A0A077Z6E6_TRITR Loading...

Reverse transcriptase

AlphaFold DB , UniProt , Accession A0A077Z6E6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 315 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.6	Very low	29.7	Very low	235 Å²	235	135.2 Å²	135.2	100%	1.158	75%	0.746	S	S	*	*				0	110.3	0	-75	177	162.7	0	0	106.2
2	P	26.7	Very low	30.6	Very low	129 Å²	129	136.6 Å²	136.6	84%	0.838	75%	0.751	S	S	*	*			trans	-72.9	141	-167.2	30.8	-31.3	0	0	0	109.7	A4	P2-A4 PolarHBondContact O-N 3.49Å
3	N	26.3	Very low	31.4	Very low	152 Å²	152	132.9 Å²	132.9	81%	0.813	73%	0.729	S	S	*	*			trans	-50.9	125.3	169.1	-63.7	-35.2	0	0	0	108	E5	N3-E5 VanDerWaalsContact C-N 3.28Å; N3-E5 PolarHBondContact O-N 3.38Å
4	A	27.8	Very low	31.9	Very low	93 Å²	93	125.2 Å²	125.2	77%	0.769	70%	0.696	S	S	*	*			trans	-63.5	97.4	168.9	0	0	0	0	0	107.2	P2 I6	P2-A4 PolarHBondContact O-N 3.49Å; A4-I6 PolarHBondContact O-N 2.7Å
5	E	23.9	Very low	32.4	Very low	157 Å²	157	120.8 Å²	120.8	73%	0.734	67%	0.673	S	S	*	*			trans	-59.2	106.2	163.9	-78.7	177.3	158.7	0	0	106.9	N3 Y7	N3-E5 VanDerWaalsContact C-N 3.28Å; N3-E5 PolarHBondContact O-N 3.38Å; E5-Y7 VanDerWaalsContact C-N 3.26Å; E5-Y7 HydrophobicContact CB-CD2 4.48Å; E5-Y7 PolarHBondContact O-N 2.72Å
6	I	31.1	Very low	32.9	Very low	148 Å²	148	119.5 Å²	119.5	76%	0.759	66%	0.659	S	S	*	*			trans	-70.5	93.1	170.9	-60.9	173.9	0	0	0	105.7	A4 T8	A4-I6 PolarHBondContact O-N 2.7Å; I6-T8 PolarHBondContact O-N 3.11Å
7	Y	26.6	Very low	33.5	Very low	181 Å²	181	115.4 Å²	115.4	71%	0.71	63%	0.633	S	S	*	*			trans	-59.1	119.7	164.8	-94.2	-97.5	0	0	0	108.8	E5 D9	E5-Y7 VanDerWaalsContact C-N 3.26Å; E5-Y7 HydrophobicContact CB-CD2 4.48Å; E5-Y7 PolarHBondContact O-N 2.72Å; Y7-D9 PolarHBondContact O-N 3Å
8	T	32.2	Very low	34.2	Very low	129 Å²	129	110 Å²	110	79%	0.791	60%	0.604	S	S	*	*			trans	-70.8	75.5	173.2	48.9	0	0	0	0	110	I6	I6-T8 PolarHBondContact O-N 3.11Å
9	D	30.7	Very low	34.9	Very low	111 Å²	111	108 Å²	108	59%	0.594	59%	0.592	S	S	*	*			trans	-90.2	112.3	165	-84.9	-24.6	0	0	0	109.4	Y7	Y7-D9 PolarHBondContact O-N 3Å
10	S	33.8	Very low	35.6	Very low	83 Å²	83	106.4 Å²	106.4	58%	0.58	59%	0.585	S	S	*	*			trans	23.1	128.5	156.6	60.3	0	0	0	0	118.3	L12	S10-L12 PolarHBondContact O-N 3.44Å
11	C	37	Very low	36.4	Very low	69 Å²	69	102 Å²	102	47%	0.466	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.3	26.9	179.7	-48.6	0	0	0	0	116.7	Q95 C96	C11-Q95 PolarHBondContact SG-O 3Å; C11-C96 WeakPolarHBondContact CB-SG 3.26Å; C11-C96 WeakPolarHBondContact SG-CB 2.77Å; C11-C96 CovalentContact SG-SG 2.05Å; C11-C96 PolarHBondContact SG-SG 3.35Å
12	L	40.8	Very low	37.8	Very low	152 Å²	152	91.3 Å²	91.3	80%	0.796	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-2.8	179.7	-98.7	147.5	0	0	0	113.9	S10	S10-L12 PolarHBondContact O-N 3.44Å
13	N	40.3	Very low	38.7	Very low	89 Å²	89	89 Å²	89	48%	0.476	50%	0.495	S	S	.	.			trans	-121.7	87	176.6	-88.2	-37.8	0	0	0	110.6	T15 K16	N13-T15 PolarHBondContact O-N 3.26Å; N13-T15 VanDerWaalsContact O-N 3.09Å; N13-K16 HydrophobicContact CB-CD 4.36Å; N13-K16 HydrophobicContact CB-CG 4.25Å; N13-K16 WeakPolarHBondContact O-CB 3.46Å; N13-K16 PolarHBondContact O-N 3.49Å
14	G	38.3	Very low	39.7	Very low	25 Å²	25	86 Å²	86	26%	0.258	48%	0.478	S	S	.	.	H	α-helix	trans	-47.8	-38.4	175.6	0	0	0	0	0	112.5	K16 H17 L18 Y130	G14-K16 VanDerWaalsContact C-N 3.25Å; G14-K16 PolarHBondContact O-N 2.85Å; G14-K16 VanDerWaalsContact O-N 3.16Å; G14-H17 WeakPolarHBondContact O-CA 3.12Å; G14-H17 WeakPolarHBondContact O-CB 3.27Å; G14-H17 PolarHBondContact O-N 2.04Å; G14-L18 PolarHBondContact O-N 3.42Å; G14-Y130 WeakPolarHBondContact O-CE1 3.41Å; G14-Y130 PolarHBondContact O-OH 3.46Å
15	T	39.4	Very low	40.7	Very low	59 Å²	59	84.3 Å²	84.3	36%	0.362	46%	0.458	S	S	.	.	H	α-helix	trans	-51.4	-37.3	175.1	45.3	0	0	0	0	114.2	N13 L19 Y130	N13-T15 PolarHBondContact O-N 3.26Å; N13-T15 VanDerWaalsContact O-N 3.09Å; T15-L19 WeakPolarHBondContact O-CB 3.31Å; T15-L19 WeakPolarHBondContact O-CD1 3.22Å; T15-L19 VanDerWaalsContact O-CG 3.3Å; T15-L19 WeakPolarHBondContact O-CG 3.19Å; T15-L19 PolarHBondContact O-N 3.22Å; T15-Y130 HydrophobicContact CG2-CD1 3.92Å; T15-Y130 HydrophobicContact CG2-CE1 4.42Å; T15-Y130 VanDerWaalsContact N-CE1 3.28Å
16	K	40.5	Very low	42.1	Very low	100 Å²	100	78.3 Å²	78.3	44%	0.435	43%	0.428	S	S	.	.	H	α-helix	trans	-70.5	-32.8	175.5	-70.6	-174.7	179	-178.9	0	111.9	N13 G14 L19 V20	N13-K16 HydrophobicContact CB-CD 4.36Å; N13-K16 HydrophobicContact CB-CG 4.25Å; N13-K16 WeakPolarHBondContact O-CB 3.46Å; N13-K16 PolarHBondContact O-N 3.49Å; G14-K16 VanDerWaalsContact C-N 3.25Å; G14-K16 PolarHBondContact O-N 2.85Å; G14-K16 VanDerWaalsContact O-N 3.16Å; K16-L19 CarbonylContact O-C 3.52Å; K16-L19 WeakPolarHBondContact O-CB 3.36Å; K16-L19 PolarHBondContact O-N 2.68Å; K16-V20 WeakPolarHBondContact O-CG2 3.46Å; K16-V20 PolarHBondContact O-N 2.91Å
17	H	43.2	Very low	43.1	Very low	49 Å²	49	75.1 Å²	75.1	23%	0.227	41%	0.412	C	S	.	.	H	α-helix	trans	-73.4	-38.9	-178.9	-74.4	-69.4	0	0	0	112.8	G14 L19 V20 F21 C96 M100	G14-H17 WeakPolarHBondContact O-CA 3.12Å; G14-H17 WeakPolarHBondContact O-CB 3.27Å; G14-H17 PolarHBondContact O-N 2.04Å; H17-L19 VanDerWaalsContact C-N 3.32Å; H17-V20 CarbonylContact O-C 3.53Å; H17-V20 WeakPolarHBondContact O-CA 3.43Å; H17-V20 WeakPolarHBondContact O-CB 3.44Å; H17-V20 PolarHBondContact O-N 3.48Å; H17-F21 PolarHBondContact O-N 3.03Å; H17-C96 PolarHBondContact CE1-SG 2.99Å; H17-C96 PolarHBondContact NE2-SG 2.94Å; H17-M100 HydrophobicContact CB-CG 4.27Å; H17-M100 HydrophobicContact CB-SD 3.71Å
18	L	47.1	Very low	44.7	Very low	19 Å²	19	69.3 Å²	69.3	10%	0.099	41%	0.408	C	S	.	.	H	α-helix	trans	-67.4	-37.1	170.3	-153.7	114.2	0	0	0	112.2	G14 V20 F21 C22 W126 Y130	G14-L18 PolarHBondContact O-N 3.42Å; L18-V20 PolarHBondContact O-N 3.47Å; L18-F21 PolarHBondContact O-N 3.48Å; L18-C22 VanDerWaalsContact CD2-SG 3.56Å; L18-C22 WeakPolarHBondContact O-CA 3.49Å; L18-C22 WeakPolarHBondContact O-CB 3.46Å; L18-C22 PolarHBondContact O-N 3.27Å; L18-C22 PolarHBondContact O-SG 2.94Å; L18-W126 HydrophobicContact CD1-CD2 3.96Å; L18-W126 HydrophobicContact CD1-CE3 3.39Å; L18-W126 HydrophobicContact CD1-CH2 3.63Å; L18-W126 HydrophobicContact CD1-CZ2 4.12Å; L18-W126 HydrophobicContact CD1-CZ3 3.2Å; L18-W126 HydrophobicContact CD2-CE3 4.44Å; L18-W126 HydrophobicContact CD2-CH2 3.02Å; L18-W126 HydrophobicContact CD2-CZ2 3.67Å; L18-W126 HydrophobicContact CD2-CZ3 3.47Å; L18-W126 VanDerWaalsContact CD2-CZ3 3.47Å; L18-W126 HydrophobicContact CG-CE3 4.48Å; L18-W126 HydrophobicContact CG-CH2 3.89Å; L18-W126 HydrophobicContact CG-CZ2 4.47Å; L18-W126 HydrophobicContact CG-CZ3 3.86Å; L18-Y130 HydrophobicContact CB-CE1 3.8Å; L18-Y130 WeakPolarHBondContact CB-OH 3.34Å; L18-Y130 HydrophobicContact CD1-CE2 4.06Å; L18-Y130 PolarHBondContact N-OH 2.87Å
19	L	47	Very low	46.4	Very low	72 Å²	72	63.4 Å²	63.4	38%	0.377	37%	0.372	S	S	.	.	H	α-helix	trans	-63.9	-23.1	169.7	-75.6	166.5	0	0	0	112	T15 K16 H17 C22 S23 V25 T30	T15-L19 WeakPolarHBondContact O-CB 3.31Å; T15-L19 WeakPolarHBondContact O-CD1 3.22Å; T15-L19 VanDerWaalsContact O-CG 3.3Å; T15-L19 WeakPolarHBondContact O-CG 3.19Å; T15-L19 PolarHBondContact O-N 3.22Å; K16-L19 CarbonylContact O-C 3.52Å; K16-L19 WeakPolarHBondContact O-CB 3.36Å; K16-L19 PolarHBondContact O-N 2.68Å; H17-L19 VanDerWaalsContact C-N 3.32Å; L19-C22 CarbonylContact O-C 3.6Å; L19-S23 WeakPolarHBondContact O-CA 2.93Å; L19-S23 WeakPolarHBondContact O-CB 3.13Å; L19-S23 PolarHBondContact O-N 3.24Å; L19-V25 HydrophobicContact CD2-CG2 3.8Å; L19-T30 HydrophobicContact CD2-CG2 4.22Å
20	V	48.2	Very low	48.3	Very low	76 Å²	76	60.4 Å²	60.4	46%	0.461	36%	0.358	S	S	.	.	H	α-helix	trans	-78.8	-39.6	171.5	169.4	0	0	0	0	110.8	K16 H17 L18 S23	K16-V20 WeakPolarHBondContact O-CG2 3.46Å; K16-V20 PolarHBondContact O-N 2.91Å; H17-V20 CarbonylContact O-C 3.53Å; H17-V20 WeakPolarHBondContact O-CA 3.43Å; H17-V20 WeakPolarHBondContact O-CB 3.44Å; H17-V20 PolarHBondContact O-N 3.48Å; L18-V20 PolarHBondContact O-N 3.47Å; V20-S23 WeakPolarHBondContact O-CB 3.48Å; V20-S23 PolarHBondContact O-N 3.34Å; V20-S23 PolarHBondContact O-OG 3.27Å
21	F	54.2	Low	50.4	Low	13 Å²	13	56.5 Å²	56.5	6%	0.057	33%	0.33	C	S	.	.	H	α-helix	trans	-66.7	-47.1	174.9	-161.3	-125	0	0	0	111.7	H17 L18 S23 P35 L77 M100 E104	H17-F21 PolarHBondContact O-N 3.03Å; L18-F21 PolarHBondContact O-N 3.48Å; F21-S23 PolarHBondContact O-N 2.88Å; F21-P35 HydrophobicContact CE1-CG 4.1Å; F21-P35 HydrophobicContact CE2-CB 4.33Å; F21-P35 HydrophobicContact CZ-CB 4.32Å; F21-P35 HydrophobicContact CZ-CG 4.04Å; F21-P35 WeakPolarHBondContact O-CB 3.41Å; F21-L77 HydrophobicContact CE1-CD1 4.35Å; F21-M100 HydrophobicContact CB-CE 3.26Å; F21-M100 HydrophobicContact CD2-CE 3.43Å; F21-M100 VanDerWaalsContact CD2-CE 3.43Å; F21-M100 HydrophobicContact CG-CE 3.67Å; F21-E104 HydrophobicContact CD2-CG 4.06Å; F21-E104 HydrophobicContact CE2-CG 3.23Å; F21-E104 WeakPolarHBondContact CE2-OE1 3.3Å; F21-E104 HydrophobicContact CZ-CG 3.89Å
22	C	59.1	Low	52.7	Low	12 Å²	12	53.4 Å²	53.4	8%	0.081	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	23.1	175.9	-50.5	0	0	0	0	111.2	L18 L19 M24 V25 C33	L18-C22 VanDerWaalsContact CD2-SG 3.56Å; L18-C22 WeakPolarHBondContact O-CA 3.49Å; L18-C22 WeakPolarHBondContact O-CB 3.46Å; L18-C22 PolarHBondContact O-N 3.27Å; L18-C22 PolarHBondContact O-SG 2.94Å; L19-C22 CarbonylContact O-C 3.6Å; C22-M24 CarbonylContact O-C 3.15Å; C22-M24 PolarHBondContact O-N 3.38Å; C22-V25 PolarHBondContact O-N 3.41Å; C22-C33 WeakPolarHBondContact CA-SG 3.16Å; C22-C33 HydrophobicContact CB-CB 3.68Å; C22-C33 WeakPolarHBondContact CB-SG 3.46Å; C22-C33 WeakPolarHBondContact SG-CB 3.01Å; C22-C33 CovalentContact SG-SG 2.01Å; C22-C33 PolarHBondContact SG-SG 3.3Å
23	S	46.3	Very low	54.6	Low	80 Å²	80	46.2 Å²	46.2	56%	0.559	27%	0.271	S	S	*	.			trans	-66.3	-3.5	-171.3	53.7	0	0	0	0	116.2	L19 V20 F21 V25	L19-S23 WeakPolarHBondContact O-CA 2.93Å; L19-S23 WeakPolarHBondContact O-CB 3.13Å; L19-S23 PolarHBondContact O-N 3.24Å; V20-S23 WeakPolarHBondContact O-CB 3.48Å; V20-S23 PolarHBondContact O-N 3.34Å; V20-S23 PolarHBondContact O-OG 3.27Å; F21-S23 PolarHBondContact O-N 2.88Å; S23-V25 PolarHBondContact O-N 3Å
24	M	46.1	Very low	56.4	Low	90 Å²	90	42 Å²	42	44%	0.443	25%	0.248	S	C	.	.	S	Bend	trans	-74.6	68.5	145	-61.9	-140.4	-158.8	0	0	108.5	C22 Y26 A37	C22-M24 CarbonylContact O-C 3.15Å; C22-M24 PolarHBondContact O-N 3.38Å; M24-Y26 HydrophobicContact CB-CD2 4.44Å; M24-Y26 HydrophobicContact CB-CE2 4.46Å; M24-Y26 PolarHBondContact O-N 2.93Å; M24-A37 HydrophobicContact CE-CB 3.78Å; M24-A37 HydrophobicContact SD-CB 4.21Å
25	V	49.9	Very low	58.1	Low	57 Å²	57	42.4 Å²	42.4	35%	0.345	25%	0.247	S	C	.	.			trans	-61.3	90.1	163.6	-177.1	0	0	0	0	104.2	L19 C22 S23 L27 G28	L19-V25 HydrophobicContact CD2-CG2 3.8Å; C22-V25 PolarHBondContact O-N 3.41Å; S23-V25 PolarHBondContact O-N 3Å; V25-L27 VanDerWaalsContact C-N 3.25Å; V25-L27 PolarHBondContact O-N 2.79Å; V25-G28 VanDerWaalsContact CG1-CA 3.41Å
26	Y	51.8	Low	59.8	Low	30 Å²	30	42 Å²	42	12%	0.118	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-61.1	97.6	174.9	-95.2	-70.9	0	0	0	106	M24 G28 T29 D34 L39 R41 A44	M24-Y26 HydrophobicContact CB-CD2 4.44Å; M24-Y26 HydrophobicContact CB-CE2 4.46Å; M24-Y26 PolarHBondContact O-N 2.93Å; Y26-G28 PolarHBondContact O-N 2.82Å; Y26-T29 PolarHBondContact O-N 2.77Å; Y26-T29 PolarHBondContact O-OG1 3.46Å; Y26-D34 HydrophobicContact CE2-CB 4.1Å; Y26-L39 PolarHBondContact OH-O 3.29Å; Y26-R41 HydrophobicContact CD1-CG 4.35Å; Y26-R41 VanDerWaalsContact CE1-CA 3.45Å; Y26-R41 HydrophobicContact CE1-CB 3.84Å; Y26-R41 HydrophobicContact CE1-CG 4.15Å; Y26-A44 HydrophobicContact CD1-CB 3.7Å; Y26-A44 HydrophobicContact CD2-CB 3.95Å; Y26-A44 HydrophobicContact CE1-CB 3.96Å; Y26-A44 HydrophobicContact CE2-CB 4.13Å; Y26-A44 HydrophobicContact CG-CB 3.71Å
27	L	53.2	Low	61.6	Low	81 Å²	81	39.6 Å²	39.6	42%	0.424	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	51.6	50.2	172.1	-67.7	158.2	0	0	0	114.4	V25 T29 R41 D45 K48	V25-L27 VanDerWaalsContact C-N 3.25Å; V25-L27 PolarHBondContact O-N 2.79Å; L27-T29 VanDerWaalsContact C-N 3.33Å; L27-T29 PolarHBondContact O-N 3.48Å; L27-R41 HydrophobicContact CD1-CG 4.45Å; L27-D45 WeakPolarHBondContact CD1-OD1 3.49Å; L27-K48 PolarHBondContact O-NZ 3.1Å
28	G	58.9	Low	63.4	Low	60 Å²	60	38.9 Å²	38.9	62%	0.619	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	74.6	14.9	174.9	0	0	0	0	0	115.4	V25 Y26	V25-G28 VanDerWaalsContact CG1-CA 3.41Å; Y26-G28 PolarHBondContact O-N 2.82Å
29	T	67.8	Low	65.1	Low	5 Å²	5	38.2 Å²	38.2	3%	0.031	23%	0.233	C	C	.	.			trans	-103	144.8	177.4	79.3	0	0	0	0	112.7	Y26 L27 M31 K48	Y26-T29 PolarHBondContact O-N 2.77Å; Y26-T29 PolarHBondContact O-OG1 3.46Å; L27-T29 VanDerWaalsContact C-N 3.33Å; L27-T29 PolarHBondContact O-N 3.48Å; T29-M31 HydrophobicContact CG2-CE 4.2Å; T29-K48 HydrophobicContact CG2-CD 3.44Å; T29-K48 VanDerWaalsContact CG2-CD 3.44Å; T29-K48 HydrophobicContact CG2-CG 4.02Å
30	T	70.7	Confident	66.9	Low	48 Å²	48	37 Å²	37	29%	0.294	23%	0.231	S	C	.	.	S	Bend	trans	-103	10.3	168.8	80.5	0	0	0	0	112.3	L19 S58 V60	L19-T30 HydrophobicContact CD2-CG2 4.22Å; T30-S58 PolarHBondContact OG1-O 3Å; T30-V60 WeakPolarHBondContact OG1-CG2 3.41Å
31	M	79.5	Confident	68.5	Low	1 Å²	1	40.6 Å²	40.6	1%	0.005	24%	0.236	C	C	.	.	S	Bend	trans	-77.7	-27.9	-179	-66.1	-174.7	-70.1	0	0	112.2	T29 K48 L51 V52 V74 L75 I76	T29-M31 HydrophobicContact CG2-CE 4.2Å; M31-K48 HydrophobicContact CE-CB 4.3Å; M31-K48 HydrophobicContact CE-CG 3.68Å; M31-L51 HydrophobicContact CB-CD1 4.44Å; M31-L51 HydrophobicContact SD-CB 4.04Å; M31-L51 HydrophobicContact SD-CD1 4.21Å; M31-V52 HydrophobicContact CE-CG2 3.88Å; M31-V74 HydrophobicContact CB-CG1 4.12Å; M31-V74 HydrophobicContact CG-CG1 3.9Å; M31-V74 HydrophobicContact SD-CG1 3.89Å; M31-L75 CarbonylContact O-C 2.99Å; M31-L75 WeakPolarHBondContact O-CA 3.47Å; M31-I76 PolarHBondContact O-N 3.46Å
32	I	83.6	Confident	69.9	Low	3 Å²	3	45.2 Å²	45.2	2%	0.015	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	124.5	-176.9	-54.1	174.4	0	0	0	107.9	L39 A44 I47 I76 L78	I32-L39 HydrophobicContact CG2-CD1 4.13Å; I32-A44 HydrophobicContact CD1-CB 4.22Å; I32-A44 WeakPolarHBondContact CD1-O 3.28Å; I32-I47 HydrophobicContact CD1-CB 3.99Å; I32-I47 HydrophobicContact CD1-CG2 3.81Å; I32-I47 HydrophobicContact CG1-CG2 4.42Å; I32-I76 CarbonylContact C-O 3.54Å; I32-I76 HydrophobicContact CG1-CD1 4.29Å; I32-L78 HydrophobicContact CG2-CD1 3.76Å
33	C	80.8	Confident	71.3	Confident	1 Å²	1	47 Å²	47	1%	0.007	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	107	173.9	-175.6	0	0	0	0	108.5	C22 P35 L75 I76 L77 L78	C22-C33 WeakPolarHBondContact CA-SG 3.16Å; C22-C33 HydrophobicContact CB-CB 3.68Å; C22-C33 WeakPolarHBondContact CB-SG 3.46Å; C22-C33 WeakPolarHBondContact SG-CB 3.01Å; C22-C33 CovalentContact SG-SG 2.01Å; C22-C33 PolarHBondContact SG-SG 3.3Å; C33-P35 VanDerWaalsContact C-CD 3.47Å; C33-P35 WeakPolarHBondContact O-CD 3.2Å; C33-L75 HydrophobicContact CB-CD1 4.4Å; C33-I76 PolarHBondContact N-O 3.44Å; C33-L77 HydrophobicContact CB-CD1 3.69Å; C33-L77 WeakPolarHBondContact SG-CD1 3.14Å; C33-L78 PolarHBondContact O-N 3.26Å
34	D	79.8	Confident	73.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.247	C	C	.	.			trans	-125.1	71.9	-178.8	-170.9	11.6	0	0	0	111.5	Y26 F36 A37 L38 L39 L78	Y26-D34 HydrophobicContact CE2-CB 4.1Å; D34-F36 PolarHBondContact O-N 3.25Å; D34-F36 VanDerWaalsContact O-N 3.12Å; D34-A37 PolarHBondContact O-N 2.97Å; D34-A37 PolarHBondContact OD1-N 3.23Å; D34-A37 VanDerWaalsContact OD1-N 3.09Å; D34-A37 VanDerWaalsContact OD2-C 3.3Å; D34-A37 VanDerWaalsContact OD2-CA 3.29Å; D34-A37 WeakPolarHBondContact OD2-CA 3.28Å; D34-L38 VanDerWaalsContact CG-N 3.27Å; D34-L38 PolarHBondContact OD1-N 3.32Å; D34-L38 PolarHBondContact OD2-N 3.38Å; D34-L39 PolarHBondContact OD2-N 3.19Å; D34-L78 HydrophobicContact CB-CB 4.37Å; D34-L78 HydrophobicContact CB-CD1 4.05Å
35	P	72.8	Confident	75.1	Confident	34 Å²	34	41.1 Å²	41.1	22%	0.221	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.2	179.3	21.1	-31.6	0	0	0	113	F21 C33 L78	F21-P35 HydrophobicContact CE1-CG 4.1Å; F21-P35 HydrophobicContact CE2-CB 4.33Å; F21-P35 HydrophobicContact CZ-CB 4.32Å; F21-P35 HydrophobicContact CZ-CG 4.04Å; F21-P35 WeakPolarHBondContact O-CB 3.41Å; C33-P35 VanDerWaalsContact C-CD 3.47Å; C33-P35 WeakPolarHBondContact O-CD 3.2Å; P35-L78 WeakPolarHBondContact CD-O 3.45Å
36	F	75	Confident	76.9	Confident	50 Å²	50	42.3 Å²	42.3	22%	0.219	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	1.7	-174.4	-61.1	-64.1	0	0	0	114.1	D34 L38 V79 T80 M83	D34-F36 PolarHBondContact O-N 3.25Å; D34-F36 VanDerWaalsContact O-N 3.12Å; F36-L38 HydrophobicContact CB-CD2 3.95Å; F36-L38 HydrophobicContact CB-CG 3.89Å; F36-L38 PolarHBondContact O-N 3.42Å; F36-V79 HydrophobicContact CE2-CG1 4.28Å; F36-T80 HydrophobicContact CB-CG2 3.93Å; F36-T80 HydrophobicContact CD1-CG2 3.8Å; F36-T80 HydrophobicContact CD2-CG2 3.97Å; F36-T80 HydrophobicContact CE1-CG2 4.4Å; F36-T80 HydrophobicContact CG-CG2 3.58Å; F36-M83 HydrophobicContact CD1-CG 4.21Å; F36-M83 HydrophobicContact CE1-CE 4.14Å; F36-M83 HydrophobicContact CE1-CG 3.19Å; F36-M83 HydrophobicContact CE1-SD 3.32Å; F36-M83 WeakPolarHBondContact CE1-SD 3.28Å; F36-M83 HydrophobicContact CZ-CE 3.66Å; F36-M83 HydrophobicContact CZ-CG 3.6Å; F36-M83 HydrophobicContact CZ-SD 3.5Å; F36-M83 WeakPolarHBondContact CZ-SD 3.5Å
37	A	78.7	Confident	78.7	Confident	51 Å²	51	40.9 Å²	40.9	42%	0.421	24%	0.236	S	C	.	.			trans	49	44.2	-174.2	0	0	0	0	0	112.4	M24 D34 L39	M24-A37 HydrophobicContact CE-CB 3.78Å; M24-A37 HydrophobicContact SD-CB 4.21Å; D34-A37 PolarHBondContact O-N 2.97Å; D34-A37 PolarHBondContact OD1-N 3.23Å; D34-A37 VanDerWaalsContact OD1-N 3.09Å; D34-A37 VanDerWaalsContact OD2-C 3.3Å; D34-A37 VanDerWaalsContact OD2-CA 3.29Å; D34-A37 WeakPolarHBondContact OD2-CA 3.28Å; A37-L39 VanDerWaalsContact C-N 3.28Å
38	L	80.6	Confident	80.2	Confident	33 Å²	33	39.4 Å²	39.4	17%	0.173	23%	0.226	C	C	.	.			trans	-69.6	-28.9	176.4	-61.6	-171.9	0	0	0	112.1	D34 F36 L78 T80 K142 W188	D34-L38 VanDerWaalsContact CG-N 3.27Å; D34-L38 PolarHBondContact OD1-N 3.32Å; D34-L38 PolarHBondContact OD2-N 3.38Å; F36-L38 HydrophobicContact CB-CD2 3.95Å; F36-L38 HydrophobicContact CB-CG 3.89Å; F36-L38 PolarHBondContact O-N 3.42Å; L38-L78 HydrophobicContact CB-CD2 4Å; L38-L78 HydrophobicContact CD1-CB 4.2Å; L38-L78 HydrophobicContact CD1-CD2 4.43Å; L38-T80 HydrophobicContact CD2-CG2 4.36Å; L38-K142 HydrophobicContact CD1-CB 4.02Å; L38-K142 HydrophobicContact CD1-CD 4.29Å; L38-K142 HydrophobicContact CD2-CD 4.24Å; L38-W188 HydrophobicContact CB-CH2 4.28Å
39	L	83.4	Confident	81.4	Confident	5 Å²	5	40.6 Å²	40.6	3%	0.026	22%	0.218	C	C	.	.	S	Bend	trans	-95.5	144.6	175.1	-65.4	170.2	0	0	0	110.1	Y26 I32 D34 A37 Q43 I47 L78 W188 F189	Y26-L39 PolarHBondContact OH-O 3.29Å; I32-L39 HydrophobicContact CG2-CD1 4.13Å; D34-L39 PolarHBondContact OD2-N 3.19Å; A37-L39 VanDerWaalsContact C-N 3.28Å; L39-Q43 HydrophobicContact CB-CB 4.29Å; L39-Q43 HydrophobicContact CD2-CB 4.04Å; L39-I47 HydrophobicContact CD1-CD1 4.11Å; L39-I47 HydrophobicContact CD2-CD1 4.5Å; L39-L78 HydrophobicContact CD1-CD1 3.77Å; L39-L78 HydrophobicContact CD1-CD2 3.72Å; L39-L78 HydrophobicContact CD1-CG 4.42Å; L39-L78 HydrophobicContact CD2-CD2 4.26Å; L39-L78 HydrophobicContact CG-CD2 3.62Å; L39-W188 HydrophobicContact CD2-CH2 3.59Å; L39-W188 HydrophobicContact CD2-CZ2 4.47Å; L39-W188 HydrophobicContact CD2-CZ3 4.12Å; L39-W188 HydrophobicContact CG-CH2 4.3Å; L39-F189 HydrophobicContact CD2-CD2 3.65Å; L39-F189 HydrophobicContact CD2-CE2 3.97Å
40	S	84.1	Confident	82.2	Confident	48 Å²	48	42.7 Å²	42.7	34%	0.336	23%	0.229	S	C	.	.			trans	-73.4	161.6	160.8	80.2	0	0	0	0	110.3	T42 Q43 A44	S40-T42 VanDerWaalsContact C-N 3.3Å; S40-T42 PolarHBondContact O-N 3.37Å; S40-T42 PolarHBondContact OG-N 3.09Å; S40-T42 PolarHBondContact OG-OG1 2.65Å; S40-Q43 WeakPolarHBondContact O-CB 3.37Å; S40-Q43 PolarHBondContact O-N 3.04Å; S40-Q43 VanDerWaalsContact O-N 3.13Å; S40-Q43 WeakPolarHBondContact OG-CB 3.27Å; S40-Q43 VanDerWaalsContact OG-CG 3.28Å; S40-Q43 WeakPolarHBondContact OG-CG 3.22Å; S40-Q43 PolarHBondContact OG-N 2.73Å; S40-A44 PolarHBondContact O-N 3.06Å
41	R	81.5	Confident	83	Confident	151 Å²	151	40.6 Å²	40.6	57%	0.57	22%	0.216	S	C	*	.	H	α-helix	trans	-56.3	-42.5	173.7	-176.9	173.3	170.8	175.5	-2.5	113.4	Y26 L27 Q43 A44 D45	Y26-R41 HydrophobicContact CD1-CG 4.35Å; Y26-R41 VanDerWaalsContact CE1-CA 3.45Å; Y26-R41 HydrophobicContact CE1-CB 3.84Å; Y26-R41 HydrophobicContact CE1-CG 4.15Å; L27-R41 HydrophobicContact CD1-CG 4.45Å; R41-Q43 VanDerWaalsContact C-N 3.29Å; R41-Q43 PolarHBondContact O-N 3.38Å; R41-A44 PolarHBondContact O-N 3.2Å; R41-D45 WeakPolarHBondContact O-CB 3.27Å; R41-D45 PolarHBondContact O-N 1.98Å
42	T	85.5	Confident	83.1	Confident	109 Å²	109	44.3 Å²	44.3	67%	0.669	24%	0.238	S	C	*	.	H	α-helix	trans	-65.7	-34.5	179	51.9	0	0	0	0	112	S40 L46	S40-T42 VanDerWaalsContact C-N 3.3Å; S40-T42 PolarHBondContact O-N 3.37Å; S40-T42 PolarHBondContact OG-N 3.09Å; S40-T42 PolarHBondContact OG-OG1 2.65Å; T42-L46 WeakPolarHBondContact O-CB 3.5Å; T42-L46 PolarHBondContact O-N 3.11Å; T42-L46 VanDerWaalsContact O-N 3.1Å
43	Q	88.3	Confident	83.1	Confident	50 Å²	50	51.9 Å²	51.9	23%	0.234	27%	0.271	C	S	.	.	H	α-helix	trans	-68.7	-43.7	175.2	-74.7	176.2	-31.1	0	0	112	L39 S40 R41 L46 I47 F189	L39-Q43 HydrophobicContact CB-CB 4.29Å; L39-Q43 HydrophobicContact CD2-CB 4.04Å; S40-Q43 WeakPolarHBondContact O-CB 3.37Å; S40-Q43 PolarHBondContact O-N 3.04Å; S40-Q43 VanDerWaalsContact O-N 3.13Å; S40-Q43 WeakPolarHBondContact OG-CB 3.27Å; S40-Q43 VanDerWaalsContact OG-CG 3.28Å; S40-Q43 WeakPolarHBondContact OG-CG 3.22Å; S40-Q43 PolarHBondContact OG-N 2.73Å; R41-Q43 VanDerWaalsContact C-N 3.29Å; R41-Q43 PolarHBondContact O-N 3.38Å; Q43-L46 PolarHBondContact O-N 2.93Å; Q43-I47 WeakPolarHBondContact O-CG1 3.27Å; Q43-I47 PolarHBondContact O-N 2.91Å; Q43-F189 HydrophobicContact CB-CD2 4.01Å; Q43-F189 HydrophobicContact CB-CE1 4.42Å; Q43-F189 HydrophobicContact CB-CE2 3.4Å; Q43-F189 VanDerWaalsContact CB-CE2 3.4Å; Q43-F189 HydrophobicContact CB-CZ 3.64Å; Q43-F189 HydrophobicContact CG-CD1 4.15Å; Q43-F189 HydrophobicContact CG-CD2 3.93Å; Q43-F189 HydrophobicContact CG-CE1 3.84Å; Q43-F189 HydrophobicContact CG-CE2 3.62Å; Q43-F189 HydrophobicContact CG-CG 4.19Å; Q43-F189 HydrophobicContact CG-CZ 3.56Å
44	A	85.8	Confident	83.1	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-63	-43.1	176	0	0	0	0	0	111.8	Y26 I32 S40 R41 L46 I47 K48	Y26-A44 HydrophobicContact CD1-CB 3.7Å; Y26-A44 HydrophobicContact CD2-CB 3.95Å; Y26-A44 HydrophobicContact CE1-CB 3.96Å; Y26-A44 HydrophobicContact CE2-CB 4.13Å; Y26-A44 HydrophobicContact CG-CB 3.71Å; I32-A44 HydrophobicContact CD1-CB 4.22Å; I32-A44 WeakPolarHBondContact CD1-O 3.28Å; S40-A44 PolarHBondContact O-N 3.06Å; R41-A44 PolarHBondContact O-N 3.2Å; A44-L46 PolarHBondContact O-N 3.09Å; A44-I47 PolarHBondContact O-N 3.18Å; A44-K48 WeakPolarHBondContact O-CB 3.48Å; A44-K48 PolarHBondContact O-N 3.16Å
45	D	85.8	Confident	83.1	Confident	45 Å²	45	53.4 Å²	53.4	24%	0.241	29%	0.285	C	S	.	.	H	α-helix	trans	-63	-40.8	177.5	-75.1	-26.6	0	0	0	112.1	L27 R41 I47 K48 D49	L27-D45 WeakPolarHBondContact CD1-OD1 3.49Å; R41-D45 WeakPolarHBondContact O-CB 3.27Å; R41-D45 PolarHBondContact O-N 1.98Å; D45-I47 PolarHBondContact O-N 3.23Å; D45-K48 PolarHBondContact O-N 2.86Å; D45-D49 WeakPolarHBondContact O-CB 3.24Å; D45-D49 PolarHBondContact O-N 3.16Å
46	L	87.7	Confident	83.5	Confident	82 Å²	82	52 Å²	52	43%	0.429	28%	0.276	S	S	.	.	H	α-helix	trans	-60	-45.2	175.8	-170.4	96.6	0	0	0	111.9	T42 Q43 A44 N50 F189 V193	T42-L46 WeakPolarHBondContact O-CB 3.5Å; T42-L46 PolarHBondContact O-N 3.11Å; T42-L46 VanDerWaalsContact O-N 3.1Å; Q43-L46 PolarHBondContact O-N 2.93Å; A44-L46 PolarHBondContact O-N 3.09Å; L46-N50 PolarHBondContact O-N 3.05Å; L46-F189 HydrophobicContact CD2-CE1 4.14Å; L46-F189 HydrophobicContact CD2-CZ 3.8Å; L46-V193 HydrophobicContact CD2-CG1 4.22Å; L46-V193 HydrophobicContact CD2-CG2 3.83Å
47	I	88.4	Confident	83.4	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-64.8	-47.1	178.2	-69.9	170.5	0	0	0	110.3	I32 L39 Q43 A44 D45 D49 N50 L51 I76 F189 L192 V193 I196	I32-I47 HydrophobicContact CD1-CB 3.99Å; I32-I47 HydrophobicContact CD1-CG2 3.81Å; I32-I47 HydrophobicContact CG1-CG2 4.42Å; L39-I47 HydrophobicContact CD1-CD1 4.11Å; L39-I47 HydrophobicContact CD2-CD1 4.5Å; Q43-I47 WeakPolarHBondContact O-CG1 3.27Å; Q43-I47 PolarHBondContact O-N 2.91Å; A44-I47 PolarHBondContact O-N 3.18Å; D45-I47 PolarHBondContact O-N 3.23Å; I47-D49 VanDerWaalsContact C-N 3.34Å; I47-D49 PolarHBondContact O-N 3.47Å; I47-N50 PolarHBondContact O-N 3.45Å; I47-L51 HydrophobicContact CG2-CD1 3.8Å; I47-L51 HydrophobicContact CG2-CG 4.38Å; I47-L51 WeakPolarHBondContact O-CG 3.39Å; I47-L51 PolarHBondContact O-N 3.35Å; I47-I76 HydrophobicContact CG2-CD1 3.53Å; I47-F189 HydrophobicContact CD1-CE2 3.83Å; I47-F189 HydrophobicContact CG1-CE2 4.2Å; I47-L192 HydrophobicContact CD1-CD2 3.73Å; I47-L192 HydrophobicContact CD1-CG 4.27Å; I47-V193 HydrophobicContact CG1-CG2 4.42Å; I47-I196 HydrophobicContact CB-CD1 4.47Å; I47-I196 HydrophobicContact CD1-CD1 4.23Å; I47-I196 HydrophobicContact CG1-CD1 4.18Å; I47-I196 HydrophobicContact CG2-CD1 3.52Å
48	K	85.6	Confident	82.9	Confident	50 Å²	50	49.9 Å²	49.9	22%	0.217	26%	0.264	C	S	.	.	H	α-helix	trans	-53.9	-50.2	177.3	173.7	-173.1	178.4	168.4	0	111.2	L27 T29 M31 A44 D45 N50 L51 V52	L27-K48 PolarHBondContact O-NZ 3.1Å; T29-K48 HydrophobicContact CG2-CD 3.44Å; T29-K48 VanDerWaalsContact CG2-CD 3.44Å; T29-K48 HydrophobicContact CG2-CG 4.02Å; M31-K48 HydrophobicContact CE-CB 4.3Å; M31-K48 HydrophobicContact CE-CG 3.68Å; A44-K48 WeakPolarHBondContact O-CB 3.48Å; A44-K48 PolarHBondContact O-N 3.16Å; D45-K48 PolarHBondContact O-N 2.86Å; K48-N50 VanDerWaalsContact C-N 3.29Å; K48-N50 PolarHBondContact O-N 2.98Å; K48-L51 PolarHBondContact O-N 3.36Å; K48-V52 HydrophobicContact CG-CG2 4.34Å; K48-V52 WeakPolarHBondContact O-CG2 3.29Å; K48-V52 PolarHBondContact O-N 3.01Å
49	D	84.3	Confident	82.2	Confident	85 Å²	85	49.5 Å²	49.5	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-61.5	-38.3	-177.8	-83	-0.4	0	0	0	112.3	D45 I47 K53	D45-D49 WeakPolarHBondContact O-CB 3.24Å; D45-D49 PolarHBondContact O-N 3.16Å; I47-D49 VanDerWaalsContact C-N 3.34Å; I47-D49 PolarHBondContact O-N 3.47Å; D49-K53 WeakPolarHBondContact O-CB 3.23Å; D49-K53 WeakPolarHBondContact O-CD 3.48Å; D49-K53 WeakPolarHBondContact O-CG 3.47Å; D49-K53 PolarHBondContact O-N 2.05Å; D49-K53 VanDerWaalsContact O-N 3.08Å
50	N	85.2	Confident	81.2	Confident	49 Å²	49	49.5 Å²	49.5	26%	0.262	26%	0.264	S	S	.	.	H	α-helix	trans	-66.6	-42.7	176.5	-74.4	-13.6	0	0	0	111.9	L46 I47 K48 A54	L46-N50 PolarHBondContact O-N 3.05Å; I47-N50 PolarHBondContact O-N 3.45Å; K48-N50 VanDerWaalsContact C-N 3.29Å; K48-N50 PolarHBondContact O-N 2.98Å; N50-A54 PolarHBondContact O-N 3.48Å; N50-A54 VanDerWaalsContact O-N 3.15Å
51	L	86.3	Confident	80	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-65.8	-45.7	178.6	-69.2	170.5	0	0	0	112.1	M31 I47 K48 K53 A54 G55 F56 V74 I76 I196 T200	M31-L51 HydrophobicContact CB-CD1 4.44Å; M31-L51 HydrophobicContact SD-CB 4.04Å; M31-L51 HydrophobicContact SD-CD1 4.21Å; I47-L51 HydrophobicContact CG2-CD1 3.8Å; I47-L51 HydrophobicContact CG2-CG 4.38Å; I47-L51 WeakPolarHBondContact O-CG 3.39Å; I47-L51 PolarHBondContact O-N 3.35Å; K48-L51 PolarHBondContact O-N 3.36Å; L51-K53 VanDerWaalsContact C-N 3.35Å; L51-K53 PolarHBondContact O-N 3.44Å; L51-A54 PolarHBondContact O-N 2.94Å; L51-A54 VanDerWaalsContact O-N 3.15Å; L51-G55 PolarHBondContact O-N 3Å; L51-F56 HydrophobicContact CB-CB 4.22Å; L51-F56 HydrophobicContact CB-CD2 4.5Å; L51-F56 HydrophobicContact CD2-CD2 3.95Å; L51-F56 HydrophobicContact CD2-CE2 4.41Å; L51-F56 HydrophobicContact CD2-CG 4.4Å; L51-F56 WeakPolarHBondContact O-CB 3.3Å; L51-F56 PolarHBondContact O-N 3.37Å; L51-V74 HydrophobicContact CD1-CG1 3.81Å; L51-V74 HydrophobicContact CD2-CG1 4.07Å; L51-V74 HydrophobicContact CD2-CG2 4.22Å; L51-V74 HydrophobicContact CG-CG1 4.35Å; L51-I76 HydrophobicContact CD1-CD1 3.85Å; L51-I196 HydrophobicContact CD2-CG2 3.71Å; L51-I196 HydrophobicContact CG-CG2 4.14Å; L51-T200 HydrophobicContact CD2-CG2 4.03Å
52	V	83.3	Confident	78.7	Confident	79 Å²	79	43.1 Å²	43.1	48%	0.479	24%	0.243	S	C	.	.	H	α-helix	trans	-62.8	-42.5	178.3	173.2	0	0	0	0	110.8	M31 K48 A54 G55	M31-V52 HydrophobicContact CE-CG2 3.88Å; K48-V52 HydrophobicContact CG-CG2 4.34Å; K48-V52 WeakPolarHBondContact O-CG2 3.29Å; K48-V52 PolarHBondContact O-N 3.01Å; V52-A54 PolarHBondContact O-N 3.25Å; V52-G55 PolarHBondContact O-N 2.88Å
53	K	82.9	Confident	76.9	Confident	162 Å²	162	45 Å²	45	70%	0.704	25%	0.248	S	C	*	.	H	α-helix	trans	-61.4	-32.4	175.9	-76.6	170.5	-171.5	164.7	0	112.9	D49 L51 G55	D49-K53 WeakPolarHBondContact O-CB 3.23Å; D49-K53 WeakPolarHBondContact O-CD 3.48Å; D49-K53 WeakPolarHBondContact O-CG 3.47Å; D49-K53 PolarHBondContact O-N 2.05Å; D49-K53 VanDerWaalsContact O-N 3.08Å; L51-K53 VanDerWaalsContact C-N 3.35Å; L51-K53 PolarHBondContact O-N 3.44Å; K53-G55 PolarHBondContact O-N 3.29Å
54	A	80.3	Confident	74.7	Confident	15 Å²	15	48 Å²	48	12%	0.124	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-4.5	175.6	0	0	0	0	0	113.4	N50 L51 V52 F56 T200	N50-A54 PolarHBondContact O-N 3.48Å; N50-A54 VanDerWaalsContact O-N 3.15Å; L51-A54 PolarHBondContact O-N 2.94Å; L51-A54 VanDerWaalsContact O-N 3.15Å; V52-A54 PolarHBondContact O-N 3.25Å; A54-F56 HydrophobicContact CB-CD2 3.94Å; A54-F56 HydrophobicContact CB-CE2 4.09Å; A54-T200 HydrophobicContact CB-CG2 3.48Å; A54-T200 VanDerWaalsContact CB-CG2 3.48Å
55	G	79.6	Confident	72.6	Confident	18 Å²	18	54.1 Å²	54.1	19%	0.186	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	13.2	177.3	0	0	0	0	0	114.7	L51 V52 K53 T70	L51-G55 PolarHBondContact O-N 3Å; V52-G55 PolarHBondContact O-N 2.88Å; K53-G55 PolarHBondContact O-N 3.29Å; G55-T70 VanDerWaalsContact O-CB 3.22Å; G55-T70 WeakPolarHBondContact O-CB 2.84Å; G55-T70 PolarHBondContact O-OG1 3.08Å
56	F	81.4	Confident	70.3	Confident	5 Å²	5	56.1 Å²	56.1	2%	0.022	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	145.7	170.2	-68.6	-82.7	0	0	0	111	L51 A54 W72 V74 V136 F163 V199 T200 T203	L51-F56 HydrophobicContact CB-CB 4.22Å; L51-F56 HydrophobicContact CB-CD2 4.5Å; L51-F56 HydrophobicContact CD2-CD2 3.95Å; L51-F56 HydrophobicContact CD2-CE2 4.41Å; L51-F56 HydrophobicContact CD2-CG 4.4Å; L51-F56 WeakPolarHBondContact O-CB 3.3Å; L51-F56 PolarHBondContact O-N 3.37Å; A54-F56 HydrophobicContact CB-CD2 3.94Å; A54-F56 HydrophobicContact CB-CE2 4.09Å; F56-W72 WeakPolarHBondContact CA-O 3.41Å; F56-W72 HydrophobicContact CD1-CB 3.97Å; F56-W72 HydrophobicContact CE1-CB 4.05Å; F56-V74 HydrophobicContact CB-CB 4.41Å; F56-V74 HydrophobicContact CB-CG1 3.78Å; F56-V74 HydrophobicContact CD1-CB 3.74Å; F56-V74 HydrophobicContact CD1-CG1 4.07Å; F56-V74 HydrophobicContact CE1-CB 4.25Å; F56-V74 HydrophobicContact CG-CB 4.17Å; F56-V74 HydrophobicContact CG-CG1 4.02Å; F56-V136 HydrophobicContact CE1-CG2 4.19Å; F56-V136 HydrophobicContact CZ-CG2 4.5Å; F56-F163 HydrophobicContact CE1-CE2 4.3Å; F56-F163 AromaticContact CE1-CZ 3.91Å; F56-F163 HydrophobicContact CE1-CZ 3.91Å; F56-F163 AromaticContact CZ-CZ 3.93Å; F56-F163 HydrophobicContact CZ-CZ 3.93Å; F56-V199 HydrophobicContact CZ-CG1 4.34Å; F56-T200 HydrophobicContact CD2-CG2 4.41Å; F56-T200 HydrophobicContact CE2-CG2 4.08Å; F56-T203 HydrophobicContact CZ-CG2 4.21Å
57	S	73.7	Confident	68.2	Low	12 Å²	12	58.4 Å²	58.4	8%	0.084	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	155.7	175.1	70.7	0	0	0	0	113.4	C59 T70 W72	S57-C59 PolarHBondContact O-N 2.84Å; S57-T70 WeakPolarHBondContact CB-OG1 3.18Å; S57-T70 PolarHBondContact N-OG1 3.23Å; S57-T70 VanDerWaalsContact N-OG1 3.11Å; S57-T70 PolarHBondContact OG-N 3.26Å; S57-W72 PolarHBondContact N-O 3.44Å; S57-W72 VanDerWaalsContact N-O 3.09Å
58	S	66.6	Low	66.3	Low	45 Å²	45	68.3 Å²	68.3	32%	0.315	39%	0.392	S	S	.	.	S	Bend	trans	-83.7	19.3	170.8	62.1	0	0	0	0	113.6	T30	T30-S58 PolarHBondContact OG1-O 3Å
59	C	65.8	Low	64.9	Low	25 Å²	25	68 Å²	68	17%	0.169	40%	0.395	C	S	.	.			trans	-104.5	78.1	175.9	-56.1	0	0	0	0	109.5	S57 C61 C69	S57-C59 PolarHBondContact O-N 2.84Å; C59-C61 PolarHBondContact O-N 3.35Å; C59-C69 HydrophobicContact CB-CB 3.37Å; C59-C69 WeakPolarHBondContact CB-SG 3.41Å; C59-C69 WeakPolarHBondContact SG-CB 3.29Å; C59-C69 CovalentContact SG-SG 2.04Å; C59-C69 PolarHBondContact SG-SG 3.36Å
60	V	63.2	Low	63.8	Low	4 Å²	4	66.8 Å²	66.8	2%	0.024	39%	0.391	C	S	.	.	S	Bend	trans	-68	-31.5	-179	-175.7	0	0	0	0	110.5	T30 R73 W126 P134	T30-V60 WeakPolarHBondContact OG1-CG2 3.41Å; V60-R73 WeakPolarHBondContact O-CD 3.36Å; V60-R73 PolarHBondContact O-NH1 3.49Å; V60-W126 HydrophobicContact CB-CZ2 4.43Å; V60-W126 HydrophobicContact CG1-CZ2 3.76Å; V60-P134 HydrophobicContact CG1-CB 4.2Å
61	C	58.9	Low	62.9	Low	32 Å²	32	68.1 Å²	68.1	22%	0.216	41%	0.408	C	S	.	.	S	Bend	trans	-154.9	17.8	-169.1	-56.4	0	0	0	0	117.4	C59 C132	C59-C61 PolarHBondContact O-N 3.35Å; C61-C132 HydrophobicContact CB-CB 3.78Å; C61-C132 WeakPolarHBondContact CB-SG 3.05Å; C61-C132 WeakPolarHBondContact SG-CB 3.4Å; C61-C132 CovalentContact SG-SG 1.98Å; C61-C132 PolarHBondContact SG-SG 2.94Å
62	S	54.5	Low	62.4	Low	34 Å²	34	71.6 Å²	71.6	24%	0.238	42%	0.422	C	S	.	.			trans	-113.8	101.3	177	174.9	0	0	0	0	109.6	S64 M65	S62-S64 PolarHBondContact OG-N 2.77Å; S62-S64 PolarHBondContact OG-OG 2.79Å; S62-M65 VanDerWaalsContact OG-CG 3.26Å; S62-M65 WeakPolarHBondContact OG-CG 3.5Å; S62-M65 PolarHBondContact OG-N 3.39Å; S62-M65 VanDerWaalsContact OG-N 3.11Å
63	D	47.7	Very low	62.3	Low	148 Å²	148	70.8 Å²	70.8	79%	0.791	41%	0.41	S	S	*	.	S	Bend	trans	-75.4	-12.5	163.4	-68.9	-21.2	0	0	0	111.1
64	S	42.5	Very low	62.3	Low	112 Å²	112	63.2 Å²	63.2	78%	0.783	38%	0.377	S	S	*	.	S	Bend	trans	-88.7	-16.3	-171.4	53.3	0	0	0	0	115.1	S62 G66	S62-S64 PolarHBondContact OG-N 2.77Å; S62-S64 PolarHBondContact OG-OG 2.79Å; S64-G66 PolarHBondContact O-N 3.34Å
65	M	40.8	Very low	62.5	Low	131 Å²	131	62.7 Å²	62.7	65%	0.645	37%	0.372	S	S	*	.	S	Bend	trans	-87.5	106.6	169.5	-67.8	-87.4	-165.3	0	0	106.3	S62 D67	S62-M65 VanDerWaalsContact OG-CG 3.26Å; S62-M65 WeakPolarHBondContact OG-CG 3.5Å; S62-M65 PolarHBondContact OG-N 3.39Å; S62-M65 VanDerWaalsContact OG-N 3.11Å; M65-D67 PolarHBondContact O-N 3.11Å
66	G	38.8	Very low	62.9	Low	86 Å²	86	61.8 Å²	61.8	89%	0.887	36%	0.363	S	S	*	.			trans	-60.7	20.8	-176.9	0	0	0	0	0	116.8	S64	S64-G66 PolarHBondContact O-N 3.34Å
67	D	41.7	Very low	63	Low	130 Å²	130	62 Å²	62	70%	0.695	36%	0.364	S	S	*	.	S	Bend	trans	-82.4	139.6	168.3	-76.6	-29.5	0	0	0	109.9	M65 C69	M65-D67 PolarHBondContact O-N 3.11Å; D67-C69 VanDerWaalsContact C-N 3.25Å; D67-C69 PolarHBondContact O-N 3.45Å; D67-C69 PolarHBondContact O-SG 2.93Å; D67-C69 VanDerWaalsContact O-SG 3.38Å
68	K	48.8	Very low	63.5	Low	210 Å²	210	61.4 Å²	61.4	91%	0.913	36%	0.36	S	S	*	.			trans	-62.6	84.7	178.3	-67.9	178.1	179	179	0	110.3	T70	K68-T70 PolarHBondContact O-N 3.24Å
69	C	57.1	Low	64.1	Low	43 Å²	43	59.3 Å²	59.3	29%	0.291	35%	0.346	S	S	.	.			trans	-61.5	120.2	168.3	-59.2	0	0	0	0	107.5	C59 D67	C59-C69 HydrophobicContact CB-CB 3.37Å; C59-C69 WeakPolarHBondContact CB-SG 3.41Å; C59-C69 WeakPolarHBondContact SG-CB 3.29Å; C59-C69 CovalentContact SG-SG 2.04Å; C59-C69 PolarHBondContact SG-SG 3.36Å; D67-C69 VanDerWaalsContact C-N 3.25Å; D67-C69 PolarHBondContact O-N 3.45Å; D67-C69 PolarHBondContact O-SG 2.93Å; D67-C69 VanDerWaalsContact O-SG 3.38Å
70	T	61.3	Low	64.7	Low	60 Å²	60	58.9 Å²	58.9	37%	0.368	34%	0.342	S	S	.	.			trans	-65.7	166.3	179.8	64.7	0	0	0	0	110.7	G55 S57 K68 W72	G55-T70 VanDerWaalsContact O-CB 3.22Å; G55-T70 WeakPolarHBondContact O-CB 2.84Å; G55-T70 PolarHBondContact O-OG1 3.08Å; S57-T70 WeakPolarHBondContact CB-OG1 3.18Å; S57-T70 PolarHBondContact N-OG1 3.23Å; S57-T70 VanDerWaalsContact N-OG1 3.11Å; S57-T70 PolarHBondContact OG-N 3.26Å; K68-T70 PolarHBondContact O-N 3.24Å; T70-W72 PolarHBondContact O-N 2.81Å
71	A	65	Low	65	Low	76 Å²	76	60.4 Å²	60.4	63%	0.628	35%	0.35	S	S	*	.	S	Bend	trans	-57.4	-25.5	-173.2	0	0	0	0	0	114.4
72	W	77.3	Confident	64.8	Low	77 Å²	77	61.1 Å²	61.1	29%	0.292	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.4	-166	-55.5	129.9	0	0	0	113.6	F56 S57 T70 D135 F163 A166 H167	F56-W72 WeakPolarHBondContact CA-O 3.41Å; F56-W72 HydrophobicContact CD1-CB 3.97Å; F56-W72 HydrophobicContact CE1-CB 4.05Å; S57-W72 PolarHBondContact N-O 3.44Å; S57-W72 VanDerWaalsContact N-O 3.09Å; T70-W72 PolarHBondContact O-N 2.81Å; W72-D135 WeakPolarHBondContact CA-OD2 3.3Å; W72-D135 HydrophobicContact CE3-CB 4.36Å; W72-F163 HydrophobicContact CB-CE2 3.73Å; W72-F163 AromaticContact CD2-CD2 3.58Å; W72-F163 HydrophobicContact CD2-CD2 3.58Å; W72-F163 AromaticContact CD2-CE2 3.37Å; W72-F163 HydrophobicContact CD2-CE2 3.37Å; W72-F163 AromaticContact CE2-CE2 3.93Å; W72-F163 AromaticContact CE3-CD2 3.28Å; W72-F163 HydrophobicContact CE3-CD2 3.28Å; W72-F163 AromaticContact CE3-CE2 3.6Å; W72-F163 HydrophobicContact CE3-CE2 3.6Å; W72-F163 HydrophobicContact CG-CD2 4.15Å; W72-F163 AromaticContact CG-CE2 3.47Å; W72-F163 HydrophobicContact CG-CE2 3.47Å; W72-F163 VanDerWaalsContact CG-CE2 3.47Å; W72-F163 HydrophobicContact CG-CZ 4.49Å; W72-F163 HydrophobicContact CH2-CD2 4.09Å; W72-F163 HydrophobicContact CZ2-CD2 4.4Å; W72-F163 AromaticContact CZ3-CD2 3.54Å; W72-F163 HydrophobicContact CZ3-CD2 3.54Å; W72-F163 HydrophobicContact CZ3-CE2 4.23Å; W72-F163 HydrophobicContact CZ3-CG 4.5Å; W72-A166 HydrophobicContact CH2-CB 3.92Å; W72-A166 HydrophobicContact CZ2-CB 3.97Å; W72-H167 AromaticContact CE2-CE1 3.57Å; W72-H167 AromaticContact CZ2-CE1 3.53Å; W72-H167 AromaticContact NE1-CE1 3.6Å; W72-H167 AromaticContact NE1-NE2 3.96Å
73	R	79.7	Confident	64.6	Low	61 Å²	61	62 Å²	62	23%	0.23	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.2	-170.3	-57.1	167.8	-172.4	-169.8	1.8	110	V60 D135 V136	V60-R73 WeakPolarHBondContact O-CD 3.36Å; V60-R73 PolarHBondContact O-NH1 3.49Å; R73-D135 PolarHBondContact N-OD2 3.46Å; R73-D135 WeakPolarHBondContact O-CB 3.23Å; R73-D135 PolarHBondContact O-N 3.3Å; R73-V136 PolarHBondContact O-N 3.39Å; R73-V136 VanDerWaalsContact O-N 3.07Å
74	V	84.5	Confident	64.3	Low	3 Å²	3	59.9 Å²	59.9	2%	0.018	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	141.1	177.7	67.5	0	0	0	0	110.9	M31 L51 F56 V136	M31-V74 HydrophobicContact CB-CG1 4.12Å; M31-V74 HydrophobicContact CG-CG1 3.9Å; M31-V74 HydrophobicContact SD-CG1 3.89Å; L51-V74 HydrophobicContact CD1-CG1 3.81Å; L51-V74 HydrophobicContact CD2-CG1 4.07Å; L51-V74 HydrophobicContact CD2-CG2 4.22Å; L51-V74 HydrophobicContact CG-CG1 4.35Å; F56-V74 HydrophobicContact CB-CB 4.41Å; F56-V74 HydrophobicContact CB-CG1 3.78Å; F56-V74 HydrophobicContact CD1-CB 3.74Å; F56-V74 HydrophobicContact CD1-CG1 4.07Å; F56-V74 HydrophobicContact CE1-CB 4.25Å; F56-V74 HydrophobicContact CG-CB 4.17Å; F56-V74 HydrophobicContact CG-CG1 4.02Å; V74-V136 CarbonylContact C-O 3.54Å; V74-V136 VanDerWaalsContact CA-O 3.3Å; V74-V136 WeakPolarHBondContact CA-O 3.49Å; V74-V136 HydrophobicContact CG2-CB 4.2Å; V74-V136 HydrophobicContact CG2-CG1 4.36Å
75	L	84.4	Confident	64.1	Low	4 Å²	4	65.6 Å²	65.6	2%	0.021	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.7	172.2	176.1	69.3	0	0	0	109.5	M31 C33 W126 P134 V136 A137 V138	M31-L75 CarbonylContact O-C 2.99Å; M31-L75 WeakPolarHBondContact O-CA 3.47Å; C33-L75 HydrophobicContact CB-CD1 4.4Å; L75-W126 HydrophobicContact CD1-CH2 3.55Å; L75-W126 HydrophobicContact CD1-CZ3 3.99Å; L75-W126 HydrophobicContact CD2-CD2 4.44Å; L75-W126 HydrophobicContact CD2-CE3 3.77Å; L75-W126 HydrophobicContact CD2-CH2 3.39Å; L75-W126 HydrophobicContact CD2-CZ2 4.16Å; L75-W126 HydrophobicContact CD2-CZ3 3.18Å; L75-W126 HydrophobicContact CG-CH2 4.06Å; L75-W126 HydrophobicContact CG-CZ3 4.2Å; L75-P134 HydrophobicContact CB-CB 3.84Å; L75-P134 HydrophobicContact CB-CG 3.91Å; L75-P134 HydrophobicContact CD2-CG 4.22Å; L75-V136 PolarHBondContact N-O 3.33Å; L75-A137 CarbonylContact O-C 3.5Å; L75-A137 VanDerWaalsContact O-CA 3.31Å; L75-A137 WeakPolarHBondContact O-CA 3.28Å; L75-V138 PolarHBondContact O-N 3.41Å
76	I	87.3	Confident	63.9	Low	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	115.4	170.7	-58.1	168	0	0	0	107	M31 I32 C33 I47 L51 L78 V138 V140 I196	M31-I76 PolarHBondContact O-N 3.46Å; I32-I76 CarbonylContact C-O 3.54Å; I32-I76 HydrophobicContact CG1-CD1 4.29Å; C33-I76 PolarHBondContact N-O 3.44Å; I47-I76 HydrophobicContact CG2-CD1 3.53Å; L51-I76 HydrophobicContact CD1-CD1 3.85Å; I76-L78 HydrophobicContact CG2-CD1 3.86Å; I76-V138 CarbonylContact C-O 3.55Å; I76-V138 VanDerWaalsContact CA-O 3.3Å; I76-V138 WeakPolarHBondContact CA-O 3.29Å; I76-V138 HydrophobicContact CG1-CB 4.2Å; I76-V140 HydrophobicContact CG2-CG2 4.27Å; I76-I196 HydrophobicContact CD1-CD1 3.38Å; I76-I196 HydrophobicContact CD1-CG1 4.37Å; I76-I196 HydrophobicContact CG1-CD1 4.45Å
77	L	83.8	Confident	63.6	Low	8 Å²	8	71.7 Å²	71.7	4%	0.042	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122.7	178.3	177.9	62	0	0	0	109.7	F21 C33 V79 L122 V138 L139 V140	F21-L77 HydrophobicContact CE1-CD1 4.35Å; C33-L77 HydrophobicContact CB-CD1 3.69Å; C33-L77 WeakPolarHBondContact SG-CD1 3.14Å; L77-V79 HydrophobicContact CD1-CG2 4.49Å; L77-V79 HydrophobicContact CD2-CG2 4.22Å; L77-V79 HydrophobicContact CG-CG2 3.9Å; L77-L122 HydrophobicContact CD2-CD2 3.39Å; L77-V138 PolarHBondContact N-O 2.93Å; L77-L139 HydrophobicContact CB-CD1 3.97Å; L77-L139 HydrophobicContact CD2-CD1 3.74Å; L77-L139 HydrophobicContact CG-CD1 3.84Å; L77-V140 PolarHBondContact O-N 3.48Å
78	L	84.8	Confident	63.4	Low	0 Å²	0	70.8 Å²	70.8	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	128.4	178.5	-68.3	101.7	0	0	0	110.9	I32 C33 D34 P35 L38 L39 I76 V140 W188	I32-L78 HydrophobicContact CG2-CD1 3.76Å; C33-L78 PolarHBondContact O-N 3.26Å; D34-L78 HydrophobicContact CB-CB 4.37Å; D34-L78 HydrophobicContact CB-CD1 4.05Å; P35-L78 WeakPolarHBondContact CD-O 3.45Å; L38-L78 HydrophobicContact CB-CD2 4Å; L38-L78 HydrophobicContact CD1-CB 4.2Å; L38-L78 HydrophobicContact CD1-CD2 4.43Å; L39-L78 HydrophobicContact CD1-CD1 3.77Å; L39-L78 HydrophobicContact CD1-CD2 3.72Å; L39-L78 HydrophobicContact CD1-CG 4.42Å; L39-L78 HydrophobicContact CD2-CD2 4.26Å; L39-L78 HydrophobicContact CG-CD2 3.62Å; I76-L78 HydrophobicContact CG2-CD1 3.86Å; L78-V140 HydrophobicContact CD2-CB 4.37Å; L78-V140 HydrophobicContact CD2-CG1 4.35Å; L78-V140 HydrophobicContact CG-CB 4.08Å; L78-V140 HydrophobicContact CG-CG2 4.36Å; L78-W188 HydrophobicContact CD2-CH2 4.2Å; L78-W188 HydrophobicContact CD2-CZ3 4.21Å
79	V	78.8	Confident	62.8	Low	1 Å²	1	68.9 Å²	68.9	1%	0.006	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	146.2	-171.9	179.8	0	0	0	0	110.4	F36 L77 V107 L110 L139 V140 Y141 K142	F36-V79 HydrophobicContact CE2-CG1 4.28Å; L77-V79 HydrophobicContact CD1-CG2 4.49Å; L77-V79 HydrophobicContact CD2-CG2 4.22Å; L77-V79 HydrophobicContact CG-CG2 3.9Å; V79-V107 HydrophobicContact CB-CG1 4.13Å; V79-V107 HydrophobicContact CG1-CG1 3.11Å; V79-V107 HydrophobicContact CG2-CG1 3.88Å; V79-L110 HydrophobicContact CG1-CD1 4.23Å; V79-L139 HydrophobicContact CG2-CD1 3.75Å; V79-V140 PolarHBondContact N-O 3.21Å; V79-Y141 HydrophobicContact CB-CD2 4.05Å; V79-Y141 HydrophobicContact CG1-CD2 3.69Å; V79-Y141 HydrophobicContact CG1-CE2 4.02Å; V79-K142 PolarHBondContact O-N 2.79Å
80	T	77	Confident	61.9	Low	16 Å²	16	72.1 Å²	72.1	10%	0.098	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	150	166.8	-174.2	0	0	0	0	113.5	F36 L38 G82 K142	F36-T80 HydrophobicContact CB-CG2 3.93Å; F36-T80 HydrophobicContact CD1-CG2 3.8Å; F36-T80 HydrophobicContact CD2-CG2 3.97Å; F36-T80 HydrophobicContact CE1-CG2 4.4Å; F36-T80 HydrophobicContact CG-CG2 3.58Å; L38-T80 HydrophobicContact CD2-CG2 4.36Å; T80-G82 PolarHBondContact O-N 3.06Å; T80-G82 PolarHBondContact OG1-N 3.15Å; T80-K142 WeakPolarHBondContact CA-O 2.94Å; T80-K142 WeakPolarHBondContact CB-O 3.11Å; T80-K142 PolarHBondContact OG1-O 3.15Å
81	N	70.4	Confident	60.9	Low	37 Å²	37	77 Å²	77	20%	0.198	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-70.6	-6.4	173	74.1	-23.1	0	0	0	114	M83 Y141 K142 E143 Q144	N81-M83 PolarHBondContact O-N 3.41Å; N81-Y141 VanDerWaalsContact CB-OH 3.28Å; N81-Y141 WeakPolarHBondContact CB-OH 3.44Å; N81-K142 PolarHBondContact N-O 3.49Å; N81-E143 VanDerWaalsContact ND2-CG 3.33Å; N81-E143 WeakPolarHBondContact ND2-CG 3.3Å; N81-Q144 PolarHBondContact ND2-N 3.42Å; N81-Q144 PolarHBondContact ND2-O 3.18Å; N81-Q144 PolarHBondContact OD1-N 3.13Å
82	G	55.5	Low	59.8	Low	47 Å²	47	77.8 Å²	77.8	49%	0.485	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-61.5	-9.3	-177.5	0	0	0	0	0	115.3	T80 S84	T80-G82 PolarHBondContact O-N 3.06Å; T80-G82 PolarHBondContact OG1-N 3.15Å; G82-S84 VanDerWaalsContact C-N 3.34Å; G82-S84 PolarHBondContact O-N 3.03Å
83	M	49	Very low	57.9	Low	53 Å²	53	79 Å²	79	26%	0.261	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-72.1	-17	-177.8	-77.6	-141.5	-63.7	0	0	115.7	F36 N81 R85 E104 A108	F36-M83 HydrophobicContact CD1-CG 4.21Å; F36-M83 HydrophobicContact CE1-CE 4.14Å; F36-M83 HydrophobicContact CE1-CG 3.19Å; F36-M83 HydrophobicContact CE1-SD 3.32Å; F36-M83 WeakPolarHBondContact CE1-SD 3.28Å; F36-M83 HydrophobicContact CZ-CE 3.66Å; F36-M83 HydrophobicContact CZ-CG 3.6Å; F36-M83 HydrophobicContact CZ-SD 3.5Å; F36-M83 WeakPolarHBondContact CZ-SD 3.5Å; N81-M83 PolarHBondContact O-N 3.41Å; M83-R85 PolarHBondContact O-N 2.91Å; M83-E104 HydrophobicContact CE-CB 4.06Å; M83-E104 HydrophobicContact CE-CG 4.16Å; M83-A108 HydrophobicContact CB-CB 4.25Å; M83-A108 HydrophobicContact CE-CB 4.03Å
84	S	42.3	Very low	56.1	Low	103 Å²	103	81.2 Å²	81.2	72%	0.72	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-62.7	-8.6	-173.2	-171	0	0	0	0	114.8	G82	G82-S84 VanDerWaalsContact C-N 3.34Å; G82-S84 PolarHBondContact O-N 3.03Å
85	R	38.4	Very low	54	Low	232 Å²	232	88.5 Å²	88.5	88%	0.875	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-123.3	-7.8	-173	-96.8	-175.7	175.9	-170.7	-0.4	118.9	M83 N87	M83-R85 PolarHBondContact O-N 2.91Å; R85-N87 PolarHBondContact O-N 2.93Å
86	R	35.5	Very low	51.8	Low	234 Å²	234	91 Å²	91	88%	0.883	49%	0.491	S	S	*	.	S	Bend	trans	-102.7	84.4	177.4	-75.8	-171.6	-172.9	177.6	4.6	110.6
87	N	33.6	Very low	49.6	Very low	111 Å²	111	93.2 Å²	93.2	59%	0.594	51%	0.505	S	S	*	.			trans	59.7	86.4	160.3	-59.2	-16.7	0	0	0	116.7	R85 H89 T90	R85-N87 PolarHBondContact O-N 2.93Å; N87-H89 PolarHBondContact O-N 2.95Å; N87-T90 PolarHBondContact O-OG1 2.76Å
88	A	37.5	Very low	47.8	Very low	110 Å²	110	100.7 Å²	100.7	91%	0.909	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	25.2	150.2	0	0	0	0	0	113.3
89	H	36.1	Very low	45.9	Very low	171 Å²	171	106.4 Å²	106.4	79%	0.792	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.6	2.4	-177.4	-74.3	-49.6	0	0	0	113.3	N87 L91	N87-H89 PolarHBondContact O-N 2.95Å; H89-L91 PolarHBondContact O-N 3.22Å; H89-L91 VanDerWaalsContact O-N 3.1Å
90	T	38.7	Very low	44.2	Very low	110 Å²	110	108.4 Å²	108.4	68%	0.675	58%	0.576	S	S	*	*	S	Bend	trans	-70.2	108.7	161	28.9	0	0	0	0	107.7	N87 V92	N87-T90 PolarHBondContact O-OG1 2.76Å; T90-V92 PolarHBondContact O-N 3.21Å
91	L	38.8	Very low	42.7	Very low	162 Å²	162	109.8 Å²	109.8	85%	0.848	59%	0.59	S	S	*	*			trans	-34.3	107.9	170.5	-122	81.8	0	0	0	109	H89 D93	H89-L91 PolarHBondContact O-N 3.22Å; H89-L91 VanDerWaalsContact O-N 3.1Å; L91-D93 PolarHBondContact O-N 2.71Å; L91-D93 VanDerWaalsContact O-N 3.1Å
92	V	43	Very low	41.7	Very low	94 Å²	94	109.6 Å²	109.6	57%	0.57	59%	0.593	S	S	*	*			trans	-57.6	114.5	165.3	169.9	0	0	0	0	105.5	T90 P94 P97	T90-V92 PolarHBondContact O-N 3.21Å; V92-P94 VanDerWaalsContact O-CD 3.31Å; V92-P94 WeakPolarHBondContact O-CD 3.05Å; V92-P94 VanDerWaalsContact O-N 3.11Å; V92-P97 HydrophobicContact CG1-CB 3.2Å; V92-P97 HydrophobicContact CG1-CG 4.38Å
93	D	37.1	Very low	41.5	Very low	102 Å²	102	108.2 Å²	108.2	55%	0.545	57%	0.574	S	S	.	*			trans	-57.1	116.1	177.4	-166.6	-18.3	0	0	0	107.9	L91 Q95 C96	L91-D93 PolarHBondContact O-N 2.71Å; L91-D93 VanDerWaalsContact O-N 3.1Å; D93-Q95 PolarHBondContact O-N 2.92Å; D93-Q95 PolarHBondContact OD1-N 3.03Å; D93-C96 PolarHBondContact O-N 3.07Å
94	P	42.2	Very low	41.5	Very low	108 Å²	108	109.3 Å²	109.3	70%	0.701	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-10.3	-174.1	23.3	-33.4	0	0	0	113.1	V92	V92-P94 VanDerWaalsContact O-CD 3.31Å; V92-P94 WeakPolarHBondContact O-CD 3.05Å; V92-P94 VanDerWaalsContact O-N 3.11Å
95	Q	40.5	Very low	41.9	Very low	156 Å²	156	107.2 Å²	107.2	73%	0.729	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-9.5	-179.2	-71.4	-176.9	-11.7	0	0	115	C11 D93	C11-Q95 PolarHBondContact SG-O 3Å; D93-Q95 PolarHBondContact O-N 2.92Å; D93-Q95 PolarHBondContact OD1-N 3.03Å
96	C	36.8	Very low	42.6	Very low	57 Å²	57	100.2 Å²	100.2	39%	0.385	54%	0.541	S	S	.	.	S	Bend	trans	-148.9	54.4	175.5	-132.8	0	0	0	0	115.3	C11 H17 D93	C11-C96 WeakPolarHBondContact CB-SG 3.26Å; C11-C96 WeakPolarHBondContact SG-CB 2.77Å; C11-C96 CovalentContact SG-SG 2.05Å; C11-C96 PolarHBondContact SG-SG 3.35Å; H17-C96 PolarHBondContact CE1-SG 2.99Å; H17-C96 PolarHBondContact NE2-SG 2.94Å; D93-C96 PolarHBondContact O-N 3.07Å
97	P	42.7	Very low	43.3	Very low	46 Å²	46	89.3 Å²	89.3	30%	0.299	50%	0.501	S	S	.	.			trans	-121.6	93.6	-163.3	37.9	-18.5	0	0	0	111.1	V92	V92-P97 HydrophobicContact CG1-CB 3.2Å; V92-P97 HydrophobicContact CG1-CG 4.38Å
98	H	45.4	Very low	44.1	Very low	164 Å²	164	85.2 Å²	85.2	76%	0.759	48%	0.482	S	S	*	.	S	Bend	trans	-167.3	-41.4	148.4	-96	-52	0	0	0	111.8	A102	H98-A102 WeakPolarHBondContact O-CB 3.36Å; H98-A102 PolarHBondContact O-N 2.87Å
99	E	45.2	Very low	44.7	Very low	120 Å²	120	86 Å²	86	56%	0.561	47%	0.471	S	S	*	.	H	α-helix	trans	-78.5	-46.9	-170	-65.8	-171.2	173.3	0	0	113.6	A102 M103	E99-A102 PolarHBondContact O-N 3.39Å; E99-M103 WeakPolarHBondContact O-CB 3.17Å; E99-M103 PolarHBondContact O-N 3.3Å
100	M	42.7	Very low	45.5	Very low	43 Å²	43	78.6 Å²	78.6	21%	0.212	44%	0.437	C	S	.	.	H	α-helix	trans	-72.1	-41.6	-179.6	-77.6	-161.6	62	0	0	113.3	H17 F21 A102 M103 E104	H17-M100 HydrophobicContact CB-CG 4.27Å; H17-M100 HydrophobicContact CB-SD 3.71Å; F21-M100 HydrophobicContact CB-CE 3.26Å; F21-M100 HydrophobicContact CD2-CE 3.43Å; F21-M100 VanDerWaalsContact CD2-CE 3.43Å; F21-M100 HydrophobicContact CG-CE 3.67Å; M100-A102 VanDerWaalsContact C-N 3.28Å; M100-A102 PolarHBondContact O-N 2.97Å; M100-M103 PolarHBondContact O-N 2.8Å; M100-E104 WeakPolarHBondContact O-CB 3.02Å; M100-E104 PolarHBondContact O-N 3.22Å
101	A	45.4	Very low	46.3	Very low	46 Å²	46	80.2 Å²	80.2	38%	0.38	44%	0.437	S	S	.	.	H	α-helix	trans	-65.5	-34.7	173.6	0	0	0	0	0	111.1	S105	A101-S105 WeakPolarHBondContact O-CB 3.18Å; A101-S105 PolarHBondContact O-N 2.64Å; A101-S105 PolarHBondContact O-OG 3.07Å; A101-S105 VanDerWaalsContact O-OG 3.07Å
102	A	49.8	Very low	47	Very low	32 Å²	32	75.1 Å²	75.1	26%	0.264	42%	0.415	S	S	.	.	H	α-helix	trans	-64.6	-45.8	171.1	0	0	0	0	0	111.1	H98 E99 M100 S105 Q106	H98-A102 WeakPolarHBondContact O-CB 3.36Å; H98-A102 PolarHBondContact O-N 2.87Å; E99-A102 PolarHBondContact O-N 3.39Å; M100-A102 VanDerWaalsContact C-N 3.28Å; M100-A102 PolarHBondContact O-N 2.97Å; A102-S105 WeakPolarHBondContact CA-OG 3.37Å; A102-S105 PolarHBondContact O-N 2.82Å; A102-S105 PolarHBondContact O-OG 3.02Å; A102-Q106 WeakPolarHBondContact O-CB 3.39Å; A102-Q106 VanDerWaalsContact O-CG 3.29Å; A102-Q106 WeakPolarHBondContact O-CG 3.39Å; A102-Q106 PolarHBondContact O-N 2.93Å
103	M	49.7	Very low	47.5	Very low	18 Å²	18	81.3 Å²	81.3	9%	0.089	43%	0.428	C	S	.	.	H	α-helix	trans	-62	-47.6	177.8	-150.7	172.8	179.1	0	0	110.9	E99 M100 S105 Q106 V107 L122	E99-M103 WeakPolarHBondContact O-CB 3.17Å; E99-M103 PolarHBondContact O-N 3.3Å; M100-M103 PolarHBondContact O-N 2.8Å; M103-S105 PolarHBondContact O-N 3.21Å; M103-Q106 PolarHBondContact O-N 3.31Å; M103-V107 WeakPolarHBondContact O-CB 3.25Å; M103-V107 WeakPolarHBondContact O-CG2 3.31Å; M103-V107 PolarHBondContact O-N 3.48Å; M103-L122 HydrophobicContact CE-CD1 3.36Å; M103-L122 HydrophobicContact CE-CD2 4.28Å; M103-L122 HydrophobicContact CE-CG 3.57Å; M103-L122 HydrophobicContact CG-CD1 3.69Å; M103-L122 HydrophobicContact SD-CD1 4.36Å
104	E	50.1	Low	48.7	Very low	77 Å²	77	80.6 Å²	80.6	36%	0.36	42%	0.424	S	S	.	.	H	α-helix	trans	-59.3	-43.7	172.9	-85.3	-173.6	161.7	0	0	112.7	F21 M83 M100 V107 A108	F21-E104 HydrophobicContact CD2-CG 4.06Å; F21-E104 HydrophobicContact CE2-CG 3.23Å; F21-E104 WeakPolarHBondContact CE2-OE1 3.3Å; F21-E104 HydrophobicContact CZ-CG 3.89Å; M83-E104 HydrophobicContact CE-CB 4.06Å; M83-E104 HydrophobicContact CE-CG 4.16Å; M100-E104 WeakPolarHBondContact O-CB 3.02Å; M100-E104 PolarHBondContact O-N 3.22Å; E104-V107 CarbonylContact O-C 3.58Å; E104-V107 PolarHBondContact O-N 2.83Å; E104-A108 VanDerWaalsContact O-CB 3.23Å; E104-A108 WeakPolarHBondContact O-CB 3.5Å; E104-A108 PolarHBondContact O-N 3.37Å
105	S	50	Low	49.7	Very low	58 Å²	58	75.6 Å²	75.6	41%	0.406	39%	0.392	S	S	.	.	H	α-helix	trans	-70.6	-37.1	-179.3	73.1	0	0	0	0	112.6	A101 A102 M103 V107 A108 N109	A101-S105 WeakPolarHBondContact O-CB 3.18Å; A101-S105 PolarHBondContact O-N 2.64Å; A101-S105 PolarHBondContact O-OG 3.07Å; A101-S105 VanDerWaalsContact O-OG 3.07Å; A102-S105 WeakPolarHBondContact CA-OG 3.37Å; A102-S105 PolarHBondContact O-N 2.82Å; A102-S105 PolarHBondContact O-OG 3.02Å; M103-S105 PolarHBondContact O-N 3.21Å; S105-V107 VanDerWaalsContact C-N 3.32Å; S105-A108 PolarHBondContact O-N 3.32Å; S105-N109 WeakPolarHBondContact O-CB 3.47Å; S105-N109 PolarHBondContact O-N 2.74Å; S105-N109 VanDerWaalsContact O-N 3.16Å; S105-N109 PolarHBondContact O-ND2 3.2Å
106	Q	53.8	Low	50.6	Low	85 Å²	85	70.4 Å²	70.4	40%	0.397	37%	0.372	S	S	.	.	H	α-helix	trans	-64.6	-42.6	172.7	-77.9	-179.6	3.1	0	0	110.2	A102 M103 N109	A102-Q106 WeakPolarHBondContact O-CB 3.39Å; A102-Q106 VanDerWaalsContact O-CG 3.29Å; A102-Q106 WeakPolarHBondContact O-CG 3.39Å; A102-Q106 PolarHBondContact O-N 2.93Å; M103-Q106 PolarHBondContact O-N 3.31Å; Q106-N109 PolarHBondContact O-N 2.95Å
107	V	50.8	Low	51.6	Low	6 Å²	6	73.2 Å²	73.2	4%	0.036	38%	0.383	C	S	.	.	H	α-helix	trans	-68.2	-36.9	178.4	170	0	0	0	0	111.6	V79 M103 E104 S105 N109 L110 L122	V79-V107 HydrophobicContact CB-CG1 4.13Å; V79-V107 HydrophobicContact CG1-CG1 3.11Å; V79-V107 HydrophobicContact CG2-CG1 3.88Å; M103-V107 WeakPolarHBondContact O-CB 3.25Å; M103-V107 WeakPolarHBondContact O-CG2 3.31Å; M103-V107 PolarHBondContact O-N 3.48Å; E104-V107 CarbonylContact O-C 3.58Å; E104-V107 PolarHBondContact O-N 2.83Å; S105-V107 VanDerWaalsContact C-N 3.32Å; V107-N109 VanDerWaalsContact C-N 3.33Å; V107-N109 PolarHBondContact O-N 3.28Å; V107-L110 HydrophobicContact CB-CD1 4.36Å; V107-L110 HydrophobicContact CG1-CD1 4.23Å; V107-L110 WeakPolarHBondContact O-CB 3.34Å; V107-L110 VanDerWaalsContact O-CD1 3.25Å; V107-L110 WeakPolarHBondContact O-CD1 3.4Å; V107-L110 VanDerWaalsContact O-CG 3.25Å; V107-L110 WeakPolarHBondContact O-CG 3.41Å; V107-L110 PolarHBondContact O-N 3.33Å; V107-L122 HydrophobicContact CG2-CD1 3.94Å
108	A	49.5	Very low	52.7	Low	24 Å²	24	73.1 Å²	73.1	20%	0.198	38%	0.381	C	S	.	.	H	α-helix	trans	-71.3	-26	177.4	0	0	0	0	0	113.5	M83 E104 S105	M83-A108 HydrophobicContact CB-CB 4.25Å; M83-A108 HydrophobicContact CE-CB 4.03Å; E104-A108 VanDerWaalsContact O-CB 3.23Å; E104-A108 WeakPolarHBondContact O-CB 3.5Å; E104-A108 PolarHBondContact O-N 3.37Å; S105-A108 PolarHBondContact O-N 3.32Å
109	N	50.2	Low	53.8	Low	127 Å²	127	65.5 Å²	65.5	68%	0.679	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	8.6	179.5	-72.2	-28.8	0	0	0	113.6	S105 Q106 V107 Q111	S105-N109 WeakPolarHBondContact O-CB 3.47Å; S105-N109 PolarHBondContact O-N 2.74Å; S105-N109 VanDerWaalsContact O-N 3.16Å; S105-N109 PolarHBondContact O-ND2 3.2Å; Q106-N109 PolarHBondContact O-N 2.95Å; V107-N109 VanDerWaalsContact C-N 3.33Å; V107-N109 PolarHBondContact O-N 3.28Å; N109-Q111 PolarHBondContact O-N 3.28Å
110	L	53.7	Low	55	Low	15 Å²	15	62.6 Å²	62.6	8%	0.079	34%	0.335	C	S	.	.			trans	-62.1	104.5	179.3	-74.8	169.9	0	0	0	111	V79 V107 I115 T118 Y141	V79-L110 HydrophobicContact CG1-CD1 4.23Å; V107-L110 HydrophobicContact CB-CD1 4.36Å; V107-L110 HydrophobicContact CG1-CD1 4.23Å; V107-L110 WeakPolarHBondContact O-CB 3.34Å; V107-L110 VanDerWaalsContact O-CD1 3.25Å; V107-L110 WeakPolarHBondContact O-CD1 3.4Å; V107-L110 VanDerWaalsContact O-CG 3.25Å; V107-L110 WeakPolarHBondContact O-CG 3.41Å; V107-L110 PolarHBondContact O-N 3.33Å; L110-I115 HydrophobicContact CD2-CG1 4.4Å; L110-T118 VanDerWaalsContact CD2-CB 3.48Å; L110-T118 HydrophobicContact CD2-CG2 3.72Å; L110-T118 WeakPolarHBondContact CD2-OG1 3.42Å; L110-Y141 HydrophobicContact CB-CD2 4.28Å; L110-Y141 HydrophobicContact CB-CE2 3.62Å; L110-Y141 HydrophobicContact CD1-CD2 3.89Å; L110-Y141 HydrophobicContact CD1-CE2 3.93Å; L110-Y141 HydrophobicContact CG-CE2 4.41Å; L110-Y141 PolarHBondContact O-OH 3.48Å
111	Q	54.4	Low	56.3	Low	144 Å²	144	62.6 Å²	62.6	67%	0.673	34%	0.342	S	S	*	.			trans	-83.5	142	160.5	-70.1	-169.8	-6.1	0	0	109.1	N109 R113 D114	N109-Q111 PolarHBondContact O-N 3.28Å; Q111-R113 PolarHBondContact O-N 3.35Å; Q111-D114 PolarHBondContact O-N 2.81Å; Q111-D114 VanDerWaalsContact O-N 3.09Å
112	S	54.3	Low	57.4	Low	55 Å²	55	61 Å²	61	39%	0.385	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-22.4	-172.1	54.3	0	0	0	0	115.8
113	R	53.5	Low	58.5	Low	224 Å²	224	60.7 Å²	60.7	85%	0.845	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-23.6	-178.6	-71.5	-174.5	176.1	-170.4	-1.2	114.8	Q111	Q111-R113 PolarHBondContact O-N 3.35Å
114	D	62	Low	59.6	Low	88 Å²	88	65 Å²	65	47%	0.471	34%	0.344	S	S	.	.	S	Bend	trans	-112.8	9.7	-172.5	-63.7	-35	0	0	0	113.8	Q111 S116 L117 T118	Q111-D114 PolarHBondContact O-N 2.81Å; Q111-D114 VanDerWaalsContact O-N 3.09Å; D114-S116 VanDerWaalsContact C-N 3.29Å; D114-S116 PolarHBondContact O-N 3.23Å; D114-L117 PolarHBondContact O-N 3.25Å; D114-T118 PolarHBondContact O-N 3.26Å; D114-T118 PolarHBondContact O-OG1 3.44Å
115	I	62.4	Low	60.5	Low	3 Å²	3	63.8 Å²	63.8	2%	0.015	34%	0.338	C	S	.	.	H	α-helix	trans	-60.5	-36.6	-173	-67.4	176	0	0	0	112.1	L110 T118 T119 L139 Y141 I154 V156	L110-I115 HydrophobicContact CD2-CG1 4.4Å; I115-T118 VanDerWaalsContact CA-OG1 3.24Å; I115-T118 WeakPolarHBondContact CA-OG1 3.25Å; I115-T118 PolarHBondContact O-OG1 3.16Å; I115-T119 WeakPolarHBondContact O-CB 3.4Å; I115-T119 PolarHBondContact O-N 3.15Å; I115-T119 PolarHBondContact O-OG1 3.38Å; I115-L139 HydrophobicContact CG2-CD2 3.65Å; I115-Y141 HydrophobicContact CD1-CD1 3.27Å; I115-Y141 HydrophobicContact CD1-CE1 3.79Å; I115-Y141 HydrophobicContact CD1-CG 3.66Å; I115-Y141 HydrophobicContact CG1-CD1 4.47Å; I115-I154 HydrophobicContact CD1-CB 4.21Å; I115-I154 HydrophobicContact CD1-CD1 3.53Å; I115-I154 HydrophobicContact CD1-CG1 4.43Å; I115-I154 HydrophobicContact CD1-CG2 4.19Å; I115-V156 HydrophobicContact CG2-CG2 3.59Å
116	S	60.1	Low	61.4	Low	47 Å²	47	61.4 Å²	61.4	33%	0.329	32%	0.321	S	S	.	.	H	α-helix	trans	-67.4	-41.8	-179.9	70	0	0	0	0	112.4	D114 T119 D120	D114-S116 VanDerWaalsContact C-N 3.29Å; D114-S116 PolarHBondContact O-N 3.23Å; S116-T119 PolarHBondContact O-N 2.9Å; S116-D120 PolarHBondContact O-N 2.88Å
117	L	58.5	Low	62.3	Low	116 Å²	116	59 Å²	59	61%	0.607	32%	0.315	S	S	*	.	H	α-helix	trans	-66.8	-41.6	177.8	-76.6	157.9	0	0	0	111.3	D114 D120 A121	D114-L117 PolarHBondContact O-N 3.25Å; L117-D120 PolarHBondContact O-N 3.21Å; L117-A121 PolarHBondContact O-N 3.32Å
118	T	65.4	Low	63.2	Low	43 Å²	43	62.5 Å²	62.5	26%	0.264	35%	0.345	S	S	.	.	H	α-helix	trans	-72.7	-30.8	176.6	32.2	0	0	0	0	112.6	L110 D114 I115 D120 A121 L122	L110-T118 VanDerWaalsContact CD2-CB 3.48Å; L110-T118 HydrophobicContact CD2-CG2 3.72Å; L110-T118 WeakPolarHBondContact CD2-OG1 3.42Å; D114-T118 PolarHBondContact O-N 3.26Å; D114-T118 PolarHBondContact O-OG1 3.44Å; I115-T118 VanDerWaalsContact CA-OG1 3.24Å; I115-T118 WeakPolarHBondContact CA-OG1 3.25Å; I115-T118 PolarHBondContact O-OG1 3.16Å; T118-D120 VanDerWaalsContact C-N 3.3Å; T118-D120 PolarHBondContact O-N 2.94Å; T118-A121 PolarHBondContact O-N 2.97Å; T118-L122 WeakPolarHBondContact O-CB 3.4Å; T118-L122 PolarHBondContact O-N 2.86Å
119	T	67.5	Low	63.8	Low	4 Å²	4	63.5 Å²	63.5	3%	0.025	35%	0.35	C	S	.	.	H	α-helix	trans	-61.6	-42.1	170.6	-51.7	0	0	0	0	110.4	I115 S116 L122 L123 L139 V156 K158	I115-T119 WeakPolarHBondContact O-CB 3.4Å; I115-T119 PolarHBondContact O-N 3.15Å; I115-T119 PolarHBondContact O-OG1 3.38Å; S116-T119 PolarHBondContact O-N 2.9Å; T119-L122 PolarHBondContact O-N 3.18Å; T119-L123 HydrophobicContact CG2-CD1 4.07Å; T119-L123 HydrophobicContact CG2-CG 4.46Å; T119-L123 WeakPolarHBondContact O-CB 3.39Å; T119-L123 VanDerWaalsContact O-CG 3.28Å; T119-L123 WeakPolarHBondContact O-CG 3.33Å; T119-L123 PolarHBondContact O-N 3.36Å; T119-L139 HydrophobicContact CG2-CB 4.21Å; T119-L139 HydrophobicContact CG2-CD2 4.37Å; T119-L139 WeakPolarHBondContact OG1-CD2 3.5Å; T119-V156 HydrophobicContact CG2-CG1 4.4Å; T119-K158 HydrophobicContact CG2-CG 3.82Å
120	D	71.6	Confident	64.4	Low	59 Å²	59	59.2 Å²	59.2	32%	0.316	33%	0.325	S	S	.	.	H	α-helix	trans	-66	-43.8	176.5	-67.4	-32.3	0	0	0	111.4	S116 L117 T118 L122 L123 N124 K158	S116-D120 PolarHBondContact O-N 2.88Å; L117-D120 PolarHBondContact O-N 3.21Å; T118-D120 VanDerWaalsContact C-N 3.3Å; T118-D120 PolarHBondContact O-N 2.94Å; D120-L122 VanDerWaalsContact C-N 3.32Å; D120-L122 PolarHBondContact O-N 3.44Å; D120-L123 PolarHBondContact O-N 3.37Å; D120-N124 VanDerWaalsContact O-CB 3.28Å; D120-N124 WeakPolarHBondContact O-CB 3.46Å; D120-N124 PolarHBondContact O-N 2.85Å; D120-N124 PolarHBondContact O-ND2 2.89Å; D120-K158 WeakPolarHBondContact OD1-CD 3.28Å; D120-K158 WeakPolarHBondContact OD1-CE 3.34Å; D120-K158 IonicContact OD1-NZ 2.74Å; D120-K158 PolarHBondContact OD1-NZ 3.47Å; D120-K158 IonicContact OD2-NZ 2.73Å; D120-K158 PolarHBondContact OD2-NZ 3.31Å
121	A	69.1	Low	65.1	Low	44 Å²	44	64.2 Å²	64.2	36%	0.364	36%	0.361	S	S	.	.	H	α-helix	trans	-59.2	-43.9	175.2	0	0	0	0	0	111.9	L117 T118 N124 Q125	L117-A121 PolarHBondContact O-N 3.32Å; T118-A121 PolarHBondContact O-N 2.97Å; A121-N124 PolarHBondContact O-N 3.18Å; A121-Q125 WeakPolarHBondContact O-CB 3.19Å; A121-Q125 PolarHBondContact O-N 3.27Å
122	L	69.7	Low	65.9	Low	12 Å²	12	58 Å²	58	6%	0.063	33%	0.334	C	S	.	.	H	α-helix	trans	-62.9	-45.6	177.5	-171.7	103.4	0	0	0	111.7	L77 M103 V107 T118 T119 D120 Q125 W126	L77-L122 HydrophobicContact CD2-CD2 3.39Å; M103-L122 HydrophobicContact CE-CD1 3.36Å; M103-L122 HydrophobicContact CE-CD2 4.28Å; M103-L122 HydrophobicContact CE-CG 3.57Å; M103-L122 HydrophobicContact CG-CD1 3.69Å; M103-L122 HydrophobicContact SD-CD1 4.36Å; V107-L122 HydrophobicContact CG2-CD1 3.94Å; T118-L122 WeakPolarHBondContact O-CB 3.4Å; T118-L122 PolarHBondContact O-N 2.86Å; T119-L122 PolarHBondContact O-N 3.18Å; D120-L122 VanDerWaalsContact C-N 3.32Å; D120-L122 PolarHBondContact O-N 3.44Å; L122-Q125 PolarHBondContact O-N 3.4Å; L122-W126 WeakPolarHBondContact O-CB 3.45Å; L122-W126 PolarHBondContact O-N 3.35Å
123	L	72	Confident	67.1	Low	25 Å²	25	56.6 Å²	56.6	13%	0.131	32%	0.323	C	S	.	.	H	α-helix	trans	-68.6	-34.4	177.4	-71.2	172.5	0	0	0	112.3	T119 D120 W126 A127 P134 A137 K158	T119-L123 HydrophobicContact CG2-CD1 4.07Å; T119-L123 HydrophobicContact CG2-CG 4.46Å; T119-L123 WeakPolarHBondContact O-CB 3.39Å; T119-L123 VanDerWaalsContact O-CG 3.28Å; T119-L123 WeakPolarHBondContact O-CG 3.33Å; T119-L123 PolarHBondContact O-N 3.36Å; D120-L123 PolarHBondContact O-N 3.37Å; L123-W126 WeakPolarHBondContact O-CB 3.36Å; L123-W126 PolarHBondContact O-N 2.92Å; L123-A127 WeakPolarHBondContact O-CB 3.34Å; L123-A127 PolarHBondContact O-N 2.8Å; L123-P134 HydrophobicContact CD2-CG 3.99Å; L123-A137 HydrophobicContact CD1-CB 3.84Å; L123-A137 HydrophobicContact CD2-CB 3.64Å; L123-A137 HydrophobicContact CG-CB 4.34Å; L123-K158 HydrophobicContact CD1-CB 3.68Å; L123-K158 HydrophobicContact CD1-CG 3.96Å
124	N	73.5	Confident	68.4	Low	109 Å²	109	46.3 Å²	46.3	58%	0.583	29%	0.285	S	S	*	.	H	α-helix	trans	-68.6	-42.6	174.4	-72.4	-24	0	0	0	111.1	D120 A121 W126 A127 A128	D120-N124 VanDerWaalsContact O-CB 3.28Å; D120-N124 WeakPolarHBondContact O-CB 3.46Å; D120-N124 PolarHBondContact O-N 2.85Å; D120-N124 PolarHBondContact O-ND2 2.89Å; A121-N124 PolarHBondContact O-N 3.18Å; N124-W126 VanDerWaalsContact C-N 3.32Å; N124-A127 PolarHBondContact O-N 3.42Å; N124-A128 WeakPolarHBondContact O-CB 2.94Å; N124-A128 PolarHBondContact O-N 2.85Å
125	Q	67.9	Low	69.5	Low	51 Å²	51	42.6 Å²	42.6	24%	0.238	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-40.9	174.9	-169.2	170.4	3.4	0	0	110.7	A121 L122 A128 S129	A121-Q125 WeakPolarHBondContact O-CB 3.19Å; A121-Q125 PolarHBondContact O-N 3.27Å; L122-Q125 PolarHBondContact O-N 3.4Å; Q125-A128 PolarHBondContact O-N 3.07Å; Q125-S129 WeakPolarHBondContact O-CB 3.49Å; Q125-S129 PolarHBondContact O-N 3.46Å; Q125-S129 PolarHBondContact O-OG 3Å
126	W	69	Low	70.7	Confident	9 Å²	9	42.5 Å²	42.5	3%	0.034	27%	0.265	C	S	.	.	H	α-helix	trans	-58.6	-51.3	169.9	-172.7	-54.5	0	0	0	111.4	L18 V60 L75 L122 L123 N124 A128 S129 Y130 C132	L18-W126 HydrophobicContact CD1-CD2 3.96Å; L18-W126 HydrophobicContact CD1-CE3 3.39Å; L18-W126 HydrophobicContact CD1-CH2 3.63Å; L18-W126 HydrophobicContact CD1-CZ2 4.12Å; L18-W126 HydrophobicContact CD1-CZ3 3.2Å; L18-W126 HydrophobicContact CD2-CE3 4.44Å; L18-W126 HydrophobicContact CD2-CH2 3.02Å; L18-W126 HydrophobicContact CD2-CZ2 3.67Å; L18-W126 HydrophobicContact CD2-CZ3 3.47Å; L18-W126 VanDerWaalsContact CD2-CZ3 3.47Å; L18-W126 HydrophobicContact CG-CE3 4.48Å; L18-W126 HydrophobicContact CG-CH2 3.89Å; L18-W126 HydrophobicContact CG-CZ2 4.47Å; L18-W126 HydrophobicContact CG-CZ3 3.86Å; V60-W126 HydrophobicContact CB-CZ2 4.43Å; V60-W126 HydrophobicContact CG1-CZ2 3.76Å; L75-W126 HydrophobicContact CD1-CH2 3.55Å; L75-W126 HydrophobicContact CD1-CZ3 3.99Å; L75-W126 HydrophobicContact CD2-CD2 4.44Å; L75-W126 HydrophobicContact CD2-CE3 3.77Å; L75-W126 HydrophobicContact CD2-CH2 3.39Å; L75-W126 HydrophobicContact CD2-CZ2 4.16Å; L75-W126 HydrophobicContact CD2-CZ3 3.18Å; L75-W126 HydrophobicContact CG-CH2 4.06Å; L75-W126 HydrophobicContact CG-CZ3 4.2Å; L122-W126 WeakPolarHBondContact O-CB 3.45Å; L122-W126 PolarHBondContact O-N 3.35Å; L123-W126 WeakPolarHBondContact O-CB 3.36Å; L123-W126 PolarHBondContact O-N 2.92Å; N124-W126 VanDerWaalsContact C-N 3.32Å; W126-A128 PolarHBondContact O-N 3.48Å; W126-S129 PolarHBondContact O-N 3.5Å; W126-Y130 AromaticContact CD1-CD2 3.88Å; W126-Y130 HydrophobicContact CG-CD2 4.1Å; W126-Y130 VanDerWaalsContact O-CD2 3.25Å; W126-Y130 WeakPolarHBondContact O-CD2 3.5Å; W126-Y130 PolarHBondContact O-N 3.25Å; W126-C132 VanDerWaalsContact CD1-O 3.31Å
127	A	73.4	Confident	72	Confident	35 Å²	35	40.5 Å²	40.5	29%	0.289	25%	0.252	S	S	.	.	H	α-helix	trans	-57.7	-40.2	-179.4	0	0	0	0	0	112	L123 N124 S131 C132	L123-A127 WeakPolarHBondContact O-CB 3.34Å; L123-A127 PolarHBondContact O-N 2.8Å; N124-A127 PolarHBondContact O-N 3.42Å; A127-S131 VanDerWaalsContact O-CA 3.28Å; A127-S131 WeakPolarHBondContact O-CA 3.43Å; A127-S131 PolarHBondContact O-N 3.43Å; A127-C132 WeakPolarHBondContact CA-O 3.39Å
128	A	69.1	Low	73.4	Confident	79 Å²	79	35.2 Å²	35.2	65%	0.653	22%	0.224	S	C	*	.	H	α-helix	trans	-66.6	-49.9	176.5	0	0	0	0	0	112.4	N124 Q125 W126 Y130	N124-A128 WeakPolarHBondContact O-CB 2.94Å; N124-A128 PolarHBondContact O-N 2.85Å; Q125-A128 PolarHBondContact O-N 3.07Å; W126-A128 PolarHBondContact O-N 3.48Å; A128-Y130 PolarHBondContact O-N 3.48Å
129	S	62	Low	74.4	Confident	45 Å²	45	33.6 Å²	33.6	32%	0.315	21%	0.214	S	C	.	.	H	α-helix	trans	-71.5	-28.1	-174.9	-64.1	0	0	0	0	113.5	Q125 W126	Q125-S129 WeakPolarHBondContact O-CB 3.49Å; Q125-S129 PolarHBondContact O-N 3.46Å; Q125-S129 PolarHBondContact O-OG 3Å; W126-S129 PolarHBondContact O-N 3.5Å
130	Y	62.4	Low	75.3	Confident	37 Å²	37	33.4 Å²	33.4	15%	0.145	21%	0.213	C	C	.	.	H	α-helix	trans	-118.7	-1.5	-171.3	-57.4	-100.4	0	0	0	113.8	G14 T15 L18 W126 A128 C132	G14-Y130 WeakPolarHBondContact O-CE1 3.41Å; G14-Y130 PolarHBondContact O-OH 3.46Å; T15-Y130 HydrophobicContact CG2-CD1 3.92Å; T15-Y130 HydrophobicContact CG2-CE1 4.42Å; T15-Y130 VanDerWaalsContact N-CE1 3.28Å; L18-Y130 HydrophobicContact CB-CE1 3.8Å; L18-Y130 WeakPolarHBondContact CB-OH 3.34Å; L18-Y130 HydrophobicContact CD1-CE2 4.06Å; L18-Y130 PolarHBondContact N-OH 2.87Å; W126-Y130 AromaticContact CD1-CD2 3.88Å; W126-Y130 HydrophobicContact CG-CD2 4.1Å; W126-Y130 VanDerWaalsContact O-CD2 3.25Å; W126-Y130 WeakPolarHBondContact O-CD2 3.5Å; W126-Y130 PolarHBondContact O-N 3.25Å; A128-Y130 PolarHBondContact O-N 3.48Å; Y130-C132 VanDerWaalsContact C-SG 3.56Å; Y130-C132 WeakPolarHBondContact CB-SG 3.41Å; Y130-C132 PolarHBondContact O-N 2.85Å; Y130-C132 VanDerWaalsContact O-N 3.1Å; Y130-C132 PolarHBondContact O-SG 3.26Å
131	S	69.5	Low	75.9	Confident	119 Å²	119	30.7 Å²	30.7	83%	0.832	20%	0.198	S	C	*	.	S	Bend	trans	55.1	24.4	-177.4	-59.1	0	0	0	0	114.2	A127	A127-S131 VanDerWaalsContact O-CA 3.28Å; A127-S131 WeakPolarHBondContact O-CA 3.43Å; A127-S131 PolarHBondContact O-N 3.43Å
132	C	72	Confident	76.5	Confident	15 Å²	15	30.3 Å²	30.3	10%	0.101	19%	0.188	C	C	.	.			trans	-149.6	153.8	-175.4	56.1	0	0	0	0	108.7	C61 W126 A127 Y130	C61-C132 HydrophobicContact CB-CB 3.78Å; C61-C132 WeakPolarHBondContact CB-SG 3.05Å; C61-C132 WeakPolarHBondContact SG-CB 3.4Å; C61-C132 CovalentContact SG-SG 1.98Å; C61-C132 PolarHBondContact SG-SG 2.94Å; W126-C132 VanDerWaalsContact CD1-O 3.31Å; A127-C132 WeakPolarHBondContact CA-O 3.39Å; Y130-C132 VanDerWaalsContact C-SG 3.56Å; Y130-C132 WeakPolarHBondContact CB-SG 3.41Å; Y130-C132 PolarHBondContact O-N 2.85Å; Y130-C132 VanDerWaalsContact O-N 3.1Å; Y130-C132 PolarHBondContact O-SG 3.26Å
133	S	77.9	Confident	76.9	Confident	24 Å²	24	32.1 Å²	32.1	17%	0.168	20%	0.196	C	C	.	.			trans	-137.7	148.1	169.2	58.4	0	0	0	0	110.3
134	P	81.8	Confident	77.1	Confident	8 Å²	8	35.7 Å²	35.7	5%	0.052	21%	0.212	C	C	.	.			trans	-64.7	147.8	169.9	29	-35	0	0	0	110.1	V60 L75 L123 A137	V60-P134 HydrophobicContact CG1-CB 4.2Å; L75-P134 HydrophobicContact CB-CB 3.84Å; L75-P134 HydrophobicContact CB-CG 3.91Å; L75-P134 HydrophobicContact CD2-CG 4.22Å; L123-P134 HydrophobicContact CD2-CG 3.99Å; P134-A137 HydrophobicContact CG-CB 4.05Å
135	D	85.2	Confident	77	Confident	10 Å²	10	33.3 Å²	33.3	5%	0.053	20%	0.2	C	C	.	.	S	Bend	trans	-75.8	-33.8	175	-60.2	-60	0	0	0	111.2	W72 R73 V159 R160 F163	W72-D135 WeakPolarHBondContact CA-OD2 3.3Å; W72-D135 HydrophobicContact CE3-CB 4.36Å; R73-D135 PolarHBondContact N-OD2 3.46Å; R73-D135 WeakPolarHBondContact O-CB 3.23Å; R73-D135 PolarHBondContact O-N 3.3Å; D135-V159 CarbonylContact O-C 3.58Å; D135-V159 WeakPolarHBondContact O-CA 3.36Å; D135-R160 PolarHBondContact O-N 2.93Å; D135-F163 HydrophobicContact CB-CB 4.09Å; D135-F163 HydrophobicContact CB-CD2 3.62Å; D135-F163 HydrophobicContact CB-CE2 4.26Å; D135-F163 HydrophobicContact CB-CG 4Å
136	V	87.5	Confident	77.1	Confident	1 Å²	1	37 Å²	37	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	123.2	171.6	-177.8	0	0	0	0	109.1	F56 R73 V74 L75 V138 T157 V159 F163 V199	F56-V136 HydrophobicContact CE1-CG2 4.19Å; F56-V136 HydrophobicContact CZ-CG2 4.5Å; R73-V136 PolarHBondContact O-N 3.39Å; R73-V136 VanDerWaalsContact O-N 3.07Å; V74-V136 CarbonylContact C-O 3.54Å; V74-V136 VanDerWaalsContact CA-O 3.3Å; V74-V136 WeakPolarHBondContact CA-O 3.49Å; V74-V136 HydrophobicContact CG2-CB 4.2Å; V74-V136 HydrophobicContact CG2-CG1 4.36Å; L75-V136 PolarHBondContact N-O 3.33Å; V136-V138 HydrophobicContact CG1-CG2 4.26Å; V136-T157 HydrophobicContact CG1-CG2 4.12Å; V136-V159 HydrophobicContact CG2-CG1 4.26Å; V136-F163 HydrophobicContact CG2-CD1 3.84Å; V136-F163 HydrophobicContact CG2-CE1 3.48Å; V136-F163 VanDerWaalsContact CG2-CE1 3.48Å; V136-F163 HydrophobicContact CG2-CG 4.44Å; V136-F163 HydrophobicContact CG2-CZ 3.9Å; V136-V199 HydrophobicContact CG1-CG1 4.22Å; V136-V199 HydrophobicContact CG2-CG1 4.43Å
137	A	86.9	Confident	77.3	Confident	6 Å²	6	42.9 Å²	42.9	5%	0.05	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.4	171.7	0	0	0	0	0	109.9	L75 L123 P134 T157 K158	L75-A137 CarbonylContact O-C 3.5Å; L75-A137 VanDerWaalsContact O-CA 3.31Å; L75-A137 WeakPolarHBondContact O-CA 3.28Å; L123-A137 HydrophobicContact CD1-CB 3.84Å; L123-A137 HydrophobicContact CD2-CB 3.64Å; L123-A137 HydrophobicContact CG-CB 4.34Å; P134-A137 HydrophobicContact CG-CB 4.05Å; A137-T157 CarbonylContact O-C 3.59Å; A137-T157 VanDerWaalsContact O-CA 3.32Å; A137-T157 WeakPolarHBondContact O-CA 3.47Å; A137-K158 HydrophobicContact CB-CB 4.43Å; A137-K158 PolarHBondContact N-O 3.13Å; A137-K158 PolarHBondContact O-N 2.83Å
138	V	88.6	Confident	77.3	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.024	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	111.2	174	-175.8	0	0	0	0	108.2	L75 I76 L77 V136 V140 V156 T157 L192	L75-V138 PolarHBondContact O-N 3.41Å; I76-V138 CarbonylContact C-O 3.55Å; I76-V138 VanDerWaalsContact CA-O 3.3Å; I76-V138 WeakPolarHBondContact CA-O 3.29Å; I76-V138 HydrophobicContact CG1-CB 4.2Å; L77-V138 PolarHBondContact N-O 2.93Å; V136-V138 HydrophobicContact CG1-CG2 4.26Å; V138-V140 HydrophobicContact CG1-CG2 4.3Å; V138-V156 WeakPolarHBondContact CA-O 3.36Å; V138-T157 HydrophobicContact CG2-CG2 4.15Å; V138-L192 HydrophobicContact CG1-CD1 4.23Å
139	L	85.6	Confident	77.5	Confident	10 Å²	10	49.9 Å²	49.9	5%	0.052	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	124.9	169.9	-174.5	71.4	0	0	0	109.1	L77 V79 I115 T119 F155 V156	L77-L139 HydrophobicContact CB-CD1 3.97Å; L77-L139 HydrophobicContact CD2-CD1 3.74Å; L77-L139 HydrophobicContact CG-CD1 3.84Å; V79-L139 HydrophobicContact CG2-CD1 3.75Å; I115-L139 HydrophobicContact CG2-CD2 3.65Å; T119-L139 HydrophobicContact CG2-CB 4.21Å; T119-L139 HydrophobicContact CG2-CD2 4.37Å; T119-L139 WeakPolarHBondContact OG1-CD2 3.5Å; L139-F155 WeakPolarHBondContact O-CA 3.41Å; L139-V156 HydrophobicContact CB-CB 4.32Å; L139-V156 PolarHBondContact N-O 2.83Å; L139-V156 PolarHBondContact O-N 3.33Å
140	V	87.1	Confident	78	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	106.5	172	-179.7	0	0	0	0	107.8	I76 L77 L78 V79 V138 V153 F155 W188 L192	I76-V140 HydrophobicContact CG2-CG2 4.27Å; L77-V140 PolarHBondContact O-N 3.48Å; L78-V140 HydrophobicContact CD2-CB 4.37Å; L78-V140 HydrophobicContact CD2-CG1 4.35Å; L78-V140 HydrophobicContact CG-CB 4.08Å; L78-V140 HydrophobicContact CG-CG2 4.36Å; V79-V140 PolarHBondContact N-O 3.21Å; V138-V140 HydrophobicContact CG1-CG2 4.3Å; V140-V153 HydrophobicContact CG1-CG1 3.95Å; V140-F155 HydrophobicContact CB-CD1 4.18Å; V140-F155 HydrophobicContact CB-CE1 4.21Å; V140-F155 HydrophobicContact CG1-CD1 3.98Å; V140-F155 HydrophobicContact CG1-CE1 3.61Å; V140-F155 HydrophobicContact CG2-CD1 3.78Å; V140-F155 HydrophobicContact CG2-CE1 3.84Å; V140-W188 HydrophobicContact CG1-CE3 4.34Å; V140-W188 HydrophobicContact CG1-CZ3 4.12Å; V140-L192 HydrophobicContact CG2-CD1 3.81Å; V140-L192 HydrophobicContact CG2-CD2 4.2Å
141	Y	83.1	Confident	78.8	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	117.4	177.6	-179.9	-103.3	0	0	0	110.5	V79 N81 L110 I115 E143 V153 I154	V79-Y141 HydrophobicContact CB-CD2 4.05Å; V79-Y141 HydrophobicContact CG1-CD2 3.69Å; V79-Y141 HydrophobicContact CG1-CE2 4.02Å; N81-Y141 VanDerWaalsContact CB-OH 3.28Å; N81-Y141 WeakPolarHBondContact CB-OH 3.44Å; L110-Y141 HydrophobicContact CB-CD2 4.28Å; L110-Y141 HydrophobicContact CB-CE2 3.62Å; L110-Y141 HydrophobicContact CD1-CD2 3.89Å; L110-Y141 HydrophobicContact CD1-CE2 3.93Å; L110-Y141 HydrophobicContact CG-CE2 4.41Å; L110-Y141 PolarHBondContact O-OH 3.48Å; I115-Y141 HydrophobicContact CD1-CD1 3.27Å; I115-Y141 HydrophobicContact CD1-CE1 3.79Å; I115-Y141 HydrophobicContact CD1-CG 3.66Å; I115-Y141 HydrophobicContact CG1-CD1 4.47Å; Y141-E143 HydrophobicContact CD1-CB 4.34Å; Y141-E143 HydrophobicContact CE1-CB 3.75Å; Y141-E143 HydrophobicContact CE1-CG 4.19Å; Y141-V153 CarbonylContact O-C 3.57Å; Y141-V153 VanDerWaalsContact O-CA 3.3Å; Y141-V153 WeakPolarHBondContact O-CA 3.48Å; Y141-I154 HydrophobicContact CD1-CD1 4.27Å; Y141-I154 PolarHBondContact N-O 3.36Å; Y141-I154 PolarHBondContact O-N 3.38Å
142	K	82.3	Confident	79.3	Confident	36 Å²	36	48.2 Å²	48.2	16%	0.157	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	106.1	176.7	-174.8	176.4	-178.4	179.7	0	110.3	L38 V79 T80 N81 T152 V153	L38-K142 HydrophobicContact CD1-CB 4.02Å; L38-K142 HydrophobicContact CD1-CD 4.29Å; L38-K142 HydrophobicContact CD2-CD 4.24Å; V79-K142 PolarHBondContact O-N 2.79Å; T80-K142 WeakPolarHBondContact CA-O 2.94Å; T80-K142 WeakPolarHBondContact CB-O 3.11Å; T80-K142 PolarHBondContact OG1-O 3.15Å; N81-K142 PolarHBondContact N-O 3.49Å; K142-T152 CarbonylContact C-O 3.52Å; K142-V153 HydrophobicContact CB-CG2 4.13Å; K142-V153 HydrophobicContact CD-CG2 4.5Å; K142-V153 HydrophobicContact CG-CG2 3.91Å
143	E	78.6	Confident	79.8	Confident	50 Å²	50	47.5 Å²	47.5	23%	0.234	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.2	171.6	-161	174	-170.7	0	0	109.6	N81 Y141 N151 T152	N81-E143 VanDerWaalsContact ND2-CG 3.33Å; N81-E143 WeakPolarHBondContact ND2-CG 3.3Å; Y141-E143 HydrophobicContact CD1-CB 4.34Å; Y141-E143 HydrophobicContact CE1-CB 3.75Å; Y141-E143 HydrophobicContact CE1-CG 4.19Å; E143-N151 CarbonylContact O-C 3.57Å; E143-N151 WeakPolarHBondContact O-CA 3.35Å; E143-T152 PolarHBondContact N-O 3.33Å; E143-T152 PolarHBondContact O-N 3.11Å
144	Q	76	Confident	80	Confident	100 Å²	100	46.9 Å²	46.9	47%	0.467	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	110.8	170.8	-174	155.9	38.8	0	0	108.4	N81 V146 N151	N81-Q144 PolarHBondContact ND2-N 3.42Å; N81-Q144 PolarHBondContact ND2-O 3.18Å; N81-Q144 PolarHBondContact OD1-N 3.13Å; Q144-V146 PolarHBondContact O-N 3.1Å; Q144-N151 VanDerWaalsContact CG-OD1 3.26Å; Q144-N151 WeakPolarHBondContact CG-OD1 3.47Å; Q144-N151 PolarHBondContact NE2-OD1 3.48Å
145	D	71.1	Confident	80.2	Confident	59 Å²	59	46.6 Å²	46.6	32%	0.316	24%	0.241	S	C	.	.			trans	-83.7	110.8	174.2	-178	-6.1	0	0	0	109	V147 T148 K149 K150	D145-V147 PolarHBondContact O-N 3.42Å; D145-V147 WeakPolarHBondContact OD1-CB 3.48Å; D145-V147 PolarHBondContact OD1-N 2.94Å; D145-T148 WeakPolarHBondContact CB-OG1 3.47Å; D145-T148 PolarHBondContact OD1-N 3.33Å; D145-T148 WeakPolarHBondContact OD2-CB 3.43Å; D145-T148 WeakPolarHBondContact OD2-CG2 3.31Å; D145-T148 PolarHBondContact OD2-OG1 2.96Å; D145-K149 WeakPolarHBondContact O-CA 3.49Å; D145-K149 PolarHBondContact O-N 2.93Å; D145-K150 PolarHBondContact N-O 2.79Å
146	V	71.3	Confident	80.1	Confident	127 Å²	127	46.2 Å²	46.2	77%	0.77	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-31	-179.4	-175.2	0	0	0	0	111.4	Q144	Q144-V146 PolarHBondContact O-N 3.1Å
147	V	72.5	Confident	80.1	Confident	134 Å²	134	46.2 Å²	46.2	81%	0.812	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-51	-175.3	-176.7	0	0	0	0	110.1	D145 K149	D145-V147 PolarHBondContact O-N 3.42Å; D145-V147 WeakPolarHBondContact OD1-CB 3.48Å; D145-V147 PolarHBondContact OD1-N 2.94Å; V147-K149 VanDerWaalsContact C-N 3.34Å
148	T	73.9	Confident	80.1	Confident	76 Å²	76	48.6 Å²	48.6	47%	0.466	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-8.4	-178.1	64.5	0	0	0	0	113.4	D145 K150	D145-T148 WeakPolarHBondContact CB-OG1 3.47Å; D145-T148 PolarHBondContact OD1-N 3.33Å; D145-T148 WeakPolarHBondContact OD2-CB 3.43Å; D145-T148 WeakPolarHBondContact OD2-CG2 3.31Å; D145-T148 PolarHBondContact OD2-OG1 2.96Å; T148-K150 PolarHBondContact O-N 3.31Å; T148-K150 VanDerWaalsContact O-N 3.09Å; T148-K150 PolarHBondContact OG1-N 3.2Å
149	K	71.4	Confident	80	Confident	185 Å²	185	49.4 Å²	49.4	80%	0.804	25%	0.253	S	S	*	.			trans	54.7	16.7	-170	-61.8	-178	178.3	176.9	0	113.4	D145 V147	D145-K149 WeakPolarHBondContact O-CA 3.49Å; D145-K149 PolarHBondContact O-N 2.93Å; V147-K149 VanDerWaalsContact C-N 3.34Å
150	K	74	Confident	80	Confident	123 Å²	123	54.1 Å²	54.1	54%	0.535	27%	0.271	S	S	.	.			trans	-89.7	138.4	176.6	-67.3	-176.3	178.6	-178.3	0	108.8	D145 T148	D145-K150 PolarHBondContact N-O 2.79Å; T148-K150 PolarHBondContact O-N 3.31Å; T148-K150 VanDerWaalsContact O-N 3.09Å; T148-K150 PolarHBondContact OG1-N 3.2Å
151	N	78	Confident	79.9	Confident	17 Å²	17	63.2 Å²	63.2	9%	0.091	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	138.9	165.8	-66.1	-24.5	0	0	0	106.8	E143 Q144 P183	E143-N151 CarbonylContact O-C 3.57Å; E143-N151 WeakPolarHBondContact O-CA 3.35Å; Q144-N151 VanDerWaalsContact CG-OD1 3.26Å; Q144-N151 WeakPolarHBondContact CG-OD1 3.47Å; Q144-N151 PolarHBondContact NE2-OD1 3.48Å; N151-P183 HydrophobicContact CB-CG 3.86Å; N151-P183 WeakPolarHBondContact O-CD 3.46Å; N151-P183 WeakPolarHBondContact O-CG 3.42Å
152	T	79.7	Confident	79.8	Confident	26 Å²	26	68 Å²	68	16%	0.16	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.2	173.1	-49.9	0	0	0	0	106.9	K142 E143 L180 I181 I182	K142-T152 CarbonylContact C-O 3.52Å; E143-T152 PolarHBondContact N-O 3.33Å; E143-T152 PolarHBondContact O-N 3.11Å; T152-L180 HydrophobicContact CG2-CD1 3.37Å; T152-L180 HydrophobicContact CG2-CG 4.22Å; T152-I181 CarbonylContact C-O 3.47Å; T152-I181 WeakPolarHBondContact CA-O 3.46Å; T152-I182 HydrophobicContact CG2-CG1 4.48Å
153	V	83.4	Confident	80	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.5	177.7	174.3	0	0	0	0	108.6	V140 Y141 K142 F155 I181 P183 W188	V140-V153 HydrophobicContact CG1-CG1 3.95Å; Y141-V153 CarbonylContact O-C 3.57Å; Y141-V153 VanDerWaalsContact O-CA 3.3Å; Y141-V153 WeakPolarHBondContact O-CA 3.48Å; K142-V153 HydrophobicContact CB-CG2 4.13Å; K142-V153 HydrophobicContact CD-CG2 4.5Å; K142-V153 HydrophobicContact CG-CG2 3.91Å; V153-F155 HydrophobicContact CG1-CD1 4.03Å; V153-F155 HydrophobicContact CG1-CE1 3.49Å; V153-F155 VanDerWaalsContact CG1-CE1 3.49Å; V153-F155 HydrophobicContact CG1-CZ 3.8Å; V153-I181 PolarHBondContact N-O 2.92Å; V153-I181 PolarHBondContact O-N 3.33Å; V153-I181 VanDerWaalsContact O-O 3.12Å; V153-P183 HydrophobicContact CB-CG 4.37Å; V153-P183 HydrophobicContact CG2-CG 3.77Å; V153-W188 HydrophobicContact CB-CB 4.08Å; V153-W188 HydrophobicContact CG1-CB 4.19Å; V153-W188 HydrophobicContact CG1-CE3 4.44Å; V153-W188 HydrophobicContact CG2-CB 3.88Å; V153-W188 HydrophobicContact CG2-CD2 4.42Å; V153-W188 HydrophobicContact CG2-CG 4.04Å
154	I	82.5	Confident	80.3	Confident	11 Å²	11	65.5 Å²	65.5	6%	0.056	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.4	178.9	-62.7	169.2	0	0	0	107.5	I115 Y141 V156 V179 L180	I115-I154 HydrophobicContact CD1-CB 4.21Å; I115-I154 HydrophobicContact CD1-CD1 3.53Å; I115-I154 HydrophobicContact CD1-CG1 4.43Å; I115-I154 HydrophobicContact CD1-CG2 4.19Å; Y141-I154 HydrophobicContact CD1-CD1 4.27Å; Y141-I154 PolarHBondContact N-O 3.36Å; Y141-I154 PolarHBondContact O-N 3.38Å; I154-V156 HydrophobicContact CG2-CG2 3.98Å; I154-V179 WeakPolarHBondContact CA-O 3.35Å; I154-L180 HydrophobicContact CD1-CD1 3.83Å; I154-L180 HydrophobicContact CG1-CD1 3.38Å
155	F	84.6	Confident	80.7	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.009	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125	169.9	-56.9	-47.8	0	0	0	109.5	L139 V140 V153 P178 V179 I181 W188 A191 L192	L139-F155 WeakPolarHBondContact O-CA 3.41Å; V140-F155 HydrophobicContact CB-CD1 4.18Å; V140-F155 HydrophobicContact CB-CE1 4.21Å; V140-F155 HydrophobicContact CG1-CD1 3.98Å; V140-F155 HydrophobicContact CG1-CE1 3.61Å; V140-F155 HydrophobicContact CG2-CD1 3.78Å; V140-F155 HydrophobicContact CG2-CE1 3.84Å; V153-F155 HydrophobicContact CG1-CD1 4.03Å; V153-F155 HydrophobicContact CG1-CE1 3.49Å; V153-F155 VanDerWaalsContact CG1-CE1 3.49Å; V153-F155 HydrophobicContact CG1-CZ 3.8Å; F155-P178 CarbonylContact O-C 3.51Å; F155-P178 VanDerWaalsContact O-CA 3.29Å; F155-P178 WeakPolarHBondContact O-CA 3.36Å; F155-V179 HydrophobicContact CB-CB 4.29Å; F155-V179 HydrophobicContact CD2-CB 4.31Å; F155-V179 HydrophobicContact CD2-CG1 4.5Å; F155-V179 PolarHBondContact N-O 2.82Å; F155-V179 PolarHBondContact O-N 3.39Å; F155-I181 HydrophobicContact CD2-CD1 3.81Å; F155-I181 HydrophobicContact CD2-CG1 4.43Å; F155-I181 HydrophobicContact CE2-CD1 3.27Å; F155-I181 HydrophobicContact CE2-CG1 4.23Å; F155-I181 HydrophobicContact CZ-CD1 4.19Å; F155-W188 WeakPolarHBondContact CZ-O 3.49Å; F155-A191 HydrophobicContact CE2-CB 3.85Å; F155-A191 HydrophobicContact CZ-CB 4.44Å; F155-L192 HydrophobicContact CD1-CD1 4.44Å; F155-L192 HydrophobicContact CE1-CB 4.1Å; F155-L192 HydrophobicContact CE1-CD1 4.11Å; F155-L192 HydrophobicContact CZ-CB 3.81Å
156	V	84.5	Confident	81.3	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.012	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.9	170.3	-179.1	0	0	0	0	107.8	I115 T119 V138 L139 I154 K158 P178	I115-V156 HydrophobicContact CG2-CG2 3.59Å; T119-V156 HydrophobicContact CG2-CG1 4.4Å; V138-V156 WeakPolarHBondContact CA-O 3.36Å; L139-V156 HydrophobicContact CB-CB 4.32Å; L139-V156 PolarHBondContact N-O 2.83Å; L139-V156 PolarHBondContact O-N 3.33Å; I154-V156 HydrophobicContact CG2-CG2 3.98Å; V156-K158 HydrophobicContact CG1-CG 4.38Å; V156-P178 HydrophobicContact CG2-CB 4.22Å
157	T	87.7	Confident	81.9	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	123	176.3	-56.6	0	0	0	0	109.5	V136 A137 V138 V159 L175 H195	V136-T157 HydrophobicContact CG1-CG2 4.12Å; A137-T157 CarbonylContact O-C 3.59Å; A137-T157 VanDerWaalsContact O-CA 3.32Å; A137-T157 WeakPolarHBondContact O-CA 3.47Å; V138-T157 HydrophobicContact CG2-CG2 4.15Å; T157-V159 HydrophobicContact CG2-CG2 3.94Å; T157-L175 VanDerWaalsContact CB-O 3.3Å; T157-L175 WeakPolarHBondContact CB-O 3.38Å; T157-H195 PolarHBondContact OG1-NE2 3.46Å
158	K	86.5	Confident	82.3	Confident	55 Å²	55	57.5 Å²	57.5	24%	0.239	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.4	174.1	-66	-69.2	-176.7	149.6	0	107.9	T119 D120 L123 A137 V156	T119-K158 HydrophobicContact CG2-CG 3.82Å; D120-K158 WeakPolarHBondContact OD1-CD 3.28Å; D120-K158 WeakPolarHBondContact OD1-CE 3.34Å; D120-K158 IonicContact OD1-NZ 2.74Å; D120-K158 PolarHBondContact OD1-NZ 3.47Å; D120-K158 IonicContact OD2-NZ 2.73Å; D120-K158 PolarHBondContact OD2-NZ 3.31Å; L123-K158 HydrophobicContact CD1-CB 3.68Å; L123-K158 HydrophobicContact CD1-CG 3.96Å; A137-K158 HydrophobicContact CB-CB 4.43Å; A137-K158 PolarHBondContact N-O 3.13Å; A137-K158 PolarHBondContact O-N 2.83Å; V156-K158 HydrophobicContact CG1-CG 4.38Å
159	V	87	Confident	82.7	Confident	21 Å²	21	58 Å²	58	13%	0.127	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	129.9	-178.2	-171.9	0	0	0	0	107.6	D135 V136 T157 F163 L164 I170 T176	D135-V159 CarbonylContact O-C 3.58Å; D135-V159 WeakPolarHBondContact O-CA 3.36Å; V136-V159 HydrophobicContact CG2-CG1 4.26Å; T157-V159 HydrophobicContact CG2-CG2 3.94Å; V159-F163 HydrophobicContact CG1-CB 3.99Å; V159-F163 HydrophobicContact CG1-CD1 3.4Å; V159-F163 VanDerWaalsContact CG1-CD1 3.4Å; V159-F163 HydrophobicContact CG1-CE1 4.3Å; V159-F163 HydrophobicContact CG1-CG 4.08Å; V159-L164 HydrophobicContact CB-CD1 4.21Å; V159-L164 HydrophobicContact CB-CD2 3.91Å; V159-L164 HydrophobicContact CB-CG 3.89Å; V159-L164 HydrophobicContact CG1-CD1 4.43Å; V159-L164 HydrophobicContact CG1-CD2 3.69Å; V159-L164 HydrophobicContact CG1-CG 3.61Å; V159-I170 HydrophobicContact CG2-CG2 4.23Å; V159-T176 HydrophobicContact CB-CG2 4.43Å; V159-T176 HydrophobicContact CG2-CG2 4.01Å
160	R	85	Confident	83.1	Confident	110 Å²	110	49.2 Å²	49.2	42%	0.415	24%	0.237	S	C	.	.			trans	-64.9	142	-179.8	-164.2	174.9	-174.5	-171.3	3	109.4	D135 L162 F163 L164	D135-R160 PolarHBondContact O-N 2.93Å; R160-L162 VanDerWaalsContact C-N 3.31Å; R160-L162 PolarHBondContact O-N 3.21Å; R160-F163 HydrophobicContact CB-CB 4.39Å; R160-F163 WeakPolarHBondContact O-CA 3.43Å; R160-F163 VanDerWaalsContact O-CB 3.29Å; R160-F163 WeakPolarHBondContact O-CB 3.33Å; R160-F163 PolarHBondContact O-N 3.33Å; R160-L164 PolarHBondContact O-N 3.37Å
161	R	83.9	Confident	83.2	Confident	190 Å²	190	48 Å²	48	72%	0.717	24%	0.236	S	C	*	.	H	α-helix	trans	-55.2	-44.9	-177.3	-175.5	176.4	173.7	160.4	4.1	113	F163 L164 E165	R161-F163 PolarHBondContact O-N 3.21Å; R161-L164 WeakPolarHBondContact O-CB 3.3Å; R161-L164 PolarHBondContact O-N 3.44Å; R161-L164 VanDerWaalsContact O-N 3.12Å; R161-E165 HydrophobicContact CG-CG 4.45Å; R161-E165 WeakPolarHBondContact CG-OE1 3.25Å; R161-E165 IonicContact CZ-OE1 3.83Å; R161-E165 IonicContact NE-OE1 2.92Å; R161-E165 PolarHBondContact NE-OE1 3.13Å; R161-E165 IonicContact NH2-OE1 3.87Å; R161-E165 WeakPolarHBondContact O-CG 3.48Å; R161-E165 PolarHBondContact O-N 3.04Å
162	L	82.8	Confident	83	Confident	104 Å²	104	51.2 Å²	51.2	55%	0.545	27%	0.265	S	S	.	.	H	α-helix	trans	-59.2	-35.2	176.7	-66.4	170.3	0	0	0	112.3	R160 A166	R160-L162 VanDerWaalsContact C-N 3.31Å; R160-L162 PolarHBondContact O-N 3.21Å; L162-A166 PolarHBondContact O-N 3.47Å
163	F	84.9	Confident	82.9	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-71.7	-39.8	176.3	-167.3	-96	0	0	0	112.2	F56 W72 D135 V136 V159 R160 R161 A166 H167 I170 T203	F56-F163 HydrophobicContact CE1-CE2 4.3Å; F56-F163 AromaticContact CE1-CZ 3.91Å; F56-F163 HydrophobicContact CE1-CZ 3.91Å; F56-F163 AromaticContact CZ-CZ 3.93Å; F56-F163 HydrophobicContact CZ-CZ 3.93Å; W72-F163 HydrophobicContact CB-CE2 3.73Å; W72-F163 AromaticContact CD2-CD2 3.58Å; W72-F163 HydrophobicContact CD2-CD2 3.58Å; W72-F163 AromaticContact CD2-CE2 3.37Å; W72-F163 HydrophobicContact CD2-CE2 3.37Å; W72-F163 AromaticContact CE2-CE2 3.93Å; W72-F163 AromaticContact CE3-CD2 3.28Å; W72-F163 HydrophobicContact CE3-CD2 3.28Å; W72-F163 AromaticContact CE3-CE2 3.6Å; W72-F163 HydrophobicContact CE3-CE2 3.6Å; W72-F163 HydrophobicContact CG-CD2 4.15Å; W72-F163 AromaticContact CG-CE2 3.47Å; W72-F163 HydrophobicContact CG-CE2 3.47Å; W72-F163 VanDerWaalsContact CG-CE2 3.47Å; W72-F163 HydrophobicContact CG-CZ 4.49Å; W72-F163 HydrophobicContact CH2-CD2 4.09Å; W72-F163 HydrophobicContact CZ2-CD2 4.4Å; W72-F163 AromaticContact CZ3-CD2 3.54Å; W72-F163 HydrophobicContact CZ3-CD2 3.54Å; W72-F163 HydrophobicContact CZ3-CE2 4.23Å; W72-F163 HydrophobicContact CZ3-CG 4.5Å; D135-F163 HydrophobicContact CB-CB 4.09Å; D135-F163 HydrophobicContact CB-CD2 3.62Å; D135-F163 HydrophobicContact CB-CE2 4.26Å; D135-F163 HydrophobicContact CB-CG 4Å; V136-F163 HydrophobicContact CG2-CD1 3.84Å; V136-F163 HydrophobicContact CG2-CE1 3.48Å; V136-F163 VanDerWaalsContact CG2-CE1 3.48Å; V136-F163 HydrophobicContact CG2-CG 4.44Å; V136-F163 HydrophobicContact CG2-CZ 3.9Å; V159-F163 HydrophobicContact CG1-CB 3.99Å; V159-F163 HydrophobicContact CG1-CD1 3.4Å; V159-F163 VanDerWaalsContact CG1-CD1 3.4Å; V159-F163 HydrophobicContact CG1-CE1 4.3Å; V159-F163 HydrophobicContact CG1-CG 4.08Å; R160-F163 HydrophobicContact CB-CB 4.39Å; R160-F163 WeakPolarHBondContact O-CA 3.43Å; R160-F163 VanDerWaalsContact O-CB 3.29Å; R160-F163 WeakPolarHBondContact O-CB 3.33Å; R160-F163 PolarHBondContact O-N 3.33Å; R161-F163 PolarHBondContact O-N 3.21Å; F163-A166 PolarHBondContact O-N 3.13Å; F163-H167 AromaticContact CD1-ND1 3.98Å; F163-H167 AromaticContact CD2-ND1 3.95Å; F163-H167 AromaticContact CE1-ND1 3.92Å; F163-H167 AromaticContact CE2-CE1 3.73Å; F163-H167 AromaticContact CE2-ND1 3.82Å; F163-H167 AromaticContact CZ-CE1 3.97Å; F163-H167 AromaticContact CZ-ND1 3.83Å; F163-H167 PolarHBondContact O-N 3.25Å; F163-H167 PolarHBondContact O-ND1 2.76Å; F163-I170 HydrophobicContact CD1-CD1 3.71Å; F163-I170 HydrophobicContact CE1-CD1 3.33Å; F163-I170 HydrophobicContact CZ-CD1 4.47Å; F163-T203 HydrophobicContact CE1-CG2 3.73Å; F163-T203 HydrophobicContact CZ-CG2 3.42Å; F163-T203 VanDerWaalsContact CZ-CG2 3.42Å
164	L	85.3	Confident	82.7	Confident	32 Å²	32	59 Å²	59	17%	0.168	30%	0.303	C	S	.	.	H	α-helix	trans	-65.4	-37.8	174.9	-73	170.7	0	0	0	112.2	V159 R160 R161 A166 H167 P168 I170 L171	V159-L164 HydrophobicContact CB-CD1 4.21Å; V159-L164 HydrophobicContact CB-CD2 3.91Å; V159-L164 HydrophobicContact CB-CG 3.89Å; V159-L164 HydrophobicContact CG1-CD1 4.43Å; V159-L164 HydrophobicContact CG1-CD2 3.69Å; V159-L164 HydrophobicContact CG1-CG 3.61Å; R160-L164 PolarHBondContact O-N 3.37Å; R161-L164 WeakPolarHBondContact O-CB 3.3Å; R161-L164 PolarHBondContact O-N 3.44Å; R161-L164 VanDerWaalsContact O-N 3.12Å; L164-A166 VanDerWaalsContact C-N 3.28Å; L164-A166 PolarHBondContact O-N 3.19Å; L164-H167 CarbonylContact O-C 3.59Å; L164-H167 PolarHBondContact O-N 3.12Å; L164-P168 WeakPolarHBondContact O-CA 3.35Å; L164-P168 VanDerWaalsContact O-N 3.16Å; L164-I170 HydrophobicContact CD2-CB 4.06Å; L164-I170 HydrophobicContact CD2-CG2 3.91Å; L164-L171 HydrophobicContact CB-CD1 4.22Å; L164-L171 HydrophobicContact CD1-CD1 4.29Å; L164-L171 HydrophobicContact CD2-CD1 3.95Å; L164-L171 HydrophobicContact CD2-CG 4.13Å; L164-L171 HydrophobicContact CG-CD1 4.37Å
165	E	85.6	Confident	82.4	Confident	116 Å²	116	59.1 Å²	59.1	54%	0.542	30%	0.304	S	S	.	.	H	α-helix	trans	-64.8	-35.3	175.7	-73.1	170.2	-174.6	0	0	111.2	R161	R161-E165 HydrophobicContact CG-CG 4.45Å; R161-E165 WeakPolarHBondContact CG-OE1 3.25Å; R161-E165 IonicContact CZ-OE1 3.83Å; R161-E165 IonicContact NE-OE1 2.92Å; R161-E165 PolarHBondContact NE-OE1 3.13Å; R161-E165 IonicContact NH2-OE1 3.87Å; R161-E165 WeakPolarHBondContact O-CG 3.48Å; R161-E165 PolarHBondContact O-N 3.04Å
166	A	82.9	Confident	81.9	Confident	45 Å²	45	61.4 Å²	61.4	37%	0.372	32%	0.318	S	S	.	.	H	α-helix	trans	-76.8	-25.5	173.1	0	0	0	0	0	113.7	W72 L162 F163 L164	W72-A166 HydrophobicContact CH2-CB 3.92Å; W72-A166 HydrophobicContact CZ2-CB 3.97Å; L162-A166 PolarHBondContact O-N 3.47Å; F163-A166 PolarHBondContact O-N 3.13Å; L164-A166 VanDerWaalsContact C-N 3.28Å; L164-A166 PolarHBondContact O-N 3.19Å
167	H	83.2	Confident	81.4	Confident	8 Å²	8	66.9 Å²	66.9	4%	0.037	35%	0.345	C	S	.	.			trans	-135.5	70.3	-175.1	-51.6	89.6	0	0	0	111.7	W72 F163 L164 E169 I170	W72-H167 AromaticContact CE2-CE1 3.57Å; W72-H167 AromaticContact CZ2-CE1 3.53Å; W72-H167 AromaticContact NE1-CE1 3.6Å; W72-H167 AromaticContact NE1-NE2 3.96Å; F163-H167 AromaticContact CD1-ND1 3.98Å; F163-H167 AromaticContact CD2-ND1 3.95Å; F163-H167 AromaticContact CE1-ND1 3.92Å; F163-H167 AromaticContact CE2-CE1 3.73Å; F163-H167 AromaticContact CE2-ND1 3.82Å; F163-H167 AromaticContact CZ-CE1 3.97Å; F163-H167 AromaticContact CZ-ND1 3.83Å; F163-H167 PolarHBondContact O-N 3.25Å; F163-H167 PolarHBondContact O-ND1 2.76Å; L164-H167 CarbonylContact O-C 3.59Å; L164-H167 PolarHBondContact O-N 3.12Å; H167-E169 PolarHBondContact O-N 2.91Å; H167-E169 VanDerWaalsContact O-N 3.13Å; H167-I170 HydrophobicContact CB-CD1 3.69Å; H167-I170 HydrophobicContact CB-CG1 4.09Å; H167-I170 WeakPolarHBondContact O-CB 3.28Å; H167-I170 PolarHBondContact O-N 2.87Å
168	P	81.7	Confident	80.7	Confident	84 Å²	84	70.6 Å²	70.6	55%	0.545	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.1	-177.1	25.4	-34.4	0	0	0	113.3	L164 I170 L171 A172	L164-P168 WeakPolarHBondContact O-CA 3.35Å; L164-P168 VanDerWaalsContact O-N 3.16Å; P168-I170 PolarHBondContact O-N 2.81Å; P168-I170 VanDerWaalsContact O-N 3.16Å; P168-L171 WeakPolarHBondContact O-CB 3.5Å; P168-L171 PolarHBondContact O-N 2.76Å; P168-L171 VanDerWaalsContact O-N 3.09Å; P168-A172 PolarHBondContact O-N 3.12Å
169	E	83	Confident	80	Confident	86 Å²	86	70.7 Å²	70.7	40%	0.402	37%	0.374	S	S	.	.	H	α-helix	trans	-58.6	-26.2	176.2	-62.2	-178.1	-173.5	0	0	113.1	H167 L171 A172 Q173 A202	H167-E169 PolarHBondContact O-N 2.91Å; H167-E169 VanDerWaalsContact O-N 3.13Å; E169-L171 VanDerWaalsContact C-N 3.31Å; E169-L171 PolarHBondContact O-N 2.8Å; E169-A172 WeakPolarHBondContact O-CB 3.42Å; E169-A172 PolarHBondContact O-N 3.01Å; E169-Q173 WeakPolarHBondContact O-CG 3.5Å; E169-Q173 PolarHBondContact O-N 2.81Å; E169-A202 HydrophobicContact CB-CB 4.19Å
170	I	79.2	Confident	79.2	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.005	40%	0.397	C	S	.	.	H	α-helix	trans	-65.4	-37.4	177.7	-62.9	175.4	0	0	0	111.3	V159 F163 L164 H167 P168 Q173 L175 A202 T203	V159-I170 HydrophobicContact CG2-CG2 4.23Å; F163-I170 HydrophobicContact CD1-CD1 3.71Å; F163-I170 HydrophobicContact CE1-CD1 3.33Å; F163-I170 HydrophobicContact CZ-CD1 4.47Å; L164-I170 HydrophobicContact CD2-CB 4.06Å; L164-I170 HydrophobicContact CD2-CG2 3.91Å; H167-I170 HydrophobicContact CB-CD1 3.69Å; H167-I170 HydrophobicContact CB-CG1 4.09Å; H167-I170 WeakPolarHBondContact O-CB 3.28Å; H167-I170 PolarHBondContact O-N 2.87Å; P168-I170 PolarHBondContact O-N 2.81Å; P168-I170 VanDerWaalsContact O-N 3.16Å; I170-Q173 PolarHBondContact O-N 2.89Å; I170-L175 HydrophobicContact CG2-CB 4.14Å; I170-L175 HydrophobicContact CG2-CD1 4.17Å; I170-A202 HydrophobicContact CG1-CB 3.65Å; I170-T203 HydrophobicContact CD1-CG2 4.14Å
171	L	76.1	Confident	78.4	Confident	96 Å²	96	71.5 Å²	71.5	50%	0.503	39%	0.385	S	S	.	.	H	α-helix	trans	-67.7	-40.3	174.6	-94.5	143.2	0	0	0	110.9	L164 P168 E169 Q173 N174	L164-L171 HydrophobicContact CB-CD1 4.22Å; L164-L171 HydrophobicContact CD1-CD1 4.29Å; L164-L171 HydrophobicContact CD2-CD1 3.95Å; L164-L171 HydrophobicContact CD2-CG 4.13Å; L164-L171 HydrophobicContact CG-CD1 4.37Å; P168-L171 WeakPolarHBondContact O-CB 3.5Å; P168-L171 PolarHBondContact O-N 2.76Å; P168-L171 VanDerWaalsContact O-N 3.09Å; E169-L171 VanDerWaalsContact C-N 3.31Å; E169-L171 PolarHBondContact O-N 2.8Å; L171-Q173 PolarHBondContact O-N 2.01Å; L171-N174 PolarHBondContact O-N 2.92Å; L171-N174 VanDerWaalsContact O-N 3.12Å
172	A	73.6	Confident	77.5	Confident	86 Å²	86	67.8 Å²	67.8	71%	0.711	38%	0.378	S	S	*	.	H	α-helix	trans	-62.7	-28.5	178.5	0	0	0	0	0	113	P168 E169	P168-A172 PolarHBondContact O-N 3.12Å; E169-A172 WeakPolarHBondContact O-CB 3.42Å; E169-A172 PolarHBondContact O-N 3.01Å
173	Q	76.5	Confident	76.6	Confident	83 Å²	83	63.5 Å²	63.5	39%	0.388	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	4.6	178.6	-65.9	-176.3	20.1	0	0	114.1	E169 I170 L171 L175	E169-Q173 WeakPolarHBondContact O-CG 3.5Å; E169-Q173 PolarHBondContact O-N 2.81Å; I170-Q173 PolarHBondContact O-N 2.89Å; L171-Q173 PolarHBondContact O-N 2.01Å; Q173-L175 HydrophobicContact CB-CD1 3.87Å; Q173-L175 HydrophobicContact CB-CD2 4.45Å; Q173-L175 HydrophobicContact CB-CG 3.72Å; Q173-L175 PolarHBondContact O-N 3.47Å; Q173-L175 VanDerWaalsContact O-N 3.15Å
174	N	79.4	Confident	75.5	Confident	107 Å²	107	70.2 Å²	70.2	57%	0.572	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	29.3	-178	-73.1	-22.2	0	0	0	114.4	L171 T176 M177	L171-N174 PolarHBondContact O-N 2.92Å; L171-N174 VanDerWaalsContact O-N 3.12Å; N174-T176 PolarHBondContact O-N 2.86Å; N174-M177 HydrophobicContact CB-CG 4.5Å; N174-M177 PolarHBondContact O-N 2.82Å
175	L	76.9	Confident	74.1	Confident	12 Å²	12	74.8 Å²	74.8	6%	0.063	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-14.8	-173.1	-67.6	170	0	0	0	114	T157 I170 Q173 H195 A198 V199	T157-L175 VanDerWaalsContact CB-O 3.3Å; T157-L175 WeakPolarHBondContact CB-O 3.38Å; I170-L175 HydrophobicContact CG2-CB 4.14Å; I170-L175 HydrophobicContact CG2-CD1 4.17Å; Q173-L175 HydrophobicContact CB-CD1 3.87Å; Q173-L175 HydrophobicContact CB-CD2 4.45Å; Q173-L175 HydrophobicContact CB-CG 3.72Å; Q173-L175 PolarHBondContact O-N 3.47Å; Q173-L175 VanDerWaalsContact O-N 3.15Å; L175-H195 PolarHBondContact O-CE1 2.78Å; L175-A198 HydrophobicContact CD1-CB 4.18Å; L175-A198 HydrophobicContact CD2-CB 3.67Å; L175-V199 HydrophobicContact CD1-CG2 4Å
176	T	75	Confident	73.1	Confident	50 Å²	50	76.6 Å²	76.6	31%	0.307	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-11.8	178.5	53.9	0	0	0	0	113.4	V159 N174	V159-T176 HydrophobicContact CB-CG2 4.43Å; V159-T176 HydrophobicContact CG2-CG2 4.01Å; N174-T176 PolarHBondContact O-N 2.86Å
177	M	74.2	Confident	72.9	Confident	118 Å²	118	76.7 Å²	76.7	58%	0.581	42%	0.424	S	S	*	.	S	Bend	trans	-73.9	137.6	177.6	-63.5	-159.1	95.7	0	0	110.5	N174 V179	N174-M177 HydrophobicContact CB-CG 4.5Å; N174-M177 PolarHBondContact O-N 2.82Å; M177-V179 PolarHBondContact O-N 3.35Å
178	P	71.1	Confident	73	Confident	79 Å²	79	77 Å²	77	51%	0.513	42%	0.424	S	S	.	.			trans	-59	127.7	174.5	-22.3	32.7	0	0	0	111	F155 V156	F155-P178 CarbonylContact O-C 3.51Å; F155-P178 VanDerWaalsContact O-CA 3.29Å; F155-P178 WeakPolarHBondContact O-CA 3.36Å; V156-P178 HydrophobicContact CG2-CB 4.22Å
179	V	71.9	Confident	73.3	Confident	57 Å²	57	73.9 Å²	73.9	35%	0.345	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	117.2	176.9	-176.4	0	0	0	0	108.8	I154 F155 M177 I181	I154-V179 WeakPolarHBondContact CA-O 3.35Å; F155-V179 HydrophobicContact CB-CB 4.29Å; F155-V179 HydrophobicContact CD2-CB 4.31Å; F155-V179 HydrophobicContact CD2-CG1 4.5Å; F155-V179 PolarHBondContact N-O 2.82Å; F155-V179 PolarHBondContact O-N 3.39Å; M177-V179 PolarHBondContact O-N 3.35Å; V179-I181 HydrophobicContact CG1-CD1 4.25Å; V179-I181 HydrophobicContact CG1-CG1 3.94Å
180	L	71	Confident	73.5	Confident	115 Å²	115	74.5 Å²	74.5	60%	0.602	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	127.3	173	-176.3	73	0	0	0	109.5	T152 I154	T152-L180 HydrophobicContact CG2-CD1 3.37Å; T152-L180 HydrophobicContact CG2-CG 4.22Å; I154-L180 HydrophobicContact CD1-CD1 3.83Å; I154-L180 HydrophobicContact CG1-CD1 3.38Å
181	I	69.2	Low	73.8	Confident	32 Å²	32	75.8 Å²	75.8	16%	0.164	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	133.4	177	-53.3	-170.3	0	0	0	108.3	T152 V153 F155 V179 P183 A191	T152-I181 CarbonylContact C-O 3.47Å; T152-I181 WeakPolarHBondContact CA-O 3.46Å; V153-I181 PolarHBondContact N-O 2.92Å; V153-I181 PolarHBondContact O-N 3.33Å; V153-I181 VanDerWaalsContact O-O 3.12Å; F155-I181 HydrophobicContact CD2-CD1 3.81Å; F155-I181 HydrophobicContact CD2-CG1 4.43Å; F155-I181 HydrophobicContact CE2-CD1 3.27Å; F155-I181 HydrophobicContact CE2-CG1 4.23Å; F155-I181 HydrophobicContact CZ-CD1 4.19Å; V179-I181 HydrophobicContact CG1-CD1 4.25Å; V179-I181 HydrophobicContact CG1-CG1 3.94Å; I181-P183 VanDerWaalsContact C-CD 3.44Å; I181-P183 WeakPolarHBondContact O-CD 3.49Å; I181-A191 HydrophobicContact CD1-CB 3.23Å
182	I	63.8	Low	74.4	Confident	112 Å²	112	71.2 Å²	71.2	57%	0.574	40%	0.395	S	S	*	.			trans	-101.3	93.7	169.9	-57.6	172.9	0	0	0	106.7	T152	T152-I182 HydrophobicContact CG2-CG1 4.48Å
183	P	63.6	Low	75.1	Confident	14 Å²	14	68.5 Å²	68.5	9%	0.091	37%	0.37	C	S	.	.			trans	-73	141	-173.4	21.8	-35.7	0	0	0	116.4	N151 V153 I181 S187 W188	N151-P183 HydrophobicContact CB-CG 3.86Å; N151-P183 WeakPolarHBondContact O-CD 3.46Å; N151-P183 WeakPolarHBondContact O-CG 3.42Å; V153-P183 HydrophobicContact CB-CG 4.37Å; V153-P183 HydrophobicContact CG2-CG 3.77Å; I181-P183 VanDerWaalsContact C-CD 3.44Å; I181-P183 WeakPolarHBondContact O-CD 3.49Å; P183-S187 VanDerWaalsContact CA-OG 3.29Å; P183-S187 WeakPolarHBondContact CA-OG 3.29Å; P183-W188 HydrophobicContact CB-CB 3.99Å; P183-W188 HydrophobicContact CB-CG 4.41Å; P183-W188 HydrophobicContact CG-CB 4.34Å
184	D	62.1	Low	75.6	Confident	141 Å²	141	72.2 Å²	72.2	75%	0.754	39%	0.385	S	S	*	.			trans	-77.3	151.1	134.5	-83.2	-35.3	0	0	0	108.5	E186 S187	D184-E186 PolarHBondContact O-N 2.96Å; D184-S187 PolarHBondContact N-OG 3.23Å; D184-S187 PolarHBondContact O-N 3.42Å; D184-S187 PolarHBondContact O-OG 3.1Å; D184-S187 VanDerWaalsContact O-OG 3.1Å
185	N	57.1	Low	76	Confident	128 Å²	128	68.1 Å²	68.1	68%	0.684	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	-26.5	-162.4	-78.1	-27.2	0	0	0	117.2	W188	N185-W188 PolarHBondContact O-NE1 2.84Å
186	E	63.7	Low	76.5	Confident	154 Å²	154	67.7 Å²	67.7	72%	0.72	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-12.7	179.4	-67.3	-172	163.9	0	0	115	D184 W188	D184-E186 PolarHBondContact O-N 2.96Å; E186-W188 PolarHBondContact O-N 3.47Å
187	S	78.3	Confident	77	Confident	48 Å²	48	68.1 Å²	68.1	34%	0.336	36%	0.364	S	S	.	.	H	α-helix	trans	-73.1	-31.4	-171	69.7	0	0	0	0	113.3	P183 D184 A191	P183-S187 VanDerWaalsContact CA-OG 3.29Å; P183-S187 WeakPolarHBondContact CA-OG 3.29Å; D184-S187 PolarHBondContact N-OG 3.23Å; D184-S187 PolarHBondContact O-N 3.42Å; D184-S187 PolarHBondContact O-OG 3.1Å; D184-S187 VanDerWaalsContact O-OG 3.1Å; S187-A191 WeakPolarHBondContact O-CB 3.39Å; S187-A191 PolarHBondContact O-N 3.33Å; S187-A191 VanDerWaalsContact O-N 3.08Å
188	W	86.1	Confident	77.6	Confident	13 Å²	13	63.5 Å²	63.5	5%	0.049	35%	0.345	C	S	.	.	H	α-helix	trans	-69.2	-39.4	-179.9	73.2	-82.5	0	0	0	112.4	L38 L39 L78 V140 V153 F155 P183 N185 E186 A191 L192	L38-W188 HydrophobicContact CB-CH2 4.28Å; L39-W188 HydrophobicContact CD2-CH2 3.59Å; L39-W188 HydrophobicContact CD2-CZ2 4.47Å; L39-W188 HydrophobicContact CD2-CZ3 4.12Å; L39-W188 HydrophobicContact CG-CH2 4.3Å; L78-W188 HydrophobicContact CD2-CH2 4.2Å; L78-W188 HydrophobicContact CD2-CZ3 4.21Å; V140-W188 HydrophobicContact CG1-CE3 4.34Å; V140-W188 HydrophobicContact CG1-CZ3 4.12Å; V153-W188 HydrophobicContact CB-CB 4.08Å; V153-W188 HydrophobicContact CG1-CB 4.19Å; V153-W188 HydrophobicContact CG1-CE3 4.44Å; V153-W188 HydrophobicContact CG2-CB 3.88Å; V153-W188 HydrophobicContact CG2-CD2 4.42Å; V153-W188 HydrophobicContact CG2-CG 4.04Å; F155-W188 WeakPolarHBondContact CZ-O 3.49Å; P183-W188 HydrophobicContact CB-CB 3.99Å; P183-W188 HydrophobicContact CB-CG 4.41Å; P183-W188 HydrophobicContact CG-CB 4.34Å; N185-W188 PolarHBondContact O-NE1 2.84Å; E186-W188 PolarHBondContact O-N 3.47Å; W188-A191 PolarHBondContact O-N 2.86Å; W188-L192 HydrophobicContact CZ3-CD2 4.25Å; W188-L192 PolarHBondContact O-N 3.4Å
189	F	87.7	Confident	78.2	Confident	19 Å²	19	60 Å²	60	8%	0.083	32%	0.322	C	S	.	.	H	α-helix	trans	-64.7	-44.7	178.8	173.5	-104.2	0	0	0	110.9	L39 Q43 L46 I47 A191 L192 V193	L39-F189 HydrophobicContact CD2-CD2 3.65Å; L39-F189 HydrophobicContact CD2-CE2 3.97Å; Q43-F189 HydrophobicContact CB-CD2 4.01Å; Q43-F189 HydrophobicContact CB-CE1 4.42Å; Q43-F189 HydrophobicContact CB-CE2 3.4Å; Q43-F189 VanDerWaalsContact CB-CE2 3.4Å; Q43-F189 HydrophobicContact CB-CZ 3.64Å; Q43-F189 HydrophobicContact CG-CD1 4.15Å; Q43-F189 HydrophobicContact CG-CD2 3.93Å; Q43-F189 HydrophobicContact CG-CE1 3.84Å; Q43-F189 HydrophobicContact CG-CE2 3.62Å; Q43-F189 HydrophobicContact CG-CG 4.19Å; Q43-F189 HydrophobicContact CG-CZ 3.56Å; L46-F189 HydrophobicContact CD2-CE1 4.14Å; L46-F189 HydrophobicContact CD2-CZ 3.8Å; I47-F189 HydrophobicContact CD1-CE2 3.83Å; I47-F189 HydrophobicContact CG1-CE2 4.2Å; F189-A191 VanDerWaalsContact C-N 3.25Å; F189-A191 PolarHBondContact O-N 3.47Å; F189-L192 WeakPolarHBondContact O-CB 3.3Å; F189-L192 PolarHBondContact O-N 3.43Å; F189-L192 VanDerWaalsContact O-N 3.1Å; F189-V193 HydrophobicContact CD1-CG2 4.19Å; F189-V193 HydrophobicContact CD2-CG2 4.3Å; F189-V193 HydrophobicContact CE1-CG2 3.63Å; F189-V193 HydrophobicContact CE2-CG2 3.74Å; F189-V193 HydrophobicContact CZ-CG2 3.38Å; F189-V193 WeakPolarHBondContact O-CG2 3.5Å; F189-V193 PolarHBondContact O-N 3.24Å
190	N	87	Confident	78.8	Confident	100 Å²	100	58.1 Å²	58.1	54%	0.535	31%	0.311	S	S	.	.	H	α-helix	trans	-60.7	-38.1	176.2	-70.5	-22	0	0	0	111.8	V193 K194	N190-V193 PolarHBondContact O-N 2.89Å; N190-K194 WeakPolarHBondContact O-CB 3.43Å; N190-K194 PolarHBondContact O-N 3.1Å
191	A	86.3	Confident	79.4	Confident	27 Å²	27	55.6 Å²	55.6	22%	0.223	30%	0.303	C	S	.	.	H	α-helix	trans	-66.5	-39.8	174.1	0	0	0	0	0	112.5	F155 I181 S187 W188 F189 K194 H195	F155-A191 HydrophobicContact CE2-CB 3.85Å; F155-A191 HydrophobicContact CZ-CB 4.44Å; I181-A191 HydrophobicContact CD1-CB 3.23Å; S187-A191 WeakPolarHBondContact O-CB 3.39Å; S187-A191 PolarHBondContact O-N 3.33Å; S187-A191 VanDerWaalsContact O-N 3.08Å; W188-A191 PolarHBondContact O-N 2.86Å; F189-A191 VanDerWaalsContact C-N 3.25Å; F189-A191 PolarHBondContact O-N 3.47Å; A191-K194 PolarHBondContact O-N 2.93Å; A191-H195 WeakPolarHBondContact O-CB 3.48Å; A191-H195 PolarHBondContact O-N 3.06Å
192	L	87.9	Confident	79.9	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.2	-46.8	173.6	178.9	62	0	0	0	111.3	I47 V138 V140 F155 W188 F189 K194 H195 I196	I47-L192 HydrophobicContact CD1-CD2 3.73Å; I47-L192 HydrophobicContact CD1-CG 4.27Å; V138-L192 HydrophobicContact CG1-CD1 4.23Å; V140-L192 HydrophobicContact CG2-CD1 3.81Å; V140-L192 HydrophobicContact CG2-CD2 4.2Å; F155-L192 HydrophobicContact CD1-CD1 4.44Å; F155-L192 HydrophobicContact CE1-CB 4.1Å; F155-L192 HydrophobicContact CE1-CD1 4.11Å; F155-L192 HydrophobicContact CZ-CB 3.81Å; W188-L192 HydrophobicContact CZ3-CD2 4.25Å; W188-L192 PolarHBondContact O-N 3.4Å; F189-L192 WeakPolarHBondContact O-CB 3.3Å; F189-L192 PolarHBondContact O-N 3.43Å; F189-L192 VanDerWaalsContact O-N 3.1Å; L192-K194 VanDerWaalsContact C-N 3.32Å; L192-K194 PolarHBondContact O-N 3.39Å; L192-H195 PolarHBondContact O-N 3.41Å; L192-I196 HydrophobicContact CD1-CD1 3.89Å; L192-I196 HydrophobicContact CD1-CG1 4.19Å; L192-I196 HydrophobicContact CG-CD1 3.95Å; L192-I196 WeakPolarHBondContact O-CB 3.42Å; L192-I196 WeakPolarHBondContact O-CG1 3.32Å; L192-I196 PolarHBondContact O-N 2.96Å
193	V	88.9	Confident	80.4	Confident	29 Å²	29	49.3 Å²	49.3	18%	0.176	27%	0.272	C	S	.	.	H	α-helix	trans	-60.7	-43.5	177	173	0	0	0	0	110.8	L46 I47 F189 N190 H195 I196 S197	L46-V193 HydrophobicContact CD2-CG1 4.22Å; L46-V193 HydrophobicContact CD2-CG2 3.83Å; I47-V193 HydrophobicContact CG1-CG2 4.42Å; F189-V193 HydrophobicContact CD1-CG2 4.19Å; F189-V193 HydrophobicContact CD2-CG2 4.3Å; F189-V193 HydrophobicContact CE1-CG2 3.63Å; F189-V193 HydrophobicContact CE2-CG2 3.74Å; F189-V193 HydrophobicContact CZ-CG2 3.38Å; F189-V193 WeakPolarHBondContact O-CG2 3.5Å; F189-V193 PolarHBondContact O-N 3.24Å; N190-V193 PolarHBondContact O-N 2.89Å; V193-H195 VanDerWaalsContact C-N 3.34Å; V193-H195 PolarHBondContact O-N 2.91Å; V193-I196 PolarHBondContact O-N 2.75Å; V193-S197 VanDerWaalsContact O-CB 3.25Å; V193-S197 WeakPolarHBondContact O-CB 3.41Å; V193-S197 PolarHBondContact O-N 3.46Å
194	K	86.7	Confident	80.4	Confident	162 Å²	162	50.1 Å²	50.1	70%	0.704	28%	0.283	S	S	*	.	H	α-helix	trans	-62.7	-42.2	176.4	-173.2	179	179.2	-178	0	111.7	N190 A191 L192 S197 A198	N190-K194 WeakPolarHBondContact O-CB 3.43Å; N190-K194 PolarHBondContact O-N 3.1Å; A191-K194 PolarHBondContact O-N 2.93Å; L192-K194 VanDerWaalsContact C-N 3.32Å; L192-K194 PolarHBondContact O-N 3.39Å; K194-S197 WeakPolarHBondContact O-CB 2.99Å; K194-S197 PolarHBondContact O-N 3.44Å; K194-A198 PolarHBondContact O-N 2.82Å
195	H	86.7	Confident	80	Confident	20 Å²	20	49.5 Å²	49.5	9%	0.093	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-47.1	178.3	-167.3	77.1	0	0	0	111.7	T157 L175 A191 L192 V193 S197 A198 V199	T157-H195 PolarHBondContact OG1-NE2 3.46Å; L175-H195 PolarHBondContact O-CE1 2.78Å; A191-H195 WeakPolarHBondContact O-CB 3.48Å; A191-H195 PolarHBondContact O-N 3.06Å; L192-H195 PolarHBondContact O-N 3.41Å; V193-H195 VanDerWaalsContact C-N 3.34Å; V193-H195 PolarHBondContact O-N 2.91Å; H195-S197 VanDerWaalsContact C-N 3.33Å; H195-S197 PolarHBondContact O-N 3.34Å; H195-A198 WeakPolarHBondContact O-CB 3.32Å; H195-A198 PolarHBondContact O-N 3.47Å; H195-V199 WeakPolarHBondContact O-CG2 3.13Å; H195-V199 PolarHBondContact O-N 3.46Å
196	I	87.4	Confident	79.4	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-63	-42.6	175.3	-68.6	175	0	0	0	110.4	I47 L51 I76 L192 V193 A198 V199 T200	I47-I196 HydrophobicContact CB-CD1 4.47Å; I47-I196 HydrophobicContact CD1-CD1 4.23Å; I47-I196 HydrophobicContact CG1-CD1 4.18Å; I47-I196 HydrophobicContact CG2-CD1 3.52Å; L51-I196 HydrophobicContact CD2-CG2 3.71Å; L51-I196 HydrophobicContact CG-CG2 4.14Å; I76-I196 HydrophobicContact CD1-CD1 3.38Å; I76-I196 HydrophobicContact CD1-CG1 4.37Å; I76-I196 HydrophobicContact CG1-CD1 4.45Å; L192-I196 HydrophobicContact CD1-CD1 3.89Å; L192-I196 HydrophobicContact CD1-CG1 4.19Å; L192-I196 HydrophobicContact CG-CD1 3.95Å; L192-I196 WeakPolarHBondContact O-CB 3.42Å; L192-I196 WeakPolarHBondContact O-CG1 3.32Å; L192-I196 PolarHBondContact O-N 2.96Å; V193-I196 PolarHBondContact O-N 2.75Å; I196-A198 VanDerWaalsContact C-N 3.26Å; I196-A198 PolarHBondContact O-N 2.76Å; I196-V199 PolarHBondContact O-N 2.73Å; I196-T200 HydrophobicContact CG2-CG2 4.17Å; I196-T200 WeakPolarHBondContact O-CG2 3.22Å; I196-T200 PolarHBondContact O-N 2.88Å; I196-T200 PolarHBondContact O-OG1 3.05Å; I196-T200 VanDerWaalsContact O-OG1 3.11Å
197	S	87.1	Confident	78.4	Confident	58 Å²	58	45.2 Å²	45.2	41%	0.406	26%	0.257	S	S	.	.	H	α-helix	trans	-57.4	-41.4	175.6	-171.9	0	0	0	0	111.4	V193 K194 H195 T200 S201	V193-S197 VanDerWaalsContact O-CB 3.25Å; V193-S197 WeakPolarHBondContact O-CB 3.41Å; V193-S197 PolarHBondContact O-N 3.46Å; K194-S197 WeakPolarHBondContact O-CB 2.99Å; K194-S197 PolarHBondContact O-N 3.44Å; H195-S197 VanDerWaalsContact C-N 3.33Å; H195-S197 PolarHBondContact O-N 3.34Å; S197-T200 VanDerWaalsContact CA-OG1 3.23Å; S197-T200 WeakPolarHBondContact CA-OG1 3.28Å; S197-T200 PolarHBondContact O-N 3.22Å; S197-T200 PolarHBondContact O-OG1 3.18Å; S197-S201 VanDerWaalsContact O-CB 3.28Å; S197-S201 WeakPolarHBondContact O-CB 3.13Å; S197-S201 PolarHBondContact O-N 2.94Å; S197-S201 PolarHBondContact O-OG 3.5Å
198	A	85.2	Confident	76.5	Confident	21 Å²	21	46.4 Å²	46.4	17%	0.174	27%	0.265	C	S	.	.	H	α-helix	trans	-63.2	-48.1	177	0	0	0	0	0	111.5	L175 K194 H195 I196 T200 S201 A202	L175-A198 HydrophobicContact CD1-CB 4.18Å; L175-A198 HydrophobicContact CD2-CB 3.67Å; K194-A198 PolarHBondContact O-N 2.82Å; H195-A198 WeakPolarHBondContact O-CB 3.32Å; H195-A198 PolarHBondContact O-N 3.47Å; I196-A198 VanDerWaalsContact C-N 3.26Å; I196-A198 PolarHBondContact O-N 2.76Å; A198-T200 VanDerWaalsContact C-N 3.34Å; A198-T200 PolarHBondContact O-N 2.86Å; A198-S201 WeakPolarHBondContact CA-OG 3.39Å; A198-S201 PolarHBondContact O-N 2.94Å; A198-S201 VanDerWaalsContact O-N 3.13Å; A198-S201 PolarHBondContact O-OG 3.37Å; A198-A202 PolarHBondContact O-N 2.72Å
199	V	83.9	Confident	73.9	Confident	6 Å²	6	50.5 Å²	50.5	4%	0.036	30%	0.296	C	S	.	.	H	α-helix	trans	-57.5	-45.2	174.2	175.1	0	0	0	0	111.6	F56 V136 L175 H195 I196 S201 T203	F56-V199 HydrophobicContact CZ-CG1 4.34Å; V136-V199 HydrophobicContact CG1-CG1 4.22Å; V136-V199 HydrophobicContact CG2-CG1 4.43Å; L175-V199 HydrophobicContact CD1-CG2 4Å; H195-V199 WeakPolarHBondContact O-CG2 3.13Å; H195-V199 PolarHBondContact O-N 3.46Å; I196-V199 PolarHBondContact O-N 2.73Å; V199-S201 VanDerWaalsContact C-N 3.33Å; V199-S201 PolarHBondContact O-N 3.47Å; V199-T203 WeakPolarHBondContact O-CG2 3.13Å; V199-T203 PolarHBondContact O-N 3.34Å; V199-T203 PolarHBondContact O-OG1 2.88Å
200	T	85.4	Confident	71.7	Confident	17 Å²	17	56.3 Å²	56.3	10%	0.104	33%	0.327	C	S	.	.	H	α-helix	trans	-68.2	-31.6	178.1	56.5	0	0	0	0	112.9	L51 A54 F56 I196 S197 A198 T203 G204	L51-T200 HydrophobicContact CD2-CG2 4.03Å; A54-T200 HydrophobicContact CB-CG2 3.48Å; A54-T200 VanDerWaalsContact CB-CG2 3.48Å; F56-T200 HydrophobicContact CD2-CG2 4.41Å; F56-T200 HydrophobicContact CE2-CG2 4.08Å; I196-T200 HydrophobicContact CG2-CG2 4.17Å; I196-T200 WeakPolarHBondContact O-CG2 3.22Å; I196-T200 PolarHBondContact O-N 2.88Å; I196-T200 PolarHBondContact O-OG1 3.05Å; I196-T200 VanDerWaalsContact O-OG1 3.11Å; S197-T200 VanDerWaalsContact CA-OG1 3.23Å; S197-T200 WeakPolarHBondContact CA-OG1 3.28Å; S197-T200 PolarHBondContact O-N 3.22Å; S197-T200 PolarHBondContact O-OG1 3.18Å; A198-T200 VanDerWaalsContact C-N 3.34Å; A198-T200 PolarHBondContact O-N 2.86Å; T200-T203 VanDerWaalsContact CA-OG1 3.29Å; T200-T203 WeakPolarHBondContact CA-OG1 3.29Å; T200-T203 PolarHBondContact O-N 3.18Å; T200-T203 PolarHBondContact O-OG1 2.91Å; T200-G204 PolarHBondContact O-N 2.82Å
201	S	83.7	Confident	69	Low	63 Å²	63	58 Å²	58	44%	0.441	34%	0.336	S	S	.	.	H	α-helix	trans	-72.3	-39.5	179.8	70.1	0	0	0	0	111.7	S197 A198 V199 T203 G204	S197-S201 VanDerWaalsContact O-CB 3.28Å; S197-S201 WeakPolarHBondContact O-CB 3.13Å; S197-S201 PolarHBondContact O-N 2.94Å; S197-S201 PolarHBondContact O-OG 3.5Å; A198-S201 WeakPolarHBondContact CA-OG 3.39Å; A198-S201 PolarHBondContact O-N 2.94Å; A198-S201 VanDerWaalsContact O-N 3.13Å; A198-S201 PolarHBondContact O-OG 3.37Å; V199-S201 VanDerWaalsContact C-N 3.33Å; V199-S201 PolarHBondContact O-N 3.47Å; S201-T203 PolarHBondContact O-N 3.26Å; S201-G204 PolarHBondContact O-N 2.77Å
202	A	78.7	Confident	66.2	Low	4 Å²	4	59.5 Å²	59.5	3%	0.033	35%	0.354	C	S	.	.	H	α-helix	trans	-67.3	-14.5	175.6	0	0	0	0	0	113.3	E169 I170 A198	E169-A202 HydrophobicContact CB-CB 4.19Å; I170-A202 HydrophobicContact CG1-CB 3.65Å; A198-A202 PolarHBondContact O-N 2.72Å
203	T	75.7	Confident	63.5	Low	7 Å²	7	67.4 Å²	67.4	4%	0.043	40%	0.396	C	S	.	.	H	α-helix	trans	-106.3	-27	-179.9	48.3	0	0	0	0	112.2	F56 F163 I170 V199 T200 S201 H205	F56-T203 HydrophobicContact CZ-CG2 4.21Å; F163-T203 HydrophobicContact CE1-CG2 3.73Å; F163-T203 HydrophobicContact CZ-CG2 3.42Å; F163-T203 VanDerWaalsContact CZ-CG2 3.42Å; I170-T203 HydrophobicContact CD1-CG2 4.14Å; V199-T203 WeakPolarHBondContact O-CG2 3.13Å; V199-T203 PolarHBondContact O-N 3.34Å; V199-T203 PolarHBondContact O-OG1 2.88Å; T200-T203 VanDerWaalsContact CA-OG1 3.29Å; T200-T203 WeakPolarHBondContact CA-OG1 3.29Å; T200-T203 PolarHBondContact O-N 3.18Å; T200-T203 PolarHBondContact O-OG1 2.91Å; S201-T203 PolarHBondContact O-N 3.26Å; T203-H205 PolarHBondContact O-N 3.27Å
204	G	63	Low	60.8	Low	32 Å²	32	70.5 Å²	70.5	33%	0.33	43%	0.425	S	S	.	.	H	α-helix	trans	-65.7	-17.9	-179.4	0	0	0	0	0	115.3	T200 S201 L206 N207	T200-G204 PolarHBondContact O-N 2.82Å; S201-G204 PolarHBondContact O-N 2.77Å; G204-L206 VanDerWaalsContact C-N 3.27Å; G204-L206 PolarHBondContact O-N 3.22Å; G204-N207 PolarHBondContact O-N 3.44Å
205	H	53	Low	58.4	Low	127 Å²	127	70.3 Å²	70.3	59%	0.588	44%	0.437	S	S	*	.	H	α-helix	trans	-64.5	-30	-179.1	-115.9	-44.5	0	0	0	113.1	T203 S208	T203-H205 PolarHBondContact O-N 3.27Å; H205-S208 PolarHBondContact O-OG 3.18Å
206	L	45.6	Very low	55.9	Low	107 Å²	107	74 Å²	74	56%	0.56	47%	0.465	S	S	*	.	H	α-helix	trans	-77.5	-33.2	178.7	-100.3	101.9	0	0	0	114.2	G204 S208 S209	G204-L206 VanDerWaalsContact C-N 3.27Å; G204-L206 PolarHBondContact O-N 3.22Å; L206-S208 PolarHBondContact O-N 3.16Å; L206-S209 PolarHBondContact O-N 3.46Å; L206-S209 PolarHBondContact O-OG 3.46Å
207	N	42.3	Very low	53.4	Low	85 Å²	85	82.6 Å²	82.6	46%	0.455	51%	0.505	S	S	.	.	H	α-helix	trans	-74.6	-12.8	179.6	-78.1	-18.6	0	0	0	113.2	G204 S209 N211	G204-N207 PolarHBondContact O-N 3.44Å; N207-S209 VanDerWaalsContact C-N 3.26Å; N207-S209 PolarHBondContact O-N 3.09Å; N207-N211 PolarHBondContact O-N 3.09Å
208	S	38.1	Very low	50.9	Low	74 Å²	74	90.1 Å²	90.1	52%	0.517	52%	0.524	S	S	.	.	H	α-helix	trans	-71.3	-17.5	172.1	75.4	0	0	0	0	113.7	H205 L206	H205-S208 PolarHBondContact O-OG 3.18Å; L206-S208 PolarHBondContact O-N 3.16Å
209	S	32.6	Very low	48.4	Very low	98 Å²	98	97.2 Å²	97.2	69%	0.685	55%	0.554	S	S	*	*	H	α-helix	trans	-92.5	-15.5	176.8	86.9	0	0	0	0	114.1	L206 N207	L206-S209 PolarHBondContact O-N 3.46Å; L206-S209 PolarHBondContact O-OG 3.46Å; N207-S209 VanDerWaalsContact C-N 3.26Å; N207-S209 PolarHBondContact O-N 3.09Å
210	L	39.6	Very low	46.2	Very low	142 Å²	142	102 Å²	102	74%	0.743	59%	0.588	S	S	*	*	H	α-helix	trans	-99.2	-10	177.9	-91	152.3	0	0	0	114.3
211	N	31.5	Very low	43.9	Very low	136 Å²	136	109.1 Å²	109.1	73%	0.727	62%	0.617	S	S	*	*	S	Bend	trans	-130.9	77.8	164.8	-87.9	-25.4	0	0	0	109.2	N207 N213	N207-N211 PolarHBondContact O-N 3.09Å; N211-N213 PolarHBondContact O-N 2.82Å
212	G	27.4	Very low	42	Very low	58 Å²	58	113.3 Å²	113.3	60%	0.598	63%	0.633	S	S	*	*			trans	-54.5	132.9	159.3	0	0	0	0	0	109.1
213	N	30.1	Very low	40.4	Very low	165 Å²	165	122.5 Å²	122.5	88%	0.882	67%	0.672	S	S	*	*	S	Bend	trans	89.8	76.6	-179.6	-46	-24.5	0	0	0	115.2	N211	N211-N213 PolarHBondContact O-N 2.82Å
214	A	33.6	Very low	39.4	Very low	94 Å²	94	127.2 Å²	127.2	78%	0.777	71%	0.706	S	S	*	*				171	73.6	119.9	0	0	0	0	0	111.6	S216	A214-S216 PolarHBondContact O-N 2.8Å
215	V	35.4	Very low	39.3	Very low	159 Å²	159	130.5 Å²	130.5	96%	0.964	71%	0.714	S	S	*	*			trans	-88.2	89.5	147.5	177.5	0	0	0	0	105.5
216	S	34.8	Very low	40.6	Very low	96 Å²	96	127.4 Å²	127.4	67%	0.671	71%	0.705	S	S	*	*			trans	-136.8	126.8	162	-153.6	0	0	0	0	107.8	A214 R218	A214-S216 PolarHBondContact O-N 2.8Å; S216-R218 PolarHBondContact O-N 2.86Å; S216-R218 VanDerWaalsContact O-N 3.11Å
217	Q	34.2	Very low	42.4	Very low	186 Å²	186	129.2 Å²	129.2	87%	0.869	71%	0.714	S	S	*	*			trans	-24.2	107.4	173.5	-68.6	165.5	-34.1	0	0	112.2	E219	Q217-E219 PolarHBondContact O-N 2.8Å
218	R	34.7	Very low	44.8	Very low	215 Å²	215	133.6 Å²	133.6	81%	0.811	73%	0.725	S	S	*	*			trans	-90.6	95.3	162.9	-93.1	-174.5	-178.4	170	4.5	108.2	S216 S220	S216-R218 PolarHBondContact O-N 2.86Å; S216-R218 VanDerWaalsContact O-N 3.11Å; R218-S220 PolarHBondContact O-N 2.8Å
219	E	32.5	Very low	47.1	Very low	171 Å²	171	130.9 Å²	130.9	80%	0.799	71%	0.707	S	S	*	*			trans	-34.7	134.2	141.2	-65.2	177.9	150.8	0	0	109.1	Q217 K221	Q217-E219 PolarHBondContact O-N 2.8Å; E219-K221 PolarHBondContact O-N 3.33Å
220	S	38.2	Very low	49.7	Very low	106 Å²	106	129.4 Å²	129.4	74%	0.741	69%	0.691	S	S	*	*			trans	-46.2	103.1	171.8	49.3	0	0	0	0	108.9	R218 I222	R218-S220 PolarHBondContact O-N 2.8Å; S220-I222 PolarHBondContact O-N 2.78Å
221	K	36.2	Very low	52.2	Low	167 Å²	167	127.3 Å²	127.3	73%	0.726	68%	0.684	S	S	*	*			trans	-63	95.7	167.8	-113.1	-177	178.5	-176.4	0	105.2	E219 F223	E219-K221 PolarHBondContact O-N 3.33Å; K221-F223 PolarHBondContact O-N 2.91Å
222	I	44.3	Very low	55.1	Low	150 Å²	150	125.5 Å²	125.5	77%	0.769	67%	0.674	S	S	*	*			trans	-50.1	110.2	162.7	-62.3	168	0	0	0	103.8	S220 S224	S220-I222 PolarHBondContact O-N 2.78Å; I222-S224 PolarHBondContact O-N 3.42Å
223	F	45.2	Very low	58.1	Low	197 Å²	197	127.4 Å²	127.4	86%	0.864	67%	0.67	S	S	*	*			trans	-60.4	96.3	174.2	-113.8	-95	0	0	0	105.8	K221 M225	K221-F223 PolarHBondContact O-N 2.91Å; F223-M225 PolarHBondContact O-N 3.46Å
224	S	54.6	Low	61	Low	106 Å²	106	124.8 Å²	124.8	74%	0.741	66%	0.655	S	S	*	*			trans	-64.3	91	170.1	166.6	0	0	0	0	106.2	I222	I222-S224 PolarHBondContact O-N 3.42Å
225	M	61.3	Low	63.8	Low	102 Å²	102	123.3 Å²	123.3	50%	0.502	64%	0.638	S	S	.	*			trans	-51.7	128	170.3	-98.3	-177.5	161.3	0	0	107.4	F223 L227	F223-M225 PolarHBondContact O-N 3.46Å; M225-L227 PolarHBondContact O-N 3.43Å
226	P	80.5	Confident	66.4	Low	62 Å²	62	119.3 Å²	119.3	40%	0.403	62%	0.616	S	S	.	*			trans	-59	137.7	-179.5	25.9	-34.1	0	0	0	108.8	W228 A229	P226-W228 HydrophobicContact CB-CG 4.5Å; P226-W228 HydrophobicContact CG-CZ2 3.94Å; P226-W228 PolarHBondContact O-N 3.18Å; P226-A229 HydrophobicContact CG-CB 4.13Å; P226-A229 WeakPolarHBondContact O-CA 3.44Å; P226-A229 VanDerWaalsContact O-CB 3.31Å; P226-A229 WeakPolarHBondContact O-CB 3.34Å; P226-A229 PolarHBondContact O-N 3.48Å
227	L	83.7	Confident	69.1	Low	144 Å²	144	119.3 Å²	119.3	75%	0.754	61%	0.612	S	S	*	*	H	α-helix	trans	-50	-36.1	-170	-88.5	158.1	0	0	0	113.7	M225 A229 N230 V231	M225-L227 PolarHBondContact O-N 3.43Å; L227-A229 VanDerWaalsContact C-N 3.27Å; L227-A229 PolarHBondContact O-N 3.41Å; L227-N230 PolarHBondContact O-N 2.85Å; L227-V231 WeakPolarHBondContact O-CG2 3.4Å; L227-V231 PolarHBondContact O-N 2.73Å
228	W	92.2	Very high	71.9	Confident	177 Å²	177	114 Å²	114	67%	0.67	59%	0.592	S	S	*	*	H	α-helix	trans	-61.2	-33.7	176.9	66.8	-101.2	0	0	0	113	P226 V231 L232	P226-W228 HydrophobicContact CB-CG 4.5Å; P226-W228 HydrophobicContact CG-CZ2 3.94Å; P226-W228 PolarHBondContact O-N 3.18Å; W228-V231 PolarHBondContact O-N 2.74Å; W228-L232 HydrophobicContact CE3-CD1 3.75Å; W228-L232 HydrophobicContact CZ3-CD1 3.83Å; W228-L232 PolarHBondContact O-N 3.04Å
229	A	86.8	Confident	74.5	Confident	18 Å²	18	108 Å²	108	15%	0.149	58%	0.576	C	S	.	*	H	α-helix	trans	-71.3	-38.8	178	0	0	0	0	0	111.3	P226 L227 L232 L233	P226-A229 HydrophobicContact CG-CB 4.13Å; P226-A229 WeakPolarHBondContact O-CA 3.44Å; P226-A229 VanDerWaalsContact O-CB 3.31Å; P226-A229 WeakPolarHBondContact O-CB 3.34Å; P226-A229 PolarHBondContact O-N 3.48Å; L227-A229 VanDerWaalsContact C-N 3.27Å; L227-A229 PolarHBondContact O-N 3.41Å; A229-L232 PolarHBondContact O-N 3.07Å; A229-L233 WeakPolarHBondContact O-CB 2.96Å; A229-L233 PolarHBondContact O-N 3.34Å
230	N	85.9	Confident	77.2	Confident	67 Å²	67	104.3 Å²	104.3	36%	0.358	56%	0.564	S	S	.	*	H	α-helix	trans	-65	-42.1	173.6	-77.6	-18.4	0	0	0	111.6	L227 L233 I234	L227-N230 PolarHBondContact O-N 2.85Å; N230-L233 PolarHBondContact O-N 3.18Å; N230-I234 WeakPolarHBondContact O-CB 3.34Å; N230-I234 VanDerWaalsContact O-CG1 3.28Å; N230-I234 WeakPolarHBondContact O-CG1 3.45Å; N230-I234 PolarHBondContact O-N 3.35Å
231	V	92.3	Very high	79.6	Confident	97 Å²	97	102.3 Å²	102.3	59%	0.588	55%	0.549	S	S	*	.	H	α-helix	trans	-61.8	-45	175.9	174.3	0	0	0	0	110.9	L227 W228 L233 I234 C235	L227-V231 WeakPolarHBondContact O-CG2 3.4Å; L227-V231 PolarHBondContact O-N 2.73Å; W228-V231 PolarHBondContact O-N 2.74Å; V231-L233 PolarHBondContact O-N 3.1Å; V231-I234 PolarHBondContact O-N 2.84Å; V231-C235 VanDerWaalsContact O-CB 3.27Å; V231-C235 WeakPolarHBondContact O-CB 3.34Å; V231-C235 PolarHBondContact O-N 3.28Å
232	L	92.6	Very high	82.2	Confident	99 Å²	99	98 Å²	98	52%	0.518	53%	0.533	S	S	.	.	H	α-helix	trans	-60.6	-43.5	175.3	-89.9	170.4	0	0	0	112.3	W228 A229 C235 C236	W228-L232 HydrophobicContact CE3-CD1 3.75Å; W228-L232 HydrophobicContact CZ3-CD1 3.83Å; W228-L232 PolarHBondContact O-N 3.04Å; A229-L232 PolarHBondContact O-N 3.07Å; L232-C235 PolarHBondContact O-N 2.87Å; L232-C236 PolarHBondContact O-N 2.81Å; L232-C236 PolarHBondContact O-SG 3Å; L232-C236 VanDerWaalsContact O-SG 3.38Å
233	L	90.2	Very high	84.4	Confident	98 Å²	98	94.6 Å²	94.6	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-66.2	-43.7	-178	-160.4	143.6	0	0	0	111.2	A229 N230 V231 C235 C236 V237	A229-L233 WeakPolarHBondContact O-CB 2.96Å; A229-L233 PolarHBondContact O-N 3.34Å; N230-L233 PolarHBondContact O-N 3.18Å; V231-L233 PolarHBondContact O-N 3.1Å; L233-C235 VanDerWaalsContact C-N 3.34Å; L233-C235 PolarHBondContact O-N 3.33Å; L233-C236 PolarHBondContact O-N 3.27Å; L233-V237 HydrophobicContact CD2-CG2 4.3Å; L233-V237 VanDerWaalsContact O-CG2 3.29Å; L233-V237 WeakPolarHBondContact O-CG2 3.42Å; L233-V237 PolarHBondContact O-N 3.1Å
234	I	92	Very high	86.5	Confident	109 Å²	109	88.5 Å²	88.5	56%	0.559	50%	0.498	S	S	*	.	H	α-helix	trans	-61.6	-43.6	173.1	-67.1	166.5	0	0	0	110.6	N230 V231 C236 V237 V238	N230-I234 WeakPolarHBondContact O-CB 3.34Å; N230-I234 VanDerWaalsContact O-CG1 3.28Å; N230-I234 WeakPolarHBondContact O-CG1 3.45Å; N230-I234 PolarHBondContact O-N 3.35Å; V231-I234 PolarHBondContact O-N 2.84Å; I234-C236 VanDerWaalsContact C-N 3.35Å; I234-C236 PolarHBondContact O-N 2.77Å; I234-V237 PolarHBondContact O-N 2.86Å; I234-V238 HydrophobicContact CG2-CG2 4.46Å; I234-V238 WeakPolarHBondContact O-CG2 3.23Å; I234-V238 PolarHBondContact O-N 3.34Å
235	C	92.6	Very high	88.2	Confident	63 Å²	63	88.2 Å²	88.2	43%	0.426	49%	0.487	S	S	.	.	H	α-helix	trans	-62	-42.5	178.9	-148.7	0	0	0	0	111.4	V231 L232 L233 V238 L239	V231-C235 VanDerWaalsContact O-CB 3.27Å; V231-C235 WeakPolarHBondContact O-CB 3.34Å; V231-C235 PolarHBondContact O-N 3.28Å; L232-C235 PolarHBondContact O-N 2.87Å; L233-C235 VanDerWaalsContact C-N 3.34Å; L233-C235 PolarHBondContact O-N 3.33Å; C235-V238 PolarHBondContact O-N 2.88Å; C235-L239 VanDerWaalsContact O-CB 3.23Å; C235-L239 WeakPolarHBondContact O-CB 3.37Å; C235-L239 WeakPolarHBondContact O-CD1 3.38Å; C235-L239 VanDerWaalsContact O-CG 3.24Å; C235-L239 WeakPolarHBondContact O-CG 3.29Å; C235-L239 PolarHBondContact O-N 3.41Å
236	C	89.9	Confident	89.6	Confident	75 Å²	75	87.7 Å²	87.7	51%	0.507	49%	0.486	S	S	.	.	H	α-helix	trans	-62	-44.9	174.2	-75.1	0	0	0	0	112.3	L232 L233 I234 V238 L239 V240	L232-C236 PolarHBondContact O-N 2.81Å; L232-C236 PolarHBondContact O-SG 3Å; L232-C236 VanDerWaalsContact O-SG 3.38Å; L233-C236 PolarHBondContact O-N 3.27Å; I234-C236 VanDerWaalsContact C-N 3.35Å; I234-C236 PolarHBondContact O-N 2.77Å; C236-V238 VanDerWaalsContact C-N 3.27Å; C236-V238 PolarHBondContact O-N 3.26Å; C236-L239 PolarHBondContact O-N 3.37Å; C236-V240 VanDerWaalsContact O-CG2 3.3Å; C236-V240 WeakPolarHBondContact O-CG2 3.38Å; C236-V240 PolarHBondContact O-N 2.89Å
237	V	90.9	Very high	89.8	Confident	96 Å²	96	90 Å²	90	58%	0.582	49%	0.492	S	S	*	.	H	α-helix	trans	-64.5	-32.4	180	173.1	0	0	0	0	111.8	L233 I234 P241	L233-V237 HydrophobicContact CD2-CG2 4.3Å; L233-V237 VanDerWaalsContact O-CG2 3.29Å; L233-V237 WeakPolarHBondContact O-CG2 3.42Å; L233-V237 PolarHBondContact O-N 3.1Å; I234-V237 PolarHBondContact O-N 2.86Å; V237-P241 WeakPolarHBondContact O-CD 3.23Å; V237-P241 WeakPolarHBondContact O-CG 3.16Å
238	V	92.5	Very high	89.9	Confident	75 Å²	75	92.3 Å²	92.3	46%	0.455	49%	0.49	S	S	.	.	H	α-helix	trans	-85.2	-35.3	178.2	176.7	0	0	0	0	112.6	I234 C235 C236 V240 P241 I242	I234-V238 HydrophobicContact CG2-CG2 4.46Å; I234-V238 WeakPolarHBondContact O-CG2 3.23Å; I234-V238 PolarHBondContact O-N 3.34Å; C235-V238 PolarHBondContact O-N 2.88Å; C236-V238 VanDerWaalsContact C-N 3.27Å; C236-V238 PolarHBondContact O-N 3.26Å; V238-V240 PolarHBondContact O-N 2.86Å; V238-P241 WeakPolarHBondContact O-CD 3.44Å; V238-P241 VanDerWaalsContact O-CG 3.27Å; V238-P241 WeakPolarHBondContact O-CG 3.3Å; V238-I242 HydrophobicContact CG1-CD1 3.67Å; V238-I242 HydrophobicContact CG1-CG1 4.45Å; V238-I242 WeakPolarHBondContact O-CD1 3.25Å; V238-I242 VanDerWaalsContact O-CG1 3.28Å; V238-I242 WeakPolarHBondContact O-CG1 3.43Å; V238-I242 PolarHBondContact O-N 3.08Å
239	L	90.3	Very high	89.6	Confident	90 Å²	90	89.3 Å²	89.3	47%	0.471	49%	0.487	S	S	.	.	H	α-helix	trans	-68.2	-33.8	179.8	-80.6	165.5	0	0	0	112.9	C235 C236 I242 T243	C235-L239 VanDerWaalsContact O-CB 3.23Å; C235-L239 WeakPolarHBondContact O-CB 3.37Å; C235-L239 WeakPolarHBondContact O-CD1 3.38Å; C235-L239 VanDerWaalsContact O-CG 3.24Å; C235-L239 WeakPolarHBondContact O-CG 3.29Å; C235-L239 PolarHBondContact O-N 3.41Å; C236-L239 PolarHBondContact O-N 3.37Å; L239-I242 PolarHBondContact O-N 3.24Å; L239-T243 WeakPolarHBondContact O-CB 3.25Å; L239-T243 VanDerWaalsContact O-CG2 3.27Å; L239-T243 WeakPolarHBondContact O-CG2 2.97Å; L239-T243 PolarHBondContact O-N 2.99Å; L239-T243 PolarHBondContact O-OG1 3.44Å
240	V	88.5	Confident	89.4	Confident	92 Å²	92	93.1 Å²	93.1	56%	0.558	50%	0.504	S	S	*	.	H	α-helix	trans	-60.4	-53.1	178.3	172.8	0	0	0	0	112.5	C236 V238 I242 T243 V244	C236-V240 VanDerWaalsContact O-CG2 3.3Å; C236-V240 WeakPolarHBondContact O-CG2 3.38Å; C236-V240 PolarHBondContact O-N 2.89Å; V238-V240 PolarHBondContact O-N 2.86Å; V240-I242 VanDerWaalsContact C-N 3.34Å; V240-I242 PolarHBondContact O-N 3.04Å; V240-T243 PolarHBondContact O-N 3.15Å; V240-T243 PolarHBondContact O-OG1 3.26Å; V240-V244 WeakPolarHBondContact O-CG2 3.45Å; V240-V244 PolarHBondContact O-N 2.88Å; V240-V244 VanDerWaalsContact O-N 3.13Å
241	P	89.4	Confident	89	Confident	64 Å²	64	92.3 Å²	92.3	42%	0.416	51%	0.506	S	S	.	.	H	α-helix	trans	-65.6	-36	177	22.4	-30.7	0	0	0	112.4	V237 V238 T243 V244 I245	V237-P241 WeakPolarHBondContact O-CD 3.23Å; V237-P241 WeakPolarHBondContact O-CG 3.16Å; V238-P241 WeakPolarHBondContact O-CD 3.44Å; V238-P241 VanDerWaalsContact O-CG 3.27Å; V238-P241 WeakPolarHBondContact O-CG 3.3Å; P241-T243 PolarHBondContact O-N 3.12Å; P241-V244 PolarHBondContact O-N 3.24Å; P241-I245 VanDerWaalsContact O-CG1 3.25Å; P241-I245 WeakPolarHBondContact O-CG1 3.29Å; P241-I245 PolarHBondContact O-N 3.45Å
242	I	90.4	Very high	88.3	Confident	77 Å²	77	91.1 Å²	91.1	40%	0.395	50%	0.502	S	S	.	.	H	α-helix	trans	-60.9	-46.1	176.2	-69.3	172.7	0	0	0	110.8	V238 L239 V240 V244 I245 L246	V238-I242 HydrophobicContact CG1-CD1 3.67Å; V238-I242 HydrophobicContact CG1-CG1 4.45Å; V238-I242 WeakPolarHBondContact O-CD1 3.25Å; V238-I242 VanDerWaalsContact O-CG1 3.28Å; V238-I242 WeakPolarHBondContact O-CG1 3.43Å; V238-I242 PolarHBondContact O-N 3.08Å; L239-I242 PolarHBondContact O-N 3.24Å; V240-I242 VanDerWaalsContact C-N 3.34Å; V240-I242 PolarHBondContact O-N 3.04Å; I242-V244 VanDerWaalsContact C-N 3.34Å; I242-V244 PolarHBondContact O-N 3.42Å; I242-I245 PolarHBondContact O-N 3Å; I242-L246 HydrophobicContact CG2-CD1 3.8Å; I242-L246 WeakPolarHBondContact O-CB 3.46Å; I242-L246 PolarHBondContact O-N 2.68Å
243	T	90.6	Very high	87.4	Confident	78 Å²	78	89.2 Å²	89.2	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-65.1	-37.5	179.6	52.5	0	0	0	0	111.9	L239 V240 P241 L246 E247	L239-T243 WeakPolarHBondContact O-CB 3.25Å; L239-T243 VanDerWaalsContact O-CG2 3.27Å; L239-T243 WeakPolarHBondContact O-CG2 2.97Å; L239-T243 PolarHBondContact O-N 2.99Å; L239-T243 PolarHBondContact O-OG1 3.44Å; V240-T243 PolarHBondContact O-N 3.15Å; V240-T243 PolarHBondContact O-OG1 3.26Å; P241-T243 PolarHBondContact O-N 3.12Å; T243-L246 PolarHBondContact O-N 3Å; T243-E247 PolarHBondContact O-N 2.8Å
244	V	89	Confident	86.2	Confident	69 Å²	69	93.3 Å²	93.3	42%	0.418	51%	0.506	S	S	.	.	H	α-helix	trans	-65.6	-40.9	173.9	174.7	0	0	0	0	112	V240 P241 I242 E247 R248	V240-V244 WeakPolarHBondContact O-CG2 3.45Å; V240-V244 PolarHBondContact O-N 2.88Å; V240-V244 VanDerWaalsContact O-N 3.13Å; P241-V244 PolarHBondContact O-N 3.24Å; I242-V244 VanDerWaalsContact C-N 3.34Å; I242-V244 PolarHBondContact O-N 3.42Å; V244-E247 PolarHBondContact O-N 2.85Å; V244-R248 WeakPolarHBondContact O-CG 3.24Å; V244-R248 PolarHBondContact O-N 2.88Å
245	I	90.5	Very high	84.9	Confident	101 Å²	101	93.2 Å²	93.2	52%	0.518	51%	0.507	S	S	.	.	H	α-helix	trans	-66.6	-43.6	176.4	-68	164.6	0	0	0	110.3	P241 I242 R248 L249	P241-I245 VanDerWaalsContact O-CG1 3.25Å; P241-I245 WeakPolarHBondContact O-CG1 3.29Å; P241-I245 PolarHBondContact O-N 3.45Å; I242-I245 PolarHBondContact O-N 3Å; I245-R248 PolarHBondContact O-N 3.36Å; I245-L249 HydrophobicContact CG2-CD1 3.93Å; I245-L249 HydrophobicContact CG2-CG 4.41Å; I245-L249 WeakPolarHBondContact O-CG 3.2Å; I245-L249 PolarHBondContact O-N 3.31Å
246	L	89.6	Confident	83.3	Confident	91 Å²	91	97.4 Å²	97.4	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-60.8	-43.9	175.5	-108.2	139.2	0	0	0	111.7	I242 T243 R248 L249 L250	I242-L246 HydrophobicContact CG2-CD1 3.8Å; I242-L246 WeakPolarHBondContact O-CB 3.46Å; I242-L246 PolarHBondContact O-N 2.68Å; T243-L246 PolarHBondContact O-N 3Å; L246-R248 VanDerWaalsContact C-N 3.33Å; L246-R248 PolarHBondContact O-N 2.85Å; L246-L249 PolarHBondContact O-N 3.25Å; L246-L250 HydrophobicContact CD2-CD1 4.26Å; L246-L250 WeakPolarHBondContact O-CB 3.3Å; L246-L250 VanDerWaalsContact O-CG 3.27Å; L246-L250 WeakPolarHBondContact O-CG 3.42Å; L246-L250 PolarHBondContact O-N 2.97Å
247	E	86.7	Confident	81.6	Confident	110 Å²	110	102.8 Å²	102.8	51%	0.514	53%	0.532	S	S	.	.	H	α-helix	trans	-59.1	-44.7	173.1	-100	-150.2	152.4	0	0	111.4	T243 V244 L250 A251 R274	T243-E247 PolarHBondContact O-N 2.8Å; V244-E247 PolarHBondContact O-N 2.85Å; E247-L250 PolarHBondContact O-N 3.28Å; E247-A251 WeakPolarHBondContact O-CB 3.24Å; E247-A251 PolarHBondContact O-N 2.62Å; E247-R274 IonicContact OE2-NH2 2.79Å; E247-R274 PolarHBondContact OE2-NH2 2.91Å
248	R	84.6	Confident	79.7	Confident	193 Å²	193	103.3 Å²	103.3	73%	0.728	53%	0.53	S	S	*	.	H	α-helix	trans	-64.5	-40	178.5	-78	-175.7	175.2	-176.9	0.2	112.2	V244 I245 L246 S252	V244-R248 WeakPolarHBondContact O-CG 3.24Å; V244-R248 PolarHBondContact O-N 2.88Å; I245-R248 PolarHBondContact O-N 3.36Å; L246-R248 VanDerWaalsContact C-N 3.33Å; L246-R248 PolarHBondContact O-N 2.85Å; R248-S252 VanDerWaalsContact O-CB 3.3Å; R248-S252 WeakPolarHBondContact O-CB 3.39Å; R248-S252 PolarHBondContact O-N 2.86Å
249	L	85.3	Confident	77.7	Confident	113 Å²	113	108.9 Å²	108.9	59%	0.592	54%	0.543	S	S	*	.	H	α-helix	trans	-67.4	-43.4	176.3	-74.8	169.6	0	0	0	111.8	I245 L246 S252 S253	I245-L249 HydrophobicContact CG2-CD1 3.93Å; I245-L249 HydrophobicContact CG2-CG 4.41Å; I245-L249 WeakPolarHBondContact O-CG 3.2Å; I245-L249 PolarHBondContact O-N 3.31Å; L246-L249 PolarHBondContact O-N 3.25Å; L249-S252 WeakPolarHBondContact O-CB 3.35Å; L249-S252 PolarHBondContact O-N 3.2Å; L249-S253 PolarHBondContact O-N 3.47Å
250	L	83.8	Confident	75.9	Confident	99 Å²	99	112.5 Å²	112.5	52%	0.518	56%	0.558	S	S	.	*	H	α-helix	trans	-67	-38.2	176.4	-72.9	169.2	0	0	0	112	L246 E247 S253 R254	L246-L250 HydrophobicContact CD2-CD1 4.26Å; L246-L250 WeakPolarHBondContact O-CB 3.3Å; L246-L250 VanDerWaalsContact O-CG 3.27Å; L246-L250 WeakPolarHBondContact O-CG 3.42Å; L246-L250 PolarHBondContact O-N 2.97Å; E247-L250 PolarHBondContact O-N 3.28Å; L250-S253 PolarHBondContact O-N 2.88Å; L250-S253 PolarHBondContact O-OG 3.41Å; L250-R254 WeakPolarHBondContact O-CB 3.39Å; L250-R254 WeakPolarHBondContact O-CG 3.43Å; L250-R254 PolarHBondContact O-N 3.16Å
251	A	77.8	Confident	73.8	Confident	49 Å²	49	114.4 Å²	114.4	41%	0.405	57%	0.565	S	S	.	*	H	α-helix	trans	-66.2	-39.3	173.7	0	0	0	0	0	111.5	E247 R254 N255	E247-A251 WeakPolarHBondContact O-CB 3.24Å; E247-A251 PolarHBondContact O-N 2.62Å; A251-R254 PolarHBondContact O-N 2.76Å; A251-N255 WeakPolarHBondContact O-CB 3.28Å; A251-N255 PolarHBondContact O-N 3.47Å
252	S	77.2	Confident	71.3	Confident	72 Å²	72	121.3 Å²	121.3	50%	0.503	58%	0.582	S	S	.	*	H	α-helix	trans	-63.9	-45.4	174.5	-171.9	0	0	0	0	111.7	R248 L249 R254 N255 M256	R248-S252 VanDerWaalsContact O-CB 3.3Å; R248-S252 WeakPolarHBondContact O-CB 3.39Å; R248-S252 PolarHBondContact O-N 2.86Å; L249-S252 WeakPolarHBondContact O-CB 3.35Å; L249-S252 PolarHBondContact O-N 3.2Å; S252-R254 PolarHBondContact O-N 3.45Å; S252-N255 PolarHBondContact O-N 3.37Å; S252-M256 PolarHBondContact O-N 2.85Å
253	S	74.3	Confident	68.9	Low	59 Å²	59	121 Å²	121	41%	0.413	60%	0.598	S	S	.	*	H	α-helix	trans	-66.8	-37.9	178.1	90.6	0	0	0	0	112.3	L249 L250 M256 R257	L249-S253 PolarHBondContact O-N 3.47Å; L250-S253 PolarHBondContact O-N 2.88Å; L250-S253 PolarHBondContact O-OG 3.41Å; S253-M256 PolarHBondContact O-N 3.48Å; S253-R257 PolarHBondContact O-N 3.4Å; S253-R257 VanDerWaalsContact O-N 3.07Å
254	R	65.2	Low	66.7	Low	185 Å²	185	124.4 Å²	124.4	70%	0.698	61%	0.612	S	S	*	*	H	α-helix	trans	-65.2	-39.7	172.5	-80.6	-177.4	167.3	-178.6	-2.6	112.1	L250 A251 S252 M256 R257 L258	L250-R254 WeakPolarHBondContact O-CB 3.39Å; L250-R254 WeakPolarHBondContact O-CG 3.43Å; L250-R254 PolarHBondContact O-N 3.16Å; A251-R254 PolarHBondContact O-N 2.76Å; S252-R254 PolarHBondContact O-N 3.45Å; R254-M256 VanDerWaalsContact C-N 3.33Å; R254-R257 PolarHBondContact O-N 3.19Å; R254-L258 WeakPolarHBondContact O-CB 3.49Å; R254-L258 PolarHBondContact O-N 3Å
255	N	63.1	Low	64.2	Low	106 Å²	106	128.3 Å²	128.3	57%	0.567	63%	0.626	S	S	*	*	H	α-helix	trans	-67.1	-32.7	175.5	-86.4	-20.4	0	0	0	112.8	A251 S252 R259	A251-N255 WeakPolarHBondContact O-CB 3.28Å; A251-N255 PolarHBondContact O-N 3.47Å; S252-N255 PolarHBondContact O-N 3.37Å; N255-R259 PolarHBondContact O-N 3.26Å
256	M	59.5	Low	62.1	Low	151 Å²	151	129.6 Å²	129.6	74%	0.744	64%	0.638	S	S	*	*	H	α-helix	trans	-65.8	-43.6	170.2	-95.7	-161.5	164	0	0	112.1	S252 S253 R254 R259 Q260	S252-M256 PolarHBondContact O-N 2.85Å; S253-M256 PolarHBondContact O-N 3.48Å; R254-M256 VanDerWaalsContact C-N 3.33Å; M256-R259 PolarHBondContact O-N 3.21Å; M256-Q260 PolarHBondContact O-N 3.45Å
257	R	55	Low	59.9	Low	189 Å²	189	134 Å²	134	71%	0.713	65%	0.653	S	S	*	*	H	α-helix	trans	-66.3	-36.8	175.3	-74.6	-175.8	176.5	177.7	-0.1	113.1	S253 R254 R259 Q260 N261	S253-R257 PolarHBondContact O-N 3.4Å; S253-R257 VanDerWaalsContact O-N 3.07Å; R254-R257 PolarHBondContact O-N 3.19Å; R257-R259 VanDerWaalsContact C-N 3.34Å; R257-Q260 WeakPolarHBondContact O-CB 3.26Å; R257-Q260 PolarHBondContact O-N 2.67Å; R257-N261 PolarHBondContact O-N 3.1Å
258	L	50.1	Low	58.1	Low	106 Å²	106	130.9 Å²	130.9	56%	0.555	65%	0.652	S	S	*	*	H	α-helix	trans	-68.7	-29.3	175.6	-88.3	154	0	0	0	113	R254 Q260 N261 R262	R254-L258 WeakPolarHBondContact O-CB 3.49Å; R254-L258 PolarHBondContact O-N 3Å; L258-Q260 VanDerWaalsContact C-N 3.26Å; L258-Q260 PolarHBondContact O-N 2.81Å; L258-N261 PolarHBondContact O-N 2.89Å; L258-R262 PolarHBondContact O-N 3.22Å
259	R	51.2	Low	56.3	Low	192 Å²	192	129.8 Å²	129.8	73%	0.725	65%	0.652	S	S	*	*	H	α-helix	trans	-66.8	-28.4	170.8	-95.2	-171.6	171.6	-167	-1.7	112.7	N255 M256 R257	N255-R259 PolarHBondContact O-N 3.26Å; M256-R259 PolarHBondContact O-N 3.21Å; R257-R259 VanDerWaalsContact C-N 3.34Å
260	Q	52.4	Low	54.6	Low	167 Å²	167	132.2 Å²	132.2	78%	0.78	67%	0.665	S	S	*	*	H	α-helix	trans	-77.5	-23.3	176.9	-130.1	171.5	-5.5	0	0	112.9	M256 R257 L258	M256-Q260 PolarHBondContact O-N 3.45Å; R257-Q260 WeakPolarHBondContact O-CB 3.26Å; R257-Q260 PolarHBondContact O-N 2.67Å; L258-Q260 VanDerWaalsContact C-N 3.26Å; L258-Q260 PolarHBondContact O-N 2.81Å
261	N	44.4	Very low	52.9	Low	131 Å²	131	131.9 Å²	131.9	70%	0.701	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.9	30.9	-179.5	-78.9	-10.1	0	0	0	113.7	R257 L258 G263	R257-N261 PolarHBondContact O-N 3.1Å; L258-N261 PolarHBondContact O-N 2.89Å; N261-G263 PolarHBondContact O-N 3.34Å
262	R	37.6	Very low	51.4	Low	209 Å²	209	135.2 Å²	135.2	79%	0.789	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	73.4	171.8	-89.6	-175	175.1	175.8	-4	111.1	L258	L258-R262 PolarHBondContact O-N 3.22Å
263	G	39.7	Very low	50.1	Low	70 Å²	70	142.6 Å²	142.6	72%	0.722	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.1	-12.9	163.6	0	0	0	0	0	113.3	N261	N261-G263 PolarHBondContact O-N 3.34Å
264	I	43	Very low	49	Very low	151 Å²	151	149.3 Å²	149.3	77%	0.774	72%	0.715	S	S	*	*			trans	-140.6	104	-176.5	-52.3	177.6	0	0	0	110.2	T266	I264-T266 PolarHBondContact O-N 3.48Å
265	E	37.9	Very low	48.3	Very low	151 Å²	151	143 Å²	143	71%	0.706	70%	0.703	S	S	*	*			trans	-67.8	121.1	171	-75.6	-166.9	124.5	0	0	110.9	K267	E265-K267 IonicContact OE1-NZ 2.77Å; E265-K267 PolarHBondContact OE1-NZ 2.78Å
266	T	45.8	Very low	47.4	Very low	128 Å²	128	140.8 Å²	140.8	79%	0.785	71%	0.705	S	S	*	*			trans	-132.9	79.4	155.6	44.3	0	0	0	0	109.5	I264 G268	I264-T266 PolarHBondContact O-N 3.48Å; T266-G268 PolarHBondContact O-N 3.09Å; T266-G268 VanDerWaalsContact O-N 3.1Å
267	K	43.6	Very low	47.3	Very low	182 Å²	182	143.5 Å²	143.5	79%	0.791	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	16.2	178	-83.8	174.1	176.5	149	0	114.8	E265	E265-K267 IonicContact OE1-NZ 2.77Å; E265-K267 PolarHBondContact OE1-NZ 2.78Å
268	G	49.1	Very low	47.3	Very low	46 Å²	46	138.2 Å²	138.2	47%	0.474	71%	0.71	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.7	-24.7	-163.4	0	0	0	0	0	118.4	T266	T266-G268 PolarHBondContact O-N 3.09Å; T266-G268 VanDerWaalsContact O-N 3.1Å
269	F	46.6	Very low	47.5	Very low	169 Å²	169	134.8 Å²	134.8	74%	0.741	70%	0.696	S	S	*	*	S	Bend	trans	-110.2	-13	-157.7	-94.3	-85.9	0	0	0	117.2
270	L	48.7	Very low	47.8	Very low	164 Å²	164	127.8 Å²	127.8	86%	0.859	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-14.9	-173	-85.1	157.3	0	0	0	115
271	S	49.2	Very low	48.2	Very low	93 Å²	93	126.3 Å²	126.3	65%	0.65	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-15.5	178.6	56.1	0	0	0	0	114.1
272	N	46.6	Very low	49	Very low	118 Å²	118	125 Å²	125	63%	0.631	67%	0.672	S	S	*	*	S	Bend	trans	-92.1	-13.6	-172	-70.9	-9.7	0	0	0	114.5
273	W	49	Very low	50.1	Low	227 Å²	227	117.6 Å²	117.6	86%	0.86	65%	0.654	S	S	*	*	S	Bend	trans	-93.4	-14.1	-173.9	-90.1	86.5	0	0	0	114.9
274	R	51.3	Low	51.1	Low	201 Å²	201	123.3 Å²	123.3	76%	0.758	65%	0.654	S	S	*	*	S	Bend	trans	-100.7	-2.1	-172.7	-98.9	-173.7	164.1	-154	-2.8	116	E247	E247-R274 IonicContact OE2-NH2 2.79Å; E247-R274 PolarHBondContact OE2-NH2 2.91Å
275	A	50.2	Low	51.9	Low	52 Å²	52	120.5 Å²	120.5	43%	0.43	64%	0.641	S	S	.	*	S	Bend	trans	-110	98.4	179	0	0	0	0	0	106.6	A279	A275-A279 HydrophobicContact CB-CB 3.12Å
276	G	44.2	Very low	53.3	Low	60 Å²	60	120.2 Å²	120.2	62%	0.619	64%	0.638	S	S	*	*			trans	-54.5	178.3	-175.2	0	0	0	0	0	114	A278 A279	G276-A278 PolarHBondContact O-N 2.95Å; G276-A279 PolarHBondContact O-N 3.42Å
277	F	56.9	Low	54.1	Low	208 Å²	208	119 Å²	119	91%	0.912	63%	0.627	S	S	*	*	H	α-helix	trans	-30.4	-42.1	-171.2	-93.6	-91.5	0	0	0	117.2	A279 G280 M281	F277-A279 PolarHBondContact O-N 2.8Å; F277-G280 PolarHBondContact O-N 2.8Å; F277-M281 PolarHBondContact O-N 2.89Å
278	A	55.8	Low	55.2	Low	78 Å²	78	114.7 Å²	114.7	65%	0.645	61%	0.611	S	S	*	*	H	α-helix	trans	-61.2	-38.3	176.8	0	0	0	0	0	114.6	G276 L282	G276-A278 PolarHBondContact O-N 2.95Å; A278-L282 PolarHBondContact O-N 3.12Å
279	A	55.3	Low	56.1	Low	33 Å²	33	116.1 Å²	116.1	27%	0.273	61%	0.611	S	S	.	*	H	α-helix	trans	-79.9	-27.3	179.3	0	0	0	0	0	112.9	A275 G276 F277 M281 L282 A283	A275-A279 HydrophobicContact CB-CB 3.12Å; G276-A279 PolarHBondContact O-N 3.42Å; F277-A279 PolarHBondContact O-N 2.8Å; A279-M281 VanDerWaalsContact C-N 3.33Å; A279-L282 PolarHBondContact O-N 2.76Å; A279-A283 WeakPolarHBondContact O-CB 3.4Å; A279-A283 PolarHBondContact O-N 3.26Å
280	G	56.3	Low	57.2	Low	45 Å²	45	113.9 Å²	113.9	46%	0.464	60%	0.6	S	S	.	*	H	α-helix	trans	-61.7	-40.5	171.2	0	0	0	0	0	112.2	F277 R284	F277-G280 PolarHBondContact O-N 2.8Å; G280-R284 PolarHBondContact O-N 3.27Å
281	M	61	Low	58.1	Low	137 Å²	137	112.6 Å²	112.6	68%	0.675	59%	0.59	S	S	*	*	H	α-helix	trans	-68.7	-40.6	173.2	-92.6	-175.2	70	0	0	112.9	F277 A279 R284 N285	F277-M281 PolarHBondContact O-N 2.89Å; A279-M281 VanDerWaalsContact C-N 3.33Å; M281-R284 PolarHBondContact O-N 2.76Å; M281-N285 PolarHBondContact O-N 3.02Å
282	L	61.7	Low	58.7	Low	104 Å²	104	116.5 Å²	116.5	55%	0.545	59%	0.591	S	S	.	*	H	α-helix	trans	-65.1	-42.4	176.8	-78.7	166.3	0	0	0	112.1	A278 A279 R284 N285 F286	A278-L282 PolarHBondContact O-N 3.12Å; A279-L282 PolarHBondContact O-N 2.76Å; L282-R284 VanDerWaalsContact C-N 3.3Å; L282-R284 PolarHBondContact O-N 2.96Å; L282-N285 PolarHBondContact O-N 3.45Å; L282-F286 VanDerWaalsContact O-CD2 3.3Å; L282-F286 WeakPolarHBondContact O-CD2 3.01Å; L282-F286 PolarHBondContact O-N 3.12Å
283	A	60.2	Low	59.5	Low	52 Å²	52	119.8 Å²	119.8	43%	0.43	59%	0.594	S	S	.	*	H	α-helix	trans	-62.8	-37.7	176.9	0	0	0	0	0	112	A279 F286 N287	A279-A283 WeakPolarHBondContact O-CB 3.4Å; A279-A283 PolarHBondContact O-N 3.26Å; A283-F286 PolarHBondContact O-N 3.43Å; A283-N287 PolarHBondContact O-N 3.11Å
284	R	60.3	Low	60.1	Low	190 Å²	190	116.7 Å²	116.7	72%	0.717	58%	0.582	S	S	*	*	H	α-helix	trans	-65.9	-42.9	175.4	-150.6	173.8	-171.2	174.2	1.9	111.4	G280 M281 L282 N287 I288	G280-R284 PolarHBondContact O-N 3.27Å; M281-R284 PolarHBondContact O-N 2.76Å; L282-R284 VanDerWaalsContact C-N 3.3Å; L282-R284 PolarHBondContact O-N 2.96Å; R284-N287 PolarHBondContact O-N 3.29Å; R284-I288 HydrophobicContact CG-CD1 4.33Å; R284-I288 WeakPolarHBondContact O-CD1 3.49Å; R284-I288 VanDerWaalsContact O-CG1 3.23Å; R284-I288 WeakPolarHBondContact O-CG1 3.05Å; R284-I288 PolarHBondContact O-N 2.88Å
285	N	61.1	Low	60.6	Low	93 Å²	93	109.8 Å²	109.8	50%	0.497	57%	0.565	S	S	.	*	H	α-helix	trans	-66.3	-37.2	175.5	-83.5	-19	0	0	0	113.2	M281 L282 T289	M281-N285 PolarHBondContact O-N 3.02Å; L282-N285 PolarHBondContact O-N 3.45Å; N285-T289 PolarHBondContact O-N 3.5Å; N285-T289 PolarHBondContact O-OG1 3.01Å
286	F	67.2	Low	61	Low	145 Å²	145	112 Å²	112	64%	0.636	57%	0.566	S	S	*	*	H	α-helix	trans	-66.7	-38.4	174.2	-90	-70	0	0	0	112.7	L282 A283 T289 K290	L282-F286 VanDerWaalsContact O-CD2 3.3Å; L282-F286 WeakPolarHBondContact O-CD2 3.01Å; L282-F286 PolarHBondContact O-N 3.12Å; A283-F286 PolarHBondContact O-N 3.43Å; F286-T289 WeakPolarHBondContact CA-OG1 3.31Å; F286-T289 PolarHBondContact O-OG1 3.09Å; F286-T289 VanDerWaalsContact O-OG1 3.12Å; F286-K290 VanDerWaalsContact O-CB 3.24Å; F286-K290 WeakPolarHBondContact O-CB 3.33Å; F286-K290 PolarHBondContact O-N 3.29Å
287	N	62.9	Low	61.8	Low	103 Å²	103	112.9 Å²	112.9	55%	0.551	56%	0.559	S	S	*	*	H	α-helix	trans	-68.4	-42.4	175.4	-86.6	-13.3	0	0	0	112	A283 R284 T289 K290 E291	A283-N287 PolarHBondContact O-N 3.11Å; R284-N287 PolarHBondContact O-N 3.29Å; N287-T289 PolarHBondContact O-N 3.41Å; N287-K290 PolarHBondContact O-N 2.57Å; N287-E291 PolarHBondContact O-N 2.99Å
288	I	66.3	Low	61.9	Low	90 Å²	90	112.1 Å²	112.1	46%	0.462	55%	0.551	S	S	.	*	H	α-helix	trans	-62.1	-43	176.9	-67.3	164.5	0	0	0	110.8	R284 E291 R292	R284-I288 HydrophobicContact CG-CD1 4.33Å; R284-I288 WeakPolarHBondContact O-CD1 3.49Å; R284-I288 VanDerWaalsContact O-CG1 3.23Å; R284-I288 WeakPolarHBondContact O-CG1 3.05Å; R284-I288 PolarHBondContact O-N 2.88Å; I288-E291 PolarHBondContact O-N 3.43Å; I288-R292 WeakPolarHBondContact O-CB 3.49Å; I288-R292 PolarHBondContact O-N 2.8Å
289	T	68.3	Low	62	Low	77 Å²	77	114.2 Å²	114.2	47%	0.472	55%	0.549	S	S	.	.	H	α-helix	trans	-68.8	-34.6	176.4	36.8	0	0	0	0	113.1	N285 F286 N287 R292 R293	N285-T289 PolarHBondContact O-N 3.5Å; N285-T289 PolarHBondContact O-OG1 3.01Å; F286-T289 WeakPolarHBondContact CA-OG1 3.31Å; F286-T289 PolarHBondContact O-OG1 3.09Å; F286-T289 VanDerWaalsContact O-OG1 3.12Å; N287-T289 PolarHBondContact O-N 3.41Å; T289-R292 PolarHBondContact O-N 2.95Å; T289-R293 PolarHBondContact O-N 3.05Å; T289-R293 VanDerWaalsContact O-N 3.11Å
290	K	68.5	Low	62	Low	121 Å²	121	118.7 Å²	118.7	53%	0.526	57%	0.567	S	S	.	*	H	α-helix	trans	-69.8	-37.6	175.6	-170.1	176.1	-178	178.2	0	112.4	F286 N287 R294	F286-K290 VanDerWaalsContact O-CB 3.24Å; F286-K290 WeakPolarHBondContact O-CB 3.33Å; F286-K290 PolarHBondContact O-N 3.29Å; N287-K290 PolarHBondContact O-N 2.57Å; K290-R294 PolarHBondContact O-N 2.76Å; K290-R294 VanDerWaalsContact O-N 3.09Å
291	E	67.9	Low	62	Low	137 Å²	137	123.4 Å²	123.4	64%	0.64	58%	0.579	S	S	*	*	H	α-helix	trans	-67.1	-41.4	173.3	-79.3	-179.3	164	0	0	111.8	N287 I288 R293 R294 S295	N287-E291 PolarHBondContact O-N 2.99Å; I288-E291 PolarHBondContact O-N 3.43Å; E291-R293 PolarHBondContact O-N 3.49Å; E291-R294 PolarHBondContact O-N 3.39Å; E291-R294 VanDerWaalsContact O-N 3.12Å; E291-S295 PolarHBondContact O-N 2.95Å; E291-S295 PolarHBondContact O-OG 3.18Å
292	R	61.6	Low	61.9	Low	175 Å²	175	121 Å²	121	66%	0.66	58%	0.575	S	S	*	*	H	α-helix	trans	-59.2	-45	175.8	-135.3	178.3	-164	177	3.2	112.3	I288 T289 R294 S295 E296	I288-R292 WeakPolarHBondContact O-CB 3.49Å; I288-R292 PolarHBondContact O-N 2.8Å; T289-R292 PolarHBondContact O-N 2.95Å; R292-R294 VanDerWaalsContact C-N 3.35Å; R292-R294 PolarHBondContact O-N 2.96Å; R292-S295 WeakPolarHBondContact CA-OG 3.46Å; R292-S295 PolarHBondContact O-N 3.44Å; R292-S295 PolarHBondContact O-OG 3.37Å; R292-E296 WeakPolarHBondContact O-CG 3.38Å; R292-E296 PolarHBondContact O-N 2.86Å
293	R	62.8	Low	61.5	Low	187 Å²	187	122.6 Å²	122.6	71%	0.706	58%	0.584	S	S	*	*	H	α-helix	trans	-64.6	-36.3	174.8	-74.4	-173.7	-179.4	-175.2	1.1	112.8	T289 E291 E296 V297	T289-R293 PolarHBondContact O-N 3.05Å; T289-R293 VanDerWaalsContact O-N 3.11Å; E291-R293 PolarHBondContact O-N 3.49Å; R293-E296 PolarHBondContact O-N 3.16Å; R293-V297 VanDerWaalsContact O-CG2 3.31Å; R293-V297 WeakPolarHBondContact O-CG2 3.4Å; R293-V297 PolarHBondContact O-N 3.4Å
294	R	62.6	Low	61.1	Low	163 Å²	163	124.7 Å²	124.7	62%	0.615	59%	0.592	S	S	*	*	H	α-helix	trans	-68	-38.2	174.8	-81.6	-178.1	173.3	-177.8	-3.5	112.1	K290 E291 R292 R298	K290-R294 PolarHBondContact O-N 2.76Å; K290-R294 VanDerWaalsContact O-N 3.09Å; E291-R294 PolarHBondContact O-N 3.39Å; E291-R294 VanDerWaalsContact O-N 3.12Å; R292-R294 VanDerWaalsContact C-N 3.35Å; R292-R294 PolarHBondContact O-N 2.96Å; R294-R298 WeakPolarHBondContact O-CB 3.19Å; R294-R298 PolarHBondContact O-N 3.32Å
295	S	61.8	Low	60.5	Low	56 Å²	56	121 Å²	121	39%	0.392	59%	0.593	S	S	.	*	H	α-helix	trans	-68.3	-37	174.8	52.8	0	0	0	0	112.6	E291 R292 R298 M299	E291-S295 PolarHBondContact O-N 2.95Å; E291-S295 PolarHBondContact O-OG 3.18Å; R292-S295 WeakPolarHBondContact CA-OG 3.46Å; R292-S295 PolarHBondContact O-N 3.44Å; R292-S295 PolarHBondContact O-OG 3.37Å; S295-R298 PolarHBondContact O-N 2.99Å; S295-M299 PolarHBondContact O-N 3.09Å
296	E	59.4	Low	59.8	Low	97 Å²	97	128.4 Å²	128.4	45%	0.453	61%	0.614	S	S	.	*	H	α-helix	trans	-65.6	-44	175.8	-75.4	168.2	-175.1	0	0	111.8	R292 R293 R298 M299 L300	R292-E296 WeakPolarHBondContact O-CG 3.38Å; R292-E296 PolarHBondContact O-N 2.86Å; R293-E296 PolarHBondContact O-N 3.16Å; E296-R298 VanDerWaalsContact C-N 3.32Å; E296-R298 PolarHBondContact O-N 3.07Å; E296-M299 PolarHBondContact O-N 3.46Å; E296-L300 WeakPolarHBondContact O-CG 3.36Å; E296-L300 PolarHBondContact O-N 2.92Å
297	V	60.4	Low	58.7	Low	79 Å²	79	129.2 Å²	129.2	48%	0.479	62%	0.619	S	S	.	*	H	α-helix	trans	-65.1	-35.9	174.6	174.1	0	0	0	0	111.5	R293 L300 M301	R293-V297 VanDerWaalsContact O-CG2 3.31Å; R293-V297 WeakPolarHBondContact O-CG2 3.4Å; R293-V297 PolarHBondContact O-N 3.4Å; V297-L300 PolarHBondContact O-N 3.3Å; V297-M301 HydrophobicContact CG1-SD 4.44Å; V297-M301 WeakPolarHBondContact O-CB 3.38Å; V297-M301 WeakPolarHBondContact O-CG 3.19Å; V297-M301 PolarHBondContact O-N 3.32Å
298	R	58.9	Low	57.8	Low	193 Å²	193	129.1 Å²	129.1	73%	0.728	63%	0.627	S	S	*	*	H	α-helix	trans	-68.8	-35.7	176.9	-136.3	-177.7	-93.4	165.1	-10.3	112.3	R294 S295 E296 S302	R294-R298 WeakPolarHBondContact O-CB 3.19Å; R294-R298 PolarHBondContact O-N 3.32Å; S295-R298 PolarHBondContact O-N 2.99Å; E296-R298 VanDerWaalsContact C-N 3.32Å; E296-R298 PolarHBondContact O-N 3.07Å; R298-S302 PolarHBondContact O-N 3.4Å; R298-S302 VanDerWaalsContact O-N 3.16Å
299	M	57.8	Low	56.7	Low	122 Å²	122	133.5 Å²	133.5	60%	0.601	64%	0.643	S	S	*	*	H	α-helix	trans	-70.9	-35.6	172.9	-75.9	-161	-69.9	0	0	112.7	S295 E296 M301 S302	S295-M299 PolarHBondContact O-N 3.09Å; E296-M299 PolarHBondContact O-N 3.46Å; M299-M301 VanDerWaalsContact C-N 3.34Å; M299-S302 PolarHBondContact O-N 2.84Å; M299-S302 PolarHBondContact O-OG 2.61Å; M299-S302 VanDerWaalsContact O-OG 3.07Å
300	L	55.9	Low	55.5	Low	127 Å²	127	138 Å²	138	67%	0.665	66%	0.659	S	S	*	*	H	α-helix	trans	-68.6	-33.3	174.7	-73.5	166.4	0	0	0	112.2	E296 V297	E296-L300 WeakPolarHBondContact O-CG 3.36Å; E296-L300 PolarHBondContact O-N 2.92Å; V297-L300 PolarHBondContact O-N 3.3Å
301	M	56.3	Low	54.3	Low	143 Å²	143	138.1 Å²	138.1	70%	0.704	67%	0.673	S	S	*	*	H	α-helix	trans	-79	-17.4	175.4	-76	-172.1	164.5	0	0	114.3	V297 M299 T304	V297-M301 HydrophobicContact CG1-SD 4.44Å; V297-M301 WeakPolarHBondContact O-CB 3.38Å; V297-M301 WeakPolarHBondContact O-CG 3.19Å; V297-M301 PolarHBondContact O-N 3.32Å; M299-M301 VanDerWaalsContact C-N 3.34Å; M301-T304 PolarHBondContact O-OG1 3.14Å
302	S	57.3	Low	53.3	Low	86 Å²	86	137.2 Å²	137.2	60%	0.601	68%	0.677	S	S	*	*	H	α-helix	trans	-85.2	-14.6	175.3	68.6	0	0	0	0	113.5	R298 M299	R298-S302 PolarHBondContact O-N 3.4Å; R298-S302 VanDerWaalsContact O-N 3.16Å; M299-S302 PolarHBondContact O-N 2.84Å; M299-S302 PolarHBondContact O-OG 2.61Å; M299-S302 VanDerWaalsContact O-OG 3.07Å
303	N	54.3	Low	52.4	Low	138 Å²	138	133.3 Å²	133.3	74%	0.738	68%	0.682	S	S	*	*	S	Bend	trans	-102.7	5.6	-179.3	-79	-5.8	0	0	0	114	P305	N303-P305 WeakPolarHBondContact O-CD 3.4Å
304	T	51.9	Low	51.5	Low	96 Å²	96	131.9 Å²	131.9	59%	0.589	69%	0.689	S	S	*	*	S	Bend	trans	-79.1	118.2	169.6	35.4	0	0	0	0	109.7	M301 R306	M301-T304 PolarHBondContact O-OG1 3.14Å; T304-R306 PolarHBondContact O-N 3.21Å
305	P	47.2	Very low	50.7	Low	113 Å²	113	135.6 Å²	135.6	73%	0.734	72%	0.72	S	S	*	*			trans	-60.4	126.2	174.1	24.1	-31	0	0	0	108.7	N303 Q307	N303-P305 WeakPolarHBondContact O-CD 3.4Å; P305-Q307 VanDerWaalsContact C-N 3.32Å; P305-Q307 PolarHBondContact O-N 3.28Å
306	R	46.2	Very low	50.2	Low	248 Å²	248	139.6 Å²	139.6	94%	0.936	74%	0.736	S	S	*	*			trans	-58.1	95.6	169	-90.9	179.6	168.5	164	-4.1	108.2	T304 S308	T304-R306 PolarHBondContact O-N 3.21Å; R306-S308 PolarHBondContact O-N 3.13Å; R306-S308 VanDerWaalsContact O-N 3.12Å
307	Q	44.4	Very low	49.7	Very low	162 Å²	162	141.8 Å²	141.8	76%	0.757	75%	0.751	S	S	*	*			trans	-69.8	102.2	157.8	-77.6	-175.1	-12.3	0	0	106.8	P305 F309	P305-Q307 VanDerWaalsContact C-N 3.32Å; P305-Q307 PolarHBondContact O-N 3.28Å; Q307-F309 PolarHBondContact O-N 3.12Å; Q307-F309 VanDerWaalsContact O-N 3.13Å
308	S	43.3	Very low	49.1	Very low	101 Å²	101	145.3 Å²	145.3	71%	0.706	77%	0.766	S	S	*	*			trans	-66	105.4	165.9	47.9	0	0	0	0	108	R306 Q310	R306-S308 PolarHBondContact O-N 3.13Å; R306-S308 VanDerWaalsContact O-N 3.12Å; S308-Q310 VanDerWaalsContact C-N 3.32Å; S308-Q310 PolarHBondContact O-N 3.31Å
309	F	44.5	Very low	48.5	Very low	182 Å²	182	142.5 Å²	142.5	80%	0.798	77%	0.768	S	S	*	*			trans	-66.6	96.5	159.6	-86.2	-90.5	0	0	0	107.4	Q307 C311	Q307-F309 PolarHBondContact O-N 3.12Å; Q307-F309 VanDerWaalsContact O-N 3.13Å; F309-C311 PolarHBondContact O-N 2.83Å
310	Q	42.3	Very low	48	Very low	172 Å²	172	143.8 Å²	143.8	80%	0.804	78%	0.779	S	S	*	*			trans	-72.2	104.6	160	-83.7	-179.6	-31.8	0	0	107.2	S308 T312	S308-Q310 VanDerWaalsContact C-N 3.32Å; S308-Q310 PolarHBondContact O-N 3.31Å; Q310-T312 PolarHBondContact O-N 3.23Å
311	C	44	Very low	47.4	Very low	123 Å²	123	144.9 Å²	144.9	83%	0.831	79%	0.786	S	S	*	*			trans	-74.2	100.3	160.9	-68.9	0	0	0	0	107.6	F309 A313	F309-C311 PolarHBondContact O-N 2.83Å; C311-A313 PolarHBondContact O-N 3.02Å
312	T	45.7	Very low	46.8	Very low	118 Å²	118	145 Å²	145	72%	0.724	79%	0.792	S	S	*	*			trans	-72	107.9	161.6	31.8	0	0	0	0	108.2	Q310 N314	Q310-T312 PolarHBondContact O-N 3.23Å; T312-N314 PolarHBondContact O-N 3.46Å
313	A	42.5	Very low	46	Very low	93 Å²	93	149.5 Å²	149.5	77%	0.769	81%	0.807	S	S	*	*			trans	-76.8	108.1	161.3	0	0	0	0	0	107.3	C311 L315	C311-A313 PolarHBondContact O-N 3.02Å; A313-L315 PolarHBondContact O-N 3.41Å
314	N	45	Very low	45.3	Very low	157 Å²	157	150.5 Å²	150.5	84%	0.84	81%	0.812	S	S	*	*			trans	-77.8	114.8	163.9	-76.8	-14.8	0	0	0	107.6	T312	T312-N314 PolarHBondContact O-N 3.46Å
315	L	46.3	Very low	44.7	Very low	241 Å²	241	155.5 Å²	155.5	100%	1.262	83%	0.833	S	S	*	*			trans	-92.1	0	161.2	-102.9	145.5	0	0	0	108.4	A313	A313-L315 PolarHBondContact O-N 3.41Å

Retrieved 315 of 315 residues in 211.3 ms (Link to these results)

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