarHBondContact O-CB 3.1Å; L301-S305 PolarHBondContact O-N 2.9Å; L301-S305 PolarHBondContact O-OG 2.89Å; D302-S305 PolarHBondContact O-N 3.3Å; D302-S305 PolarHBondContact O-OG 2.89Å; L303-S305 VanDerWaalsContact C-N 3.32Å; L303-S305 PolarHBondContact O-N 3.45Å
306	S	70.3	Confident	71.5	Confident	49 Å²	49	71.8 Å²	71.8	34%	0.343	40%	0.396	S	S	.	.	S	Bend	trans	-78.1	143	179.1	72.3	0	0	0	0	111.7	D302 L303 I308	D302-S306 WeakPolarHBondContact O-CA 3.46Å; D302-S306 WeakPolarHBondContact O-CB 3.28Å; D302-S306 PolarHBondContact O-N 3.39Å; D302-S306 PolarHBondContact O-OG 2.96Å; L303-S306 PolarHBondContact O-N 3.03Å; L303-S306 PolarHBondContact O-OG 2.62Å; S306-I308 PolarHBondContact O-N 2.99Å
307	T	69.7	Low	71.2	Confident	135 Å²	135	75.8 Å²	75.8	83%	0.828	42%	0.415	S	S	*	.			trans	-85.3	105.7	164.9	53.5	0	0	0	0	108.6	T309	T307-T309 PolarHBondContact O-N 3.41Å
308	I	67.8	Low	71.1	Confident	40 Å²	40	76 Å²	76	21%	0.205	42%	0.423	C	S	.	.			trans	-70.9	120.3	174.8	-58.3	171.8	0	0	0	108.5	S306 W311 L316 L352 S357	S306-I308 PolarHBondContact O-N 2.99Å; I308-W311 HydrophobicContact CB-CB 4.12Å; I308-W311 HydrophobicContact CD1-CE3 4.33Å; I308-W311 HydrophobicContact CG2-CB 4.09Å; I308-W311 HydrophobicContact CG2-CE3 4.25Å; I308-L316 HydrophobicContact CD1-CD1 4.36Å; I308-L316 HydrophobicContact CD1-CD2 4.28Å; I308-L352 HydrophobicContact CD1-CD1 3.95Å; I308-L352 HydrophobicContact CG2-CD2 4.35Å; I308-S357 WeakPolarHBondContact CG2-OG 3.3Å
309	T	62	Low	70.7	Confident	82 Å²	82	71.8 Å²	71.8	50%	0.503	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	139.5	177.2	49.9	0	0	0	0	110.8	T307 W311	T307-T309 PolarHBondContact O-N 3.41Å; T309-W311 PolarHBondContact O-N 3.14Å
310	D	61.9	Low	70.3	Confident	127 Å²	127	71.8 Å²	71.8	68%	0.679	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	30.1	179	-52	-38.7	0	0	0	113.6	E312	D310-E312 PolarHBondContact O-N 3.5Å
311	W	64.3	Low	69.7	Low	49 Å²	49	73.2 Å²	73.2	19%	0.186	42%	0.421	C	S	.	.			trans	-68.7	111.1	172.9	178.3	-103.6	0	0	0	110.9	I308 T309 G313 E314 L316 L319 V350 L352 T359	I308-W311 HydrophobicContact CB-CB 4.12Å; I308-W311 HydrophobicContact CD1-CE3 4.33Å; I308-W311 HydrophobicContact CG2-CB 4.09Å; I308-W311 HydrophobicContact CG2-CE3 4.25Å; T309-W311 PolarHBondContact O-N 3.14Å; W311-G313 PolarHBondContact NE1-O 3.05Å; W311-E314 PolarHBondContact NE1-O 3.24Å; W311-L316 HydrophobicContact CH2-CD1 3.65Å; W311-L316 HydrophobicContact CZ2-CD1 3.96Å; W311-L316 HydrophobicContact CZ3-CD1 4.25Å; W311-L319 HydrophobicContact CH2-CD1 3.83Å; W311-L319 HydrophobicContact CZ2-CD1 3.77Å; W311-V350 HydrophobicContact CH2-CG1 3.93Å; W311-V350 HydrophobicContact CH2-CG2 4.11Å; W311-V350 HydrophobicContact CZ3-CG1 3.68Å; W311-L352 HydrophobicContact CE3-CD2 4.46Å; W311-L352 HydrophobicContact CZ3-CD2 4.17Å; W311-T359 HydrophobicContact CD2-CG2 4.11Å; W311-T359 HydrophobicContact CE3-CG2 3.61Å; W311-T359 HydrophobicContact CH2-CG2 3.3Å; W311-T359 HydrophobicContact CZ2-CG2 3.79Å; W311-T359 HydrophobicContact CZ3-CG2 3.17Å
312	E	60.6	Low	69.7	Low	152 Å²	152	68.4 Å²	68.4	71%	0.71	40%	0.395	S	S	*	.			trans	-94.9	89.4	174	-65.9	-172.9	172.1	0	0	110.5	D310	D310-E312 PolarHBondContact O-N 3.5Å
313	G	65.3	Low	69.5	Low	53 Å²	53	66.5 Å²	66.5	55%	0.546	39%	0.385	S	S	.	.	S	Bend	trans	167	-179.5	176.2	0	0	0	0	0	113.4	W311	W311-G313 PolarHBondContact NE1-O 3.05Å
314	E	68.7	Low	69.6	Low	99 Å²	99	66.8 Å²	66.8	46%	0.463	39%	0.386	S	S	.	.	S	Bend	trans	-62.2	153.9	167.1	-67.2	-67	150.3	0	0	110.4	W311 T318	W311-E314 PolarHBondContact NE1-O 3.24Å; E314-T318 HydrophobicContact CB-CG2 4.36Å; E314-T318 WeakPolarHBondContact CB-OG1 3.35Å
315	P	69.9	Low	70	Confident	63 Å²	63	63.7 Å²	63.7	41%	0.409	37%	0.371	S	S	.	.			trans	-49.3	147	-179.9	-25.6	33.8	0	0	0	112.7	E317 T318	P315-E317 WeakPolarHBondContact CB-OE2 3.38Å; P315-E317 PolarHBondContact O-N 3.12Å; P315-T318 HydrophobicContact CB-CG2 4.33Å; P315-T318 HydrophobicContact CG-CG2 4.42Å; P315-T318 PolarHBondContact O-N 2.91Å; P315-T318 PolarHBondContact O-OG1 3.46Å
316	L	72	Confident	70.6	Confident	10 Å²	10	60 Å²	60	5%	0.052	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-57.2	-27.8	-174.1	-161.6	75.6	0	0	0	112.1	L303 L304 I308 W311 T318 L319 I322 I343 F345	L303-L316 HydrophobicContact CB-CD2 3.99Å; L304-L316 HydrophobicContact CD2-CD2 4.44Å; I308-L316 HydrophobicContact CD1-CD1 4.36Å; I308-L316 HydrophobicContact CD1-CD2 4.28Å; W311-L316 HydrophobicContact CH2-CD1 3.65Å; W311-L316 HydrophobicContact CZ2-CD1 3.96Å; W311-L316 HydrophobicContact CZ3-CD1 4.25Å; L316-T318 PolarHBondContact O-N 2.86Å; L316-L319 HydrophobicContact CD1-CD1 4.14Å; L316-L319 PolarHBondContact O-N 2.95Å; L316-I322 HydrophobicContact CD2-CD1 4.23Å; L316-I343 HydrophobicContact CD2-CD1 4.48Å; L316-F345 HydrophobicContact CD1-CE2 4.19Å; L316-F345 HydrophobicContact CD1-CZ 3.67Å; L316-F345 HydrophobicContact CD2-CZ 4.34Å; L316-F345 HydrophobicContact CG-CE1 4.44Å; L316-F345 HydrophobicContact CG-CZ 3.77Å
317	E	71.8	Confident	71.4	Confident	113 Å²	113	63.5 Å²	63.5	53%	0.528	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-63.9	-24.9	175.8	-52.6	86.7	171	0	0	113.5	L304 P315	L304-E317 HydrophobicContact CD2-CG 4.02Å; P315-E317 WeakPolarHBondContact CB-OE2 3.38Å; P315-E317 PolarHBondContact O-N 3.12Å
318	T	73.1	Confident	72.1	Confident	83 Å²	83	57.8 Å²	57.8	51%	0.509	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-85.5	-17.9	-178.2	69.1	0	0	0	0	113.2	E314 P315 L316 G320	E314-T318 HydrophobicContact CB-CG2 4.36Å; E314-T318 WeakPolarHBondContact CB-OG1 3.35Å; P315-T318 HydrophobicContact CB-CG2 4.33Å; P315-T318 HydrophobicContact CG-CG2 4.42Å; P315-T318 PolarHBondContact O-N 2.91Å; P315-T318 PolarHBondContact O-OG1 3.46Å; L316-T318 PolarHBondContact O-N 2.86Å; T318-G320 PolarHBondContact O-N 3.37Å; T318-G320 VanDerWaalsContact O-N 3.15Å
319	L	69.1	Low	72.9	Confident	31 Å²	31	60.1 Å²	60.1	16%	0.162	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-70.3	-1	173	-65.4	-177.8	0	0	0	112.4	W311 L316 F345 V350 I420	W311-L319 HydrophobicContact CH2-CD1 3.83Å; W311-L319 HydrophobicContact CZ2-CD1 3.77Å; L316-L319 HydrophobicContact CD1-CD1 4.14Å; L316-L319 PolarHBondContact O-N 2.95Å; L319-F345 HydrophobicContact CB-CD1 3.86Å; L319-F345 HydrophobicContact CB-CE1 3.86Å; L319-F345 HydrophobicContact CB-CG 4.21Å; L319-F345 HydrophobicContact CB-CZ 4.23Å; L319-F345 HydrophobicContact CD1-CE2 4.17Å; L319-F345 HydrophobicContact CD1-CZ 4.29Å; L319-V350 HydrophobicContact CD1-CG2 3.93Å; L319-I420 HydrophobicContact CD2-CD1 3.84Å
320	G	71.7	Confident	74	Confident	33 Å²	33	56.3 Å²	56.3	34%	0.34	31%	0.308	S	S	.	.			trans	90.7	-160.7	-177.9	0	0	0	0	0	111.8	T318 F345	T318-G320 PolarHBondContact O-N 3.37Å; T318-G320 VanDerWaalsContact O-N 3.15Å; G320-F345 WeakPolarHBondContact O-CD1 3.47Å; G320-F345 WeakPolarHBondContact O-CE1 3.41Å
321	D	68.3	Low	74.9	Confident	53 Å²	53	57 Å²	57	28%	0.283	30%	0.301	S	S	.	.			trans	-82	135.3	-171.5	-66.7	-31.1	0	0	0	112.1	N205 V207 L323	N205-D321 WeakPolarHBondContact CA-OD2 3.21Å; N205-D321 HydrophobicContact CB-CB 4.18Å; N205-D321 VanDerWaalsContact CB-OD1 3.3Å; N205-D321 WeakPolarHBondContact CB-OD1 3.41Å; N205-D321 WeakPolarHBondContact CB-OD2 3.48Å; N205-D321 VanDerWaalsContact CG-OD1 3.23Å; N205-D321 PolarHBondContact ND2-OD1 2.83Å; N205-D321 WeakPolarHBondContact O-CB 3.12Å; V207-D321 HydrophobicContact CG2-CB 3.76Å; D321-L323 PolarHBondContact O-N 3.39Å
322	I	74.4	Confident	75.6	Confident	14 Å²	14	55 Å²	55	7%	0.072	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	113.5	174.9	-58.5	171.3	0	0	0	109.4	Q300 L303 L304 L316 V325 I343 F345	Q300-I322 HydrophobicContact CB-CD1 4.41Å; Q300-I322 HydrophobicContact CG-CB 4.04Å; Q300-I322 HydrophobicContact CG-CD1 4.4Å; Q300-I322 HydrophobicContact CG-CG2 3.8Å; Q300-I322 PolarHBondContact NE2-O 2.69Å; L303-I322 HydrophobicContact CB-CD1 4.36Å; L303-I322 HydrophobicContact CD1-CD1 4.43Å; L304-I322 HydrophobicContact CD1-CD1 4.42Å; L304-I322 HydrophobicContact CD2-CD1 4.03Å; L304-I322 HydrophobicContact CG-CD1 3.99Å; L316-I322 HydrophobicContact CD2-CD1 4.23Å; I322-V325 HydrophobicContact CG2-CG2 3.33Å; I322-I343 HydrophobicContact CB-CG2 4.4Å; I322-I343 HydrophobicContact CD1-CG2 4.33Å; I322-I343 HydrophobicContact CG1-CG2 4.03Å; I322-I343 HydrophobicContact CG2-CG2 3.62Å; I322-F345 HydrophobicContact CB-CE1 4.49Å; I322-F345 HydrophobicContact CG1-CD1 4.32Å; I322-F345 HydrophobicContact CG1-CE1 3.53Å; I322-F345 HydrophobicContact CG1-CZ 3.8Å
323	L	74.7	Confident	76.2	Confident	40 Å²	40	52.6 Å²	52.6	21%	0.209	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-56.5	176.1	-77	176.1	0	0	0	111.9	V207 D321 L344	V207-L323 HydrophobicContact CB-CD2 3.44Å; V207-L323 VanDerWaalsContact CB-CD2 3.44Å; V207-L323 HydrophobicContact CB-CG 4.4Å; V207-L323 HydrophobicContact CG1-CD1 4.42Å; V207-L323 HydrophobicContact CG1-CD2 3.73Å; V207-L323 HydrophobicContact CG1-CG 4.39Å; V207-L323 HydrophobicContact CG2-CD2 3.28Å; V207-L323 HydrophobicContact CG2-CG 3.87Å; D321-L323 PolarHBondContact O-N 3.39Å; L323-L344 HydrophobicContact CB-CB 4.18Å; L323-L344 HydrophobicContact CB-CD2 4.13Å; L323-L344 HydrophobicContact CB-CG 4.06Å; L323-L344 WeakPolarHBondContact CB-O 3.42Å; L323-L344 HydrophobicContact CD1-CD2 4.19Å; L323-L344 HydrophobicContact CD1-CG 4.09Å; L323-L344 PolarHBondContact N-O 2.92Å
324	L	79.2	Confident	76.3	Confident	18 Å²	18	54.5 Å²	54.5	9%	0.094	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	144.8	-175.9	-68.4	173.3	0	0	0	110	L344 R400 W401	L324-L344 HydrophobicContact CB-CB 4.12Å; L324-L344 HydrophobicContact CB-CD2 4.42Å; L324-L344 HydrophobicContact CD1-CD2 4.09Å; L324-L344 HydrophobicContact CG-CD2 4.46Å; L324-L344 PolarHBondContact O-N 2.9Å; L324-R400 HydrophobicContact CD1-CB 4.37Å; L324-R400 HydrophobicContact CD2-CB 4.4Å; L324-W401 HydrophobicContact CB-CD2 4.31Å; L324-W401 HydrophobicContact CB-CH2 4.08Å; L324-W401 HydrophobicContact CB-CZ2 3.65Å; L324-W401 HydrophobicContact CD1-CB 4.33Å; L324-W401 HydrophobicContact CD1-CD2 3.75Å; L324-W401 HydrophobicContact CD1-CE3 4.2Å; L324-W401 HydrophobicContact CD1-CG 3.81Å
325	V	83.5	Confident	76.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	132.6	172.6	-174.3	0	0	0	0	108.9	Q296 M299 Q300 L303 I322 C341 I342 I343	Q296-V325 PolarHBondContact NE2-O 3.24Å; Q296-V325 VanDerWaalsContact OE1-N 3.12Å; Q296-V325 PolarHBondContact OE1-O 3.48Å; Q296-V325 VanDerWaalsContact OE1-O 3.11Å; M299-V325 HydrophobicContact CB-CB 4.14Å; M299-V325 HydrophobicContact CB-CG1 3.88Å; M299-V325 HydrophobicContact CE-CB 4.21Å; M299-V325 HydrophobicContact CE-CG1 4.36Å; M299-V325 WeakPolarHBondContact CE-O 3.46Å; M299-V325 HydrophobicContact SD-CG1 4.14Å; Q300-V325 HydrophobicContact CG-CG2 3.84Å; L303-V325 HydrophobicContact CD1-CB 4.38Å; L303-V325 HydrophobicContact CD1-CG1 3.64Å; L303-V325 HydrophobicContact CD1-CG2 3.76Å; I322-V325 HydrophobicContact CG2-CG2 3.33Å; V325-C341 VanDerWaalsContact CG1-SG 3.57Å; V325-I342 WeakPolarHBondContact CA-O 3.31Å; V325-I343 HydrophobicContact CG2-CG2 4.4Å
326	T	85.1	Confident	76.3	Confident	16 Å²	16	51 Å²	51	10%	0.098	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	141	169.8	-169.6	0	0	0	0	110.6	C341 I342 F390 W401	T326-C341 CarbonylContact O-C 3.49Å; T326-C341 WeakPolarHBondContact O-CA 3.22Å; T326-I342 HydrophobicContact CG2-CB 3.95Å; T326-I342 HydrophobicContact CG2-CD1 4.38Å; T326-I342 HydrophobicContact CG2-CG1 4.49Å; T326-I342 PolarHBondContact N-O 3.35Å; T326-I342 PolarHBondContact O-N 3.39Å; T326-F390 HydrophobicContact CG2-CD2 4.07Å; T326-F390 HydrophobicContact CG2-CE2 4Å; T326-W401 HydrophobicContact CG2-CH2 4.38Å; T326-W401 HydrophobicContact CG2-CZ2 3.56Å
327	K	85.5	Confident	76.8	Confident	123 Å²	123	56 Å²	56	54%	0.535	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	111.8	170.4	-67	-177.7	-177.1	-178.2	0	107	M299 D302 C340 C341	M299-K327 HydrophobicContact SD-CD 4.37Å; M299-K327 HydrophobicContact SD-CG 4.26Å; D302-K327 IonicContact OD2-NZ 2.67Å; K327-C340 CarbonylContact C-O 3.11Å; K327-C340 WeakPolarHBondContact CA-O 3.36Å; K327-C341 HydrophobicContact CG-CB 4.18Å
328	S	85.3	Confident	77.3	Confident	14 Å²	14	51.4 Å²	51.4	10%	0.098	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	167.1	-178.7	68	0	0	0	0	112.3	A330 C340 S391	S328-A330 PolarHBondContact O-N 2.91Å; S328-C340 PolarHBondContact N-O 3.5Å; S328-C340 PolarHBondContact O-N 3.15Å; S328-C340 VanDerWaalsContact O-O 3.14Å; S328-C340 PolarHBondContact O-SG 2.66Å; S328-C340 VanDerWaalsContact O-SG 3.39Å; S328-S391 WeakPolarHBondContact CB-O 3.39Å; S328-S391 PolarHBondContact OG-O 3.4Å
329	N	85	Confident	77.9	Confident	89 Å²	89	53 Å²	53	48%	0.476	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	120.2	168.2	-81.2	-69.5	0	0	0	108.8	G338 D339 S391	N329-G338 WeakPolarHBondContact CA-O 3.32Å; N329-G338 VanDerWaalsContact OD1-C 3.26Å; N329-D339 PolarHBondContact ND2-OD1 3.22Å; N329-D339 PolarHBondContact OD1-N 3.29Å; N329-D339 PolarHBondContact OD1-OD1 2.95Å; N329-S391 PolarHBondContact O-N 3.14Å; N329-S391 VanDerWaalsContact O-N 3.17Å; N329-S391 PolarHBondContact O-OG 3.26Å
330	A	83.8	Confident	78.5	Confident	3 Å²	3	51.9 Å²	51.9	3%	0.025	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	152.3	173.6	0	0	0	0	0	111.2	S328 D337 G338 C340 I342 L388 T389 F390	S328-A330 PolarHBondContact O-N 2.91Å; A330-D337 WeakPolarHBondContact O-CA 3.5Å; A330-G338 PolarHBondContact N-O 3.31Å; A330-G338 PolarHBondContact O-N 3.12Å; A330-C340 WeakPolarHBondContact CB-SG 3.41Å; A330-I342 HydrophobicContact CB-CD1 3.92Å; A330-L388 HydrophobicContact CB-CD1 4.12Å; A330-T389 CarbonylContact C-O 3.59Å; A330-T389 VanDerWaalsContact CA-O 3.24Å; A330-T389 WeakPolarHBondContact CA-O 3.44Å; A330-F390 HydrophobicContact CB-CB 3.54Å
331	R	82	Confident	79	Confident	140 Å²	140	51 Å²	51	53%	0.528	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	113.7	174.9	-173.6	174.1	-179.9	-143.1	-3.5	107.7	C336 D337 T389	R331-C336 CarbonylContact C-O 3.46Å; R331-C336 WeakPolarHBondContact CA-O 3.43Å; R331-D337 HydrophobicContact CG-CB 4.27Å; R331-D337 IonicContact NE-OD2 2.66Å; R331-T389 PolarHBondContact N-O 3.37Å; R331-T389 PolarHBondContact O-N 3.39Å
332	L	78	Confident	79.7	Confident	9 Å²	9	48.4 Å²	48.4	5%	0.047	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	113.6	170.3	-175.3	66.5	0	0	0	107	G334 V335 C336 L358 V386 L388	L332-G334 PolarHBondContact O-N 3.45Å; L332-V335 HydrophobicContact CD2-CB 3.9Å; L332-V335 HydrophobicContact CD2-CG2 4.01Å; L332-V335 HydrophobicContact CG-CB 4.18Å; L332-V335 HydrophobicContact CG-CG2 4.12Å; L332-V335 PolarHBondContact O-N 3.4Å; L332-C336 VanDerWaalsContact CB-SG 3.56Å; L332-C336 PolarHBondContact N-O 3.02Å; L332-C336 PolarHBondContact O-N 2.68Å; L332-L358 HydrophobicContact CD2-CD1 3.75Å; L332-V386 HydrophobicContact CD1-CB 4.1Å; L332-V386 HydrophobicContact CD1-CG1 3.49Å; L332-V386 VanDerWaalsContact CD1-CG1 3.49Å; L332-V386 HydrophobicContact CG-CG1 3.84Å; L332-L388 HydrophobicContact CB-CD1 4.05Å; L332-L388 HydrophobicContact CD1-CB 3.79Å; L332-L388 HydrophobicContact CD1-CD1 4.04Å; L332-L388 HydrophobicContact CD1-CG 4.44Å
333	E	73.6	Confident	80.1	Confident	101 Å²	101	47.8 Å²	47.8	47%	0.472	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	124.3	-173	-73.3	-171.6	151	0	0	112.5	V335 V386 L387	E333-V335 VanDerWaalsContact C-N 3.26Å; E333-V335 PolarHBondContact O-N 2.99Å; E333-V386 HydrophobicContact CB-CG1 3.87Å; E333-V386 WeakPolarHBondContact O-CG1 3.21Å; E333-L387 HydrophobicContact CG-CB 4.25Å; E333-L387 PolarHBondContact N-O 3.21Å
334	G	67.9	Low	80.5	Confident	92 Å²	92	45.9 Å²	45.9	95%	0.948	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	-7.1	178.3	0	0	0	0	0	115.9	L332	L332-G334 PolarHBondContact O-N 3.45Å
335	V	67.7	Low	80.4	Confident	74 Å²	74	45 Å²	45	45%	0.448	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	-51.5	-171.1	-154.7	0	0	0	0	114.1	L332 E333 L358	L332-V335 HydrophobicContact CD2-CB 3.9Å; L332-V335 HydrophobicContact CD2-CG2 4.01Å; L332-V335 HydrophobicContact CG-CB 4.18Å; L332-V335 HydrophobicContact CG-CG2 4.12Å; L332-V335 PolarHBondContact O-N 3.4Å; E333-V335 VanDerWaalsContact C-N 3.26Å; E333-V335 PolarHBondContact O-N 2.99Å; V335-L358 HydrophobicContact CB-CD1 3.95Å; V335-L358 HydrophobicContact CG1-CD1 3.28Å; V335-L358 HydrophobicContact CG1-CD2 3.5Å; V335-L358 VanDerWaalsContact CG1-CD2 3.5Å; V335-L358 HydrophobicContact CG1-CG 4.01Å
336	C	71.3	Confident	79.9	Confident	14 Å²	14	46.9 Å²	46.9	10%	0.095	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	146.4	179.2	67.7	0	0	0	0	112.6	R331 L332 H353 L358	R331-C336 CarbonylContact C-O 3.46Å; R331-C336 WeakPolarHBondContact CA-O 3.43Å; L332-C336 VanDerWaalsContact CB-SG 3.56Å; L332-C336 PolarHBondContact N-O 3.02Å; L332-C336 PolarHBondContact O-N 2.68Å; C336-H353 HydrophobicContact CB-CB 3.98Å; C336-L358 HydrophobicContact CB-CD1 4.44Å
337	D	81.2	Confident	79.1	Confident	117 Å²	117	53.6 Å²	53.6	63%	0.626	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.8	111.9	173.2	-169.1	9.8	0	0	0	108.2	A330 R331	A330-D337 WeakPolarHBondContact O-CA 3.5Å; R331-D337 HydrophobicContact CG-CB 4.27Å; R331-D337 IonicContact NE-OD2 2.66Å
338	G	83.5	Confident	78.5	Confident	15 Å²	15	48.5 Å²	48.5	16%	0.155	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.8	-165.5	-178	0	0	0	0	0	114.3	N329 A330 C340	N329-G338 WeakPolarHBondContact CA-O 3.32Å; N329-G338 VanDerWaalsContact OD1-C 3.26Å; A330-G338 PolarHBondContact N-O 3.31Å; A330-G338 PolarHBondContact O-N 3.12Å; G338-C340 PolarHBondContact O-N 2.96Å
339	D	84.4	Confident	78.1	Confident	116 Å²	116	47.9 Å²	47.9	62%	0.62	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.9	120.6	179.7	-72.4	-37.4	0	0	0	110.7	N329 H353	N329-D339 PolarHBondContact ND2-OD1 3.22Å; N329-D339 PolarHBondContact OD1-N 3.29Å; N329-D339 PolarHBondContact OD1-OD1 2.95Å; D339-H353 PolarHBondContact O-CD2 3.4Å
340	C	81.8	Confident	77.7	Confident	8 Å²	8	43.6 Å²	43.6	5%	0.054	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	163.5	179.1	74.8	0	0	0	0	111.4	K327 S328 A330 G338 V351 L352 H353	K327-C340 CarbonylContact C-O 3.11Å; K327-C340 WeakPolarHBondContact CA-O 3.36Å; S328-C340 PolarHBondContact N-O 3.5Å; S328-C340 PolarHBondContact O-N 3.15Å; S328-C340 VanDerWaalsContact O-O 3.14Å; S328-C340 PolarHBondContact O-SG 2.66Å; S328-C340 VanDerWaalsContact O-SG 3.39Å; A330-C340 WeakPolarHBondContact CB-SG 3.41Å; G338-C340 PolarHBondContact O-N 2.96Å; C340-V351 HydrophobicContact CB-CG1 4.17Å; C340-L352 CarbonylContact C-O 3.53Å; C340-L352 WeakPolarHBondContact CA-O 3.49Å; C340-L352 WeakPolarHBondContact CB-O 3.48Å; C340-H353 HydrophobicContact CB-CB 4Å
341	C	82.5	Confident	77.4	Confident	14 Å²	14	43.5 Å²	43.5	10%	0.095	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.2	165.9	-165.1	0	0	0	0	108.5	V325 T326 K327 L352	V325-C341 VanDerWaalsContact CG1-SG 3.57Å; T326-C341 CarbonylContact O-C 3.49Å; T326-C341 WeakPolarHBondContact O-CA 3.22Å; K327-C341 HydrophobicContact CG-CB 4.18Å; C341-L352 HydrophobicContact CB-CB 4.18Å; C341-L352 PolarHBondContact N-O 2.66Å; C341-L352 PolarHBondContact O-N 3.4Å
342	I	83.8	Confident	77.2	Confident	0 Å²	0	38 Å²	38	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	130	175.8	-53.9	171.7	0	0	0	107.8	V325 T326 A330 I349 V351 L388 F390 W401	V325-I342 WeakPolarHBondContact CA-O 3.31Å; T326-I342 HydrophobicContact CG2-CB 3.95Å; T326-I342 HydrophobicContact CG2-CD1 4.38Å; T326-I342 HydrophobicContact CG2-CG1 4.49Å; T326-I342 PolarHBondContact N-O 3.35Å; T326-I342 PolarHBondContact O-N 3.39Å; A330-I342 HydrophobicContact CB-CD1 3.92Å; I342-I349 HydrophobicContact CG2-CG2 3.91Å; I342-V351 HydrophobicContact CG1-CG1 4.46Å; I342-V351 HydrophobicContact CG1-CG2 4.47Å; I342-L388 HydrophobicContact CD1-CD2 4.38Å; I342-L388 HydrophobicContact CG2-CD2 4.49Å; I342-F390 HydrophobicContact CD1-CB 3.37Å; I342-F390 HydrophobicContact CD1-CD1 3.54Å; I342-F390 HydrophobicContact CD1-CD2 3.64Å; I342-F390 HydrophobicContact CD1-CE1 4.15Å; I342-F390 HydrophobicContact CD1-CE2 4.24Å; I342-F390 HydrophobicContact CD1-CG 3.24Å; I342-F390 HydrophobicContact CD1-CZ 4.46Å; I342-W401 HydrophobicContact CB-CH2 4.37Å; I342-W401 HydrophobicContact CG2-CH2 3.79Å; I342-W401 HydrophobicContact CG2-CZ3 4.28Å
343	I	83.2	Confident	76.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	121.2	-175.6	-48.9	166.6	0	0	0	107.3	L303 L316 I322 V325 F345 I349 V350 L352	L303-I343 HydrophobicContact CD1-CD1 3.57Å; L303-I343 HydrophobicContact CD1-CG1 3.71Å; L303-I343 HydrophobicContact CD2-CD1 3.79Å; L303-I343 HydrophobicContact CG-CD1 4.26Å; L316-I343 HydrophobicContact CD2-CD1 4.48Å; I322-I343 HydrophobicContact CB-CG2 4.4Å; I322-I343 HydrophobicContact CD1-CG2 4.33Å; I322-I343 HydrophobicContact CG1-CG2 4.03Å; I322-I343 HydrophobicContact CG2-CG2 3.62Å; V325-I343 HydrophobicContact CG2-CG2 4.4Å; I343-F345 HydrophobicContact CB-CE2 3.95Å; I343-F345 HydrophobicContact CG2-CD2 4.07Å; I343-F345 HydrophobicContact CG2-CE2 3.34Å; I343-F345 HydrophobicContact CG2-CZ 3.6Å; I343-I349 WeakPolarHBondContact O-CA 3.25Å; I343-V350 HydrophobicContact CB-CB 4.31Å; I343-V350 HydrophobicContact CD1-CG1 4.45Å; I343-V350 PolarHBondContact N-O 3.48Å; I343-V350 PolarHBondContact O-N 2.99Å; I343-L352 HydrophobicContact CD1-CD1 3.64Å; I343-L352 HydrophobicContact CD1-CG 4.14Å
344	L	81.9	Confident	76.5	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	126	175.3	-173	64.2	0	0	0	109.2	L323 L324 I349 W401 L405 L408	L323-L344 HydrophobicContact CB-CB 4.18Å; L323-L344 HydrophobicContact CB-CD2 4.13Å; L323-L344 HydrophobicContact CB-CG 4.06Å; L323-L344 WeakPolarHBondContact CB-O 3.42Å; L323-L344 HydrophobicContact CD1-CD2 4.19Å; L323-L344 HydrophobicContact CD1-CG 4.09Å; L323-L344 PolarHBondContact N-O 2.92Å; L324-L344 HydrophobicContact CB-CB 4.12Å; L324-L344 HydrophobicContact CB-CD2 4.42Å; L324-L344 HydrophobicContact CD1-CD2 4.09Å; L324-L344 HydrophobicContact CG-CD2 4.46Å; L324-L344 PolarHBondContact O-N 2.9Å; L344-I349 HydrophobicContact CD1-CD1 3.65Å; L344-I349 HydrophobicContact CD1-CG1 3.35Å; L344-W401 HydrophobicContact CB-CH2 3.77Å; L344-W401 HydrophobicContact CB-CZ3 3.71Å; L344-W401 HydrophobicContact CD1-CZ3 4.35Å; L344-W401 HydrophobicContact CD2-CE3 4.22Å; L344-W401 HydrophobicContact CD2-CZ3 4.05Å; L344-W401 HydrophobicContact CG-CZ3 4.27Å; L344-L405 HydrophobicContact CD1-CD2 4.11Å; L344-L408 HydrophobicContact CD1-CD1 3.57Å; L344-L408 HydrophobicContact CD2-CD1 4.41Å; L344-L408 HydrophobicContact CG-CD1 4.26Å
345	F	77.7	Confident	75.8	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	169.4	167	-63.2	-92.6	0	0	0	109.3	L316 L319 G320 I322 I343 E347 C348 V350	L316-F345 HydrophobicContact CD1-CE2 4.19Å; L316-F345 HydrophobicContact CD1-CZ 3.67Å; L316-F345 HydrophobicContact CD2-CZ 4.34Å; L316-F345 HydrophobicContact CG-CE1 4.44Å; L316-F345 HydrophobicContact CG-CZ 3.77Å; L319-F345 HydrophobicContact CB-CD1 3.86Å; L319-F345 HydrophobicContact CB-CE1 3.86Å; L319-F345 HydrophobicContact CB-CG 4.21Å; L319-F345 HydrophobicContact CB-CZ 4.23Å; L319-F345 HydrophobicContact CD1-CE2 4.17Å; L319-F345 HydrophobicContact CD1-CZ 4.29Å; G320-F345 WeakPolarHBondContact O-CD1 3.47Å; G320-F345 WeakPolarHBondContact O-CE1 3.41Å; I322-F345 HydrophobicContact CB-CE1 4.49Å; I322-F345 HydrophobicContact CG1-CD1 4.32Å; I322-F345 HydrophobicContact CG1-CE1 3.53Å; I322-F345 HydrophobicContact CG1-CZ 3.8Å; I343-F345 HydrophobicContact CB-CE2 3.95Å; I343-F345 HydrophobicContact CG2-CD2 4.07Å; I343-F345 HydrophobicContact CG2-CE2 3.34Å; I343-F345 HydrophobicContact CG2-CZ 3.6Å; F345-E347 PolarHBondContact O-N 3.45Å; F345-C348 WeakPolarHBondContact CA-O 3.48Å; F345-C348 WeakPolarHBondContact CB-O 3.38Å; F345-C348 PolarHBondContact N-O 3.25Å; F345-V350 HydrophobicContact CD2-CG2 4.02Å; F345-V350 HydrophobicContact CE2-CB 4.14Å; F345-V350 HydrophobicContact CE2-CG2 3.68Å
346	A	72.2	Confident	75	Confident	39 Å²	39	45.4 Å²	45.4	32%	0.322	25%	0.25	S	C	.	.	S	Bend	trans	-62.8	-27.6	177.4	0	0	0	0	0	113.4	V207 L408	V207-A346 HydrophobicContact CG1-CB 3.9Å; A346-L408 WeakPolarHBondContact O-CD2 3.16Å
347	E	68.8	Low	74.1	Confident	157 Å²	157	45.7 Å²	45.7	73%	0.734	25%	0.251	S	S	*	.	S	Bend	trans	-119	-7.8	-174.4	-63	-178.9	-176.8	0	0	113.3	F345	F345-E347 PolarHBondContact O-N 3.45Å
348	C	72.8	Confident	72.6	Confident	17 Å²	17	42 Å²	42	12%	0.115	23%	0.232	C	C	.	.			trans	-159.7	165.9	-177.3	64.9	0	0	0	0	113.5	F345	F345-C348 WeakPolarHBondContact CA-O 3.48Å; F345-C348 WeakPolarHBondContact CB-O 3.38Å; F345-C348 PolarHBondContact N-O 3.25Å
349	I	76.8	Confident	71	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	142.6	165.2	-69.7	-172.9	0	0	0	109.9	I342 I343 L344 V351 T361 V363 I376 L388 L405	I342-I349 HydrophobicContact CG2-CG2 3.91Å; I343-I349 WeakPolarHBondContact O-CA 3.25Å; L344-I349 HydrophobicContact CD1-CD1 3.65Å; L344-I349 HydrophobicContact CD1-CG1 3.35Å; I349-V351 HydrophobicContact CG2-CG2 4.11Å; I349-T361 PolarHBondContact N-O 2.83Å; I349-T361 PolarHBondContact O-N 3.35Å; I349-T361 PolarHBondContact O-OG1 2.9Å; I349-V363 HydrophobicContact CB-CG2 4.49Å; I349-V363 HydrophobicContact CD1-CG2 3.15Å; I349-V363 HydrophobicContact CG1-CG2 3.57Å; I349-I376 HydrophobicContact CD1-CD1 3.5Å; I349-L388 HydrophobicContact CG2-CD2 4.41Å; I349-L405 HydrophobicContact CD1-CD2 3.87Å
350	V	77.4	Confident	69.4	Low	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	130.6	172.2	177.2	0	0	0	0	109.1	W311 L319 I343 F345 L352	W311-V350 HydrophobicContact CH2-CG1 3.93Å; W311-V350 HydrophobicContact CH2-CG2 4.11Å; W311-V350 HydrophobicContact CZ3-CG1 3.68Å; L319-V350 HydrophobicContact CD1-CG2 3.93Å; I343-V350 HydrophobicContact CB-CB 4.31Å; I343-V350 HydrophobicContact CD1-CG1 4.45Å; I343-V350 PolarHBondContact N-O 3.48Å; I343-V350 PolarHBondContact O-N 2.99Å; F345-V350 HydrophobicContact CD2-CG2 4.02Å; F345-V350 HydrophobicContact CE2-CB 4.14Å; F345-V350 HydrophobicContact CE2-CG2 3.68Å; V350-L352 HydrophobicContact CG1-CD2 3.74Å; V350-L352 HydrophobicContact CG1-CG 4.14Å
351	V	77.6	Confident	68	Low	1 Å²	1	37.8 Å²	37.8	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	116	176.4	-176.5	0	0	0	0	108.9	C340 I342 I349 L358 L388	C340-V351 HydrophobicContact CB-CG1 4.17Å; I342-V351 HydrophobicContact CG1-CG1 4.46Å; I342-V351 HydrophobicContact CG1-CG2 4.47Å; I349-V351 HydrophobicContact CG2-CG2 4.11Å; V351-L358 PolarHBondContact N-O 3.32Å; V351-L358 VanDerWaalsContact N-O 3.09Å; V351-L358 PolarHBondContact O-N 2.83Å; V351-L388 HydrophobicContact CG2-CD1 4.25Å; V351-L388 HydrophobicContact CG2-CD2 3.76Å
352	L	76.4	Confident	66.6	Low	23 Å²	23	40.5 Å²	40.5	12%	0.12	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	113.6	178.6	-55.3	-179.3	0	0	0	109.4	L303 I308 W311 C340 C341 I343 V350 S357	L303-L352 HydrophobicContact CD2-CD1 3.94Å; I308-L352 HydrophobicContact CD1-CD1 3.95Å; I308-L352 HydrophobicContact CG2-CD2 4.35Å; W311-L352 HydrophobicContact CE3-CD2 4.46Å; W311-L352 HydrophobicContact CZ3-CD2 4.17Å; C340-L352 CarbonylContact C-O 3.53Å; C340-L352 WeakPolarHBondContact CA-O 3.49Å; C340-L352 WeakPolarHBondContact CB-O 3.48Å; C341-L352 HydrophobicContact CB-CB 4.18Å; C341-L352 PolarHBondContact N-O 2.66Å; C341-L352 PolarHBondContact O-N 3.4Å; I343-L352 HydrophobicContact CD1-CD1 3.64Å; I343-L352 HydrophobicContact CD1-CG 4.14Å; V350-L352 HydrophobicContact CG1-CD2 3.74Å; V350-L352 HydrophobicContact CG1-CG 4.14Å; L352-S357 WeakPolarHBondContact CD2-OG 3.29Å
353	H	73.3	Confident	65.2	Low	49 Å²	49	41.3 Å²	41.3	23%	0.227	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	110.5	179.7	178.6	-83.9	0	0	0	110.8	C336 D339 C340 R355 I356	C336-H353 HydrophobicContact CB-CB 3.98Å; D339-H353 PolarHBondContact O-CD2 3.4Å; C340-H353 HydrophobicContact CB-CB 4Å; H353-R355 PolarHBondContact O-N 3.48Å; H353-R355 VanDerWaalsContact O-N 3.11Å; H353-I356 PolarHBondContact N-O 2.92Å; H353-I356 PolarHBondContact O-N 3.48Å
354	G	64.5	Low	63.8	Low	74 Å²	74	47.2 Å²	47.2	76%	0.763	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	-115.3	-178.2	0	0	0	0	0	112.2
355	R	52.9	Low	62.4	Low	205 Å²	205	54.8 Å²	54.8	77%	0.774	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-1.7	178.2	-64.3	-175	-177.7	173.5	0.9	113.8	H353	H353-R355 PolarHBondContact O-N 3.48Å; H353-R355 VanDerWaalsContact O-N 3.11Å
356	I	51.6	Low	61.6	Low	105 Å²	105	56.6 Å²	56.6	54%	0.538	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.3	-174.8	-55	171.6	0	0	0	108.1	H353 L358	H353-I356 PolarHBondContact N-O 2.92Å; H353-I356 PolarHBondContact O-N 3.48Å; I356-L358 HydrophobicContact CG2-CD2 4.21Å; I356-L358 HydrophobicContact CG2-CG 4.22Å
357	S	51.1	Low	60.9	Low	19 Å²	19	56.9 Å²	56.9	13%	0.133	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	115.8	171.2	-61.9	0	0	0	0	109.1	I308 L352	I308-S357 WeakPolarHBondContact CG2-OG 3.3Å; L352-S357 WeakPolarHBondContact CD2-OG 3.29Å
358	L	50.6	Low	60.4	Low	40 Å²	40	55.1 Å²	55.1	21%	0.209	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	94.1	171.8	-62.8	163.5	0	0	0	107.6	L332 V335 C336 V351 I356	L332-L358 HydrophobicContact CD2-CD1 3.75Å; V335-L358 HydrophobicContact CB-CD1 3.95Å; V335-L358 HydrophobicContact CG1-CD1 3.28Å; V335-L358 HydrophobicContact CG1-CD2 3.5Å; V335-L358 VanDerWaalsContact CG1-CD2 3.5Å; V335-L358 HydrophobicContact CG1-CG 4.01Å; C336-L358 HydrophobicContact CB-CD1 4.44Å; V351-L358 PolarHBondContact N-O 3.32Å; V351-L358 VanDerWaalsContact N-O 3.09Å; V351-L358 PolarHBondContact O-N 2.83Å; I356-L358 HydrophobicContact CG2-CD2 4.21Å; I356-L358 HydrophobicContact CG2-CG 4.22Å
359	T	49.6	Very low	59.8	Low	17 Å²	17	57.8 Å²	57.8	10%	0.104	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	142.5	177.2	45.8	0	0	0	0	111.9	W311 K381	W311-T359 HydrophobicContact CD2-CG2 4.11Å; W311-T359 HydrophobicContact CE3-CG2 3.61Å; W311-T359 HydrophobicContact CH2-CG2 3.3Å; W311-T359 HydrophobicContact CZ2-CG2 3.79Å; W311-T359 HydrophobicContact CZ3-CG2 3.17Å; T359-K381 WeakPolarHBondContact O-CD 3.24Å; T359-K381 WeakPolarHBondContact O-CE 3.46Å; T359-K381 VanDerWaalsContact O-CG 3.29Å; T359-K381 WeakPolarHBondContact O-CG 3.36Å; T359-K381 WeakPolarHBondContact OG1-CE 3.27Å; T359-K381 PolarHBondContact OG1-NZ 2.92Å
360	G	51.2	Low	59.1	Low	25 Å²	25	60.6 Å²	60.6	26%	0.258	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	89	43.1	148.8	0	0	0	0	0	115.5
361	T	51.5	Low	58.6	Low	9 Å²	9	72.8 Å²	72.8	6%	0.055	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	127.8	175.3	62.7	0	0	0	0	111.3	I349 V378 I379	I349-T361 PolarHBondContact N-O 2.83Å; I349-T361 PolarHBondContact O-N 3.35Å; I349-T361 PolarHBondContact O-OG1 2.9Å; T361-V378 VanDerWaalsContact C-CG1 3.46Å; T361-V378 WeakPolarHBondContact OG1-CG1 3.34Å; T361-I379 CarbonylContact C-O 3.3Å; T361-I379 WeakPolarHBondContact CA-O 3.48Å; T361-I379 WeakPolarHBondContact CB-O 3.46Å
362	V	53.2	Low	58.2	Low	70 Å²	70	74.4 Å²	74.4	42%	0.424	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	124.6	179.5	-179.7	0	0	0	0	109.3	R364 V378 I379	V362-R364 PolarHBondContact O-N 3.41Å; V362-V378 VanDerWaalsContact C-CG1 3.43Å; V362-V378 CarbonylContact O-C 3.56Å; V362-V378 WeakPolarHBondContact O-CA 3.41Å; V362-V378 VanDerWaalsContact O-CG1 3.25Å; V362-V378 WeakPolarHBondContact O-CG1 3.2Å; V362-I379 PolarHBondContact N-O 2.65Å; V362-I379 VanDerWaalsContact N-O 3.08Å; V362-I379 PolarHBondContact O-N 3.33Å
363	V	55.1	Low	58.3	Low	17 Å²	17	78.7 Å²	78.7	10%	0.103	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	122.6	179.1	-176.5	0	0	0	0	109.4	I349 I376 V378 L405 T409	I349-V363 HydrophobicContact CB-CG2 4.49Å; I349-V363 HydrophobicContact CD1-CG2 3.15Å; I349-V363 HydrophobicContact CG1-CG2 3.57Å; V363-I376 HydrophobicContact CG2-CD1 4.37Å; V363-V378 HydrophobicContact CG2-CG1 4.28Å; V363-L405 HydrophobicContact CG1-CD2 4.09Å; V363-L405 HydrophobicContact CG2-CD2 3.98Å; V363-T409 HydrophobicContact CG1-CG2 4.28Å
364	R	53.3	Low	58.5	Low	124 Å²	124	76.3 Å²	76.3	47%	0.468	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-46.3	177.5	-172.7	178.2	63.5	-178.3	5.1	112.2	V362 E377 I379 C385	V362-R364 PolarHBondContact O-N 3.41Å; R364-E377 IonicContact CZ-OE2 3.65Å; R364-E377 PolarHBondContact N-O 3.1Å; R364-E377 IonicContact NE-OE2 3.49Å; R364-E377 PolarHBondContact NE-OE2 3.44Å; R364-E377 IonicContact NH2-OE1 3.1Å; R364-E377 IonicContact NH2-OE2 2.72Å; R364-E377 PolarHBondContact NH2-OE2 3.42Å; R364-I379 HydrophobicContact CB-CD1 4.48Å; R364-I379 HydrophobicContact CB-CG1 4.43Å; R364-C385 PolarHBondContact NH2-SG 2.95Å
365	R	53.4	Low	59.3	Low	160 Å²	160	73.4 Å²	73.4	60%	0.604	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157.6	139.4	-170.1	-169.2	178.6	179	-175.3	1.1	112.1	E377	R365-E377 HydrophobicContact CB-CB 4.44Å; R365-E377 PolarHBondContact N-O 2.93Å; R365-E377 PolarHBondContact O-N 2.98Å
366	I	59.5	Low	60.5	Low	38 Å²	38	63.6 Å²	63.6	20%	0.195	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	120.4	169.2	-55.8	170.5	0	0	0	108.6	I376 L405 E406	I366-I376 HydrophobicContact CB-CG2 4.41Å; I366-I376 HydrophobicContact CG1-CG2 4.1Å; I366-I376 HydrophobicContact CG2-CG2 4.34Å; I366-L405 HydrophobicContact CD1-CB 3.63Å; I366-L405 HydrophobicContact CG1-CB 4.03Å; I366-E406 HydrophobicContact CD1-CG 3.63Å
367	V	59.4	Low	61.6	Low	44 Å²	44	60.9 Å²	60.9	27%	0.267	30%	0.302	S	S	.	.			trans	-112.1	96.2	179.7	178.1	0	0	0	0	108.4	S375 E377 L387	V367-S375 CarbonylContact C-O 3.6Å; V367-S375 VanDerWaalsContact C-O 3.3Å; V367-S375 WeakPolarHBondContact CA-O 3.41Å; V367-S375 PolarHBondContact N-O 2.88Å; V367-S375 CarbonylContact O-C 3.43Å; V367-S375 WeakPolarHBondContact O-CB 3.42Å; V367-S375 PolarHBondContact O-OG 3.39Å; V367-E377 HydrophobicContact CG2-CB 4.38Å; V367-E377 HydrophobicContact CG2-CG 3.58Å; V367-L387 HydrophobicContact CB-CD1 4.06Å; V367-L387 HydrophobicContact CG1-CD1 4.38Å; V367-L387 HydrophobicContact CG2-CD1 4.47Å
368	D	58.3	Low	62.7	Low	120 Å²	120	60 Å²	60	64%	0.642	30%	0.296	S	S	*	.			trans	64.2	145.1	167.5	-157.6	7.8	0	0	0	115.9	P370 S375	D368-P370 VanDerWaalsContact C-CD 3.45Å; D368-P370 WeakPolarHBondContact O-CD 3.26Å; D368-S375 PolarHBondContact O-N 3.36Å
369	I	59.3	Low	63.6	Low	73 Å²	73	60.3 Å²	60.3	37%	0.374	30%	0.297	S	S	.	.			trans	-125.4	74.5	179.6	-48.4	174.9	0	0	0	107.7	R371 L374 L398	I369-R371 PolarHBondContact O-N 3.34Å; I369-L374 HydrophobicContact CD1-CD2 4.35Å; I369-L374 HydrophobicContact CG1-CD2 4.1Å; I369-L374 HydrophobicContact CG2-CD2 4.24Å; I369-L398 HydrophobicContact CG2-CD1 4.23Å; I369-L398 HydrophobicContact CG2-CD2 3.98Å; I369-L398 HydrophobicContact CG2-CG 4.46Å
370	P	62.2	Low	64.3	Low	59 Å²	59	60.9 Å²	60.9	38%	0.383	30%	0.302	S	S	.	.			trans	-58.3	138.7	164.9	20	-24.5	0	0	0	108.8	D368 G372 K373	D368-P370 VanDerWaalsContact C-CD 3.45Å; D368-P370 WeakPolarHBondContact O-CD 3.26Å; P370-G372 PolarHBondContact O-N 3.12Å; P370-K373 HydrophobicContact CG-CB 4.25Å; P370-K373 PolarHBondContact O-N 3.46Å; P370-K373 VanDerWaalsContact O-O 3.1Å
371	R	66.6	Low	64.9	Low	257 Å²	257	64.8 Å²	64.8	97%	0.97	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44	107.7	-172.1	-72	-178.5	173	152.9	-1.6	112.5	I369	I369-R371 PolarHBondContact O-N 3.34Å
372	G	68.9	Low	65.5	Low	34 Å²	34	67.7 Å²	67.7	35%	0.351	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	3.3	176.1	0	0	0	0	0	116.6	P370 V392	P370-G372 PolarHBondContact O-N 3.12Å; G372-V392 PolarHBondContact O-N 3.42Å; G372-V392 VanDerWaalsContact O-N 3.11Å
373	K	78.5	Confident	65.9	Low	113 Å²	113	70 Å²	70	49%	0.491	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143.5	175.6	-63.2	-176.4	-179.7	-174.8	0	110.7	P370 F390	P370-K373 HydrophobicContact CG-CB 4.25Å; P370-K373 PolarHBondContact O-N 3.46Å; P370-K373 VanDerWaalsContact O-O 3.1Å; K373-F390 CarbonylContact C-O 3.6Å; K373-F390 WeakPolarHBondContact CA-O 3.46Å
374	L	78.4	Confident	66.6	Low	0 Å²	0	73.9 Å²	73.9	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	132.8	170	-71.2	170.4	0	0	0	108.6	I369 T389 F390 V392 L398 W401 L405	I369-L374 HydrophobicContact CD1-CD2 4.35Å; I369-L374 HydrophobicContact CG1-CD2 4.1Å; I369-L374 HydrophobicContact CG2-CD2 4.24Å; L374-T389 CarbonylContact O-C 3.55Å; L374-T389 VanDerWaalsContact O-CA 3.28Å; L374-T389 WeakPolarHBondContact O-CA 3.28Å; L374-F390 HydrophobicContact CB-CD1 4.4Å; L374-F390 HydrophobicContact CB-CE1 3.99Å; L374-F390 HydrophobicContact CB-CE2 4.36Å; L374-F390 HydrophobicContact CB-CZ 3.98Å; L374-F390 HydrophobicContact CD1-CE2 3.94Å; L374-F390 HydrophobicContact CD1-CZ 3.73Å; L374-F390 HydrophobicContact CG-CZ 4.49Å; L374-F390 PolarHBondContact N-O 3.09Å; L374-F390 PolarHBondContact O-N 3.43Å; L374-V392 HydrophobicContact CD1-CG2 3.74Å; L374-V392 HydrophobicContact CG-CG2 4.17Å; L374-L398 HydrophobicContact CD1-CD1 3.85Å; L374-L398 HydrophobicContact CD2-CD1 3.54Å; L374-L398 HydrophobicContact CD2-CG 4.43Å; L374-L398 HydrophobicContact CG-CD1 3.39Å; L374-W401 HydrophobicContact CD1-CB 3.41Å; L374-W401 VanDerWaalsContact CD1-CB 3.41Å; L374-W401 HydrophobicContact CD1-CG 4.06Å; L374-L405 HydrophobicContact CD1-CD1 4.41Å
375	S	80.4	Confident	67.3	Low	12 Å²	12	70.8 Å²	70.8	8%	0.084	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	127.7	166.8	-12.6	0	0	0	0	108.8	V367 D368 L388	V367-S375 CarbonylContact C-O 3.6Å; V367-S375 VanDerWaalsContact C-O 3.3Å; V367-S375 WeakPolarHBondContact CA-O 3.41Å; V367-S375 PolarHBondContact N-O 2.88Å; V367-S375 CarbonylContact O-C 3.43Å; V367-S375 WeakPolarHBondContact O-CB 3.42Å; V367-S375 PolarHBondContact O-OG 3.39Å; D368-S375 PolarHBondContact O-N 3.36Å; S375-L388 CarbonylContact C-O 3.59Å; S375-L388 WeakPolarHBondContact CA-O 3.34Å
376	I	77.9	Confident	68.4	Low	0 Å²	0	64 Å²	64	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	136.4	-179.5	57.1	176.6	0	0	0	109.5	I349 V363 I366 V378 L388 F390 L405	I349-I376 HydrophobicContact CD1-CD1 3.5Å; V363-I376 HydrophobicContact CG2-CD1 4.37Å; I366-I376 HydrophobicContact CB-CG2 4.41Å; I366-I376 HydrophobicContact CG1-CG2 4.1Å; I366-I376 HydrophobicContact CG2-CG2 4.34Å; I376-V378 HydrophobicContact CD1-CG2 4.1Å; I376-V378 HydrophobicContact CG1-CG2 3.78Å; I376-L388 HydrophobicContact CD1-CD2 4.18Å; I376-L388 HydrophobicContact CG1-CB 3.98Å; I376-L388 HydrophobicContact CG1-CD2 4.29Å; I376-L388 HydrophobicContact CG1-CG 4.38Å; I376-L388 PolarHBondContact N-O 3.19Å; I376-L388 PolarHBondContact O-N 3.02Å; I376-F390 HydrophobicContact CD1-CE1 4.12Å; I376-F390 HydrophobicContact CG1-CE1 4.38Å; I376-L405 HydrophobicContact CD1-CD1 4.39Å; I376-L405 HydrophobicContact CD1-CD2 3.93Å; I376-L405 HydrophobicContact CG2-CD1 3.86Å
377	E	74.6	Confident	69.4	Low	47 Å²	47	64.1 Å²	64.1	22%	0.22	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	122.5	170.6	-79.4	175.4	-178.6	0	0	108.9	R364 R365 V367 L387	R364-E377 IonicContact CZ-OE2 3.65Å; R364-E377 PolarHBondContact N-O 3.1Å; R364-E377 IonicContact NE-OE2 3.49Å; R364-E377 PolarHBondContact NE-OE2 3.44Å; R364-E377 IonicContact NH2-OE1 3.1Å; R364-E377 IonicContact NH2-OE2 2.72Å; R364-E377 PolarHBondContact NH2-OE2 3.42Å; R365-E377 HydrophobicContact CB-CB 4.44Å; R365-E377 PolarHBondContact N-O 2.93Å; R365-E377 PolarHBondContact O-N 2.98Å; V367-E377 HydrophobicContact CG2-CB 4.38Å; V367-E377 HydrophobicContact CG2-CG 3.58Å; E377-L387 HydrophobicContact CG-CD1 4.07Å
378	V	75.2	Confident	70.3	Confident	1 Å²	1	62 Å²	62	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	134.7	-176.9	-143.7	0	0	0	0	109.3	T361 V362 V363 I376 V386 L388	T361-V378 VanDerWaalsContact C-CG1 3.46Å; T361-V378 WeakPolarHBondContact OG1-CG1 3.34Å; V362-V378 VanDerWaalsContact C-CG1 3.43Å; V362-V378 CarbonylContact O-C 3.56Å; V362-V378 WeakPolarHBondContact O-CA 3.41Å; V362-V378 VanDerWaalsContact O-CG1 3.25Å; V362-V378 WeakPolarHBondContact O-CG1 3.2Å; V363-V378 HydrophobicContact CG2-CG1 4.28Å; I376-V378 HydrophobicContact CD1-CG2 4.1Å; I376-V378 HydrophobicContact CG1-CG2 3.78Å; V378-V386 PolarHBondContact N-O 2.83Å; V378-V386 PolarHBondContact O-N 2.72Å; V378-V386 VanDerWaalsContact O-O 3.14Å; V378-L388 HydrophobicContact CG2-CB 3.72Å; V378-L388 HydrophobicContact CG2-CD2 4.36Å
379	I	68.4	Low	71.5	Confident	47 Å²	47	58 Å²	58	24%	0.241	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	118.4	176.9	-58.6	173	0	0	0	107.5	T361 V362 R364	T361-I379 CarbonylContact C-O 3.3Å; T361-I379 WeakPolarHBondContact CA-O 3.48Å; T361-I379 WeakPolarHBondContact CB-O 3.46Å; V362-I379 PolarHBondContact N-O 2.65Å; V362-I379 VanDerWaalsContact N-O 3.08Å; V362-I379 PolarHBondContact O-N 3.33Å; R364-I379 HydrophobicContact CB-CD1 4.48Å; R364-I379 HydrophobicContact CB-CG1 4.43Å
380	S	66	Low	72.7	Confident	29 Å²	29	54.6 Å²	54.6	20%	0.203	29%	0.286	C	S	.	.			trans	-66.7	163	174.7	-178	0	0	0	0	111.4	S382 D383 D384	S380-S382 PolarHBondContact O-N 3.3Å; S380-S382 PolarHBondContact OG-OG 3.39Å; S380-D383 PolarHBondContact O-N 3.2Å; S380-D384 WeakPolarHBondContact CB-O 3.38Å; S380-D384 PolarHBondContact N-O 3.41Å
381	K	62	Low	73.8	Confident	107 Å²	107	53.6 Å²	53.6	47%	0.465	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-21.3	168.4	-80.4	-176.7	163.7	-173.8	0	113.9	T359 D383	T359-K381 WeakPolarHBondContact O-CD 3.24Å; T359-K381 WeakPolarHBondContact O-CE 3.46Å; T359-K381 VanDerWaalsContact O-CG 3.29Å; T359-K381 WeakPolarHBondContact O-CG 3.36Å; T359-K381 WeakPolarHBondContact OG1-CE 3.27Å; T359-K381 PolarHBondContact OG1-NZ 2.92Å; K381-D383 VanDerWaalsContact C-N 3.28Å
382	S	64.5	Low	74.3	Confident	70 Å²	70	41.9 Å²	41.9	49%	0.49	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	8.6	176.9	55.8	0	0	0	0	114.3	S380 D384	S380-S382 PolarHBondContact O-N 3.3Å; S380-S382 PolarHBondContact OG-OG 3.39Å; S382-D384 WeakPolarHBondContact CB-OD2 3.4Å; S382-D384 PolarHBondContact O-N 3Å; S382-D384 VanDerWaalsContact O-N 3.16Å; S382-D384 PolarHBondContact OG-OD2 2.93Å
383	D	63.2	Low	74.5	Confident	117 Å²	117	44.2 Å²	44.2	63%	0.626	26%	0.261	S	S	*	.	S	Bend	trans	60.5	9.6	-168.6	-73.8	-28	0	0	0	114.5	S380 K381	S380-D383 PolarHBondContact O-N 3.2Å; K381-D383 VanDerWaalsContact C-N 3.28Å
384	D	68.5	Low	74.3	Confident	99 Å²	99	40.7 Å²	40.7	53%	0.529	25%	0.248	S	C	.	.			trans	-79	131.5	172.9	-64.9	-50.8	0	0	0	110.3	S380 S382 V386	S380-D384 WeakPolarHBondContact CB-O 3.38Å; S380-D384 PolarHBondContact N-O 3.41Å; S382-D384 WeakPolarHBondContact CB-OD2 3.4Å; S382-D384 PolarHBondContact O-N 3Å; S382-D384 VanDerWaalsContact O-N 3.16Å; S382-D384 PolarHBondContact OG-OD2 2.93Å; D384-V386 HydrophobicContact CB-CG2 4.42Å; D384-V386 PolarHBondContact O-N 3.47Å
385	C	69.3	Low	74	Confident	59 Å²	59	47 Å²	47	40%	0.399	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	123.4	169.5	-177.7	0	0	0	0	110.4	R364	R364-C385 PolarHBondContact NH2-SG 2.95Å
386	V	76.2	Confident	73.5	Confident	18 Å²	18	49.9 Å²	49.9	11%	0.109	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138.6	-177.7	-171.2	0	0	0	0	110	L332 E333 V378 D384	L332-V386 HydrophobicContact CD1-CB 4.1Å; L332-V386 HydrophobicContact CD1-CG1 3.49Å; L332-V386 VanDerWaalsContact CD1-CG1 3.49Å; L332-V386 HydrophobicContact CG-CG1 3.84Å; E333-V386 HydrophobicContact CB-CG1 3.87Å; E333-V386 WeakPolarHBondContact O-CG1 3.21Å; V378-V386 PolarHBondContact N-O 2.83Å; V378-V386 PolarHBondContact O-N 2.72Å; V378-V386 VanDerWaalsContact O-O 3.14Å; D384-V386 HydrophobicContact CB-CG2 4.42Å; D384-V386 PolarHBondContact O-N 3.47Å
387	L	78.9	Confident	73.4	Confident	40 Å²	40	51.1 Å²	51.1	21%	0.209	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	118.2	172.6	-170.9	69.8	0	0	0	110.1	E333 V367 E377	E333-L387 HydrophobicContact CG-CB 4.25Å; E333-L387 PolarHBondContact N-O 3.21Å; V367-L387 HydrophobicContact CB-CD1 4.06Å; V367-L387 HydrophobicContact CG1-CD1 4.38Å; V367-L387 HydrophobicContact CG2-CD1 4.47Å; E377-L387 HydrophobicContact CG-CD1 4.07Å
388	L	79.8	Confident	73.5	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	113.8	169.1	176.6	61.9	0	0	0	108.8	A330 L332 I342 I349 V351 S375 I376 V378 F390	A330-L388 HydrophobicContact CB-CD1 4.12Å; L332-L388 HydrophobicContact CB-CD1 4.05Å; L332-L388 HydrophobicContact CD1-CB 3.79Å; L332-L388 HydrophobicContact CD1-CD1 4.04Å; L332-L388 HydrophobicContact CD1-CG 4.44Å; I342-L388 HydrophobicContact CD1-CD2 4.38Å; I342-L388 HydrophobicContact CG2-CD2 4.49Å; I349-L388 HydrophobicContact CG2-CD2 4.41Å; V351-L388 HydrophobicContact CG2-CD1 4.25Å; V351-L388 HydrophobicContact CG2-CD2 3.76Å; S375-L388 CarbonylContact C-O 3.59Å; S375-L388 WeakPolarHBondContact CA-O 3.34Å; I376-L388 HydrophobicContact CD1-CD2 4.18Å; I376-L388 HydrophobicContact CG1-CB 3.98Å; I376-L388 HydrophobicContact CG1-CD2 4.29Å; I376-L388 HydrophobicContact CG1-CG 4.38Å; I376-L388 PolarHBondContact N-O 3.19Å; I376-L388 PolarHBondContact O-N 3.02Å; V378-L388 HydrophobicContact CG2-CB 3.72Å; V378-L388 HydrophobicContact CG2-CD2 4.36Å; L388-F390 HydrophobicContact CD2-CD1 4.31Å; L388-F390 HydrophobicContact CD2-CE1 4.47Å; L388-F390 HydrophobicContact CG-CD1 4.08Å
389	T	83.4	Confident	73.4	Confident	35 Å²	35	53 Å²	53	22%	0.215	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	124.5	174.1	-51.5	0	0	0	0	109.9	A330 R331 L374	A330-T389 CarbonylContact C-O 3.59Å; A330-T389 VanDerWaalsContact CA-O 3.24Å; A330-T389 WeakPolarHBondContact CA-O 3.44Å; R331-T389 PolarHBondContact N-O 3.37Å; R331-T389 PolarHBondContact O-N 3.39Å; L374-T389 CarbonylContact O-C 3.55Å; L374-T389 VanDerWaalsContact O-CA 3.28Å; L374-T389 WeakPolarHBondContact O-CA 3.28Å
390	F	84.8	Confident	73.7	Confident	1 Å²	1	53.6 Å²	53.6	0%	0.004	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	152.9	178	63.9	-83.2	0	0	0	112.8	T326 A330 I342 K373 L374 I376 L388 V392 W401	T326-F390 HydrophobicContact CG2-CD2 4.07Å; T326-F390 HydrophobicContact CG2-CE2 4Å; A330-F390 HydrophobicContact CB-CB 3.54Å; I342-F390 HydrophobicContact CD1-CB 3.37Å; I342-F390 HydrophobicContact CD1-CD1 3.54Å; I342-F390 HydrophobicContact CD1-CD2 3.64Å; I342-F390 HydrophobicContact CD1-CE1 4.15Å; I342-F390 HydrophobicContact CD1-CE2 4.24Å; I342-F390 HydrophobicContact CD1-CG 3.24Å; I342-F390 HydrophobicContact CD1-CZ 4.46Å; K373-F390 CarbonylContact C-O 3.6Å; K373-F390 WeakPolarHBondContact CA-O 3.46Å; L374-F390 HydrophobicContact CB-CD1 4.4Å; L374-F390 HydrophobicContact CB-CE1 3.99Å; L374-F390 HydrophobicContact CB-CE2 4.36Å; L374-F390 HydrophobicContact CB-CZ 3.98Å; L374-F390 HydrophobicContact CD1-CE2 3.94Å; L374-F390 HydrophobicContact CD1-CZ 3.73Å; L374-F390 HydrophobicContact CG-CZ 4.49Å; L374-F390 PolarHBondContact N-O 3.09Å; L374-F390 PolarHBondContact O-N 3.43Å; I376-F390 HydrophobicContact CD1-CE1 4.12Å; I376-F390 HydrophobicContact CG1-CE1 4.38Å; L388-F390 HydrophobicContact CD2-CD1 4.31Å; L388-F390 HydrophobicContact CD2-CE1 4.47Å; L388-F390 HydrophobicContact CG-CD1 4.08Å; F390-V392 HydrophobicContact CD2-CG2 3.85Å; F390-V392 HydrophobicContact CE2-CG2 3.61Å; F390-W401 HydrophobicContact CE2-CD2 4.12Å; F390-W401 HydrophobicContact CE2-CE3 4.33Å; F390-W401 HydrophobicContact CE2-CG 4.49Å; F390-W401 HydrophobicContact CZ-CD2 4.03Å; F390-W401 AromaticContact CZ-CE3 3.8Å; F390-W401 HydrophobicContact CZ-CE3 3.8Å; F390-W401 HydrophobicContact CZ-CZ3 4.08Å
391	S	84.1	Confident	74.3	Confident	39 Å²	39	52.3 Å²	52.3	27%	0.273	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	141.8	176.2	51.3	0	0	0	0	111.2	S328 N329	S328-S391 WeakPolarHBondContact CB-O 3.39Å; S328-S391 PolarHBondContact OG-O 3.4Å; N329-S391 PolarHBondContact O-N 3.14Å; N329-S391 VanDerWaalsContact O-N 3.17Å; N329-S391 PolarHBondContact O-OG 3.26Å
392	V	78.5	Confident	74.8	Confident	10 Å²	10	47.8 Å²	47.8	6%	0.061	28%	0.283	C	S	.	.			trans	-119.7	124.7	174	-173.5	0	0	0	0	108.6	G372 L374 F390 N394 D397 L398	G372-V392 PolarHBondContact O-N 3.42Å; G372-V392 VanDerWaalsContact O-N 3.11Å; L374-V392 HydrophobicContact CD1-CG2 3.74Å; L374-V392 HydrophobicContact CG-CG2 4.17Å; F390-V392 HydrophobicContact CD2-CG2 3.85Å; F390-V392 HydrophobicContact CE2-CG2 3.61Å; V392-N394 VanDerWaalsContact C-N 3.29Å; V392-N394 PolarHBondContact O-N 2.9Å; V392-D397 HydrophobicContact CG1-CB 3.55Å; V392-L398 HydrophobicContact CB-CB 4.41Å; V392-L398 HydrophobicContact CB-CD1 4.1Å; V392-L398 HydrophobicContact CG1-CB 4.27Å; V392-L398 HydrophobicContact CG2-CD1 4.11Å
393	G	72.1	Confident	75.2	Confident	83 Å²	83	50.8 Å²	50.8	86%	0.856	29%	0.289	S	S	*	.	S	Bend	trans	-70.7	-17.3	-165.8	0	0	0	0	0	115.5
394	N	74.1	Confident	75.7	Confident	39 Å²	39	46.6 Å²	46.6	21%	0.209	27%	0.27	C	S	.	.	S	Bend	trans	-145	159.9	177.8	68.6	46	0	0	0	111.2	V392 D396 D397 L398	V392-N394 VanDerWaalsContact C-N 3.29Å; V392-N394 PolarHBondContact O-N 2.9Å; N394-D396 PolarHBondContact OD1-N 3.38Å; N394-D397 VanDerWaalsContact ND2-CG 3.31Å; N394-D397 PolarHBondContact ND2-OD2 2.95Å; N394-D397 WeakPolarHBondContact OD1-CA 3.39Å; N394-D397 WeakPolarHBondContact OD1-CB 3.24Å; N394-D397 PolarHBondContact OD1-N 2.83Å; N394-D397 PolarHBondContact OD1-OD2 2.96Å; N394-L398 PolarHBondContact O-N 3.42Å; N394-L398 VanDerWaalsContact O-N 3.12Å
395	M	72.7	Confident	76	Confident	133 Å²	133	41.9 Å²	41.9	66%	0.655	24%	0.244	S	C	*	.	H	α-helix	trans	-70.6	-29.5	-178.5	-74.4	-138.3	72.1	0	0	113.4	L398 N399	M395-L398 HydrophobicContact CE-CD2 3.97Å; M395-L398 WeakPolarHBondContact O-CB 3.28Å; M395-L398 PolarHBondContact O-N 3.18Å; M395-N399 PolarHBondContact O-N 3.31Å; M395-N399 PolarHBondContact O-ND2 2.87Å
396	D	70.4	Confident	76.1	Confident	73 Å²	73	44.4 Å²	44.4	39%	0.39	25%	0.25	S	S	.	.	H	α-helix	trans	-66.6	-44.9	178.5	-72.3	-51.1	0	0	0	111.7	N394 L398 N399 R400	N394-D396 PolarHBondContact OD1-N 3.38Å; D396-L398 VanDerWaalsContact C-N 3.32Å; D396-N399 PolarHBondContact O-N 2.94Å; D396-R400 WeakPolarHBondContact O-CG 3.38Å; D396-R400 PolarHBondContact O-N 3.43Å
397	D	73.9	Confident	75.6	Confident	25 Å²	25	45.4 Å²	45.4	13%	0.134	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-38.7	175.9	-67	-18.7	0	0	0	109.4	V392 N394 N399 R400 W401	V392-D397 HydrophobicContact CG1-CB 3.55Å; N394-D397 VanDerWaalsContact ND2-CG 3.31Å; N394-D397 PolarHBondContact ND2-OD2 2.95Å; N394-D397 WeakPolarHBondContact OD1-CA 3.39Å; N394-D397 WeakPolarHBondContact OD1-CB 3.24Å; N394-D397 PolarHBondContact OD1-N 2.83Å; N394-D397 PolarHBondContact OD1-OD2 2.96Å; D397-N399 VanDerWaalsContact C-N 3.32Å; D397-N399 PolarHBondContact O-N 3.29Å; D397-R400 PolarHBondContact O-N 3.43Å; D397-W401 WeakPolarHBondContact O-CB 3.38Å; D397-W401 PolarHBondContact O-N 2.99Å
398	L	76.7	Confident	74.9	Confident	11 Å²	11	45.7 Å²	45.7	6%	0.058	26%	0.262	C	S	.	.	H	α-helix	trans	-56.3	-48.8	173.4	-174.4	74.6	0	0	0	110.6	I369 L374 V392 N394 M395 D396 W401 S402	I369-L398 HydrophobicContact CG2-CD1 4.23Å; I369-L398 HydrophobicContact CG2-CD2 3.98Å; I369-L398 HydrophobicContact CG2-CG 4.46Å; L374-L398 HydrophobicContact CD1-CD1 3.85Å; L374-L398 HydrophobicContact CD2-CD1 3.54Å; L374-L398 HydrophobicContact CD2-CG 4.43Å; L374-L398 HydrophobicContact CG-CD1 3.39Å; V392-L398 HydrophobicContact CB-CB 4.41Å; V392-L398 HydrophobicContact CB-CD1 4.1Å; V392-L398 HydrophobicContact CG1-CB 4.27Å; V392-L398 HydrophobicContact CG2-CD1 4.11Å; N394-L398 PolarHBondContact O-N 3.42Å; N394-L398 VanDerWaalsContact O-N 3.12Å; M395-L398 HydrophobicContact CE-CD2 3.97Å; M395-L398 WeakPolarHBondContact O-CB 3.28Å; M395-L398 PolarHBondContact O-N 3.18Å; D396-L398 VanDerWaalsContact C-N 3.32Å; L398-W401 PolarHBondContact O-N 3.41Å; L398-S402 PolarHBondContact O-N 3.31Å; L398-S402 PolarHBondContact O-OG 2.95Å; L398-S402 VanDerWaalsContact O-OG 3.08Å
399	N	73.6	Confident	74.1	Confident	76 Å²	76	48.3 Å²	48.3	41%	0.406	28%	0.278	S	S	.	.	H	α-helix	trans	-63.3	-42	177.5	-66	-25.9	0	0	0	111.9	M395 D396 D397 W401 S402 E403	M395-N399 PolarHBondContact O-N 3.31Å; M395-N399 PolarHBondContact O-ND2 2.87Å; D396-N399 PolarHBondContact O-N 2.94Å; D397-N399 VanDerWaalsContact C-N 3.32Å; D397-N399 PolarHBondContact O-N 3.29Å; N399-W401 VanDerWaalsContact C-N 3.34Å; N399-W401 PolarHBondContact O-N 3.36Å; N399-S402 PolarHBondContact O-N 3.16Å; N399-E403 WeakPolarHBondContact O-CB 3.47Å; N399-E403 WeakPolarHBondContact O-CG 3.32Å; N399-E403 PolarHBondContact O-N 2.67Å
400	R	74.5	Confident	72.6	Confident	60 Å²	60	51.4 Å²	51.4	23%	0.226	30%	0.301	C	S	.	.	H	α-helix	trans	-61.3	-42.8	176	-71.7	175.2	-168.5	-85.1	3.2	112.3	L324 D396 D397 S404	L324-R400 HydrophobicContact CD1-CB 4.37Å; L324-R400 HydrophobicContact CD2-CB 4.4Å; D396-R400 WeakPolarHBondContact O-CG 3.38Å; D396-R400 PolarHBondContact O-N 3.43Å; D397-R400 PolarHBondContact O-N 3.43Å; R400-S404 VanDerWaalsContact O-CB 3.3Å; R400-S404 WeakPolarHBondContact O-CB 3.28Å; R400-S404 PolarHBondContact O-N 2.88Å; R400-S404 PolarHBondContact O-OG 3.49Å
401	W	79.7	Confident	70.5	Confident	3 Å²	3	59 Å²	59	1%	0.011	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-48	175.3	-86.5	98.8	0	0	0	110.2	L324 T326 I342 L344 L374 F390 D397 L398 N399 S404 L405	L324-W401 HydrophobicContact CB-CD2 4.31Å; L324-W401 HydrophobicContact CB-CH2 4.08Å; L324-W401 HydrophobicContact CB-CZ2 3.65Å; L324-W401 HydrophobicContact CD1-CB 4.33Å; L324-W401 HydrophobicContact CD1-CD2 3.75Å; L324-W401 HydrophobicContact CD1-CE3 4.2Å; L324-W401 HydrophobicContact CD1-CG 3.81Å; T326-W401 HydrophobicContact CG2-CH2 4.38Å; T326-W401 HydrophobicContact CG2-CZ2 3.56Å; I342-W401 HydrophobicContact CB-CH2 4.37Å; I342-W401 HydrophobicContact CG2-CH2 3.79Å; I342-W401 HydrophobicContact CG2-CZ3 4.28Å; L344-W401 HydrophobicContact CB-CH2 3.77Å; L344-W401 HydrophobicContact CB-CZ3 3.71Å; L344-W401 HydrophobicContact CD1-CZ3 4.35Å; L344-W401 HydrophobicContact CD2-CE3 4.22Å; L344-W401 HydrophobicContact CD2-CZ3 4.05Å; L344-W401 HydrophobicContact CG-CZ3 4.27Å; L374-W401 HydrophobicContact CD1-CB 3.41Å; L374-W401 VanDerWaalsContact CD1-CB 3.41Å; L374-W401 HydrophobicContact CD1-CG 4.06Å; F390-W401 HydrophobicContact CE2-CD2 4.12Å; F390-W401 HydrophobicContact CE2-CE3 4.33Å; F390-W401 HydrophobicContact CE2-CG 4.49Å; F390-W401 HydrophobicContact CZ-CD2 4.03Å; F390-W401 AromaticContact CZ-CE3 3.8Å; F390-W401 HydrophobicContact CZ-CE3 3.8Å; F390-W401 HydrophobicContact CZ-CZ3 4.08Å; D397-W401 WeakPolarHBondContact O-CB 3.38Å; D397-W401 PolarHBondContact O-N 2.99Å; L398-W401 PolarHBondContact O-N 3.41Å; N399-W401 VanDerWaalsContact C-N 3.34Å; N399-W401 PolarHBondContact O-N 3.36Å; W401-S404 PolarHBondContact O-N 3.04Å; W401-L405 HydrophobicContact CB-CD1 4.4Å; W401-L405 HydrophobicContact CE3-CD1 4.07Å; W401-L405 HydrophobicContact CE3-CG 4.29Å; W401-L405 VanDerWaalsContact O-CB 3.24Å; W401-L405 WeakPolarHBondContact O-CB 3.3Å; W401-L405 WeakPolarHBondContact O-CD1 3.39Å; W401-L405 WeakPolarHBondContact O-CG 3.38Å; W401-L405 PolarHBondContact O-N 3.2Å
402	S	72.4	Confident	68.2	Low	12 Å²	12	64.5 Å²	64.5	8%	0.084	36%	0.363	C	S	.	.	H	α-helix	trans	-57.2	-51.5	176.2	-61.5	0	0	0	0	112.1	L398 N399 S404 L405 E406	L398-S402 PolarHBondContact O-N 3.31Å; L398-S402 PolarHBondContact O-OG 2.95Å; L398-S402 VanDerWaalsContact O-OG 3.08Å; N399-S402 PolarHBondContact O-N 3.16Å; S402-S404 VanDerWaalsContact C-N 3.34Å; S402-S404 PolarHBondContact O-N 3.09Å; S402-L405 PolarHBondContact O-N 3.48Å; S402-E406 VanDerWaalsContact O-CB 3.29Å; S402-E406 WeakPolarHBondContact O-CB 3.34Å; S402-E406 VanDerWaalsContact O-CG 3.24Å; S402-E406 WeakPolarHBondContact O-CG 3.34Å; S402-E406 PolarHBondContact O-N 3.19Å
403	E	72.3	Confident	66.2	Low	132 Å²	132	68.6 Å²	68.6	62%	0.617	40%	0.398	S	S	*	.	H	α-helix	trans	-58.6	-43.6	178.2	-73.6	172	-172.2	0	0	112	N399 A407	N399-E403 WeakPolarHBondContact O-CB 3.47Å; N399-E403 WeakPolarHBondContact O-CG 3.32Å; N399-E403 PolarHBondContact O-N 2.67Å; E403-A407 WeakPolarHBondContact O-CB 3.42Å; E403-A407 PolarHBondContact O-N 3.31Å; E403-A407 VanDerWaalsContact O-N 3.09Å
404	S	73.4	Confident	64.4	Low	30 Å²	30	73.6 Å²	73.6	21%	0.21	40%	0.399	C	S	.	.	H	α-helix	trans	-70.7	-38.2	-179.5	-54.5	0	0	0	0	112.1	R400 W401 S402 L408	R400-S404 VanDerWaalsContact O-CB 3.3Å; R400-S404 WeakPolarHBondContact O-CB 3.28Å; R400-S404 PolarHBondContact O-N 2.88Å; R400-S404 PolarHBondContact O-OG 3.49Å; W401-S404 PolarHBondContact O-N 3.04Å; S402-S404 VanDerWaalsContact C-N 3.34Å; S402-S404 PolarHBondContact O-N 3.09Å; S404-L408 WeakPolarHBondContact O-CG 3.31Å; S404-L408 PolarHBondContact O-N 3.36Å
405	L	75.3	Confident	62.5	Low	0 Å²	0	79.3 Å²	79.3	0%	0	43%	0.429	C	S	.	.	H	α-helix	trans	-71.8	-39.3	177.1	-70	164.4	0	0	0	111.4	L344 I349 V363 I366 L374 I376 W401 S402 A407 L408 T409	L344-L405 HydrophobicContact CD1-CD2 4.11Å; I349-L405 HydrophobicContact CD1-CD2 3.87Å; V363-L405 HydrophobicContact CG1-CD2 4.09Å; V363-L405 HydrophobicContact CG2-CD2 3.98Å; I366-L405 HydrophobicContact CD1-CB 3.63Å; I366-L405 HydrophobicContact CG1-CB 4.03Å; L374-L405 HydrophobicContact CD1-CD1 4.41Å; I376-L405 HydrophobicContact CD1-CD1 4.39Å; I376-L405 HydrophobicContact CD1-CD2 3.93Å; I376-L405 HydrophobicContact CG2-CD1 3.86Å; W401-L405 HydrophobicContact CB-CD1 4.4Å; W401-L405 HydrophobicContact CE3-CD1 4.07Å; W401-L405 HydrophobicContact CE3-CG 4.29Å; W401-L405 VanDerWaalsContact O-CB 3.24Å; W401-L405 WeakPolarHBondContact O-CB 3.3Å; W401-L405 WeakPolarHBondContact O-CD1 3.39Å; W401-L405 WeakPolarHBondContact O-CG 3.38Å; W401-L405 PolarHBondContact O-N 3.2Å; S402-L405 PolarHBondContact O-N 3.48Å; L405-A407 VanDerWaalsContact C-N 3.31Å; L405-A407 PolarHBondContact O-N 2.9Å; L405-L408 PolarHBondContact O-N 3.26Å; L405-T409 WeakPolarHBondContact O-CG2 3.37Å; L405-T409 PolarHBondContact O-N 2.9Å; L405-T409 VanDerWaalsContact O-N 3.1Å
406	E	70.7	Confident	60.3	Low	112 Å²	112	77.6 Å²	77.6	52%	0.523	43%	0.43	S	S	.	.	H	α-helix	trans	-61.1	-41.9	175.4	-78.6	176.7	-172.5	0	0	110.9	I366 S402 L408 T409 S410	I366-E406 HydrophobicContact CD1-CG 3.63Å; S402-E406 VanDerWaalsContact O-CB 3.29Å; S402-E406 WeakPolarHBondContact O-CB 3.34Å; S402-E406 VanDerWaalsContact O-CG 3.24Å; S402-E406 WeakPolarHBondContact O-CG 3.34Å; S402-E406 PolarHBondContact O-N 3.19Å; E406-L408 VanDerWaalsContact C-N 3.28Å; E406-L408 PolarHBondContact O-N 3.09Å; E406-T409 WeakPolarHBondContact CA-OG1 3.48Å; E406-T409 PolarHBondContact O-N 3.45Å; E406-T409 VanDerWaalsContact O-N 3.16Å; E406-T409 PolarHBondContact O-OG1 3.03Å; E406-S410 PolarHBondContact O-N 3.47Å
407	A	66.2	Low	58.3	Low	38 Å²	38	79.6 Å²	79.6	31%	0.314	45%	0.449	S	S	.	.	H	α-helix	trans	-58.5	-39.3	175.3	0	0	0	0	0	112.6	F208 E403 L405 S410	F208-A407 HydrophobicContact CZ-CB 4.1Å; E403-A407 WeakPolarHBondContact O-CB 3.42Å; E403-A407 PolarHBondContact O-N 3.31Å; E403-A407 VanDerWaalsContact O-N 3.09Å; L405-A407 VanDerWaalsContact C-N 3.31Å; L405-A407 PolarHBondContact O-N 2.9Å; A407-S410 PolarHBondContact O-N 3.04Å
408	L	63.9	Low	56.1	Low	47 Å²	47	83.6 Å²	83.6	25%	0.246	47%	0.474	C	S	.	.	H	α-helix	trans	-71.1	-31.6	177.4	-64.8	172.1	0	0	0	113.1	L344 A346 S404 L405 E406	L344-L408 HydrophobicContact CD1-CD1 3.57Å; L344-L408 HydrophobicContact CD2-CD1 4.41Å; L344-L408 HydrophobicContact CG-CD1 4.26Å; A346-L408 WeakPolarHBondContact O-CD2 3.16Å; S404-L408 WeakPolarHBondContact O-CG 3.31Å; S404-L408 PolarHBondContact O-N 3.36Å; L405-L408 PolarHBondContact O-N 3.26Å; E406-L408 VanDerWaalsContact C-N 3.28Å; E406-L408 PolarHBondContact O-N 3.09Å
409	T	63.1	Low	53.9	Low	55 Å²	55	87.4 Å²	87.4	34%	0.337	49%	0.494	S	S	.	.	H	α-helix	trans	-79.2	-21.3	177.5	58.3	0	0	0	0	113.7	V363 L405 E406	V363-T409 HydrophobicContact CG1-CG2 4.28Å; L405-T409 WeakPolarHBondContact O-CG2 3.37Å; L405-T409 PolarHBondContact O-N 2.9Å; L405-T409 VanDerWaalsContact O-N 3.1Å; E406-T409 WeakPolarHBondContact CA-OG1 3.48Å; E406-T409 PolarHBondContact O-N 3.45Å; E406-T409 VanDerWaalsContact O-N 3.16Å; E406-T409 PolarHBondContact O-OG1 3.03Å
410	S	51.4	Low	51.8	Low	100 Å²	100	89.6 Å²	89.6	70%	0.699	51%	0.505	S	S	*	.	S	Bend	trans	-81	-13	-174.7	-173.7	0	0	0	0	113.8	E406 A407	E406-S410 PolarHBondContact O-N 3.47Å; A407-S410 PolarHBondContact O-N 3.04Å
411	E	42	Very low	49.4	Very low	160 Å²	160	90.9 Å²	90.9	75%	0.748	52%	0.523	S	S	*	.	S	Bend	trans	-93.6	105.1	176.9	-69.7	-163.6	159.1	0	0	110.7	A413	E411-A413 PolarHBondContact O-N 3.45Å
412	N	34.7	Very low	46.9	Very low	156 Å²	156	97 Å²	97	83%	0.834	56%	0.563	S	S	*	*			trans	19	70.5	155.7	-64.4	-27.3	0	0	0	116.6	E414	N412-E414 PolarHBondContact O-N 2.93Å
413	A	38	Very low	44.7	Very low	96 Å²	96	101.5 Å²	101.5	79%	0.793	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	15.9	179	0	0	0	0	0	115.1	E411	E411-A413 PolarHBondContact O-N 3.45Å
414	E	34.5	Very low	42.5	Very low	187 Å²	187	101.3 Å²	101.3	87%	0.874	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-15.5	178	-70.2	-167.5	164.9	0	0	114.5	N412	N412-E414 PolarHBondContact O-N 2.93Å
415	D	32.8	Very low	40.4	Very low	159 Å²	159	105.6 Å²	105.6	85%	0.85	63%	0.625	S	S	*	*	S	Bend	trans	-134	11.3	-168.3	-84.2	-31.3	0	0	0	118.8
416	S	27.3	Very low	38.1	Very low	97 Å²	97	110.4 Å²	110.4	68%	0.678	66%	0.659	S	S	*	*			trans	-137.8	59.4	179.2	-167.1	0	0	0	0	115.3	T418	S416-T418 PolarHBondContact O-N 3.43Å
417	C	27.7	Very low	36	Very low	115 Å²	115	114.7 Å²	114.7	78%	0.777	68%	0.676	S	S	*	*			trans	-86.1	74.2	161.5	-74	0	0	0	0	110.3	L419	C417-L419 VanDerWaalsContact C-N 3.27Å; C417-L419 PolarHBondContact O-N 3Å
418	T	27.9	Very low	34.3	Very low	110 Å²	110	122.6 Å²	122.6	68%	0.675	70%	0.699	S	S	*	*			trans	-83.7	79.9	161	47.3	0	0	0	0	108.7	S416 I420	S416-T418 PolarHBondContact O-N 3.43Å; T418-I420 PolarHBondContact O-N 3.2Å; T418-I420 VanDerWaalsContact O-N 3.12Å
419	L	30.3	Very low	32.7	Very low	90 Å²	90	126.1 Å²	126.1	47%	0.471	72%	0.722	S	S	.	*			trans	-54.8	117.6	162.8	-79.4	165.7	0	0	0	107.7	C417 S421	C417-L419 VanDerWaalsContact C-N 3.27Å; C417-L419 PolarHBondContact O-N 3Å; L419-S421 PolarHBondContact O-N 2.94Å
420	I	30.6	Very low	31.1	Very low	122 Å²	122	131.8 Å²	131.8	63%	0.626	74%	0.743	S	S	*	*			trans	-57.3	106.7	171.1	-59.8	173.3	0	0	0	106.1	L319 T418	L319-I420 HydrophobicContact CD2-CD1 3.84Å; T418-I420 PolarHBondContact O-N 3.2Å; T418-I420 VanDerWaalsContact O-N 3.12Å
421	S	24.3	Very low	30.1	Very low	87 Å²	87	132.5 Å²	132.5	61%	0.608	74%	0.742	S	S	*	*			trans	-60.9	143.6	-178.5	-58.8	0	0	0	0	109.1	L419 T423	L419-S421 PolarHBondContact O-N 2.94Å; S421-T423 VanDerWaalsContact C-N 3.3Å; S421-T423 PolarHBondContact O-N 3.22Å; S421-T423 PolarHBondContact O-OG1 3.29Å
422	P	26	Very low	29.5	Very low	133 Å²	133	133.5 Å²	133.5	86%	0.864	75%	0.747	S	S	*	*			trans	-63	94.1	175.1	25.4	-32	0	0	0	108.8	T424	P422-T424 PolarHBondContact O-N 3Å
423	T	26.5	Very low	29.3	Very low	106 Å²	106	131 Å²	131	65%	0.65	74%	0.737	S	S	*	*			trans	-77.3	125.2	174.3	-14.5	0	0	0	0	106.5	S421	S421-T423 VanDerWaalsContact C-N 3.3Å; S421-T423 PolarHBondContact O-N 3.22Å; S421-T423 PolarHBondContact O-OG1 3.29Å
424	T	27	Very low	29	Very low	127 Å²	127	135.1 Å²	135.1	78%	0.779	74%	0.74	S	S	*	*			trans	-53.1	132	-179.1	-39	0	0	0	0	109.1	P422 S426	P422-T424 PolarHBondContact O-N 3Å; T424-S426 PolarHBondContact O-N 2.82Å
425	P	28.8	Very low	29	Very low	120 Å²	120	131.7 Å²	131.7	78%	0.779	73%	0.732	S	S	*	*			trans	-59.4	104.6	-174.9	21.1	-31.5	0	0	0	109.3	K427	P425-K427 PolarHBondContact O-N 3.4Å
426	S	27.5	Very low	29	Very low	101 Å²	101	128 Å²	128	71%	0.706	72%	0.718	S	S	*	*			trans	-65.1	122.8	168	72.5	0	0	0	0	106	T424 Y428	T424-S426 PolarHBondContact O-N 2.82Å; S426-Y428 PolarHBondContact O-N 3.35Å
427	K	24.9	Very low	29.5	Very low	202 Å²	202	129.7 Å²	129.7	88%	0.878	73%	0.727	S	S	*	*			trans	-60.9	90.9	173	-81.8	-179.6	175.2	178.4	0	107.6	P425 T429	P425-K427 PolarHBondContact O-N 3.4Å; K427-T429 PolarHBondContact O-N 3.41Å
428	Y	32	Very low	30	Very low	204 Å²	204	131.8 Å²	131.8	80%	0.8	73%	0.73	S	S	*	*			trans	-69.5	103.6	171.4	-154.3	-91.3	0	0	0	106.8	S426 K430	S426-Y428 PolarHBondContact O-N 3.35Å; Y428-K430 VanDerWaalsContact C-N 3.32Å; Y428-K430 PolarHBondContact O-N 3.18Å
429	T	29.1	Very low	30.3	Very low	121 Å²	121	132.5 Å²	132.5	74%	0.742	73%	0.729	S	S	*	*			trans	-74.8	97	172.5	-50.3	0	0	0	0	105.1	K427 V431	K427-T429 PolarHBondContact O-N 3.41Å; T429-V431 PolarHBondContact O-N 3.14Å
430	K	29.5	Very low	30.6	Very low	175 Å²	175	137 Å²	137	76%	0.761	74%	0.744	S	S	*	*			trans	-57.4	106.4	173.6	-159.3	176	-171	177	0	106.4	Y428 E432	Y428-K430 VanDerWaalsContact C-N 3.32Å; Y428-K430 PolarHBondContact O-N 3.18Å; K430-E432 PolarHBondContact O-N 3.11Å
431	V	30.5	Very low	30.7	Very low	114 Å²	114	136.4 Å²	136.4	69%	0.691	75%	0.749	S	S	*	*			trans	-59.2	112.2	167.5	178.6	0	0	0	0	104.6	T429 T433	T429-V431 PolarHBondContact O-N 3.14Å; V431-T433 PolarHBondContact O-N 3.41Å
432	E	28.9	Very low	31.3	Very low	181 Å²	181	140.8 Å²	140.8	85%	0.846	75%	0.752	S	S	*	*			trans	-62.1	70.6	169.2	-72.3	177.9	154	0	0	108.4	K430 E434	K430-E432 PolarHBondContact O-N 3.11Å; E432-E434 PolarHBondContact O-N 3.22Å
433	T	32.2	Very low	32.2	Very low	103 Å²	103	140.4 Å²	140.4	63%	0.632	75%	0.747	S	S	*	*			trans	-84.1	97.8	157.6	-47.1	0	0	0	0	103.8	V431 V435	V431-T433 PolarHBondContact O-N 3.41Å; T433-V435 HydrophobicContact CG2-CG2 4.23Å; T433-V435 PolarHBondContact O-N 3.37Å
434	E	31.4	Very low	33	Very low	183 Å²	183	139.7 Å²	139.7	86%	0.855	75%	0.746	S	S	*	*			trans	-61.2	72.4	175.3	-66.8	-162.2	156.8	0	0	110.9	E432	E432-E434 PolarHBondContact O-N 3.22Å
435	V	32.8	Very low	33.7	Very low	116 Å²	116	141 Å²	141	70%	0.703	74%	0.743	S	S	*	*			trans	-139.5	60.6	166.7	-164.7	0	0	0	0	107.2	T433 P437	T433-V435 HydrophobicContact CG2-CG2 4.23Å; T433-V435 PolarHBondContact O-N 3.37Å; V435-P437 VanDerWaalsContact O-CD 3.26Å; V435-P437 WeakPolarHBondContact O-CD 3.48Å
436	S	33.9	Very low	34	Very low	80 Å²	80	141.8 Å²	141.8	56%	0.559	74%	0.738	S	S	*	*			trans	-65.1	120.1	165.9	-71.4	0	0	0	0	108.3	L438 L439	S436-L438 PolarHBondContact O-N 2.99Å; S436-L439 PolarHBondContact O-N 2.97Å
437	P	38.7	Very low	34.3	Very low	134 Å²	134	142.6 Å²	142.6	87%	0.87	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-2.9	173.4	-16	30.1	0	0	0	113.2	V435	V435-P437 VanDerWaalsContact O-CD 3.26Å; V435-P437 WeakPolarHBondContact O-CD 3.48Å
438	L	37.3	Very low	35	Very low	159 Å²	159	138 Å²	138	83%	0.832	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	5.6	-174.3	-86.1	155.1	0	0	0	114.7	S436 K440	S436-L438 PolarHBondContact O-N 2.99Å; L438-K440 PolarHBondContact O-N 3.35Å
439	L	34.6	Very low	35.1	Very low	124 Å²	124	133.6 Å²	133.6	65%	0.649	73%	0.726	S	S	*	*	S	Bend	trans	-72.4	103.8	163.2	-84.2	163.2	0	0	0	107.9	S436 P441	S436-L439 PolarHBondContact O-N 2.97Å; L439-P441 VanDerWaalsContact O-N 3.13Å
440	K	36.4	Very low	35.3	Very low	184 Å²	184	131 Å²	131	80%	0.8	72%	0.724	S	S	*	*			trans	-39.6	125.4	156.9	-75.1	-179	178.9	177.5	0	106.4	L438 R442	L438-K440 PolarHBondContact O-N 3.35Å; K440-R442 PolarHBondContact O-N 3.32Å
441	P	32.2	Very low	35.5	Very low	110 Å²	110	131 Å²	131	71%	0.714	73%	0.726	S	S	*	*			trans	-49.4	114.2	-176.9	-21.7	27.6	0	0	0	107.4	L439 V443	L439-P441 VanDerWaalsContact O-N 3.13Å; P441-V443 PolarHBondContact O-N 3.05Å
442	R	37.4	Very low	35.5	Very low	179 Å²	179	129.9 Å²	129.9	68%	0.675	73%	0.728	S	S	*	*			trans	-56.9	118.8	171	-94	-176.8	164.7	152.9	-2.3	104.3	K440 S444 H445	K440-R442 PolarHBondContact O-N 3.32Å; R442-S444 PolarHBondContact O-N 2.7Å; R442-H445 PolarHBondContact O-N 3.29Å
443	V	44.1	Very low	35.4	Very low	126 Å²	126	129.4 Å²	129.4	76%	0.764	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-54.1	-18.6	-175	177.4	0	0	0	0	111.6	P441 H445 M446	P441-V443 PolarHBondContact O-N 3.05Å; V443-H445 VanDerWaalsContact C-N 3.31Å; V443-H445 PolarHBondContact O-N 3.02Å; V443-M446 PolarHBondContact O-N 3.47Å
444	S	44.1	Very low	35.2	Very low	90 Å²	90	132.2 Å²	132.2	63%	0.629	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-68.3	-15.4	171.3	58.9	0	0	0	0	116.2	R442	R442-S444 PolarHBondContact O-N 2.7Å
445	H	40.6	Very low	35.2	Very low	154 Å²	154	130 Å²	130	71%	0.713	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-103.7	-3.4	177.2	-68.6	-73.9	0	0	0	113.8	R442 V443 P447	R442-H445 PolarHBondContact O-N 3.29Å; V443-H445 VanDerWaalsContact C-N 3.31Å; V443-H445 PolarHBondContact O-N 3.02Å; H445-P447 WeakPolarHBondContact O-CD 3.42Å
446	M	35.9	Very low	35	Very low	138 Å²	138	133.8 Å²	133.8	68%	0.68	74%	0.736	S	S	*	*	S	Bend	trans	-62.9	128.7	159.6	-101	-166.5	154.8	0	0	106.7	V443 V448	V443-M446 PolarHBondContact O-N 3.47Å; M446-V448 VanDerWaalsContact C-N 3.31Å; M446-V448 PolarHBondContact O-N 3.28Å
447	P	33.8	Very low	34.8	Very low	118 Å²	118	141 Å²	141	77%	0.766	75%	0.751	S	S	*	*			trans	-55.5	106.2	168.1	22	-29.3	0	0	0	106.1	H445 P449	H445-P447 WeakPolarHBondContact O-CD 3.42Å; P447-P449 WeakPolarHBondContact O-CD 3.4Å; P447-P449 VanDerWaalsContact O-N 3.12Å
448	V	40.4	Very low	34.6	Very low	105 Å²	105	140.2 Å²	140.2	64%	0.636	74%	0.744	S	S	*	*			trans	-53.8	124.5	169.2	-178	0	0	0	0	103.6	M446 G450	M446-V448 VanDerWaalsContact C-N 3.31Å; M446-V448 PolarHBondContact O-N 3.28Å; V448-G450 PolarHBondContact O-N 3.27Å
449	P	34	Very low	34.6	Very low	112 Å²	112	139.6 Å²	139.6	73%	0.727	74%	0.741	S	S	*	*			trans	-44.9	112.5	178.9	-28.8	34	0	0	0	106.6	P447 H451	P447-P449 WeakPolarHBondContact O-CD 3.4Å; P447-P449 VanDerWaalsContact O-N 3.12Å; P449-H451 PolarHBondContact O-N 3.01Å
450	G	33.3	Very low	34.5	Very low	67 Å²	67	140.7 Å²	140.7	69%	0.691	75%	0.748	S	S	*	*			trans	-49.2	119	-178.2	0	0	0	0	0	104.9	V448 A452	V448-G450 PolarHBondContact O-N 3.27Å; G450-A452 PolarHBondContact O-N 3.44Å
451	H	32.9	Very low	34.2	Very low	174 Å²	174	137.5 Å²	137.5	81%	0.806	76%	0.756	S	S	*	*			trans	-58	85.4	160	-80.4	-78.6	0	0	0	103.7	P449 E453	P449-H451 PolarHBondContact O-N 3.01Å; H451-E453 PolarHBondContact O-N 3.46Å
452	A	30.9	Very low	34.4	Very low	90 Å²	90	137 Å²	137	74%	0.744	75%	0.754	S	S	*	*			trans	-56.3	99.5	158.7	0	0	0	0	0	101.6	G450 L454	G450-A452 PolarHBondContact O-N 3.44Å; A452-L454 VanDerWaalsContact C-N 3.26Å; A452-L454 PolarHBondContact O-N 3.01Å
453	E	26.9	Very low	34.2	Very low	172 Å²	172	137.8 Å²	137.8	80%	0.804	76%	0.763	S	S	*	*			trans	-52.4	104	176.1	-73	-165.9	151.5	0	0	104.8	H451 I455	H451-E453 PolarHBondContact O-N 3.46Å; E453-I455 PolarHBondContact O-N 3.49Å
454	L	28.2	Very low	33.4	Very low	161 Å²	161	136.8 Å²	136.8	84%	0.843	77%	0.768	S	S	*	*			trans	-67.5	92.1	172	-168.3	78.3	0	0	0	103.5	A452 K456	A452-L454 VanDerWaalsContact C-N 3.26Å; A452-L454 PolarHBondContact O-N 3.01Å; L454-K456 VanDerWaalsContact C-N 3.34Å; L454-K456 PolarHBondContact O-N 3.12Å
455	I	31.7	Very low	32.8	Very low	137 Å²	137	140.3 Å²	140.3	70%	0.703	78%	0.779	S	S	*	*			trans	-47.2	108.4	169.1	-65.2	170.9	0	0	0	104.4	E453 R457	E453-I455 PolarHBondContact O-N 3.49Å; I455-R457 PolarHBondContact O-N 3.09Å
456	K	28.1	Very low	32.3	Very low	196 Å²	196	138.2 Å²	138.2	85%	0.852	78%	0.779	S	S	*	*			trans	-62.2	85.2	177.6	-79.9	177.7	174.4	173.9	0	107.5	L454 V458	L454-K456 VanDerWaalsContact C-N 3.34Å; L454-K456 PolarHBondContact O-N 3.12Å; K456-V458 PolarHBondContact O-N 2.92Å
457	R	29.8	Very low	32.1	Very low	230 Å²	230	143.5 Å²	143.5	87%	0.868	79%	0.791	S	S	*	*			trans	-83.6	97.4	152.6	-73.9	-168.8	-179.4	164.2	2.1	106	I455 D459	I455-R457 PolarHBondContact O-N 3.09Å; R457-D459 PolarHBondContact O-N 3.41Å
458	V	33.9	Very low	32	Very low	119 Å²	119	147 Å²	147	72%	0.721	80%	0.795	S	S	*	*			trans	-49.9	115.4	151.5	178	0	0	0	0	105.4	K456	K456-V458 PolarHBondContact O-N 2.92Å
459	D	36.3	Very low	31.5	Very low	146 Å²	146	153.7 Å²	153.7	78%	0.781	81%	0.808	S	S	*	*			trans	179	133.7	143.1	-82.6	-25.1	0	0	0	110.7	R457	R457-D459 PolarHBondContact O-N 3.41Å
460	D	34.2	Very low	31.3	Very low	147 Å²	147	159.4 Å²	159.4	79%	0.786	82%	0.817	S	S	*	*			trans	66.5	88.9	164.4	-66.2	-24	0	0	0	121.4	S462	D460-S462 PolarHBondContact O-N 2.85Å
461	A	30.2	Very low	31.3	Very low	117 Å²	117	162.3 Å²	162.3	97%	0.967	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	38.2	172.8	0	0	0	0	0	116
462	S	35.8	Very low	31.4	Very low	98 Å²	98	157.4 Å²	157.4	69%	0.685	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.2	-0.3	-174.1	65.7	0	0	0	0	117.9	D460	D460-S462 PolarHBondContact O-N 2.85Å
463	K	32.1	Very low	31.5	Very low	196 Å²	196	163.2 Å²	163.2	85%	0.852	82%	0.817	S	S	*	*			trans	-144.4	59	177.5	-67.2	-175.7	-178.1	172.9	0	114.2	L465	K463-L465 PolarHBondContact O-N 3.03Å
464	A	28.3	Very low	32	Very low	105 Å²	105	159.8 Å²	159.8	87%	0.868	81%	0.811	S	S	*	*			trans	-88.2	96.3	171.2	0	0	0	0	0	110.5
465	L	30.4	Very low	32.1	Very low	164 Å²	164	161 Å²	161	86%	0.859	82%	0.817	S	S	*	*			trans	-69.2	144.2	166.7	-86.4	154.5	0	0	0	110.1	K463	K463-L465 PolarHBondContact O-N 3.03Å
466	P	31.6	Very low	32.4	Very low	111 Å²	111	165.1 Å²	165.1	72%	0.721	82%	0.824	S	S	*	*			trans	-67.3	135.2	-171	-3.8	12.7	0	0	0	112.9	K468	P466-K468 PolarHBondContact O-N 3.41Å; P466-K468 VanDerWaalsContact O-N 3.14Å
467	R	32.2	Very low	32.6	Very low	248 Å²	248	161.6 Å²	161.6	94%	0.936	82%	0.821	S	S	*	*			trans	-57	108.1	174.5	-71.3	174	160.7	167.6	-6.6	111	R469	R467-R469 PolarHBondContact O-N 2.97Å
468	K	30.2	Very low	32.7	Very low	193 Å²	193	158 Å²	158	84%	0.839	82%	0.819	S	S	*	*			trans	-74.7	114.7	171.2	-70.8	-175.5	177.8	-178.6	0	109.5	P466	P466-K468 PolarHBondContact O-N 3.41Å; P466-K468 VanDerWaalsContact O-N 3.14Å
469	R	29.7	Very low	32.7	Very low	244 Å²	244	157.8 Å²	157.8	92%	0.921	82%	0.819	S	S	*	*			trans	-79.2	121.5	171.1	-66.1	-174.5	-165.2	172.9	4.5	108.7	R467	R467-R469 PolarHBondContact O-N 2.97Å
470	Y	31.2	Very low	32.5	Very low	233 Å²	233	157 Å²	157	91%	0.914	82%	0.82	S	S	*	*			trans	-72.1	133.3	166.4	-112.3	-103.5	0	0	0	108.8
471	N	33.5	Very low	32.3	Very low	128 Å²	128	158.7 Å²	158.7	68%	0.684	82%	0.823	S	S	*	*			trans	-111.3	112.6	172.8	-137.7	9	0	0	0	107.6	Y473	N471-Y473 PolarHBondContact O-N 3.23Å
472	G	33.9	Very low	32.1	Very low	70 Å²	70	163.6 Å²	163.6	72%	0.722	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	35.8	-165.4	0	0	0	0	0	116.6
473	Y	32.6	Very low	31.7	Very low	213 Å²	213	163.1 Å²	163.1	84%	0.835	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.3	11.4	-172.3	-54.6	-73.6	0	0	0	115.9	N471	N471-Y473 PolarHBondContact O-N 3.23Å
474	C	37.8	Very low	31.2	Very low	100 Å²	100	165.5 Å²	165.5	68%	0.676	82%	0.817	S	S	*	*			trans	-130.4	108.9	178.5	46.3	0	0	0	0	112.9	R476	C474-R476 PolarHBondContact O-N 3.23Å
475	L	30.3	Very low	31.4	Very low	185 Å²	185	169.1 Å²	169.1	97%	0.969	81%	0.814	S	S	*	*			trans	-75.1	47.9	167.3	-65.1	172.9	0	0	0	111.3
476	R	37.8	Very low	31.2	Very low	224 Å²	224	165 Å²	165	85%	0.845	81%	0.811	S	S	*	*			trans	-112.3	123.8	168.3	-95.7	-175.1	-176.8	169.3	1.9	109	C474 L478	C474-R476 PolarHBondContact O-N 3.23Å; R476-L478 PolarHBondContact O-N 2.8Å; R476-L478 VanDerWaalsContact O-N 3.16Å
477	P	33.4	Very low	31.1	Very low	123 Å²	123	166 Å²	166	80%	0.799	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-55.4	122.7	165.9	-19.4	30.6	0	0	0	108.5
478	L	32.4	Very low	30.9	Very low	155 Å²	155	159.8 Å²	159.8	81%	0.812	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-62.3	136.6	171.1	-151.6	75.6	0	0	0	107.6	R476 T480	R476-L478 PolarHBondContact O-N 2.8Å; R476-L478 VanDerWaalsContact O-N 3.16Å; L478-T480 PolarHBondContact O-N 3.13Å; L478-T480 VanDerWaalsContact O-N 3.16Å
479	P	33.9	Very low	30.6	Very low	113 Å²	113	158.3 Å²	158.3	73%	0.734	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-53	125.9	178	-24.7	32.4	0	0	0	110	Q481	P479-Q481 PolarHBondContact O-N 3.17Å
480	T	31.8	Very low	30.7	Very low	131 Å²	131	154.5 Å²	154.5	80%	0.804	80%	0.803	S	S	*	*			trans	-57.8	110.5	174.9	45.8	0	0	0	0	108.1	L478 R482	L478-T480 PolarHBondContact O-N 3.13Å; L478-T480 VanDerWaalsContact O-N 3.16Å; T480-R482 PolarHBondContact O-N 2.99Å
481	Q	29.1	Very low	30.4	Very low	181 Å²	181	150.7 Å²	150.7	85%	0.846	80%	0.799	S	S	*	*			trans	-62.5	102.6	171.4	-89.6	-160.7	-93.1	0	0	107.4	P479 S483	P479-Q481 PolarHBondContact O-N 3.17Å; Q481-S483 PolarHBondContact O-N 3.22Å
482	R	27.2	Very low	30.2	Very low	220 Å²	220	147.6 Å²	147.6	83%	0.83	80%	0.797	S	S	*	*			trans	-59	112.4	166.7	-75.1	-175.1	-178.7	-173.8	0.5	107.5	T480 W484	T480-R482 PolarHBondContact O-N 2.99Å; R482-W484 PolarHBondContact O-N 3.4Å
483	S	25.8	Very low	29.7	Very low	89 Å²	89	152.7 Å²	152.7	62%	0.622	80%	0.802	S	S	*	*			trans	-65.2	117.9	174	-171.3	0	0	0	0	108.8	Q481 F485	Q481-S483 PolarHBondContact O-N 3.22Å; S483-F485 VanDerWaalsContact C-N 3.26Å; S483-F485 PolarHBondContact O-N 2.82Å; S483-F485 WeakPolarHBondContact OG-CD2 3.34Å; S483-F485 WeakPolarHBondContact OG-CE2 3.43Å
484	W	22.2	Very low	29.2	Very low	245 Å²	245	149.2 Å²	149.2	93%	0.928	80%	0.797	S	S	*	*			trans	-70.3	83.6	170.5	-74	38.5	0	0	0	108.6	R482	R482-W484 PolarHBondContact O-N 3.4Å
485	F	31.9	Very low	28.9	Very low	181 Å²	181	154.1 Å²	154.1	79%	0.794	81%	0.807	S	S	*	*			trans	-106	96	156.7	-77.7	-71.7	0	0	0	107.2	S483 T487	S483-F485 VanDerWaalsContact C-N 3.26Å; S483-F485 PolarHBondContact O-N 2.82Å; S483-F485 WeakPolarHBondContact OG-CD2 3.34Å; S483-F485 WeakPolarHBondContact OG-CE2 3.43Å; F485-T487 PolarHBondContact O-N 3.45Å
486	G	26.1	Very low	28.5	Very low	77 Å²	77	153.1 Å²	153.1	79%	0.794	80%	0.801	S	S	*	*			trans	-60.9	126.3	169	0	0	0	0	0	109.9
487	T	30.3	Very low	28	Very low	133 Å²	133	154.6 Å²	154.6	82%	0.816	81%	0.807	S	S	*	*			trans	-108.2	123.8	152.9	40.1	0	0	0	0	107.2	F485	F485-T487 PolarHBondContact O-N 3.45Å
488	P	27.7	Very low	27.5	Very low	118 Å²	118	157.4 Å²	157.4	77%	0.766	81%	0.807	S	S	*	*			trans	-67.4	140.7	-176	-11.2	25.1	0	0	0	111.6	I490	P488-I490 PolarHBondContact O-N 2.87Å
489	L	23.4	Very low	27	Very low	162 Å²	162	159.4 Å²	159.4	85%	0.848	81%	0.809	S	S	*	*			trans	-21	111.4	154.7	-167.6	80.7	0	0	0	113.2
490	I	32.5	Very low	26.7	Very low	163 Å²	163	157.3 Å²	157.3	84%	0.836	81%	0.808	S	S	*	*			trans	-119.3	101.7	158.7	-60.5	-177.8	0	0	0	107.1	P488	P488-I490 PolarHBondContact O-N 2.87Å
491	D	25.6	Very low	26.2	Very low	154 Å²	154	159.8 Å²	159.8	82%	0.824	81%	0.811	S	S	*	*			trans	-61.4	130.5	161.3	-125.3	-17.9	0	0	0	108.8
492	G	28.2	Very low	25.9	Very low	63 Å²	63	156.4 Å²	156.4	65%	0.649	80%	0.802	S	S	*	*			trans	170.3	75.5	-177.7	0	0	0	0	0	115.8
493	E	24.3	Very low	25.9	Very low	176 Å²	176	153.4 Å²	153.4	82%	0.822	80%	0.797	S	S	*	*			trans	28.8	116.6	137.8	-63.8	-173.9	149.7	0	0	120.4
494	I	22.6	Very low	25.7	Very low	141 Å²	141	157.1 Å²	157.1	72%	0.723	80%	0.804	S	S	*	*				40.9	109.3	119.3	-51.2	162.9	0	0	0	115.9
495	K	30.5	Very low	25.9	Very low	202 Å²	202	150.2 Å²	150.2	88%	0.878	79%	0.793	S	S	*	*				-172	123.2	126.4	-100.8	151.5	-164.8	172.4	0	113.6
496	L	22.3	Very low	25.5	Very low	164 Å²	164	150.1 Å²	150.1	86%	0.859	80%	0.795	S	S	*	*			trans	-45.3	133.2	157.9	-61.5	143	0	0	0	111.8
497	R	27.1	Very low	25.5	Very low	255 Å²	255	155.8 Å²	155.8	96%	0.962	80%	0.798	S	S	*	*				-168.6	147.3	128.1	-112.5	170.7	176	166	-1.9	114.4
498	K	22.4	Very low	25.6	Very low	182 Å²	182	157.7 Å²	157.7	79%	0.791	80%	0.802	S	S	*	*			trans	-97.3	154.1	-173.3	-162.8	-176.5	-175.9	168.9	0	108.7
499	K	23.4	Very low	25.4	Very low	197 Å²	197	164.1 Å²	164.1	86%	0.857	81%	0.811	S	S	*	*			trans	88	141.4	158.5	-61.3	-174.2	166.3	-175.3	0	119.3
500	G	26.1	Very low	25.4	Very low	70 Å²	70	167.9 Å²	167.9	72%	0.722	81%	0.814	S	S	*	*			trans	109.2	86	153.5	0	0	0	0	0	112.3
501	E	21.2	Very low	25.3	Very low	183 Å²	183	165.8 Å²	165.8	86%	0.855	81%	0.814	S	S	*	*				54.4	113	86.2	-76.2	-172.3	152.1	0	0	115.4
502	V	22.5	Very low	25.4	Very low	109 Å²	109	167.7 Å²	167.7	66%	0.661	82%	0.818	S	S	*	*			trans	56.2	114	136	-161.9	0	0	0	0	117.7
503	H	27.5	Very low	25.4	Very low	158 Å²	158	172 Å²	172	73%	0.731	83%	0.825	S	S	*	*				167.9	131.5	117.1	-90.4	-68.2	0	0	0	112.4
504	H	23.2	Very low	25.5	Very low	166 Å²	166	170.5 Å²	170.5	77%	0.769	82%	0.822	S	S	*	*			trans	20.1	125.7	146.8	-65.3	-57	0	0	0	120.2
505	S	25.9	Very low	26	Very low	101 Å²	101	168.2 Å²	168.2	71%	0.706	83%	0.825	S	S	*	*				167.3	125.7	100.9	-78.8	0	0	0	0	112.7
506	Q	23.9	Very low	26.1	Very low	178 Å²	178	166.9 Å²	166.9	83%	0.832	82%	0.822	S	S	*	*			trans	36.1	129.8	132.7	-63.8	-179.7	-42.2	0	0	120.6
507	K	25.9	Very low	26.7	Very low	196 Å²	196	166.7 Å²	166.7	85%	0.852	82%	0.816	S	S	*	*			trans	104.8	100	154.1	-64.9	175.8	176.4	174.7	0	115.4
508	L	32	Very low	27.1	Very low	173 Å²	173	160 Å²	160	91%	0.906	80%	0.803	S	S	*	*				-166.6	96.7	113.6	-137.1	67.3	0	0	0	110.2
509	R	24	Very low	27.9	Very low	253 Å²	253	157.5 Å²	157.5	96%	0.955	80%	0.799	S	S	*	*			trans	-84.7	106.1	160	-85.7	-176.8	172.3	-175	-2.5	107
510	R	23.2	Very low	28.8	Very low	241 Å²	241	153.5 Å²	153.5	91%	0.909	79%	0.786	S	S	*	*			trans	-179.4	77	147.6	-154.7	170.4	-174.4	111.1	-1.9	113.1
511	S	29.1	Very low	29.8	Very low	119 Å²	119	155.5 Å²	155.5	83%	0.832	79%	0.787	S	S	*	*			trans	-169.3	65.1	153.5	56.1	0	0	0	0	110.4
512	Q	27.7	Very low	31.4	Very low	195 Å²	195	152.4 Å²	152.4	91%	0.911	77%	0.769	S	S	*	*			trans	-103.2	80.2	159.5	-87.1	170.4	-42	0	0	106.7
513	L	28.1	Very low	33.6	Very low	153 Å²	153	152.5 Å²	152.5	80%	0.801	77%	0.766	S	S	*	*	S	Bend	trans	-145.5	113.2	159.3	-81.6	-179	0	0	0	107.6
514	L	27.9	Very low	35.7	Very low	145 Å²	145	148.5 Å²	148.5	76%	0.759	76%	0.76	S	S	*	*			trans	67.9	57.8	150.8	-56.5	162.1	0	0	0	116
515	A	32.5	Very low	37.9	Very low	93 Å²	93	146.3 Å²	146.3	77%	0.769	75%	0.754	S	S	*	*			trans	-98.3	80.7	140.3	0	0	0	0	0	106.2	Q517	A515-Q517 PolarHBondContact O-N 3.08Å
516	E	32.3	Very low	39.8	Very low	174 Å²	174	146.5 Å²	146.5	81%	0.813	74%	0.744	S	S	*	*			trans	-65.3	79.5	154.5	-84.4	177.2	157.2	0	0	105.8	V518	E516-V518 PolarHBondContact O-N 3.36Å
517	Q	34	Very low	42.1	Very low	160 Å²	160	141.6 Å²	141.6	75%	0.748	72%	0.722	S	S	*	*			trans	-64	95	162.4	-175.1	173.2	-30.2	0	0	103.8	A515 D519	A515-Q517 PolarHBondContact O-N 3.08Å; Q517-D519 PolarHBondContact O-N 3.29Å
518	V	36.2	Very low	44.4	Very low	113 Å²	113	138.3 Å²	138.3	69%	0.685	71%	0.71	S	S	*	*			trans	-57.6	99.1	163.3	177.4	0	0	0	0	103.8	E516 L520	E516-V518 PolarHBondContact O-N 3.36Å; V518-L520 HydrophobicContact CG1-CD2 4.35Å; V518-L520 HydrophobicContact CG1-CG 4.2Å; V518-L520 PolarHBondContact O-N 2.95Å
519	D	40.1	Very low	46.3	Very low	131 Å²	131	136 Å²	136	70%	0.701	70%	0.698	S	S	*	*			trans	-65.9	87.8	172.1	-154.5	17.7	0	0	0	104.3	Q517 C521	Q517-D519 PolarHBondContact O-N 3.29Å; D519-C521 PolarHBondContact O-N 2.82Å
520	L	41.1	Very low	48.6	Very low	113 Å²	113	128.7 Å²	128.7	59%	0.592	68%	0.677	S	S	*	*			trans	-65.7	83.6	167.2	-75.7	165	0	0	0	104.4	V518 Y522	V518-L520 HydrophobicContact CG1-CD2 4.35Å; V518-L520 HydrophobicContact CG1-CG 4.2Å; V518-L520 PolarHBondContact O-N 2.95Å; L520-Y522 HydrophobicContact CB-CD2 4.42Å; L520-Y522 HydrophobicContact CB-CE2 3.95Å; L520-Y522 WeakPolarHBondContact O-CD2 3.33Å; L520-Y522 PolarHBondContact O-N 2.87Å
521	C	46.5	Very low	50.8	Low	111 Å²	111	122.4 Å²	122.4	75%	0.75	66%	0.658	S	S	*	*			trans	-66	86.3	169	-173.1	0	0	0	0	105.6	D519 D523	D519-C521 PolarHBondContact O-N 2.82Å; C521-D523 PolarHBondContact O-N 3.4Å
522	Y	56	Low	52.8	Low	118 Å²	118	121.2 Å²	121.2	46%	0.463	65%	0.645	S	S	.	*			trans	-58.5	133.5	163.3	-65.6	-77.9	0	0	0	106.8	L520	L520-Y522 HydrophobicContact CB-CD2 4.42Å; L520-Y522 HydrophobicContact CB-CE2 3.95Å; L520-Y522 WeakPolarHBondContact O-CD2 3.33Å; L520-Y522 PolarHBondContact O-N 2.87Å
523	D	68.8	Low	54.5	Low	112 Å²	112	115.6 Å²	115.6	60%	0.599	63%	0.625	S	S	*	*			trans	-56.7	146.4	172.5	-97.5	-40.2	0	0	0	108.9	C521 D525 E526 I527	C521-D523 PolarHBondContact O-N 3.4Å; D523-D525 PolarHBondContact O-N 2.94Å; D523-D525 VanDerWaalsContact O-N 3.09Å; D523-E526 HydrophobicContact CB-CG 4.33Å; D523-E526 PolarHBondContact O-N 3.44Å; D523-I527 PolarHBondContact O-N 3.29Å; D523-I527 VanDerWaalsContact O-N 3.1Å
524	A	70.8	Confident	56.2	Low	73 Å²	73	114.8 Å²	114.8	60%	0.603	62%	0.616	S	S	*	*	H	α-helix	trans	-53.1	-35.7	-179.8	0	0	0	0	0	111.4	I527 E528	A524-I527 PolarHBondContact O-N 2.93Å; A524-E528 WeakPolarHBondContact O-CB 3.16Å; A524-E528 PolarHBondContact O-N 3.35Å
525	D	70.5	Confident	57.6	Low	121 Å²	121	111.1 Å²	111.1	65%	0.647	60%	0.603	S	S	*	*	H	α-helix	trans	-66	-36.3	177.2	-58.7	-9.7	0	0	0	112.3	D523 L529	D523-D525 PolarHBondContact O-N 2.94Å; D523-D525 VanDerWaalsContact O-N 3.09Å; D525-L529 WeakPolarHBondContact O-CB 3.34Å; D525-L529 PolarHBondContact O-N 3.39Å
526	E	64.6	Low	58.4	Low	105 Å²	105	115 Å²	115	49%	0.491	60%	0.599	S	S	.	*	H	α-helix	trans	-73.8	-36.6	177.7	-67.8	-171.1	148.2	0	0	111.8	D523 E528 L529 L530	D523-E526 HydrophobicContact CB-CG 4.33Å; D523-E526 PolarHBondContact O-N 3.44Å; E526-E528 VanDerWaalsContact C-N 3.35Å; E526-L529 PolarHBondContact O-N 3.46Å; E526-L530 WeakPolarHBondContact O-CB 3.44Å; E526-L530 WeakPolarHBondContact O-CG 3.34Å; E526-L530 PolarHBondContact O-N 3.17Å
527	I	73.2	Confident	59.3	Low	74 Å²	74	110.6 Å²	110.6	38%	0.379	59%	0.587	S	S	.	*	H	α-helix	trans	-64.5	-43	172.8	-62.7	174.4	0	0	0	109.9	D523 A524 L529 L530 Q531	D523-I527 PolarHBondContact O-N 3.29Å; D523-I527 VanDerWaalsContact O-N 3.1Å; A524-I527 PolarHBondContact O-N 2.93Å; I527-L529 VanDerWaalsContact C-N 3.35Å; I527-L530 PolarHBondContact O-N 3.27Å; I527-Q531 HydrophobicContact CG2-CG 4.43Å; I527-Q531 WeakPolarHBondContact O-CB 3.47Å; I527-Q531 VanDerWaalsContact O-CG 3.31Å; I527-Q531 WeakPolarHBondContact O-CG 3.49Å; I527-Q531 PolarHBondContact O-N 3.39Å
528	E	74.2	Confident	60.2	Low	127 Å²	127	106.5 Å²	106.5	59%	0.593	58%	0.576	S	S	*	*	H	α-helix	trans	-64.1	-42	176.9	-163.4	175.7	-160.4	0	0	110.9	A524 E526 L530 Q531 V532	A524-E528 WeakPolarHBondContact O-CB 3.16Å; A524-E528 PolarHBondContact O-N 3.35Å; E526-E528 VanDerWaalsContact C-N 3.35Å; E528-L530 PolarHBondContact O-N 3.02Å; E528-Q531 PolarHBondContact O-N 3.3Å; E528-V532 VanDerWaalsContact O-CG2 3.29Å; E528-V532 WeakPolarHBondContact O-CG2 3.42Å; E528-V532 PolarHBondContact O-N 2.99Å
529	L	72.1	Confident	60.6	Low	124 Å²	124	106 Å²	106	65%	0.649	58%	0.577	S	S	*	*	H	α-helix	trans	-61.9	-43.5	174.3	-151.5	105	0	0	0	111.8	D525 E526 I527 V532 V533	D525-L529 WeakPolarHBondContact O-CB 3.34Å; D525-L529 PolarHBondContact O-N 3.39Å; E526-L529 PolarHBondContact O-N 3.46Å; I527-L529 VanDerWaalsContact C-N 3.35Å; L529-V532 PolarHBondContact O-N 2.87Å; L529-V533 VanDerWaalsContact O-CG2 3.3Å; L529-V533 WeakPolarHBondContact O-CG2 3.26Å; L529-V533 PolarHBondContact O-N 3.18Å
530	L	70.7	Confident	60.4	Low	101 Å²	101	101.9 Å²	101.9	53%	0.529	56%	0.557	S	S	.	*	H	α-helix	trans	-63.4	-41.3	175.6	-80.8	164.7	0	0	0	111.7	E526 I527 E528 V533 E534	E526-L530 WeakPolarHBondContact O-CB 3.44Å; E526-L530 WeakPolarHBondContact O-CG 3.34Å; E526-L530 PolarHBondContact O-N 3.17Å; I527-L530 PolarHBondContact O-N 3.27Å; E528-L530 PolarHBondContact O-N 3.02Å; L530-V533 PolarHBondContact O-N 3.48Å; L530-E534 VanDerWaalsContact O-CB 3.31Å; L530-E534 WeakPolarHBondContact O-CB 3.49Å; L530-E534 PolarHBondContact O-N 3.37Å
531	Q	70.7	Confident	60.5	Low	109 Å²	109	98.9 Å²	98.9	51%	0.509	55%	0.545	S	S	.	.	H	α-helix	trans	-65.9	-37.3	175.8	-76.7	179.9	-5.9	0	0	111.9	I527 E528 E534 S535	I527-Q531 HydrophobicContact CG2-CG 4.43Å; I527-Q531 WeakPolarHBondContact O-CB 3.47Å; I527-Q531 VanDerWaalsContact O-CG 3.31Å; I527-Q531 WeakPolarHBondContact O-CG 3.49Å; I527-Q531 PolarHBondContact O-N 3.39Å; E528-Q531 PolarHBondContact O-N 3.3Å; Q531-E534 PolarHBondContact O-N 2.78Å; Q531-S535 WeakPolarHBondContact O-CB 3.05Å; Q531-S535 PolarHBondContact O-N 2.8Å; Q531-S535 PolarHBondContact O-OG 3.41Å
532	V	70.6	Confident	60.2	Low	93 Å²	93	100.7 Å²	100.7	56%	0.564	55%	0.547	S	S	*	.	H	α-helix	trans	-65.3	-43.1	173.8	170	0	0	0	0	110.7	E528 L529 S535 Y536	E528-V532 VanDerWaalsContact O-CG2 3.29Å; E528-V532 WeakPolarHBondContact O-CG2 3.42Å; E528-V532 PolarHBondContact O-N 2.99Å; L529-V532 PolarHBondContact O-N 2.87Å; V532-S535 PolarHBondContact O-N 3.05Å; V532-Y536 WeakPolarHBondContact O-CB 3.24Å; V532-Y536 PolarHBondContact O-N 3.33Å
533	V	63.6	Low	59.4	Low	78 Å²	78	99.6 Å²	99.6	47%	0.473	56%	0.557	S	S	.	*	H	α-helix	trans	-64.3	-45.4	176.1	172.6	0	0	0	0	110.8	L529 L530 S535 Y536 C537	L529-V533 VanDerWaalsContact O-CG2 3.3Å; L529-V533 WeakPolarHBondContact O-CG2 3.26Å; L529-V533 PolarHBondContact O-N 3.18Å; L530-V533 PolarHBondContact O-N 3.48Å; V533-S535 VanDerWaalsContact C-N 3.33Å; V533-S535 PolarHBondContact O-N 3.13Å; V533-Y536 PolarHBondContact O-N 2.94Å; V533-C537 WeakPolarHBondContact O-CB 3.39Å; V533-C537 PolarHBondContact O-N 2.92Å; V533-C537 PolarHBondContact O-SG 3.34Å; V533-C537 VanDerWaalsContact O-SG 3.33Å
534	E	64.2	Low	57.7	Low	135 Å²	135	104.3 Å²	104.3	63%	0.631	57%	0.567	S	S	*	*	H	α-helix	trans	-65.8	-38	178.5	-160.3	174.3	-144.6	0	0	111.3	L530 Q531 S538	L530-E534 VanDerWaalsContact O-CB 3.31Å; L530-E534 WeakPolarHBondContact O-CB 3.49Å; L530-E534 PolarHBondContact O-N 3.37Å; Q531-E534 PolarHBondContact O-N 2.78Å; E534-S538 WeakPolarHBondContact O-CB 3.44Å; E534-S538 PolarHBondContact O-N 3.15Å; E534-S538 PolarHBondContact O-OG 3.28Å
535	S	57.4	Low	56.1	Low	68 Å²	68	107.2 Å²	107.2	48%	0.476	57%	0.566	S	S	.	*	H	α-helix	trans	-63.9	-40.3	171.9	-60.5	0	0	0	0	111.5	Q531 V532 V533 S539	Q531-S535 WeakPolarHBondContact O-CB 3.05Å; Q531-S535 PolarHBondContact O-N 2.8Å; Q531-S535 PolarHBondContact O-OG 3.41Å; V532-S535 PolarHBondContact O-N 3.05Å; V533-S535 VanDerWaalsContact C-N 3.33Å; V533-S535 PolarHBondContact O-N 3.13Å; S535-S539 WeakPolarHBondContact O-CA 3.49Å; S535-S539 WeakPolarHBondContact O-CB 3.47Å; S535-S539 PolarHBondContact O-N 3.19Å; S535-S539 PolarHBondContact O-OG 3.25Å
536	Y	49.8	Very low	54.5	Low	174 Å²	174	106.5 Å²	106.5	68%	0.682	57%	0.567	S	S	*	*	H	α-helix	trans	-67.9	-47.1	177.4	-169.3	-95.8	0	0	0	111.3	V532 V533 S538 S539 T540	V532-Y536 WeakPolarHBondContact O-CB 3.24Å; V532-Y536 PolarHBondContact O-N 3.33Å; V533-Y536 PolarHBondContact O-N 2.94Å; Y536-S538 VanDerWaalsContact C-N 3.31Å; Y536-S538 PolarHBondContact O-N 3.4Å; Y536-S539 PolarHBondContact O-N 3.4Å; Y536-T540 PolarHBondContact O-N 3.48Å; Y536-T540 VanDerWaalsContact O-N 3.1Å; Y536-T540 PolarHBondContact O-OG1 3.01Å
537	C	50.8	Low	53.2	Low	83 Å²	83	108.7 Å²	108.7	56%	0.561	58%	0.582	S	S	*	*	H	α-helix	trans	-64.8	-33	176.5	-68.7	0	0	0	0	112.8	V533 T540	V533-C537 WeakPolarHBondContact O-CB 3.39Å; V533-C537 PolarHBondContact O-N 2.92Å; V533-C537 PolarHBondContact O-SG 3.34Å; V533-C537 VanDerWaalsContact O-SG 3.33Å; C537-T540 PolarHBondContact O-OG1 3.27Å
538	S	53	Low	51.5	Low	74 Å²	74	111.6 Å²	111.6	52%	0.517	60%	0.597	S	S	.	*	H	α-helix	trans	-83.9	-35.3	178.7	-55.9	0	0	0	0	112.4	E534 Y536 T540 S541	E534-S538 WeakPolarHBondContact O-CB 3.44Å; E534-S538 PolarHBondContact O-N 3.15Å; E534-S538 PolarHBondContact O-OG 3.28Å; Y536-S538 VanDerWaalsContact C-N 3.31Å; Y536-S538 PolarHBondContact O-N 3.4Å; S538-T540 VanDerWaalsContact C-N 3.28Å; S538-T540 PolarHBondContact O-N 3.08Å; S538-S541 WeakPolarHBondContact O-CB 3.4Å; S538-S541 PolarHBondContact O-N 3.49Å; S538-S541 VanDerWaalsContact O-N 3.11Å
539	S	43.1	Very low	49.5	Very low	102 Å²	102	111.7 Å²	111.7	71%	0.713	61%	0.61	S	S	*	*	H	α-helix	trans	-73.6	-21.1	177.8	-57.3	0	0	0	0	112.4	S535 Y536 S541	S535-S539 WeakPolarHBondContact O-CA 3.49Å; S535-S539 WeakPolarHBondContact O-CB 3.47Å; S535-S539 PolarHBondContact O-N 3.19Å; S535-S539 PolarHBondContact O-OG 3.25Å; Y536-S539 PolarHBondContact O-N 3.4Å; S539-S541 VanDerWaalsContact C-N 3.25Å; S539-S541 PolarHBondContact O-N 3.49Å
540	T	36.9	Very low	47.8	Very low	44 Å²	44	110.1 Å²	110.1	27%	0.27	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-83.1	4.6	169.5	37.7	0	0	0	0	113.7	Y536 C537 S538 D542 S543	Y536-T540 PolarHBondContact O-N 3.48Å; Y536-T540 VanDerWaalsContact O-N 3.1Å; Y536-T540 PolarHBondContact O-OG1 3.01Å; C537-T540 PolarHBondContact O-OG1 3.27Å; S538-T540 VanDerWaalsContact C-N 3.28Å; S538-T540 PolarHBondContact O-N 3.08Å; T540-D542 PolarHBondContact O-N 3.39Å; T540-S543 PolarHBondContact O-N 3.36Å
541	S	42.6	Very low	46.3	Very low	50 Å²	50	117.1 Å²	117.1	35%	0.35	63%	0.629	S	S	.	*	G	3₁₀ helix	trans	-63.1	-13.1	179.4	-178.3	0	0	0	0	114.5	S538 S539	S538-S541 WeakPolarHBondContact O-CB 3.4Å; S538-S541 PolarHBondContact O-N 3.49Å; S538-S541 VanDerWaalsContact O-N 3.11Å; S539-S541 VanDerWaalsContact C-N 3.25Å; S539-S541 PolarHBondContact O-N 3.49Å
542	D	40.5	Very low	44.9	Very low	149 Å²	149	117.9 Å²	117.9	80%	0.797	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-101.6	-20	176.7	-76	-14.2	0	0	0	114.2	T540	T540-D542 PolarHBondContact O-N 3.39Å
543	S	38.9	Very low	43.2	Very low	95 Å²	95	117.7 Å²	117.7	66%	0.664	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-19.7	-178.4	-172.5	0	0	0	0	114.3	T540	T540-S543 PolarHBondContact O-N 3.36Å
544	W	34.7	Very low	42.2	Very low	212 Å²	212	122.3 Å²	122.3	80%	0.803	67%	0.667	S	S	*	*	S	Bend	trans	-116.6	7.9	-173.5	-66.8	90.4	0	0	0	114.9
545	K	35.4	Very low	41	Very low	134 Å²	134	119.7 Å²	119.7	58%	0.583	67%	0.669	S	S	*	*	S	Bend	trans	-78.2	125	161.2	-72.6	179.3	-174.7	165.5	0	107.1	L547	K545-L547 PolarHBondContact O-N 3.32Å
546	P	37.5	Very low	40.2	Very low	105 Å²	105	121.8 Å²	121.8	68%	0.682	68%	0.681	S	S	*	*			trans	-50.2	135.5	161.3	-17.5	28.9	0	0	0	107	I548	P546-I548 HydrophobicContact CB-CG1 4.4Å; P546-I548 PolarHBondContact O-N 2.93Å
547	L	37.8	Very low	40.4	Very low	152 Å²	152	122.5 Å²	122.5	80%	0.796	68%	0.683	S	S	*	*	S	Bend	trans	-58	21.7	-174.1	-127.2	89.4	0	0	0	115.5	M99 K545	M99-L547 HydrophobicContact CE-CD2 4.02Å; K545-L547 PolarHBondContact O-N 3.32Å
548	I	38.3	Very low	40.7	Very low	135 Å²	135	124.4 Å²	124.4	69%	0.692	69%	0.692	S	S	*	*			trans	-112.5	62.1	-167.1	-42.1	177.6	0	0	0	109.2	P546	P546-I548 HydrophobicContact CB-CG1 4.4Å; P546-I548 PolarHBondContact O-N 2.93Å
549	C	31.7	Very low	41	Very low	128 Å²	128	127.2 Å²	127.2	87%	0.865	70%	0.701	S	S	*	*			trans	-124.5	59.3	154.5	-161.7	0	0	0	0	108.6	R551	C549-R551 PolarHBondContact O-N 2.98Å
550	S	35.3	Very low	42.3	Very low	91 Å²	91	126.4 Å²	126.4	64%	0.636	69%	0.688	S	S	*	*			trans	-68.8	124	167.1	-168.9	0	0	0	0	108.4	N552	S550-N552 PolarHBondContact O-N 3.39Å
551	R	39.3	Very low	43.6	Very low	248 Å²	248	126.7 Å²	126.7	94%	0.936	70%	0.695	S	S	*	*	S	Bend	trans	-63	11.1	179.8	-150.1	179.1	-169.2	-158.9	3.7	114.5	C549	C549-R551 PolarHBondContact O-N 2.98Å
552	N	41.9	Very low	44.8	Very low	125 Å²	125	131.5 Å²	131.5	67%	0.668	71%	0.711	S	S	*	*	S	Bend	trans	-96.7	111.2	175.7	-79.7	-6.7	0	0	0	108.3	S550 K554	S550-N552 PolarHBondContact O-N 3.39Å; N552-K554 PolarHBondContact O-N 3.01Å
553	G	35.9	Very low	46.2	Very low	90 Å²	90	129.8 Å²	129.8	93%	0.928	70%	0.703	S	S	*	*			trans	-61.6	56.7	-175.9	0	0	0	0	0	115.8
554	K	41.9	Very low	48	Very low	174 Å²	174	129.3 Å²	129.3	76%	0.757	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-78.3	129.9	159	-71.9	-175.7	175	-177	0	106.9	N552	N552-K554 PolarHBondContact O-N 3.01Å
555	A	38.7	Very low	50.2	Low	81 Å²	81	125.2 Å²	125.2	67%	0.669	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-46.7	144.2	179.3	0	0	0	0	0	111	Y557	A555-Y557 PolarHBondContact O-N 2.76Å
556	P	39.8	Very low	52.5	Low	112 Å²	112	122.3 Å²	122.3	73%	0.727	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-54.3	132.9	178.2	23.3	-32.8	0	0	0	109.4	V558	P556-V558 PolarHBondContact O-N 2.72Å
557	Y	54.2	Low	54.7	Low	188 Å²	188	124.2 Å²	124.2	74%	0.737	67%	0.666	S	S	*	*			trans	-60.3	107.6	170.8	-70.2	-87.6	0	0	0	107.6	A555 L559	A555-Y557 PolarHBondContact O-N 2.76Å; Y557-L559 PolarHBondContact O-N 2.67Å
558	V	58.8	Low	56.6	Low	123 Å²	123	117.9 Å²	117.9	75%	0.745	63%	0.634	S	S	*	*			trans	-74.9	103.5	170.9	177.5	0	0	0	0	105.8	P556 I560	P556-V558 PolarHBondContact O-N 2.72Å; V558-I560 HydrophobicContact CG1-CG1 4.44Å; V558-I560 PolarHBondContact O-N 2.72Å
559	L	57.8	Low	58.6	Low	133 Å²	133	118.1 Å²	118.1	70%	0.696	63%	0.632	S	S	*	*			trans	-68.6	110.5	174.1	-81.6	154.2	0	0	0	108.8	Y557 E564	Y557-L559 PolarHBondContact O-N 2.67Å; L559-E564 HydrophobicContact CD2-CG 3.98Å; L559-E564 VanDerWaalsContact CD2-OE1 3.24Å; L559-E564 WeakPolarHBondContact CD2-OE1 3.29Å
560	I	70.5	Confident	60.6	Low	85 Å²	85	114.8 Å²	114.8	44%	0.436	60%	0.604	S	S	.	*			trans	-93.2	106.2	172.1	-57.2	175.8	0	0	0	106	V558 E562 D563 E564	V558-I560 HydrophobicContact CG1-CG1 4.44Å; V558-I560 PolarHBondContact O-N 2.72Å; I560-E562 HydrophobicContact CG2-CB 4.24Å; I560-E562 HydrophobicContact CG2-CG 4.43Å; I560-E562 PolarHBondContact O-N 2.93Å; I560-D563 HydrophobicContact CB-CB 4.44Å; I560-D563 PolarHBondContact O-N 2.83Å; I560-E564 PolarHBondContact O-N 2.98Å
561	A	63.8	Low	62.5	Low	51 Å²	51	117.5 Å²	117.5	42%	0.421	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.4	-24.6	-173.5	0	0	0	0	0	113.9	D563 V584	A561-D563 VanDerWaalsContact C-N 3.34Å; A561-V584 HydrophobicContact CB-CG2 4.25Å
562	E	67.9	Low	64.2	Low	150 Å²	150	109.7 Å²	109.7	70%	0.701	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-29.1	178.5	-47.7	-172.1	-150.6	0	0	112.4	I560 V584	I560-E562 HydrophobicContact CG2-CB 4.24Å; I560-E562 HydrophobicContact CG2-CG 4.43Å; I560-E562 PolarHBondContact O-N 2.93Å; E562-V584 HydrophobicContact CG-CG2 4.46Å
563	D	70.8	Confident	65.7	Low	114 Å²	114	106.9 Å²	106.9	61%	0.61	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-17.1	179.6	-65.4	-31.3	0	0	0	112.3	I560 A561	I560-D563 HydrophobicContact CB-CB 4.44Å; I560-D563 PolarHBondContact O-N 2.83Å; A561-D563 VanDerWaalsContact C-N 3.34Å
564	E	75.4	Confident	67.5	Low	85 Å²	85	110.7 Å²	110.7	40%	0.397	58%	0.583	S	S	.	*			trans	-75.5	128	179.7	-71.3	-61.9	143.8	0	0	110.9	L559 I560 T582 L583	L559-E564 HydrophobicContact CD2-CG 3.98Å; L559-E564 VanDerWaalsContact CD2-OE1 3.24Å; L559-E564 WeakPolarHBondContact CD2-OE1 3.29Å; I560-E564 PolarHBondContact O-N 2.98Å; E564-T582 CarbonylContact O-C 3.56Å; E564-T582 WeakPolarHBondContact O-CA 3.35Å; E564-L583 HydrophobicContact CB-CB 4.13Å; E564-L583 HydrophobicContact CB-CD2 4.32Å; E564-L583 PolarHBondContact O-N 3.01Å
565	K	82.3	Confident	68.7	Low	126 Å²	126	108.9 Å²	108.9	55%	0.548	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.4	140	180	-65.4	-179.5	-177.2	-179.2	0	110.8	E580 K581	K565-E580 HydrophobicContact CB-CG 3.72Å; K565-E580 WeakPolarHBondContact CB-OE1 3.49Å; K565-E580 HydrophobicContact CD-CG 3.92Å; K565-E580 WeakPolarHBondContact CD-OE1 3.35Å; K565-E580 HydrophobicContact CG-CG 4.36Å; K565-K581 CarbonylContact C-O 3.56Å; K565-K581 VanDerWaalsContact CA-O 3.26Å; K565-K581 WeakPolarHBondContact CA-O 3.44Å
566	I	82.3	Confident	70.3	Confident	73 Å²	73	109.1 Å²	109.1	37%	0.374	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.8	140.7	179.1	-171.9	169.2	0	0	0	109.8	C568 K581 L583 T586	I566-C568 PolarHBondContact O-N 2.84Å; I566-K581 PolarHBondContact N-O 2.82Å; I566-K581 PolarHBondContact O-N 3.31Å; I566-L583 HydrophobicContact CG2-CD1 4.41Å; I566-T586 HydrophobicContact CG2-CG2 4.16Å; I566-T586 WeakPolarHBondContact CG2-OG1 3.37Å
567	F	83.7	Confident	72.4	Confident	145 Å²	145	106.6 Å²	106.6	64%	0.636	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	118	171.6	-63.3	-75.3	0	0	0	109.3	V578 Q579 E580	F567-V578 HydrophobicContact CB-CG1 3.92Å; F567-V578 HydrophobicContact CD1-CG1 4.08Å; F567-V578 HydrophobicContact CG-CG1 4.39Å; F567-Q579 WeakPolarHBondContact CA-O 3.37Å; F567-E580 HydrophobicContact CD1-CB 4.16Å; F567-E580 HydrophobicContact CE1-CB 4.02Å; F567-E580 HydrophobicContact CE1-CG 4.25Å
568	C	78.6	Confident	73.7	Confident	19 Å²	19	101.6 Å²	101.6	13%	0.128	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.3	175.8	-64.6	0	0	0	0	109.4	I566 Q579 T586	I566-C568 PolarHBondContact O-N 2.84Å; C568-Q579 PolarHBondContact N-O 2.66Å; C568-Q579 PolarHBondContact O-N 2.81Å; C568-T586 WeakPolarHBondContact SG-CG2 3.5Å; C568-T586 PolarHBondContact SG-OG1 3.12Å
569	E	80.8	Confident	74.7	Confident	140 Å²	140	99.3 Å²	99.3	65%	0.654	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	116.7	171.1	-67.9	177.1	-179.9	0	0	108.6	L576 V578	E569-L576 HydrophobicContact CB-CD1 4.11Å; E569-L576 HydrophobicContact CB-CG 4.46Å; E569-V578 HydrophobicContact CG-CG2 4.03Å
570	E	73.1	Confident	75.9	Confident	58 Å²	58	98.4 Å²	98.4	27%	0.271	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	141.6	175.8	-85.7	179.5	-175.3	0	0	110.5	I577 K581	E570-I577 PolarHBondContact N-O 3.4Å; E570-I577 PolarHBondContact O-N 2.87Å; E570-K581 IonicContact OE1-NZ 3.73Å; E570-K581 PolarHBondContact OE1-NZ 3.19Å; E570-K581 IonicContact OE2-NZ 3.14Å; E570-K581 PolarHBondContact OE2-NZ 3.44Å
571	F	75.9	Confident	76.5	Confident	148 Å²	148	96.8 Å²	96.8	65%	0.649	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	120.4	169.9	-77.2	-88.2	0	0	0	109.6	E575 L576	F571-E575 WeakPolarHBondContact CA-O 3.24Å; F571-L576 HydrophobicContact CD1-CB 4.42Å; F571-L576 HydrophobicContact CD1-CD1 4.38Å; F571-L576 HydrophobicContact CD2-CD1 3.78Å; F571-L576 HydrophobicContact CE1-CB 4.09Å; F571-L576 HydrophobicContact CE1-CD1 4.08Å; F571-L576 HydrophobicContact CE2-CD1 3.43Å; F571-L576 VanDerWaalsContact CE2-CD1 3.43Å; F571-L576 HydrophobicContact CG-CD1 4.25Å; F571-L576 HydrophobicContact CZ-CB 4.34Å; F571-L576 HydrophobicContact CZ-CD1 3.6Å
572	V	73.7	Confident	77.6	Confident	84 Å²	84	96 Å²	96	51%	0.509	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	95.9	167.9	-177.3	0	0	0	0	107	E575 I577	V572-E575 PolarHBondContact N-O 3.41Å; V572-I577 HydrophobicContact CB-CD1 3.81Å; V572-I577 HydrophobicContact CB-CG1 4.48Å; V572-I577 HydrophobicContact CG2-CD1 3.88Å; V572-I577 HydrophobicContact CG2-CG1 4.44Å
573	G	74	Confident	78.2	Confident	66 Å²	66	92.2 Å²	92.2	68%	0.68	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	-124.3	-166.7	0	0	0	0	0	110.5
574	D	73.8	Confident	78.9	Confident	169 Å²	169	89 Å²	89	90%	0.904	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	0.2	179.3	-67.1	-24	0	0	0	113.2
575	E	65.9	Low	79.4	Confident	137 Å²	137	89.4 Å²	89.4	64%	0.64	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	130	-178.7	-166.2	172.2	-179.8	0	0	111	F571 V572 I577	F571-E575 WeakPolarHBondContact CA-O 3.24Å; V572-E575 PolarHBondContact N-O 3.41Å; E575-I577 HydrophobicContact CG-CG1 4.48Å
576	L	73.7	Confident	79.6	Confident	85 Å²	85	84.1 Å²	84.1	45%	0.445	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	114.7	174.2	-172.7	82.7	0	0	0	109.2	E569 F571	E569-L576 HydrophobicContact CB-CD1 4.11Å; E569-L576 HydrophobicContact CB-CG 4.46Å; F571-L576 HydrophobicContact CD1-CB 4.42Å; F571-L576 HydrophobicContact CD1-CD1 4.38Å; F571-L576 HydrophobicContact CD2-CD1 3.78Å; F571-L576 HydrophobicContact CE1-CB 4.09Å; F571-L576 HydrophobicContact CE1-CD1 4.08Å; F571-L576 HydrophobicContact CE2-CD1 3.43Å; F571-L576 VanDerWaalsContact CE2-CD1 3.43Å; F571-L576 HydrophobicContact CG-CD1 4.25Å; F571-L576 HydrophobicContact CZ-CB 4.34Å; F571-L576 HydrophobicContact CZ-CD1 3.6Å
577	I	82.8	Confident	79.9	Confident	59 Å²	59	84.7 Å²	84.7	30%	0.303	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	130.6	179.2	-53.8	-177.4	0	0	0	109.2	E570 V572 E575 Q579	E570-I577 PolarHBondContact N-O 3.4Å; E570-I577 PolarHBondContact O-N 2.87Å; V572-I577 HydrophobicContact CB-CD1 3.81Å; V572-I577 HydrophobicContact CB-CG1 4.48Å; V572-I577 HydrophobicContact CG2-CD1 3.88Å; V572-I577 HydrophobicContact CG2-CG1 4.44Å; E575-I577 HydrophobicContact CG-CG1 4.48Å; I577-Q579 HydrophobicContact CG2-CG 3.96Å
578	V	81.2	Confident	80.2	Confident	83 Å²	83	85 Å²	85	50%	0.503	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	121.1	171.8	-175.6	0	0	0	0	108.3	F567 E569	F567-V578 HydrophobicContact CB-CG1 3.92Å; F567-V578 HydrophobicContact CD1-CG1 4.08Å; F567-V578 HydrophobicContact CG-CG1 4.39Å; E569-V578 HydrophobicContact CG-CG2 4.03Å
579	Q	80.4	Confident	80.7	Confident	76 Å²	76	85.8 Å²	85.8	36%	0.355	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141	177.6	-64	-175.5	-6.4	0	0	111	F567 C568 I577	F567-Q579 WeakPolarHBondContact CA-O 3.37Å; C568-Q579 PolarHBondContact N-O 2.66Å; C568-Q579 PolarHBondContact O-N 2.81Å; I577-Q579 HydrophobicContact CG2-CG 3.96Å
580	E	83.1	Confident	81	Confident	114 Å²	114	83.6 Å²	83.6	53%	0.533	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	114.7	171.9	-170	-177.7	-174.4	0	0	109.2	K565 F567	K565-E580 HydrophobicContact CB-CG 3.72Å; K565-E580 WeakPolarHBondContact CB-OE1 3.49Å; K565-E580 HydrophobicContact CD-CG 3.92Å; K565-E580 WeakPolarHBondContact CD-OE1 3.35Å; K565-E580 HydrophobicContact CG-CG 4.36Å; F567-E580 HydrophobicContact CD1-CB 4.16Å; F567-E580 HydrophobicContact CE1-CB 4.02Å; F567-E580 HydrophobicContact CE1-CG 4.25Å
581	K	84.2	Confident	81.9	Confident	50 Å²	50	87.7 Å²	87.7	22%	0.217	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	156.9	178.8	-66.3	-171.5	-177.9	-177.6	0	110.2	K565 I566 E570	K565-K581 CarbonylContact C-O 3.56Å; K565-K581 VanDerWaalsContact CA-O 3.26Å; K565-K581 WeakPolarHBondContact CA-O 3.44Å; I566-K581 PolarHBondContact N-O 2.82Å; I566-K581 PolarHBondContact O-N 3.31Å; E570-K581 IonicContact OE1-NZ 3.73Å; E570-K581 PolarHBondContact OE1-NZ 3.19Å; E570-K581 IonicContact OE2-NZ 3.14Å; E570-K581 PolarHBondContact OE2-NZ 3.44Å
582	T	85.8	Confident	82.7	Confident	36 Å²	36	83.8 Å²	83.8	22%	0.221	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	145.6	172.8	73.8	0	0	0	0	109.5	E564 V584 D585 T586	E564-T582 CarbonylContact O-C 3.56Å; E564-T582 WeakPolarHBondContact O-CA 3.35Å; T582-V584 PolarHBondContact O-N 3.49Å; T582-D585 PolarHBondContact O-N 2.91Å; T582-D585 VanDerWaalsContact O-N 3.12Å; T582-D585 WeakPolarHBondContact OG1-CB 3.29Å; T582-D585 PolarHBondContact OG1-N 3.49Å; T582-D585 VanDerWaalsContact OG1-N 3.09Å; T582-D585 PolarHBondContact OG1-OD2 3.19Å; T582-T586 PolarHBondContact O-N 3Å; T582-T586 PolarHBondContact O-OG1 3.14Å
583	L	81	Confident	83.5	Confident	69 Å²	69	84.9 Å²	84.9	36%	0.361	45%	0.448	S	S	.	.	H	α-helix	trans	-57.1	-36.7	178.3	-179.3	63	0	0	0	111	E564 I566 T586 V587	E564-L583 HydrophobicContact CB-CB 4.13Å; E564-L583 HydrophobicContact CB-CD2 4.32Å; E564-L583 PolarHBondContact O-N 3.01Å; I566-L583 HydrophobicContact CG2-CD1 4.41Å; L583-T586 PolarHBondContact O-N 3.25Å; L583-V587 HydrophobicContact CD1-CG2 4.44Å; L583-V587 WeakPolarHBondContact O-CB 3.32Å; L583-V587 WeakPolarHBondContact O-CG2 3.1Å; L583-V587 PolarHBondContact O-N 3.23Å
584	V	84.5	Confident	84.4	Confident	48 Å²	48	86 Å²	86	29%	0.291	44%	0.441	S	S	.	.	H	α-helix	trans	-61.7	-50	176.3	179	0	0	0	0	110.9	A561 E562 T582 T586 V587 Y588	A561-V584 HydrophobicContact CB-CG2 4.25Å; E562-V584 HydrophobicContact CG-CG2 4.46Å; T582-V584 PolarHBondContact O-N 3.49Å; V584-T586 PolarHBondContact O-N 3Å; V584-V587 PolarHBondContact O-N 3.36Å; V584-Y588 HydrophobicContact CG1-CD2 3.72Å; V584-Y588 HydrophobicContact CG1-CE2 3.59Å; V584-Y588 WeakPolarHBondContact O-CD2 2.99Å; V584-Y588 PolarHBondContact O-N 3.45Å
585	D	87.6	Confident	85.3	Confident	92 Å²	92	84.4 Å²	84.4	49%	0.492	42%	0.423	S	S	.	.	H	α-helix	trans	-62.2	-42.7	179.1	-67.4	-34	0	0	0	111.8	T582 V587 Y588 A589	T582-D585 PolarHBondContact O-N 2.91Å; T582-D585 VanDerWaalsContact O-N 3.12Å; T582-D585 WeakPolarHBondContact OG1-CB 3.29Å; T582-D585 PolarHBondContact OG1-N 3.49Å; T582-D585 VanDerWaalsContact OG1-N 3.09Å; T582-D585 PolarHBondContact OG1-OD2 3.19Å; D585-V587 VanDerWaalsContact C-N 3.34Å; D585-V587 PolarHBondContact O-N 2.96Å; D585-Y588 PolarHBondContact O-N 3.43Å; D585-A589 WeakPolarHBondContact O-CB 3.23Å; D585-A589 PolarHBondContact O-N 3.3Å
586	T	86.5	Confident	86.7	Confident	16 Å²	16	81.5 Å²	81.5	10%	0.098	41%	0.411	C	S	.	.	H	α-helix	trans	-60.3	-43.6	176.7	-57.9	0	0	0	0	111.6	I566 C568 T582 L583 V584 A589 L590	I566-T586 HydrophobicContact CG2-CG2 4.16Å; I566-T586 WeakPolarHBondContact CG2-OG1 3.37Å; C568-T586 WeakPolarHBondContact SG-CG2 3.5Å; C568-T586 PolarHBondContact SG-OG1 3.12Å; T582-T586 PolarHBondContact O-N 3Å; T582-T586 PolarHBondContact O-OG1 3.14Å; L583-T586 PolarHBondContact O-N 3.25Å; V584-T586 PolarHBondContact O-N 3Å; T586-A589 PolarHBondContact O-N 3.42Å; T586-L590 HydrophobicContact CG2-CD1 4.01Å; T586-L590 HydrophobicContact CG2-CG 4.47Å; T586-L590 WeakPolarHBondContact O-CB 3.03Å; T586-L590 VanDerWaalsContact O-CG 3.28Å; T586-L590 WeakPolarHBondContact O-CG 3.44Å; T586-L590 PolarHBondContact O-N 3.19Å
587	V	88.4	Confident	87.6	Confident	85 Å²	85	82.7 Å²	82.7	52%	0.515	42%	0.417	S	S	.	.	H	α-helix	trans	-65	-41.6	178.3	170.9	0	0	0	0	111.2	L583 V584 D585 K591	L583-V587 HydrophobicContact CD1-CG2 4.44Å; L583-V587 WeakPolarHBondContact O-CB 3.32Å; L583-V587 WeakPolarHBondContact O-CG2 3.1Å; L583-V587 PolarHBondContact O-N 3.23Å; V584-V587 PolarHBondContact O-N 3.36Å; D585-V587 VanDerWaalsContact C-N 3.34Å; D585-V587 PolarHBondContact O-N 2.96Å; V587-K591 VanDerWaalsContact O-CB 3.32Å; V587-K591 WeakPolarHBondContact O-CB 3.49Å; V587-K591 PolarHBondContact O-N 3.15Å
588	Y	89.9	Confident	88.2	Confident	152 Å²	152	82.6 Å²	82.6	60%	0.596	42%	0.422	S	S	*	.	H	α-helix	trans	-67.3	-41.2	176.2	-82.1	-69.4	0	0	0	112.5	V584 D585 K591 D592	V584-Y588 HydrophobicContact CG1-CD2 3.72Å; V584-Y588 HydrophobicContact CG1-CE2 3.59Å; V584-Y588 WeakPolarHBondContact O-CD2 2.99Å; V584-Y588 PolarHBondContact O-N 3.45Å; D585-Y588 PolarHBondContact O-N 3.43Å; Y588-K591 WeakPolarHBondContact O-CB 3.36Å; Y588-K591 PolarHBondContact O-N 2.98Å; Y588-D592 PolarHBondContact O-N 3.35Å
589	A	87.9	Confident	88.8	Confident	35 Å²	35	83.6 Å²	83.6	29%	0.289	42%	0.421	S	S	.	.	H	α-helix	trans	-61.3	-47.2	175.6	0	0	0	0	0	111.6	D585 T586 K591 D592 Q593	D585-A589 WeakPolarHBondContact O-CB 3.23Å; D585-A589 PolarHBondContact O-N 3.3Å; T586-A589 PolarHBondContact O-N 3.42Å; A589-K591 VanDerWaalsContact C-N 3.32Å; A589-K591 PolarHBondContact O-N 3.05Å; A589-D592 PolarHBondContact O-N 2.94Å; A589-Q593 WeakPolarHBondContact O-CG 3.34Å; A589-Q593 PolarHBondContact O-N 2.73Å
590	L	87.7	Confident	89.6	Confident	93 Å²	93	84 Å²	84	49%	0.487	43%	0.425	S	S	.	.	H	α-helix	trans	-61.6	-40.1	175.6	-74.4	171.1	0	0	0	111.9	T586 D592 Q593 V594	T586-L590 HydrophobicContact CG2-CD1 4.01Å; T586-L590 HydrophobicContact CG2-CG 4.47Å; T586-L590 WeakPolarHBondContact O-CB 3.03Å; T586-L590 VanDerWaalsContact O-CG 3.28Å; T586-L590 WeakPolarHBondContact O-CG 3.44Å; T586-L590 PolarHBondContact O-N 3.19Å; L590-D592 VanDerWaalsContact C-N 3.3Å; L590-D592 PolarHBondContact O-N 2.88Å; L590-Q593 PolarHBondContact O-N 2.88Å; L590-V594 WeakPolarHBondContact O-CB 3.48Å; L590-V594 VanDerWaalsContact O-CG2 3.26Å; L590-V594 WeakPolarHBondContact O-CG2 3.18Å; L590-V594 PolarHBondContact O-N 2.84Å
591	K	92.4	Very high	90.1	Very high	145 Å²	145	82.4 Å²	82.4	63%	0.63	42%	0.423	S	S	*	.	H	α-helix	trans	-62	-38.7	176.3	-175	179.2	178.8	-176.9	0	111.9	V587 Y588 A589 R595	V587-K591 VanDerWaalsContact O-CB 3.32Å; V587-K591 WeakPolarHBondContact O-CB 3.49Å; V587-K591 PolarHBondContact O-N 3.15Å; Y588-K591 WeakPolarHBondContact O-CB 3.36Å; Y588-K591 PolarHBondContact O-N 2.98Å; A589-K591 VanDerWaalsContact C-N 3.32Å; A589-K591 PolarHBondContact O-N 3.05Å; K591-R595 PolarHBondContact O-N 3.16Å; K591-R595 VanDerWaalsContact O-N 3.14Å
592	D	92.3	Very high	90.7	Very high	65 Å²	65	84.3 Å²	84.3	35%	0.348	44%	0.435	S	S	.	.	H	α-helix	trans	-69.7	-45.1	176.9	-155.5	57.9	0	0	0	111.6	Y588 A589 L590 V594 R595 I596	Y588-D592 PolarHBondContact O-N 3.35Å; A589-D592 PolarHBondContact O-N 2.94Å; L590-D592 VanDerWaalsContact C-N 3.3Å; L590-D592 PolarHBondContact O-N 2.88Å; D592-V594 PolarHBondContact O-N 3.39Å; D592-R595 WeakPolarHBondContact O-CB 3.29Å; D592-R595 PolarHBondContact O-N 2.97Å; D592-R595 VanDerWaalsContact O-N 3.09Å; D592-R595 IonicContact OD1-CZ 3.39Å; D592-R595 IonicContact OD1-NH1 3.85Å; D592-R595 PolarHBondContact OD1-NH1 2.88Å; D592-R595 IonicContact OD1-NH2 2.98Å; D592-R595 PolarHBondContact OD1-NH2 2.69Å; D592-R595 IonicContact OD2-NH2 3.74Å; D592-I596 WeakPolarHBondContact O-CG1 3.49Å; D592-I596 PolarHBondContact O-N 3.37Å
593	Q	90.7	Very high	91.2	Very high	107 Å²	107	86.5 Å²	86.5	50%	0.5	45%	0.446	S	S	.	.	H	α-helix	trans	-58.4	-44.6	174.5	-73.5	-179.9	-9.4	0	0	112.3	A589 L590 R595 I596 L597	A589-Q593 WeakPolarHBondContact O-CG 3.34Å; A589-Q593 PolarHBondContact O-N 2.73Å; L590-Q593 PolarHBondContact O-N 2.88Å; Q593-R595 VanDerWaalsContact C-N 3.28Å; Q593-R595 PolarHBondContact O-N 3.04Å; Q593-I596 PolarHBondContact O-N 3.41Å; Q593-L597 VanDerWaalsContact O-CB 3.31Å; Q593-L597 WeakPolarHBondContact O-CB 3.29Å; Q593-L597 PolarHBondContact O-N 2.94Å
594	V	93.1	Very high	91.8	Very high	89 Å²	89	88.9 Å²	88.9	54%	0.539	46%	0.458	S	S	.	.	H	α-helix	trans	-63.3	-35.7	176.5	170.4	0	0	0	0	111.2	L590 D592 S598	L590-V594 WeakPolarHBondContact O-CB 3.48Å; L590-V594 VanDerWaalsContact O-CG2 3.26Å; L590-V594 WeakPolarHBondContact O-CG2 3.18Å; L590-V594 PolarHBondContact O-N 2.84Å; D592-V594 PolarHBondContact O-N 3.39Å; V594-S598 VanDerWaalsContact O-CB 3.3Å; V594-S598 WeakPolarHBondContact O-CB 3.27Å; V594-S598 PolarHBondContact O-N 2.76Å; V594-S598 PolarHBondContact O-OG 2.67Å
595	R	92.9	Very high	92.3	Very high	137 Å²	137	89.7 Å²	89.7	52%	0.517	46%	0.463	S	S	.	.	H	α-helix	trans	-64.4	-49.5	174.5	-168.4	-175.2	75	-126.1	-10.1	111	K591 D592 Q593 L597 S598 E599	K591-R595 PolarHBondContact O-N 3.16Å; K591-R595 VanDerWaalsContact O-N 3.14Å; D592-R595 WeakPolarHBondContact O-CB 3.29Å; D592-R595 PolarHBondContact O-N 2.97Å; D592-R595 VanDerWaalsContact O-N 3.09Å; D592-R595 IonicContact OD1-CZ 3.39Å; D592-R595 IonicContact OD1-NH1 3.85Å; D592-R595 PolarHBondContact OD1-NH1 2.88Å; D592-R595 IonicContact OD1-NH2 2.98Å; D592-R595 PolarHBondContact OD1-NH2 2.69Å; D592-R595 IonicContact OD2-NH2 3.74Å; Q593-R595 VanDerWaalsContact C-N 3.28Å; Q593-R595 PolarHBondContact O-N 3.04Å; R595-L597 VanDerWaalsContact C-N 3.35Å; R595-L597 PolarHBondContact O-N 2.86Å; R595-S598 WeakPolarHBondContact O-CB 2.99Å; R595-S598 PolarHBondContact O-N 3.37Å; R595-E599 PolarHBondContact O-N 2.92Å
596	I	94.3	Very high	92.7	Very high	76 Å²	76	92.6 Å²	92.6	39%	0.39	47%	0.467	S	S	.	.	H	α-helix	trans	-59.9	-46	177.7	-65.6	165.8	0	0	0	110.6	D592 Q593 S598 E599 I600	D592-I596 WeakPolarHBondContact O-CG1 3.49Å; D592-I596 PolarHBondContact O-N 3.37Å; Q593-I596 PolarHBondContact O-N 3.41Å; I596-S598 VanDerWaalsContact C-N 3.29Å; I596-S598 PolarHBondContact O-N 3.24Å; I596-E599 WeakPolarHBondContact O-CB 3.36Å; I596-E599 PolarHBondContact O-N 2.98Å; I596-E599 VanDerWaalsContact O-N 3.14Å; I596-I600 HydrophobicContact CG2-CD1 3.99Å; I596-I600 WeakPolarHBondContact O-CG1 3.25Å; I596-I600 PolarHBondContact O-N 3.47Å
597	L	93.3	Very high	93.1	Very high	109 Å²	109	94.8 Å²	94.8	57%	0.571	49%	0.487	S	S	*	.	H	α-helix	trans	-63.4	-38.1	178.9	-160.8	71.9	0	0	0	111.5	Q593 R595 E599 I600 V601	Q593-L597 VanDerWaalsContact O-CB 3.31Å; Q593-L597 WeakPolarHBondContact O-CB 3.29Å; Q593-L597 PolarHBondContact O-N 2.94Å; R595-L597 VanDerWaalsContact C-N 3.35Å; R595-L597 PolarHBondContact O-N 2.86Å; L597-E599 VanDerWaalsContact C-N 3.34Å; L597-E599 PolarHBondContact O-N 3.14Å; L597-I600 PolarHBondContact O-N 3.05Å; L597-V601 WeakPolarHBondContact O-CB 3.4Å; L597-V601 VanDerWaalsContact O-CG2 3.26Å; L597-V601 WeakPolarHBondContact O-CG2 3.29Å; L597-V601 PolarHBondContact O-N 3.38Å
598	S	94.6	Very high	93.4	Very high	58 Å²	58	95.5 Å²	95.5	41%	0.406	49%	0.487	S	S	.	.	H	α-helix	trans	-64.2	-37.7	174.4	-60.2	0	0	0	0	112.1	V594 R595 I596 N602	V594-S598 VanDerWaalsContact O-CB 3.3Å; V594-S598 WeakPolarHBondContact O-CB 3.27Å; V594-S598 PolarHBondContact O-N 2.76Å; V594-S598 PolarHBondContact O-OG 2.67Å; R595-S598 WeakPolarHBondContact O-CB 2.99Å; R595-S598 PolarHBondContact O-N 3.37Å; I596-S598 VanDerWaalsContact C-N 3.29Å; I596-S598 PolarHBondContact O-N 3.24Å; S598-N602 WeakPolarHBondContact O-CB 3.4Å; S598-N602 VanDerWaalsContact O-CG 3.22Å; S598-N602 PolarHBondContact O-N 2.7Å; S598-N602 PolarHBondContact O-ND2 3.22Å
599	E	95.1	Very high	93.6	Very high	104 Å²	104	93.4 Å²	93.4	49%	0.486	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-47.6	173.5	-75.3	170.2	-170.2	0	0	111.5	R595 I596 L597 V601 N602 D603	R595-E599 PolarHBondContact O-N 2.92Å; I596-E599 WeakPolarHBondContact O-CB 3.36Å; I596-E599 PolarHBondContact O-N 2.98Å; I596-E599 VanDerWaalsContact O-N 3.14Å; L597-E599 VanDerWaalsContact C-N 3.34Å; L597-E599 PolarHBondContact O-N 3.14Å; E599-V601 VanDerWaalsContact C-N 3.33Å; E599-V601 PolarHBondContact O-N 2.65Å; E599-N602 WeakPolarHBondContact O-CB 3.16Å; E599-N602 PolarHBondContact O-N 3.23Å; E599-N602 VanDerWaalsContact O-N 3.12Å; E599-D603 PolarHBondContact O-N 3.45Å
600	I	95.7	Very high	93.9	Very high	84 Å²	84	94.6 Å²	94.6	43%	0.431	49%	0.493	S	S	.	.	H	α-helix	trans	-59	-43.5	176.4	-66.6	168.8	0	0	0	111.3	I596 L597 N602 D603 L604	I596-I600 HydrophobicContact CG2-CD1 3.99Å; I596-I600 WeakPolarHBondContact O-CG1 3.25Å; I596-I600 PolarHBondContact O-N 3.47Å; L597-I600 PolarHBondContact O-N 3.05Å; I600-N602 VanDerWaalsContact C-N 3.32Å; I600-N602 PolarHBondContact O-N 2.78Å; I600-D603 PolarHBondContact O-N 3.25Å; I600-L604 HydrophobicContact CG2-CD1 4.05Å; I600-L604 PolarHBondContact O-N 2.82Å
601	V	95.4	Very high	94.2	Very high	81 Å²	81	96 Å²	96	49%	0.491	50%	0.497	S	S	.	.	H	α-helix	trans	-63	-40.2	177.3	168.2	0	0	0	0	111.1	L597 E599 L604 T605	L597-V601 WeakPolarHBondContact O-CB 3.4Å; L597-V601 VanDerWaalsContact O-CG2 3.26Å; L597-V601 WeakPolarHBondContact O-CG2 3.29Å; L597-V601 PolarHBondContact O-N 3.38Å; E599-V601 VanDerWaalsContact C-N 3.33Å; E599-V601 PolarHBondContact O-N 2.65Å; V601-L604 PolarHBondContact O-N 3.38Å; V601-T605 WeakPolarHBondContact O-CB 3.1Å; V601-T605 PolarHBondContact O-N 3.12Å; V601-T605 PolarHBondContact O-OG1 3.2Å
602	N	95.3	Very high	94.3	Very high	90 Å²	90	94 Å²	94	48%	0.481	49%	0.489	S	S	.	.	H	α-helix	trans	-65	-40.2	175.3	-73.3	-36.6	0	0	0	111.7	S598 E599 I600 T605 R606	S598-N602 WeakPolarHBondContact O-CB 3.4Å; S598-N602 VanDerWaalsContact O-CG 3.22Å; S598-N602 PolarHBondContact O-N 2.7Å; S598-N602 PolarHBondContact O-ND2 3.22Å; E599-N602 WeakPolarHBondContact O-CB 3.16Å; E599-N602 PolarHBondContact O-N 3.23Å; E599-N602 VanDerWaalsContact O-N 3.12Å; I600-N602 VanDerWaalsContact C-N 3.32Å; I600-N602 PolarHBondContact O-N 2.78Å; N602-T605 PolarHBondContact O-N 3.02Å; N602-R606 WeakPolarHBondContact O-CG 3.44Å; N602-R606 PolarHBondContact O-N 3.12Å
603	D	96	Very high	94.4	Very high	82 Å²	82	95.1 Å²	95.1	44%	0.439	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-46.9	174.6	-80	-33.5	0	0	0	112.5	E599 I600 T605 R606 A607	E599-D603 PolarHBondContact O-N 3.45Å; I600-D603 PolarHBondContact O-N 3.25Å; D603-T605 VanDerWaalsContact C-N 3.26Å; D603-T605 PolarHBondContact O-N 3.06Å; D603-R606 PolarHBondContact O-N 3.01Å; D603-R606 IonicContact OD1-CZ 2.72Å; D603-R606 IonicContact OD1-NE 3.33Å; D603-R606 PolarHBondContact OD1-NE 2.8Å; D603-R606 IonicContact OD1-NH2 2.72Å; D603-R606 PolarHBondContact OD1-NH2 2.84Å; D603-A607 WeakPolarHBondContact O-CB 3.39Å; D603-A607 PolarHBondContact O-N 3.13Å
604	L	95.1	Very high	94.6	Very high	119 Å²	119	92 Å²	92	62%	0.623	49%	0.487	S	S	*	.	H	α-helix	trans	-59.1	-40.7	174.5	-110.9	88.5	0	0	0	111.5	I600 V601 A607 L608	I600-L604 HydrophobicContact CG2-CD1 4.05Å; I600-L604 PolarHBondContact O-N 2.82Å; V601-L604 PolarHBondContact O-N 3.38Å; L604-A607 PolarHBondContact O-N 3.11Å; L604-L608 WeakPolarHBondContact O-CB 3.14Å; L604-L608 PolarHBondContact O-N 3.35Å
605	T	95	Very high	94.5	Very high	64 Å²	64	93 Å²	93	39%	0.393	49%	0.486	S	S	.	.	H	α-helix	trans	-64.5	-41.9	178.4	-57.3	0	0	0	0	111.1	V601 N602 D603 L608 Q609	V601-T605 WeakPolarHBondContact O-CB 3.1Å; V601-T605 PolarHBondContact O-N 3.12Å; V601-T605 PolarHBondContact O-OG1 3.2Å; N602-T605 PolarHBondContact O-N 3.02Å; D603-T605 VanDerWaalsContact C-N 3.26Å; D603-T605 PolarHBondContact O-N 3.06Å; T605-L608 PolarHBondContact O-N 3.38Å; T605-Q609 WeakPolarHBondContact O-CG 3.31Å; T605-Q609 PolarHBondContact O-N 2.84Å
606	R	95	Very high	94.6	Very high	153 Å²	153	93.2 Å²	93.2	58%	0.577	49%	0.491	S	S	*	.	H	α-helix	trans	-62.8	-44.1	173.7	-75.2	-170.4	-76.5	-118.2	9.7	112	N602 D603 Q609 A610	N602-R606 WeakPolarHBondContact O-CG 3.44Å; N602-R606 PolarHBondContact O-N 3.12Å; D603-R606 PolarHBondContact O-N 3.01Å; D603-R606 IonicContact OD1-CZ 2.72Å; D603-R606 IonicContact OD1-NE 3.33Å; D603-R606 PolarHBondContact OD1-NE 2.8Å; D603-R606 IonicContact OD1-NH2 2.72Å; D603-R606 PolarHBondContact OD1-NH2 2.84Å; R606-Q609 PolarHBondContact O-N 2.8Å; R606-A610 PolarHBondContact O-N 2.8Å
607	A	95.3	Very high	94.6	Very high	62 Å²	62	97.9 Å²	97.9	51%	0.512	50%	0.503	S	S	.	.	H	α-helix	trans	-62.4	-44	177.6	0	0	0	0	0	111.6	D603 L604 Q609 A610 E611	D603-A607 WeakPolarHBondContact O-CB 3.39Å; D603-A607 PolarHBondContact O-N 3.13Å; L604-A607 PolarHBondContact O-N 3.11Å; A607-Q609 VanDerWaalsContact C-N 3.34Å; A607-Q609 PolarHBondContact O-N 3.09Å; A607-A610 PolarHBondContact O-N 3.12Å; A607-E611 WeakPolarHBondContact O-CB 3.05Å; A607-E611 PolarHBondContact O-N 2.75Å
608	L	94.2	Very high	94.3	Very high	100 Å²	100	96.7 Å²	96.7	52%	0.524	50%	0.501	S	S	.	.	H	α-helix	trans	-60.1	-42.8	175.9	179.8	64.5	0	0	0	111.9	L604 T605 E611 Q612	L604-L608 WeakPolarHBondContact O-CB 3.14Å; L604-L608 PolarHBondContact O-N 3.35Å; T605-L608 PolarHBondContact O-N 3.38Å; L608-E611 PolarHBondContact O-N 2.94Å; L608-Q612 VanDerWaalsContact O-CG 3.32Å; L608-Q612 WeakPolarHBondContact O-CG 3.4Å; L608-Q612 PolarHBondContact O-N 3.06Å
609	Q	94.8	Very high	94.2	Very high	109 Å²	109	97.2 Å²	97.2	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-65.2	-41.2	176.6	-73.9	178.1	-9.4	0	0	112.1	T605 R606 A607 E611 Q612 I613	T605-Q609 WeakPolarHBondContact O-CG 3.31Å; T605-Q609 PolarHBondContact O-N 2.84Å; R606-Q609 PolarHBondContact O-N 2.8Å; A607-Q609 VanDerWaalsContact C-N 3.34Å; A607-Q609 PolarHBondContact O-N 3.09Å; Q609-E611 VanDerWaalsContact C-N 3.34Å; Q609-Q612 PolarHBondContact O-N 3.22Å; Q609-I613 VanDerWaalsContact O-CG1 3.29Å; Q609-I613 WeakPolarHBondContact O-CG1 3.25Å; Q609-I613 PolarHBondContact O-N 3.36Å
610	A	94.5	Very high	94.1	Very high	60 Å²	60	96.1 Å²	96.1	50%	0.496	50%	0.497	S	S	.	.	H	α-helix	trans	-62	-42.9	175.9	0	0	0	0	0	111.6	R606 A607 I613 A614	R606-A610 PolarHBondContact O-N 2.8Å; A607-A610 PolarHBondContact O-N 3.12Å; A610-I613 PolarHBondContact O-N 2.9Å; A610-A614 PolarHBondContact O-N 2.57Å
611	E	94.2	Very high	94	Very high	123 Å²	123	95.8 Å²	95.8	58%	0.575	50%	0.499	S	S	*	.	H	α-helix	trans	-62.7	-45.6	176.7	-171.6	61	-158.3	0	0	111.6	A607 L608 Q609 I613 A614 Q615	A607-E611 WeakPolarHBondContact O-CB 3.05Å; A607-E611 PolarHBondContact O-N 2.75Å; L608-E611 PolarHBondContact O-N 2.94Å; Q609-E611 VanDerWaalsContact C-N 3.34Å; E611-I613 VanDerWaalsContact C-N 3.28Å; E611-I613 PolarHBondContact O-N 3.39Å; E611-A614 WeakPolarHBondContact O-CB 3.47Å; E611-A614 PolarHBondContact O-N 2.8Å; E611-A614 VanDerWaalsContact O-N 3.13Å; E611-Q615 WeakPolarHBondContact O-CB 3.38Å; E611-Q615 PolarHBondContact O-N 2.86Å
612	Q	94.3	Very high	93.8	Very high	101 Å²	101	97.2 Å²	97.2	47%	0.472	50%	0.503	S	S	.	.	H	α-helix	trans	-61.3	-35.6	176.1	-74.1	178.3	-8.7	0	0	112.8	L608 Q609 K616	L608-Q612 VanDerWaalsContact O-CG 3.32Å; L608-Q612 WeakPolarHBondContact O-CG 3.4Å; L608-Q612 PolarHBondContact O-N 3.06Å; Q609-Q612 PolarHBondContact O-N 3.22Å; Q612-K616 WeakPolarHBondContact O-CG 3.35Å; Q612-K616 PolarHBondContact O-N 3.46Å; Q612-K616 VanDerWaalsContact O-N 3.11Å
613	I	94.8	Very high	93.5	Very high	89 Å²	89	99.8 Å²	99.8	46%	0.456	51%	0.506	S	S	.	.	H	α-helix	trans	-69.4	-42.3	174.6	-68.1	165	0	0	0	110.6	Q609 A610 E611 Q615 K616 R617	Q609-I613 VanDerWaalsContact O-CG1 3.29Å; Q609-I613 WeakPolarHBondContact O-CG1 3.25Å; Q609-I613 PolarHBondContact O-N 3.36Å; A610-I613 PolarHBondContact O-N 2.9Å; E611-I613 VanDerWaalsContact C-N 3.28Å; E611-I613 PolarHBondContact O-N 3.39Å; I613-Q615 VanDerWaalsContact C-N 3.35Å; I613-K616 PolarHBondContact O-N 3.4Å; I613-R617 WeakPolarHBondContact O-CG 3.44Å; I613-R617 PolarHBondContact O-N 3.01Å; I613-R617 VanDerWaalsContact O-N 3.08Å
614	A	93.6	Very high	93.3	Very high	42 Å²	42	101.7 Å²	101.7	35%	0.347	51%	0.512	S	S	.	.	H	α-helix	trans	-61.2	-44.6	176.6	0	0	0	0	0	111.3	A610 E611 K616 R617 T618	A610-A614 PolarHBondContact O-N 2.57Å; E611-A614 WeakPolarHBondContact O-CB 3.47Å; E611-A614 PolarHBondContact O-N 2.8Å; E611-A614 VanDerWaalsContact O-N 3.13Å; A614-K616 PolarHBondContact O-N 3.42Å; A614-R617 WeakPolarHBondContact O-CB 3.28Å; A614-R617 PolarHBondContact O-N 2.94Å; A614-R617 VanDerWaalsContact O-N 3.14Å; A614-T618 PolarHBondContact O-N 2.91Å; A614-T618 PolarHBondContact O-OG1 3.17Å
615	Q	92.2	Very high	93.1	Very high	111 Å²	111	99.9 Å²	99.9	52%	0.519	50%	0.502	S	S	.	.	H	α-helix	trans	-62.4	-41.7	177.8	-165.9	173.6	15.8	0	0	112.3	E611 I613 R617 T618 D619	E611-Q615 WeakPolarHBondContact O-CB 3.38Å; E611-Q615 PolarHBondContact O-N 2.86Å; I613-Q615 VanDerWaalsContact C-N 3.35Å; Q615-R617 VanDerWaalsContact C-N 3.32Å; Q615-R617 PolarHBondContact O-N 3.33Å; Q615-T618 WeakPolarHBondContact CA-OG1 3.41Å; Q615-T618 PolarHBondContact O-N 3.05Å; Q615-T618 PolarHBondContact O-OG1 2.74Å; Q615-D619 VanDerWaalsContact O-CG 3.28Å; Q615-D619 PolarHBondContact O-N 2.84Å
616	K	93.7	Very high	92.8	Very high	141 Å²	141	101 Å²	101	61%	0.613	51%	0.509	S	S	*	.	H	α-helix	trans	-61.1	-40.9	173.6	-77.5	179.3	-179.3	177.7	0	112.3	Q612 I613 A614 D619 D620	Q612-K616 WeakPolarHBondContact O-CG 3.35Å; Q612-K616 PolarHBondContact O-N 3.46Å; Q612-K616 VanDerWaalsContact O-N 3.11Å; I613-K616 PolarHBondContact O-N 3.4Å; A614-K616 PolarHBondContact O-N 3.42Å; K616-D619 PolarHBondContact O-N 2.99Å; K616-D620 VanDerWaalsContact O-CG 3.3Å; K616-D620 PolarHBondContact O-N 2.83Å
617	R	94	Very high	92.4	Very high	173 Å²	173	96.6 Å²	96.6	65%	0.653	51%	0.505	S	S	*	.	H	α-helix	trans	-64.2	-41.9	176.7	-70.7	172.9	179	176.2	0.8	111.8	I613 A614 Q615 D619 D620 V621	I613-R617 WeakPolarHBondContact O-CG 3.44Å; I613-R617 PolarHBondContact O-N 3.01Å; I613-R617 VanDerWaalsContact O-N 3.08Å; A614-R617 WeakPolarHBondContact O-CB 3.28Å; A614-R617 PolarHBondContact O-N 2.94Å; A614-R617 VanDerWaalsContact O-N 3.14Å; Q615-R617 VanDerWaalsContact C-N 3.32Å; Q615-R617 PolarHBondContact O-N 3.33Å; R617-D619 VanDerWaalsContact C-N 3.34Å; R617-D620 PolarHBondContact O-N 2.8Å; R617-V621 WeakPolarHBondContact O-CG2 3.48Å; R617-V621 PolarHBondContact O-N 3.47Å
618	T	87.2	Confident	91.9	Very high	84 Å²	84	99.6 Å²	99.6	52%	0.515	51%	0.508	S	S	.	.	H	α-helix	trans	-65.7	-39.4	176.4	52	0	0	0	0	111.5	A614 Q615 D620 V621 L622	A614-T618 PolarHBondContact O-N 2.91Å; A614-T618 PolarHBondContact O-OG1 3.17Å; Q615-T618 WeakPolarHBondContact CA-OG1 3.41Å; Q615-T618 PolarHBondContact O-N 3.05Å; Q615-T618 PolarHBondContact O-OG1 2.74Å; T618-D620 VanDerWaalsContact C-N 3.33Å; T618-D620 PolarHBondContact O-N 3.01Å; T618-V621 PolarHBondContact O-N 2.81Å; T618-L622 WeakPolarHBondContact O-CB 3.09Å; T618-L622 PolarHBondContact O-N 2.62Å
619	D	92.1	Very high	91.3	Very high	69 Å²	69	103.5 Å²	103.5	37%	0.369	52%	0.516	S	S	.	.	H	α-helix	trans	-64.3	-37.9	175.5	-71.6	-13.6	0	0	0	112	Q615 K616 R617 L622 R623	Q615-D619 VanDerWaalsContact O-CG 3.28Å; Q615-D619 PolarHBondContact O-N 2.84Å; K616-D619 PolarHBondContact O-N 2.99Å; R617-D619 VanDerWaalsContact C-N 3.34Å; D619-L622 PolarHBondContact O-N 3.41Å; D619-R623 WeakPolarHBondContact O-CB 3.36Å; D619-R623 WeakPolarHBondContact O-CG 3.26Å; D619-R623 PolarHBondContact O-N 3.26Å
620	D	93.3	Very high	90.5	Very high	81 Å²	81	101 Å²	101	43%	0.433	51%	0.514	S	S	.	.	H	α-helix	trans	-65.4	-42.5	175.1	-73.2	-26.5	0	0	0	112.2	K616 R617 T618 L622 R623 Q624	K616-D620 VanDerWaalsContact O-CG 3.3Å; K616-D620 PolarHBondContact O-N 2.83Å; R617-D620 PolarHBondContact O-N 2.8Å; T618-D620 VanDerWaalsContact C-N 3.33Å; T618-D620 PolarHBondContact O-N 3.01Å; D620-L622 VanDerWaalsContact C-N 3.33Å; D620-R623 PolarHBondContact O-N 3.02Å; D620-R623 IonicContact OD1-CZ 3.44Å; D620-R623 IonicContact OD1-NE 3.42Å; D620-R623 PolarHBondContact OD1-NE 2.84Å; D620-R623 IonicContact OD1-NH2 3.34Å; D620-R623 PolarHBondContact OD1-NH2 2.86Å; D620-Q624 WeakPolarHBondContact O-CG 3.39Å; D620-Q624 PolarHBondContact O-N 2.69Å
621	V	93.5	Very high	89.5	Confident	78 Å²	78	100.9 Å²	100.9	47%	0.473	51%	0.51	S	S	.	.	H	α-helix	trans	-62.9	-42.4	173.9	171.7	0	0	0	0	110.7	R617 T618 R623 Q624 I625	R617-V621 WeakPolarHBondContact O-CG2 3.48Å; R617-V621 PolarHBondContact O-N 3.47Å; T618-V621 PolarHBondContact O-N 2.81Å; V621-R623 VanDerWaalsContact C-N 3.33Å; V621-R623 PolarHBondContact O-N 2.9Å; V621-Q624 WeakPolarHBondContact O-CB 3.19Å; V621-Q624 PolarHBondContact O-N 2.77Å; V621-I625 HydrophobicContact CG1-CD1 3.89Å; V621-I625 HydrophobicContact CG1-CG1 4.48Å; V621-I625 WeakPolarHBondContact O-CG1 3.42Å; V621-I625 PolarHBondContact O-N 2.9Å
622	L	91.6	Very high	88.3	Confident	110 Å²	110	98.7 Å²	98.7	58%	0.576	51%	0.505	S	S	*	.	H	α-helix	trans	-65.1	-40	179.2	-151.3	149.7	0	0	0	110.9	T618 D619 D620 I625 V626	T618-L622 WeakPolarHBondContact O-CB 3.09Å; T618-L622 PolarHBondContact O-N 2.62Å; D619-L622 PolarHBondContact O-N 3.41Å; D620-L622 VanDerWaalsContact C-N 3.33Å; L622-I625 PolarHBondContact O-N 3.25Å; L622-V626 HydrophobicContact CD2-CG2 4.23Å; L622-V626 VanDerWaalsContact O-CG2 3.26Å; L622-V626 WeakPolarHBondContact O-CG2 3.2Å; L622-V626 PolarHBondContact O-N 2.83Å
623	R	89.7	Confident	86.8	Confident	144 Å²	144	98 Å²	98	54%	0.543	51%	0.508	S	S	.	.	H	α-helix	trans	-60.5	-42.6	170.9	-78.3	-173.7	-81.8	-90.4	3.2	112.5	D619 D620 V621 V626 A627	D619-R623 WeakPolarHBondContact O-CB 3.36Å; D619-R623 WeakPolarHBondContact O-CG 3.26Å; D619-R623 PolarHBondContact O-N 3.26Å; D620-R623 PolarHBondContact O-N 3.02Å; D620-R623 IonicContact OD1-CZ 3.44Å; D620-R623 IonicContact OD1-NE 3.42Å; D620-R623 PolarHBondContact OD1-NE 2.84Å; D620-R623 IonicContact OD1-NH2 3.34Å; D620-R623 PolarHBondContact OD1-NH2 2.86Å; V621-R623 VanDerWaalsContact C-N 3.33Å; V621-R623 PolarHBondContact O-N 2.9Å; R623-V626 PolarHBondContact O-N 3.12Å; R623-A627 WeakPolarHBondContact O-CB 3.26Å; R623-A627 PolarHBondContact O-N 2.87Å
624	Q	91.7	Very high	85	Confident	123 Å²	123	96.6 Å²	96.6	58%	0.575	51%	0.506	S	S	*	.	H	α-helix	trans	-62.9	-46.5	176.4	-77.1	179.6	-10	0	0	112.1	D620 V621 V626 A627 E628	D620-Q624 WeakPolarHBondContact O-CG 3.39Å; D620-Q624 PolarHBondContact O-N 2.69Å; V621-Q624 WeakPolarHBondContact O-CB 3.19Å; V621-Q624 PolarHBondContact O-N 2.77Å; Q624-V626 VanDerWaalsContact C-N 3.29Å; Q624-V626 PolarHBondContact O-N 2.99Å; Q624-A627 WeakPolarHBondContact O-CB 3.48Å; Q624-A627 PolarHBondContact O-N 2.88Å; Q624-A627 VanDerWaalsContact O-N 3.12Å; Q624-E628 WeakPolarHBondContact O-CG 3.49Å; Q624-E628 PolarHBondContact O-N 2.91Å
625	I	90.8	Very high	83.3	Confident	81 Å²	81	98.1 Å²	98.1	42%	0.415	51%	0.513	S	S	.	.	H	α-helix	trans	-61	-40.2	178.1	-67.6	167.1	0	0	0	111.1	V621 L622 E628 R629	V621-I625 HydrophobicContact CG1-CD1 3.89Å; V621-I625 HydrophobicContact CG1-CG1 4.48Å; V621-I625 WeakPolarHBondContact O-CG1 3.42Å; V621-I625 PolarHBondContact O-N 2.9Å; L622-I625 PolarHBondContact O-N 3.25Å; I625-E628 PolarHBondContact O-N 2.9Å; I625-R629 WeakPolarHBondContact O-CB 3.42Å; I625-R629 WeakPolarHBondContact O-CG 3.36Å; I625-R629 PolarHBondContact O-N 3Å
626	V	89.2	Confident	81.5	Confident	87 Å²	87	98.8 Å²	98.8	53%	0.527	52%	0.52	S	S	.	.	H	α-helix	trans	-65.1	-41.3	176.1	172	0	0	0	0	111.1	L622 R623 Q624 R629 A630	L622-V626 HydrophobicContact CD2-CG2 4.23Å; L622-V626 VanDerWaalsContact O-CG2 3.26Å; L622-V626 WeakPolarHBondContact O-CG2 3.2Å; L622-V626 PolarHBondContact O-N 2.83Å; R623-V626 PolarHBondContact O-N 3.12Å; Q624-V626 VanDerWaalsContact C-N 3.29Å; Q624-V626 PolarHBondContact O-N 2.99Å; V626-R629 PolarHBondContact O-N 3.42Å; V626-A630 PolarHBondContact O-N 2.76Å
627	A	86.2	Confident	79.8	Confident	61 Å²	61	94.8 Å²	94.8	50%	0.504	51%	0.51	S	S	.	.	H	α-helix	trans	-65.6	-42	176.2	0	0	0	0	0	112.4	R623 Q624 R629 A630 S631	R623-A627 WeakPolarHBondContact O-CB 3.26Å; R623-A627 PolarHBondContact O-N 2.87Å; Q624-A627 WeakPolarHBondContact O-CB 3.48Å; Q624-A627 PolarHBondContact O-N 2.88Å; Q624-A627 VanDerWaalsContact O-N 3.12Å; A627-R629 PolarHBondContact O-N 2.72Å; A627-A630 PolarHBondContact O-N 3.48Å; A627-S631 PolarHBondContact O-N 2.95Å
628	E	85.3	Confident	78	Confident	124 Å²	124	91.3 Å²	91.3	58%	0.579	50%	0.504	S	S	*	.	H	α-helix	trans	-61.8	-42.3	174.8	-75	179.9	176.5	0	0	111.5	Q624 I625 A630 S631 T632	Q624-E628 WeakPolarHBondContact O-CG 3.49Å; Q624-E628 PolarHBondContact O-N 2.91Å; I625-E628 PolarHBondContact O-N 2.9Å; E628-A630 VanDerWaalsContact C-N 3.33Å; E628-A630 PolarHBondContact O-N 2.74Å; E628-S631 WeakPolarHBondContact CA-OG 3.33Å; E628-S631 PolarHBondContact O-N 3.24Å; E628-S631 PolarHBondContact O-OG 3.25Å; E628-T632 PolarHBondContact O-N 2.84Å; E628-T632 PolarHBondContact O-OG1 2.87Å
629	R	81.6	Confident	76.4	Confident	183 Å²	183	90.5 Å²	90.5	69%	0.691	50%	0.501	S	S	*	.	H	α-helix	trans	-62.7	-36.8	173.4	-78.5	-175.7	173.4	-173.9	-0.7	112.9	I625 V626 A627 T632 T633	I625-R629 WeakPolarHBondContact O-CB 3.42Å; I625-R629 WeakPolarHBondContact O-CG 3.36Å; I625-R629 PolarHBondContact O-N 3Å; V626-R629 PolarHBondContact O-N 3.42Å; A627-R629 PolarHBondContact O-N 2.72Å; R629-T632 WeakPolarHBondContact CA-OG1 3.18Å; R629-T632 PolarHBondContact O-OG1 3.23Å; R629-T632 VanDerWaalsContact O-OG1 3.07Å; R629-T633 VanDerWaalsContact O-CG2 3.31Å; R629-T633 WeakPolarHBondContact O-CG2 3.48Å; R629-T633 PolarHBondContact O-N 2.89Å; R629-T633 VanDerWaalsContact O-N 3.12Å; R629-T633 PolarHBondContact O-OG1 2.93Å; R629-T633 VanDerWaalsContact O-OG1 3.07Å
630	A	77.5	Confident	74.6	Confident	56 Å²	56	90.2 Å²	90.2	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-70	-36	174.9	0	0	0	0	0	112.4	V626 A627 E628 T633 S634	V626-A630 PolarHBondContact O-N 2.76Å; A627-A630 PolarHBondContact O-N 3.48Å; E628-A630 VanDerWaalsContact C-N 3.33Å; E628-A630 PolarHBondContact O-N 2.74Å; A630-T633 PolarHBondContact O-OG1 3.08Å; A630-T633 VanDerWaalsContact O-OG1 3.05Å; A630-S634 PolarHBondContact O-N 3.11Å; A630-S634 VanDerWaalsContact O-N 3.16Å; A630-S634 PolarHBondContact O-OG 3.33Å
631	S	74	Confident	72.8	Confident	58 Å²	58	92.5 Å²	92.5	41%	0.406	52%	0.515	S	S	.	.	H	α-helix	trans	-71.5	-35.5	176.2	71.7	0	0	0	0	113	A627 E628 S634 S635	A627-S631 PolarHBondContact O-N 2.95Å; E628-S631 WeakPolarHBondContact CA-OG 3.33Å; E628-S631 PolarHBondContact O-N 3.24Å; E628-S631 PolarHBondContact O-OG 3.25Å; S631-S634 WeakPolarHBondContact CA-OG 3.35Å; S631-S634 PolarHBondContact O-OG 2.81Å; S631-S635 WeakPolarHBondContact O-CB 3.23Å; S631-S635 PolarHBondContact O-N 2.76Å; S631-S635 PolarHBondContact O-OG 3.43Å
632	T	68.4	Low	70.9	Confident	76 Å²	76	94.7 Å²	94.7	47%	0.466	52%	0.524	S	S	.	.	H	α-helix	trans	-73.1	-37.1	177	44.1	0	0	0	0	112.2	E628 R629 S635 L636	E628-T632 PolarHBondContact O-N 2.84Å; E628-T632 PolarHBondContact O-OG1 2.87Å; R629-T632 WeakPolarHBondContact CA-OG1 3.18Å; R629-T632 PolarHBondContact O-OG1 3.23Å; R629-T632 VanDerWaalsContact O-OG1 3.07Å; T632-S635 PolarHBondContact O-N 3.04Å; T632-L636 WeakPolarHBondContact O-CB 3.27Å; T632-L636 WeakPolarHBondContact O-CG 3.39Å; T632-L636 PolarHBondContact O-N 3.31Å
633	T	61.8	Low	69.1	Low	88 Å²	88	98 Å²	98	54%	0.54	53%	0.53	S	S	.	.	H	α-helix	trans	-68.1	-37	174	53.4	0	0	0	0	112.7	R629 A630 L636 S637	R629-T633 VanDerWaalsContact O-CG2 3.31Å; R629-T633 WeakPolarHBondContact O-CG2 3.48Å; R629-T633 PolarHBondContact O-N 2.89Å; R629-T633 VanDerWaalsContact O-N 3.12Å; R629-T633 PolarHBondContact O-OG1 2.93Å; R629-T633 VanDerWaalsContact O-OG1 3.07Å; A630-T633 PolarHBondContact O-OG1 3.08Å; A630-T633 VanDerWaalsContact O-OG1 3.05Å; T633-L636 PolarHBondContact O-N 2.82Å; T633-S637 WeakPolarHBondContact O-CB 3.36Å; T633-S637 PolarHBondContact O-N 2.77Å
634	S	58.2	Low	67.4	Low	59 Å²	59	95 Å²	95	41%	0.413	53%	0.531	S	S	.	.	H	α-helix	trans	-68.1	-36.6	172.4	48	0	0	0	0	112.4	A630 S631 S637 N638	A630-S634 PolarHBondContact O-N 3.11Å; A630-S634 VanDerWaalsContact O-N 3.16Å; A630-S634 PolarHBondContact O-OG 3.33Å; S631-S634 WeakPolarHBondContact CA-OG 3.35Å; S631-S634 PolarHBondContact O-OG 2.81Å; S634-S637 PolarHBondContact O-N 3.06Å; S634-N638 PolarHBondContact O-N 3.32Å; S634-N638 PolarHBondContact O-ND2 3.02Å
635	S	57.1	Low	65.6	Low	73 Å²	73	93.5 Å²	93.5	51%	0.51	53%	0.534	S	S	.	.	H	α-helix	trans	-63.7	-42.9	172.9	-54.9	0	0	0	0	112.2	S631 T632 N638 C639	S631-S635 WeakPolarHBondContact O-CB 3.23Å; S631-S635 PolarHBondContact O-N 2.76Å; S631-S635 PolarHBondContact O-OG 3.43Å; T632-S635 PolarHBondContact O-N 3.04Å; S635-N638 PolarHBondContact O-N 2.85Å; S635-C639 PolarHBondContact O-N 3.17Å
636	L	55.5	Low	63.8	Low	125 Å²	125	92.9 Å²	92.9	65%	0.654	54%	0.541	S	S	*	.	H	α-helix	trans	-66	-38.5	174.5	-76	163.2	0	0	0	112	T632 T633 C639 A640	T632-L636 WeakPolarHBondContact O-CB 3.27Å; T632-L636 WeakPolarHBondContact O-CG 3.39Å; T632-L636 PolarHBondContact O-N 3.31Å; T633-L636 PolarHBondContact O-N 2.82Å; L636-C639 PolarHBondContact O-N 2.99Å; L636-A640 WeakPolarHBondContact O-CB 3.28Å; L636-A640 PolarHBondContact O-N 2.83Å
637	S	56.4	Low	62	Low	58 Å²	58	97 Å²	97	41%	0.406	55%	0.554	S	S	.	*	H	α-helix	trans	-64.4	-39	175.2	174.9	0	0	0	0	112.4	T633 S634 A640 K641	T633-S637 WeakPolarHBondContact O-CB 3.36Å; T633-S637 PolarHBondContact O-N 2.77Å; S634-S637 PolarHBondContact O-N 3.06Å; S637-A640 PolarHBondContact O-N 3.32Å; S637-K641 PolarHBondContact O-N 2.83Å; S637-K641 VanDerWaalsContact O-N 3.15Å
638	N	56.1	Low	60.3	Low	99 Å²	99	97.6 Å²	97.6	53%	0.529	57%	0.567	S	S	.	*	H	α-helix	trans	-66.7	-41.9	175.3	-72.1	-20.5	0	0	0	111	S634 S635 A640 K641 D642	S634-N638 PolarHBondContact O-N 3.32Å; S634-N638 PolarHBondContact O-ND2 3.02Å; S635-N638 PolarHBondContact O-N 2.85Å; N638-A640 VanDerWaalsContact C-N 3.32Å; N638-A640 PolarHBondContact O-N 2.97Å; N638-K641 PolarHBondContact O-N 3.14Å; N638-D642 PolarHBondContact O-N 3.36Å
639	C	55.1	Low	58.4	Low	67 Å²	67	95.7 Å²	95.7	45%	0.453	57%	0.572	S	S	.	*	H	α-helix	trans	-61.9	-39.6	175.2	-155.5	0	0	0	0	111.8	S635 L636 K641 D642 Y643	S635-C639 PolarHBondContact O-N 3.17Å; L636-C639 PolarHBondContact O-N 2.99Å; C639-K641 VanDerWaalsContact C-N 3.34Å; C639-K641 PolarHBondContact O-N 2.96Å; C639-D642 PolarHBondContact O-N 3.32Å; C639-Y643 WeakPolarHBondContact O-CD2 3.29Å; C639-Y643 PolarHBondContact O-N 2.84Å
640	A	53.9	Low	56.6	Low	63 Å²	63	96.5 Å²	96.5	52%	0.521	60%	0.598	S	S	.	*	H	α-helix	trans	-65.7	-33	176.8	0	0	0	0	0	113.5	L636 S637 N638 Y643 S644	L636-A640 WeakPolarHBondContact O-CB 3.28Å; L636-A640 PolarHBondContact O-N 2.83Å; S637-A640 PolarHBondContact O-N 3.32Å; N638-A640 VanDerWaalsContact C-N 3.32Å; N638-A640 PolarHBondContact O-N 2.97Å; A640-Y643 PolarHBondContact O-N 3.1Å; A640-S644 PolarHBondContact O-N 2.83Å
641	K	55.2	Low	55.6	Low	130 Å²	130	98.5 Å²	98.5	57%	0.565	60%	0.604	S	S	*	*	H	α-helix	trans	-71.5	-32.7	176.2	-79.3	-177.2	177	176.5	0	113.1	S637 N638 C639 Y643 S644 S645	S637-K641 PolarHBondContact O-N 2.83Å; S637-K641 VanDerWaalsContact O-N 3.15Å; N638-K641 PolarHBondContact O-N 3.14Å; C639-K641 VanDerWaalsContact C-N 3.34Å; C639-K641 PolarHBondContact O-N 2.96Å; K641-Y643 VanDerWaalsContact C-N 3.31Å; K641-S644 PolarHBondContact O-N 3.23Å; K641-S645 PolarHBondContact O-N 2.67Å; K641-S645 PolarHBondContact O-OG 2.65Å; K641-S645 VanDerWaalsContact O-OG 3.09Å
642	D	54.5	Low	54.6	Low	124 Å²	124	100.6 Å²	100.6	66%	0.663	62%	0.615	S	S	*	*	H	α-helix	trans	-68.9	-33.2	175.5	-73.2	-21.7	0	0	0	111.3	N638 C639	N638-D642 PolarHBondContact O-N 3.36Å; C639-D642 PolarHBondContact O-N 3.32Å
643	Y	52.8	Low	53.8	Low	179 Å²	179	102 Å²	102	70%	0.702	62%	0.623	S	S	*	*	H	α-helix	trans	-71.4	-38.3	173	-82.3	-78.3	0	0	0	113.4	C639 A640 K641 S645 A646	C639-Y643 WeakPolarHBondContact O-CD2 3.29Å; C639-Y643 PolarHBondContact O-N 2.84Å; A640-Y643 PolarHBondContact O-N 3.1Å; K641-Y643 VanDerWaalsContact C-N 3.31Å; Y643-S645 PolarHBondContact O-N 3.2Å; Y643-A646 PolarHBondContact O-N 3.15Å; Y643-A646 VanDerWaalsContact O-N 3.14Å
644	S	54.3	Low	53.4	Low	80 Å²	80	102.8 Å²	102.8	56%	0.559	63%	0.628	S	S	*	*	H	α-helix	trans	-70.1	-18.8	178.9	91.1	0	0	0	0	113.3	A640 K641 A646	A640-S644 PolarHBondContact O-N 2.83Å; K641-S644 PolarHBondContact O-N 3.23Å; S644-A646 VanDerWaalsContact C-N 3.31Å
645	S	53.7	Low	53.1	Low	92 Å²	92	105.6 Å²	105.6	64%	0.643	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-17.3	175.2	-58.4	0	0	0	0	112.5	K641 Y643	K641-S645 PolarHBondContact O-N 2.67Å; K641-S645 PolarHBondContact O-OG 2.65Å; K641-S645 VanDerWaalsContact O-OG 3.09Å; Y643-S645 PolarHBondContact O-N 3.2Å
646	A	53	Low	52.8	Low	69 Å²	69	107.7 Å²	107.7	57%	0.57	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-26.8	177.3	0	0	0	0	0	113.4	Y643 S644 G648	Y643-A646 PolarHBondContact O-N 3.15Å; Y643-A646 VanDerWaalsContact O-N 3.14Å; S644-A646 VanDerWaalsContact C-N 3.31Å; A646-G648 VanDerWaalsContact C-N 3.29Å; A646-G648 PolarHBondContact O-N 3.49Å
647	E	52	Low	52.6	Low	172 Å²	172	106.5 Å²	106.5	80%	0.804	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-6.2	-179.6	-78.9	-173.4	157	0	0	114.3
648	G	49.2	Very low	52.3	Low	74 Å²	74	110.2 Å²	110.2	76%	0.763	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	1.7	176.4	0	0	0	0	0	115.6	A646	A646-G648 VanDerWaalsContact C-N 3.29Å; A646-G648 PolarHBondContact O-N 3.49Å
649	A	46.9	Very low	52	Low	84 Å²	84	111.2 Å²	111.2	69%	0.694	68%	0.68	S	S	*	*			trans	-114.4	18.2	-165.9	0	0	0	0	0	116
650	T	43.7	Very low	51.7	Low	200 Å²	200	115.2 Å²	115.2	100%	1.227	70%	0.701	S	S	*	*			trans	-123.4	0	173	55.2	0	0	0	0	113.2

Retrieved 650 of 650 residues in 168 ms (Link to these results)

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