A0A077ZJ19_TRITR Loading...

Regulatory protein RecX

Modulates RecA activity through direct physical interaction. Can inhibit both RecA recombinase and coprotease activities. May have a regulatory role during the SOS response. Inhibits DNA strand exchange in vitro.

AlphaFold DB , UniProt , Accession A0A077ZJ19, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 166 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	34.6	Very low	65.1	Low	240 Å²	240	121.8 Å²	121.8	100%	1.182	63%	0.626	S	S	*	*				0	98.9	0	-62.2	-174.3	175	0	0	107.5	E3	M1-E3 PolarHBondContact O-N 3.4Å
2	T	41.1	Very low	67.6	Low	121 Å²	121	114.2 Å²	114.2	74%	0.742	59%	0.594	S	S	*	*			trans	-83.5	106.1	171.7	34.4	0	0	0	0	107.3	S4	T2-S4 PolarHBondContact O-N 3.35Å
3	E	42.2	Very low	69.7	Low	173 Å²	173	110.5 Å²	110.5	81%	0.808	57%	0.568	S	S	*	*			trans	-53.7	133.2	177.3	-75.3	177.1	135.5	0	0	111.1	M1 T5	M1-E3 PolarHBondContact O-N 3.4Å; E3-T5 PolarHBondContact O-N 3.01Å
4	S	50.9	Low	71.6	Confident	77 Å²	77	102.9 Å²	102.9	54%	0.538	53%	0.529	S	S	.	.			trans	-41.7	122.2	176.4	178.8	0	0	0	0	112.8	T2 S6	T2-S4 PolarHBondContact O-N 3.35Å; S4-S6 PolarHBondContact O-N 2.82Å; S4-S6 WeakPolarHBondContact OG-CA 3.01Å; S4-S6 WeakPolarHBondContact OG-CB 3.43Å; S4-S6 PolarHBondContact OG-N 3.46Å; S4-S6 PolarHBondContact OG-OG 3.29Å
5	T	55.8	Low	73.3	Confident	121 Å²	121	97.9 Å²	97.9	74%	0.742	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-59.3	-4.4	162.5	39.9	0	0	0	0	112.8	E3 R7	E3-T5 PolarHBondContact O-N 3.01Å; T5-R7 VanDerWaalsContact C-N 3.32Å; T5-R7 PolarHBondContact O-N 2.62Å
6	S	58.7	Low	74.7	Confident	76 Å²	76	96.3 Å²	96.3	53%	0.531	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-80.5	7.4	-174.8	97	0	0	0	0	115.9	S4	S4-S6 PolarHBondContact O-N 2.82Å; S4-S6 WeakPolarHBondContact OG-CA 3.01Å; S4-S6 WeakPolarHBondContact OG-CB 3.43Å; S4-S6 PolarHBondContact OG-N 3.46Å; S4-S6 PolarHBondContact OG-OG 3.29Å
7	R	69.5	Low	76	Confident	226 Å²	226	93.1 Å²	93.1	85%	0.853	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-71.9	-28.5	176.8	-98.7	-175.2	171.2	171.5	-0.7	114.4	T5	T5-R7 VanDerWaalsContact C-N 3.32Å; T5-R7 PolarHBondContact O-N 2.62Å
8	R	83	Confident	77.2	Confident	152 Å²	152	87.9 Å²	87.9	57%	0.574	45%	0.45	S	S	*	.	S	Bend	trans	-88.1	142.8	179	-70.8	-172.9	-179.1	-178.8	0.8	110.6	R13 D16	R8-R13 HydrophobicContact CB-CG 3.92Å; R8-R13 PolarHBondContact O-NH1 3.01Å; R8-D16 IonicContact NH1-OD2 2.83Å; R8-D16 PolarHBondContact NH1-OD2 3.32Å
9	P	91.2	Very high	78.2	Confident	92 Å²	92	85.7 Å²	85.7	60%	0.597	44%	0.44	S	S	*	.			trans	-55	148.5	171.9	-24.6	34.1	0	0	0	112.6	Y11 A12 R13	P9-Y11 VanDerWaalsContact C-N 3.35Å; P9-Y11 PolarHBondContact O-N 3.29Å; P9-A12 PolarHBondContact O-N 3.31Å; P9-A12 VanDerWaalsContact O-N 3.07Å; P9-R13 PolarHBondContact O-N 2.9Å
10	A	93.3	Very high	79.2	Confident	16 Å²	16	90 Å²	90	13%	0.132	45%	0.451	C	S	.	.	H	α-helix	trans	-52.3	-50	179.4	0	0	0	0	0	112.5	A12 R13 L14 D50 A51 D55	A10-A12 VanDerWaalsContact C-N 3.33Å; A10-A12 PolarHBondContact O-N 2.8Å; A10-R13 PolarHBondContact O-N 3.08Å; A10-R13 VanDerWaalsContact O-N 3.13Å; A10-L14 PolarHBondContact O-N 3.13Å; A10-D50 VanDerWaalsContact CB-O 3.3Å; A10-D50 WeakPolarHBondContact CB-O 3.48Å; A10-A51 HydrophobicContact CB-CB 3.87Å; A10-D55 HydrophobicContact CB-CB 4.45Å
11	Y	95.7	Very high	80	Confident	46 Å²	46	87 Å²	87	18%	0.18	44%	0.436	C	S	.	.	H	α-helix	trans	-45.5	-51.1	172.1	172.7	-99.9	0	0	0	113.5	P9 R13 L14 L15 D55 R58 V59	P9-Y11 VanDerWaalsContact C-N 3.35Å; P9-Y11 PolarHBondContact O-N 3.29Å; Y11-R13 PolarHBondContact O-N 3.2Å; Y11-L14 PolarHBondContact O-N 3.28Å; Y11-L15 HydrophobicContact CE1-CD2 4.12Å; Y11-L15 WeakPolarHBondContact O-CB 3.45Å; Y11-L15 PolarHBondContact O-N 3.25Å; Y11-D55 PolarHBondContact N-OD1 2.93Å; Y11-R58 HydrophobicContact CD2-CB 3.79Å; Y11-R58 HydrophobicContact CE2-CB 3.76Å; Y11-V59 HydrophobicContact CD2-CG2 3.6Å; Y11-V59 HydrophobicContact CE2-CG2 3.71Å
12	A	95.4	Very high	82.9	Confident	30 Å²	30	76.3 Å²	76.3	25%	0.248	38%	0.383	C	S	.	.	H	α-helix	trans	-65.1	-39.6	-176.9	0	0	0	0	0	111.9	P9 A10 L15 D16	P9-A12 PolarHBondContact O-N 3.31Å; P9-A12 VanDerWaalsContact O-N 3.07Å; A10-A12 VanDerWaalsContact C-N 3.33Å; A10-A12 PolarHBondContact O-N 2.8Å; A12-L15 PolarHBondContact O-N 2.81Å; A12-D16 PolarHBondContact O-N 2.99Å
13	R	94.3	Very high	85.4	Confident	66 Å²	66	74.3 Å²	74.3	25%	0.249	38%	0.379	C	S	.	.	H	α-helix	trans	-66.7	-41.4	176.5	-59.7	-173	-57.3	-113.9	6.7	111.8	R8 P9 A10 Y11 R17 D50	R8-R13 HydrophobicContact CB-CG 3.92Å; R8-R13 PolarHBondContact O-NH1 3.01Å; P9-R13 PolarHBondContact O-N 2.9Å; A10-R13 PolarHBondContact O-N 3.08Å; A10-R13 VanDerWaalsContact O-N 3.13Å; Y11-R13 PolarHBondContact O-N 3.2Å; R13-R17 WeakPolarHBondContact O-CB 3.45Å; R13-R17 PolarHBondContact O-N 3.36Å; R13-R17 VanDerWaalsContact O-N 3.13Å; R13-D50 PolarHBondContact NH2-O 3.43Å; R13-D50 IonicContact NH2-OD2 3.01Å
14	L	96.5	Very high	87.9	Confident	4 Å²	4	72 Å²	72	2%	0.021	38%	0.377	C	S	.	.	H	α-helix	trans	-66	-41	176.4	-77.3	179.5	0	0	0	111.6	A10 Y11 R17 A18 L36 I49 A51 D55 Y56 V59	A10-L14 PolarHBondContact O-N 3.13Å; Y11-L14 PolarHBondContact O-N 3.28Å; L14-R17 WeakPolarHBondContact O-CB 3.34Å; L14-R17 PolarHBondContact O-N 3.35Å; L14-A18 WeakPolarHBondContact O-CB 3.3Å; L14-A18 PolarHBondContact O-N 3.07Å; L14-L36 HydrophobicContact CD2-CD2 4.4Å; L14-I49 HydrophobicContact CD2-CG2 4.11Å; L14-A51 HydrophobicContact CD1-CB 3.65Å; L14-A51 HydrophobicContact CG-CB 4.28Å; L14-D55 HydrophobicContact CD1-CB 3.9Å; L14-Y56 HydrophobicContact CD1-CD1 3.88Å; L14-Y56 HydrophobicContact CD1-CD2 4.32Å; L14-Y56 HydrophobicContact CD1-CE1 3.89Å; L14-Y56 HydrophobicContact CD1-CE2 4.32Å; L14-Y56 HydrophobicContact CD1-CG 4.09Å; L14-Y56 HydrophobicContact CD2-CD1 4.29Å; L14-Y56 HydrophobicContact CD2-CE1 3.7Å; L14-Y56 HydrophobicContact CG-CE1 4.49Å; L14-V59 HydrophobicContact CB-CG2 3.77Å
15	L	97.6	Very high	89.8	Confident	28 Å²	28	73.5 Å²	73.5	15%	0.147	37%	0.371	C	S	.	.	H	α-helix	trans	-62	-49.5	176.7	-178.1	60.3	0	0	0	111.7	Y11 A12 R17 A18 V19 V59 W62	Y11-L15 HydrophobicContact CE1-CD2 4.12Å; Y11-L15 WeakPolarHBondContact O-CB 3.45Å; Y11-L15 PolarHBondContact O-N 3.25Å; A12-L15 PolarHBondContact O-N 2.81Å; L15-R17 PolarHBondContact O-N 3.23Å; L15-A18 PolarHBondContact O-N 3.37Å; L15-V19 HydrophobicContact CD1-CG2 4.25Å; L15-V19 WeakPolarHBondContact O-CG2 3.34Å; L15-V19 PolarHBondContact O-N 2.91Å; L15-V59 HydrophobicContact CB-CG2 4.22Å; L15-V59 HydrophobicContact CD1-CG1 4.48Å; L15-W62 HydrophobicContact CD1-CD2 3.68Å; L15-W62 HydrophobicContact CD1-CE3 3.37Å; L15-W62 HydrophobicContact CD1-CG 4.25Å; L15-W62 HydrophobicContact CD1-CH2 4.38Å; L15-W62 HydrophobicContact CD1-CZ3 3.76Å; L15-W62 HydrophobicContact CD2-CD2 4.47Å
16	D	96.1	Very high	91.5	Very high	72 Å²	72	70.1 Å²	70.1	39%	0.385	35%	0.348	S	S	.	.	H	α-helix	trans	-56.5	-36.1	175.2	-76.1	-15	0	0	0	111.8	R8 A12 R20	R8-D16 IonicContact NH1-OD2 2.83Å; R8-D16 PolarHBondContact NH1-OD2 3.32Å; A12-D16 PolarHBondContact O-N 2.99Å; D16-R20 WeakPolarHBondContact O-CG 3.47Å; D16-R20 PolarHBondContact O-N 3.28Å; D16-R20 PolarHBondContact O-NE 2.8Å
17	R	95.7	Very high	93.3	Very high	43 Å²	43	66.8 Å²	66.8	16%	0.162	32%	0.324	C	S	.	.	H	α-helix	trans	-71.8	-44	175.7	-173.4	179.7	178.5	169.8	1	111.5	R13 L14 L15 R20 I21 K35 L36 A38 I40	R13-R17 WeakPolarHBondContact O-CB 3.45Å; R13-R17 PolarHBondContact O-N 3.36Å; R13-R17 VanDerWaalsContact O-N 3.13Å; L14-R17 WeakPolarHBondContact O-CB 3.34Å; L14-R17 PolarHBondContact O-N 3.35Å; L15-R17 PolarHBondContact O-N 3.23Å; R17-R20 PolarHBondContact O-N 3.07Å; R17-I21 HydrophobicContact CG-CD1 3.88Å; R17-I21 VanDerWaalsContact O-CG1 3.31Å; R17-I21 WeakPolarHBondContact O-CG1 3.31Å; R17-I21 PolarHBondContact O-N 3.13Å; R17-K35 PolarHBondContact NE-O 3.21Å; R17-K35 PolarHBondContact NH2-O 3.36Å; R17-L36 HydrophobicContact CB-CD2 4.06Å; R17-L36 HydrophobicContact CG-CD2 3.92Å; R17-L36 PolarHBondContact NH1-O 3.22Å; R17-A38 PolarHBondContact NH1-O 3.04Å; R17-A38 PolarHBondContact NH2-O 2.93Å; R17-I40 VanDerWaalsContact NH1-CG1 3.25Å
18	A	97.8	Very high	94.6	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.3	-50.3	179.7	0	0	0	0	0	111.1	L14 L15 R20 I21 L22 L32 L36 V59	L14-A18 WeakPolarHBondContact O-CB 3.3Å; L14-A18 PolarHBondContact O-N 3.07Å; L15-A18 PolarHBondContact O-N 3.37Å; A18-R20 VanDerWaalsContact C-N 3.32Å; A18-R20 PolarHBondContact O-N 3.29Å; A18-I21 PolarHBondContact O-N 3.46Å; A18-I21 VanDerWaalsContact O-N 3.09Å; A18-L22 WeakPolarHBondContact O-CB 3.43Å; A18-L22 WeakPolarHBondContact O-CG 3.45Å; A18-L22 PolarHBondContact O-N 2.93Å; A18-L32 HydrophobicContact CB-CD1 4.29Å; A18-L32 HydrophobicContact CB-CD2 4.45Å; A18-L36 HydrophobicContact CB-CD1 4.23Å; A18-L36 HydrophobicContact CB-CD2 4.05Å; A18-V59 HydrophobicContact CB-CG1 3.65Å
19	V	97.3	Very high	95.3	Very high	45 Å²	45	51 Å²	51	27%	0.273	27%	0.267	S	S	.	.	H	α-helix	trans	-58.1	-44.4	178	174.3	0	0	0	0	110.9	L15 I21 L22 A23 W62 Y68	L15-V19 HydrophobicContact CD1-CG2 4.25Å; L15-V19 WeakPolarHBondContact O-CG2 3.34Å; L15-V19 PolarHBondContact O-N 2.91Å; V19-I21 PolarHBondContact O-N 2.85Å; V19-L22 PolarHBondContact O-N 3.35Å; V19-A23 VanDerWaalsContact O-CB 3.23Å; V19-A23 WeakPolarHBondContact O-CB 3.48Å; V19-A23 PolarHBondContact O-N 2.69Å; V19-W62 HydrophobicContact CG2-CZ3 4.15Å; V19-Y68 HydrophobicContact CG1-CE1 4.49Å
20	R	96.3	Very high	95.6	Very high	172 Å²	172	50 Å²	50	65%	0.649	25%	0.254	S	S	*	.	H	α-helix	trans	-61.8	-40.2	175.8	-78	-174.6	-66.3	171.9	0.2	113.2	D16 R17 A18	D16-R20 WeakPolarHBondContact O-CG 3.47Å; D16-R20 PolarHBondContact O-N 3.28Å; D16-R20 PolarHBondContact O-NE 2.8Å; R17-R20 PolarHBondContact O-N 3.07Å; A18-R20 VanDerWaalsContact C-N 3.32Å; A18-R20 PolarHBondContact O-N 3.29Å
21	I	96.4	Very high	95.8	Very high	26 Å²	26	50.4 Å²	50.4	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-47.2	177.8	-70.3	162.4	0	0	0	110.4	R17 A18 V19 A23 V24 H27 L32 K35 L36	R17-I21 HydrophobicContact CG-CD1 3.88Å; R17-I21 VanDerWaalsContact O-CG1 3.31Å; R17-I21 WeakPolarHBondContact O-CG1 3.31Å; R17-I21 PolarHBondContact O-N 3.13Å; A18-I21 PolarHBondContact O-N 3.46Å; A18-I21 VanDerWaalsContact O-N 3.09Å; V19-I21 PolarHBondContact O-N 2.85Å; I21-A23 VanDerWaalsContact C-N 3.34Å; I21-V24 PolarHBondContact O-N 2.89Å; I21-H27 PolarHBondContact O-CE1 2.99Å; I21-L32 HydrophobicContact CB-CD1 4.06Å; I21-L32 HydrophobicContact CD1-CD1 4.12Å; I21-L32 HydrophobicContact CG2-CD1 3.82Å; I21-K35 HydrophobicContact CD1-CB 3.86Å; I21-K35 HydrophobicContact CG2-CD 3.75Å; I21-L36 HydrophobicContact CD1-CD2 4.12Å
22	L	96.1	Very high	95.9	Very high	16 Å²	16	48.2 Å²	48.2	8%	0.084	24%	0.244	C	C	.	.	H	α-helix	trans	-72.9	-26.1	-176	-64.4	172.9	0	0	0	112.7	A18 V19 V24 H27 L32 C63 L69	A18-L22 WeakPolarHBondContact O-CB 3.43Å; A18-L22 WeakPolarHBondContact O-CG 3.45Å; A18-L22 PolarHBondContact O-N 2.93Å; V19-L22 PolarHBondContact O-N 3.35Å; L22-V24 VanDerWaalsContact C-N 3.26Å; L22-V24 PolarHBondContact O-N 2.73Å; L22-H27 HydrophobicContact CD2-CB 3.96Å; L22-L32 HydrophobicContact CD1-CD2 3.9Å; L22-L32 HydrophobicContact CD2-CD1 4.28Å; L22-L32 HydrophobicContact CD2-CD2 4.29Å; L22-L32 HydrophobicContact CG-CD1 4.18Å; L22-L32 HydrophobicContact CG-CD2 4.31Å; L22-C63 HydrophobicContact CD1-CB 4.24Å; L22-L69 HydrophobicContact CD1-CD2 4.23Å; L22-L69 HydrophobicContact CD1-CG 4.12Å; L22-L69 HydrophobicContact CD2-CD2 3.73Å; L22-L69 HydrophobicContact CD2-CG 4.5Å
23	A	94.5	Very high	96	Very high	80 Å²	80	49.3 Å²	49.3	66%	0.661	24%	0.242	S	C	*	.	H	α-helix	trans	-66.3	-23.9	175.8	0	0	0	0	0	113.8	V19 I21	V19-A23 VanDerWaalsContact O-CB 3.23Å; V19-A23 WeakPolarHBondContact O-CB 3.48Å; V19-A23 PolarHBondContact O-N 2.69Å; I21-A23 VanDerWaalsContact C-N 3.34Å
24	V	93.5	Very high	96.1	Very high	125 Å²	125	52.7 Å²	52.7	76%	0.758	26%	0.255	S	S	*	.	H	α-helix	trans	-78.6	-43.5	-178.2	178.1	0	0	0	0	111.8	I21 L22	I21-V24 PolarHBondContact O-N 2.89Å; L22-V24 VanDerWaalsContact C-N 3.26Å; L22-V24 PolarHBondContact O-N 2.73Å
25	R	91.4	Very high	96	Very high	107 Å²	107	56.4 Å²	56.4	40%	0.404	27%	0.271	S	S	.	.	S	Bend	trans	-163.2	164.4	178.1	64.4	167.3	-178.1	83.6	-5.1	110.2	H27 E31	R25-H27 WeakPolarHBondContact CG-CE1 3.43Å; R25-H27 PolarHBondContact NH1-CD2 3.07Å; R25-H27 PolarHBondContact NH1-NE2 3.43Å; R25-H27 PolarHBondContact NH2-CD2 3.47Å; R25-H27 PolarHBondContact NH2-NE2 2.87Å; R25-H27 PolarHBondContact O-CE1 2.82Å; R25-H27 VanDerWaalsContact O-CE1 3.23Å; R25-H27 PolarHBondContact O-ND1 3.44Å; R25-E31 IonicContact CZ-OE2 3.88Å; R25-E31 IonicContact NH1-OE2 3.81Å; R25-E31 PolarHBondContact NH1-OE2 3.01Å; R25-E31 IonicContact NH2-OE1 3.11Å; R25-E31 IonicContact NH2-OE2 2.83Å; R25-E31 PolarHBondContact NH2-OE2 3.32Å; R25-E31 VanDerWaalsContact NH2-OE2 3.11Å
26	D	91.2	Very high	95.9	Very high	50 Å²	50	55 Å²	55	27%	0.267	26%	0.264	S	S	.	.			trans	-60.1	139.7	167.3	-57.6	-13.5	0	0	0	110.5	F74 R77	D26-F74 HydrophobicContact CB-CD2 3.8Å; D26-F74 HydrophobicContact CB-CE2 4.42Å; D26-R77 IonicContact OD1-NH1 3.4Å; D26-R77 WeakPolarHBondContact OD2-CD 2.81Å; D26-R77 IonicContact OD2-CZ 3.52Å; D26-R77 VanDerWaalsContact OD2-CZ 3.3Å; D26-R77 IonicContact OD2-NE 3.52Å; D26-R77 PolarHBondContact OD2-NE 3.1Å; D26-R77 IonicContact OD2-NH1 2.77Å; D26-R77 PolarHBondContact OD2-NH1 3.49Å
27	H	95.7	Very high	95.8	Very high	6 Å²	6	54.5 Å²	54.5	3%	0.028	27%	0.269	C	S	.	.			trans	-129.9	152.4	173.7	-66.5	78.8	0	0	0	108.7	I21 L22 R25 E31 K35	I21-H27 PolarHBondContact O-CE1 2.99Å; L22-H27 HydrophobicContact CD2-CB 3.96Å; R25-H27 WeakPolarHBondContact CG-CE1 3.43Å; R25-H27 PolarHBondContact NH1-CD2 3.07Å; R25-H27 PolarHBondContact NH1-NE2 3.43Å; R25-H27 PolarHBondContact NH2-CD2 3.47Å; R25-H27 PolarHBondContact NH2-NE2 2.87Å; R25-H27 PolarHBondContact O-CE1 2.82Å; R25-H27 VanDerWaalsContact O-CE1 3.23Å; R25-H27 PolarHBondContact O-ND1 3.44Å; H27-E31 HydrophobicContact CB-CB 4.14Å; H27-E31 IonicContact CD2-OE2 3.48Å; H27-E31 PolarHBondContact CD2-OE2 3.11Å; H27-E31 VanDerWaalsContact CD2-OE2 3.31Å; H27-E31 IonicContact CG-OE2 3.31Å; H27-K35 PolarHBondContact CD2-NZ 3.33Å; H27-K35 PolarHBondContact NE2-NZ 3.37Å
28	S	97	Very high	95.8	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.277	C	S	.	.			trans	-70	157.4	162.5	63.5	0	0	0	0	110.2	Q30 E31 L32 D71 K99	S28-Q30 PolarHBondContact O-N 2.91Å; S28-E31 WeakPolarHBondContact O-CB 3.23Å; S28-E31 PolarHBondContact O-N 3.44Å; S28-E31 VanDerWaalsContact O-N 3.14Å; S28-E31 WeakPolarHBondContact OG-CB 3.38Å; S28-E31 VanDerWaalsContact OG-CG 3.31Å; S28-E31 WeakPolarHBondContact OG-CG 3.34Å; S28-E31 PolarHBondContact OG-N 3.12Å; S28-L32 PolarHBondContact O-N 3.09Å; S28-D71 VanDerWaalsContact CA-OD1 3.25Å; S28-D71 WeakPolarHBondContact CA-OD1 3.49Å; S28-K99 PolarHBondContact OG-O 3.16Å
29	E	98	Very high	95.4	Very high	47 Å²	47	57.7 Å²	57.7	22%	0.22	30%	0.299	C	S	.	.	H	α-helix	trans	-52.8	-45.9	171.6	-178.4	-177.9	144.8	0	0	111	E31 L32 R33 I60 H64 L69 D71	E29-E31 VanDerWaalsContact C-N 3.35Å; E29-E31 PolarHBondContact O-N 2.97Å; E29-L32 WeakPolarHBondContact O-CB 3.45Å; E29-L32 PolarHBondContact O-N 2.97Å; E29-L32 VanDerWaalsContact O-N 3.11Å; E29-R33 HydrophobicContact CG-CG 4.34Å; E29-R33 WeakPolarHBondContact O-CG 3.49Å; E29-R33 PolarHBondContact O-N 3.18Å; E29-R33 IonicContact OE1-CZ 2.66Å; E29-R33 VanDerWaalsContact OE1-CZ 3.25Å; E29-R33 IonicContact OE1-NE 3.72Å; E29-R33 PolarHBondContact OE1-NE 3.16Å; E29-R33 IonicContact OE1-NH2 2.74Å; E29-R33 PolarHBondContact OE1-NH2 3.43Å; E29-I60 HydrophobicContact CG-CD1 4.41Å; E29-I60 HydrophobicContact CG-CG2 3.84Å; E29-H64 IonicContact OE2-CD2 3.54Å; E29-H64 IonicContact OE2-CE1 3.25Å; E29-H64 IonicContact OE2-NE2 2.69Å; E29-H64 PolarHBondContact OE2-NE2 2.77Å; E29-L69 HydrophobicContact CG-CD1 4.42Å; E29-D71 PolarHBondContact N-OD1 2.89Å
30	Q	97.7	Very high	95	Very high	72 Å²	72	59.6 Å²	59.6	34%	0.336	31%	0.306	S	S	.	.	H	α-helix	trans	-65.7	-35.7	-179.5	-174.2	62	72.2	0	0	112.7	S28 R34	S28-Q30 PolarHBondContact O-N 2.91Å; Q30-R34 WeakPolarHBondContact O-CB 3.33Å; Q30-R34 VanDerWaalsContact O-CG 3.29Å; Q30-R34 WeakPolarHBondContact O-CG 3.35Å; Q30-R34 PolarHBondContact O-N 3.37Å; Q30-R34 VanDerWaalsContact O-N 3.08Å
31	E	96.9	Very high	94.6	Very high	23 Å²	23	58.6 Å²	58.6	11%	0.107	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-44.3	171.1	-82.3	-171.4	164.6	0	0	110.8	R25 H27 S28 E29 K35 K99	R25-E31 IonicContact CZ-OE2 3.88Å; R25-E31 IonicContact NH1-OE2 3.81Å; R25-E31 PolarHBondContact NH1-OE2 3.01Å; R25-E31 IonicContact NH2-OE1 3.11Å; R25-E31 IonicContact NH2-OE2 2.83Å; R25-E31 PolarHBondContact NH2-OE2 3.32Å; R25-E31 VanDerWaalsContact NH2-OE2 3.11Å; H27-E31 HydrophobicContact CB-CB 4.14Å; H27-E31 IonicContact CD2-OE2 3.48Å; H27-E31 PolarHBondContact CD2-OE2 3.11Å; H27-E31 VanDerWaalsContact CD2-OE2 3.31Å; H27-E31 IonicContact CG-OE2 3.31Å; S28-E31 WeakPolarHBondContact O-CB 3.23Å; S28-E31 PolarHBondContact O-N 3.44Å; S28-E31 VanDerWaalsContact O-N 3.14Å; S28-E31 WeakPolarHBondContact OG-CB 3.38Å; S28-E31 VanDerWaalsContact OG-CG 3.31Å; S28-E31 WeakPolarHBondContact OG-CG 3.34Å; S28-E31 PolarHBondContact OG-N 3.12Å; E29-E31 VanDerWaalsContact C-N 3.35Å; E29-E31 PolarHBondContact O-N 2.97Å; E31-K35 WeakPolarHBondContact O-CB 3.45Å; E31-K35 VanDerWaalsContact O-CG 3.32Å; E31-K35 WeakPolarHBondContact O-CG 3.42Å; E31-K35 PolarHBondContact O-N 3.05Å; E31-K99 HydrophobicContact CG-CB 4.41Å; E31-K99 WeakPolarHBondContact OE1-CD 3.25Å; E31-K99 WeakPolarHBondContact OE1-CG 3.35Å; E31-K99 IonicContact OE1-NZ 2.99Å; E31-K99 PolarHBondContact OE1-NZ 3.43Å
32	L	98	Very high	94	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64	-48.6	178.4	-179.4	66.6	0	0	0	111.3	A18 I21 L22 S28 E29 R34 K35 L36 I60 L69	A18-L32 HydrophobicContact CB-CD1 4.29Å; A18-L32 HydrophobicContact CB-CD2 4.45Å; I21-L32 HydrophobicContact CB-CD1 4.06Å; I21-L32 HydrophobicContact CD1-CD1 4.12Å; I21-L32 HydrophobicContact CG2-CD1 3.82Å; L22-L32 HydrophobicContact CD1-CD2 3.9Å; L22-L32 HydrophobicContact CD2-CD1 4.28Å; L22-L32 HydrophobicContact CD2-CD2 4.29Å; L22-L32 HydrophobicContact CG-CD1 4.18Å; L22-L32 HydrophobicContact CG-CD2 4.31Å; S28-L32 PolarHBondContact O-N 3.09Å; E29-L32 WeakPolarHBondContact O-CB 3.45Å; E29-L32 PolarHBondContact O-N 2.97Å; E29-L32 VanDerWaalsContact O-N 3.11Å; L32-R34 VanDerWaalsContact C-N 3.33Å; L32-R34 PolarHBondContact O-N 3.14Å; L32-K35 CarbonylContact O-C 3.53Å; L32-K35 PolarHBondContact O-N 3.3Å; L32-L36 HydrophobicContact CD1-CD1 4.17Å; L32-L36 HydrophobicContact CD1-CD2 4.41Å; L32-L36 HydrophobicContact CD1-CG 3.96Å; L32-L36 HydrophobicContact CD2-CD1 4.27Å; L32-L36 HydrophobicContact CG-CD1 3.85Å; L32-L36 HydrophobicContact CG-CG 4.06Å; L32-L36 WeakPolarHBondContact O-CB 3.32Å; L32-L36 WeakPolarHBondContact O-CG 3.15Å; L32-L36 PolarHBondContact O-N 3.4Å; L32-I60 HydrophobicContact CD2-CD1 3.65Å; L32-I60 HydrophobicContact CG-CD1 4.16Å; L32-L69 HydrophobicContact CB-CD2 4.41Å; L32-L69 HydrophobicContact CD2-CD1 3.6Å; L32-L69 HydrophobicContact CD2-CD2 3.95Å; L32-L69 HydrophobicContact CD2-CG 4.04Å
33	R	97.7	Very high	93.6	Very high	53 Å²	53	66.6 Å²	66.6	20%	0.2	35%	0.352	C	S	.	.	H	α-helix	trans	-54.9	-47.9	177.2	-73.8	179.6	177.5	-84.6	4.4	111.6	E29 K35 L36 A37 E57 I60	E29-R33 HydrophobicContact CG-CG 4.34Å; E29-R33 WeakPolarHBondContact O-CG 3.49Å; E29-R33 PolarHBondContact O-N 3.18Å; E29-R33 IonicContact OE1-CZ 2.66Å; E29-R33 VanDerWaalsContact OE1-CZ 3.25Å; E29-R33 IonicContact OE1-NE 3.72Å; E29-R33 PolarHBondContact OE1-NE 3.16Å; E29-R33 IonicContact OE1-NH2 2.74Å; E29-R33 PolarHBondContact OE1-NH2 3.43Å; R33-K35 VanDerWaalsContact C-N 3.32Å; R33-K35 PolarHBondContact O-N 2.98Å; R33-L36 PolarHBondContact O-N 3.47Å; R33-A37 WeakPolarHBondContact O-CB 3.46Å; R33-A37 PolarHBondContact O-N 3.09Å; R33-E57 IonicContact CZ-OE1 2.86Å; R33-E57 IonicContact CZ-OE2 2.99Å; R33-E57 IonicContact NH1-OE1 2.91Å; R33-E57 PolarHBondContact NH1-OE1 3.16Å; R33-E57 IonicContact NH1-OE2 2.97Å; R33-E57 PolarHBondContact NH1-OE2 3.38Å; R33-E57 IonicContact NH2-OE1 3.74Å; R33-E57 IonicContact NH2-OE2 3.21Å; R33-E57 PolarHBondContact NH2-OE2 3.39Å; R33-I60 HydrophobicContact CG-CD1 3.83Å; R33-I60 HydrophobicContact CG-CG1 4.08Å
34	R	95.9	Very high	93.4	Very high	137 Å²	137	70.3 Å²	70.3	52%	0.517	36%	0.361	S	S	.	.	H	α-helix	trans	-59	-43.6	175.8	-73.5	173.8	-173.7	171.2	5.6	111.7	Q30 L32 A38 Q98	Q30-R34 WeakPolarHBondContact O-CB 3.33Å; Q30-R34 VanDerWaalsContact O-CG 3.29Å; Q30-R34 WeakPolarHBondContact O-CG 3.35Å; Q30-R34 PolarHBondContact O-N 3.37Å; Q30-R34 VanDerWaalsContact O-N 3.08Å; L32-R34 VanDerWaalsContact C-N 3.33Å; L32-R34 PolarHBondContact O-N 3.14Å; R34-A38 PolarHBondContact O-N 3.14Å; R34-Q98 PolarHBondContact NH1-O 2.94Å
35	K	95.4	Very high	93.2	Very high	82 Å²	82	65.6 Å²	65.6	36%	0.357	34%	0.337	S	S	.	.	H	α-helix	trans	-71.5	-32.8	179.4	-74.6	-178.7	171.3	-161.8	0	113.5	R17 I21 H27 E31 L32 R33	R17-K35 PolarHBondContact NE-O 3.21Å; R17-K35 PolarHBondContact NH2-O 3.36Å; I21-K35 HydrophobicContact CD1-CB 3.86Å; I21-K35 HydrophobicContact CG2-CD 3.75Å; H27-K35 PolarHBondContact CD2-NZ 3.33Å; H27-K35 PolarHBondContact NE2-NZ 3.37Å; E31-K35 WeakPolarHBondContact O-CB 3.45Å; E31-K35 VanDerWaalsContact O-CG 3.32Å; E31-K35 WeakPolarHBondContact O-CG 3.42Å; E31-K35 PolarHBondContact O-N 3.05Å; L32-K35 CarbonylContact O-C 3.53Å; L32-K35 PolarHBondContact O-N 3.3Å; R33-K35 VanDerWaalsContact C-N 3.32Å; R33-K35 PolarHBondContact O-N 2.98Å
36	L	96.2	Very high	93.1	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-70.5	-40.4	175.8	-74.2	179.6	0	0	0	110.6	L14 R17 A18 I21 L32 R33 A38 I49 Y56 V59 I60	L14-L36 HydrophobicContact CD2-CD2 4.4Å; R17-L36 HydrophobicContact CB-CD2 4.06Å; R17-L36 HydrophobicContact CG-CD2 3.92Å; R17-L36 PolarHBondContact NH1-O 3.22Å; A18-L36 HydrophobicContact CB-CD1 4.23Å; A18-L36 HydrophobicContact CB-CD2 4.05Å; I21-L36 HydrophobicContact CD1-CD2 4.12Å; L32-L36 HydrophobicContact CD1-CD1 4.17Å; L32-L36 HydrophobicContact CD1-CD2 4.41Å; L32-L36 HydrophobicContact CD1-CG 3.96Å; L32-L36 HydrophobicContact CD2-CD1 4.27Å; L32-L36 HydrophobicContact CG-CD1 3.85Å; L32-L36 HydrophobicContact CG-CG 4.06Å; L32-L36 WeakPolarHBondContact O-CB 3.32Å; L32-L36 WeakPolarHBondContact O-CG 3.15Å; L32-L36 PolarHBondContact O-N 3.4Å; R33-L36 PolarHBondContact O-N 3.47Å; L36-A38 VanDerWaalsContact C-N 3.33Å; L36-I49 WeakPolarHBondContact O-CD1 3.41Å; L36-Y56 HydrophobicContact CB-CD1 4.11Å; L36-Y56 HydrophobicContact CB-CE1 3.91Å; L36-V59 HydrophobicContact CD1-CG1 4.09Å; L36-I60 HydrophobicContact CD1-CD1 4.25Å
37	A	94.2	Very high	92.9	Very high	60 Å²	60	66.7 Å²	66.7	50%	0.496	35%	0.353	S	S	.	.	H	α-helix	trans	-76.3	-17.4	177.9	0	0	0	0	0	113.9	R33	R33-A37 WeakPolarHBondContact O-CB 3.46Å; R33-A37 PolarHBondContact O-N 3.09Å
38	A	93.7	Very high	92.3	Very high	39 Å²	39	75.2 Å²	75.2	32%	0.322	39%	0.393	S	S	.	.	S	Bend	trans	-62.7	131.5	178.4	0	0	0	0	0	111.2	R17 R34 L36	R17-A38 PolarHBondContact NH1-O 3.04Å; R17-A38 PolarHBondContact NH2-O 2.93Å; R34-A38 PolarHBondContact O-N 3.14Å; L36-A38 VanDerWaalsContact C-N 3.33Å
39	P	91.1	Very high	91.9	Very high	71 Å²	71	76.9 Å²	76.9	46%	0.461	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-50.4	146.8	178.5	-29.1	35.4	0	0	0	113	P46 E47	P39-P46 HydrophobicContact CB-CB 3.79Å; P39-E47 WeakPolarHBondContact CA-O 3.47Å
40	I	87.7	Confident	91.6	Very high	85 Å²	85	80.5 Å²	80.5	44%	0.436	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	130.9	177.4	-60.4	173.9	0	0	0	107.9	R17 G42 E47 I49	R17-I40 VanDerWaalsContact NH1-CG1 3.25Å; I40-G42 PolarHBondContact O-N 3.29Å; I40-G42 VanDerWaalsContact O-N 3.08Å; I40-E47 PolarHBondContact N-O 2.75Å; I40-E47 PolarHBondContact O-N 3.37Å; I40-I49 HydrophobicContact CD1-CG1 4.27Å; I40-I49 HydrophobicContact CG1-CG1 4.2Å
41	M	87.9	Confident	91.4	Very high	152 Å²	152	78.2 Å²	78.2	75%	0.749	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	100.7	174.8	-67.5	-63.5	-179.6	0	0	109.6	P46	M41-P46 HydrophobicContact CE-CG 4.18Å; M41-P46 HydrophobicContact SD-CB 4.35Å; M41-P46 HydrophobicContact SD-CG 3.92Å
42	G	85.1	Confident	91.3	Very high	27 Å²	27	80.8 Å²	80.8	28%	0.278	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-178.5	173.9	0	0	0	0	0	112.4	I40 N44 G45	I40-G42 PolarHBondContact O-N 3.29Å; I40-G42 VanDerWaalsContact O-N 3.08Å; G42-N44 PolarHBondContact O-N 3.01Å; G42-G45 WeakPolarHBondContact CA-O 3.45Å; G42-G45 PolarHBondContact N-O 3.41Å; G42-G45 PolarHBondContact O-N 3.06Å
43	K	87.3	Confident	91.2	Very high	183 Å²	183	84.5 Å²	84.5	80%	0.796	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-29.8	179.4	-66.4	-176.3	-179.6	-177.7	0	112.7
44	N	89.4	Confident	91.2	Very high	158 Å²	158	88.4 Å²	88.4	85%	0.845	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	14.7	-176.6	-61.6	-25.1	0	0	0	112.6	G42	G42-N44 PolarHBondContact O-N 3.01Å
45	G	89.4	Confident	91.3	Very high	25 Å²	25	82.9 Å²	82.9	26%	0.258	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	105.2	-163.3	-176.7	0	0	0	0	0	113.3	G42 E47	G42-G45 WeakPolarHBondContact CA-O 3.45Å; G42-G45 PolarHBondContact N-O 3.41Å; G42-G45 PolarHBondContact O-N 3.06Å; G45-E47 PolarHBondContact O-N 2.95Å
46	P	89	Confident	91.4	Very high	92 Å²	92	80.9 Å²	80.9	60%	0.597	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	122.1	-179.7	-18.1	30.6	0	0	0	111.3	P39 M41	P39-P46 HydrophobicContact CB-CB 3.79Å; M41-P46 HydrophobicContact CE-CG 4.18Å; M41-P46 HydrophobicContact SD-CB 4.35Å; M41-P46 HydrophobicContact SD-CG 3.92Å
47	E	87	Confident	91.6	Very high	88 Å²	88	85.5 Å²	85.5	41%	0.411	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	131	174.7	-68.7	173.2	-163.6	0	0	109.3	P39 I40 G45	P39-E47 WeakPolarHBondContact CA-O 3.47Å; I40-E47 PolarHBondContact N-O 2.75Å; I40-E47 PolarHBondContact O-N 3.37Å; G45-E47 PolarHBondContact O-N 2.95Å
48	E	84.3	Confident	91.7	Very high	186 Å²	186	88.2 Å²	88.2	87%	0.869	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-65.4	152.3	172.4	-69.2	-170.2	168.7	0	0	111
49	I	87.8	Confident	92	Very high	34 Å²	34	86.3 Å²	86.3	17%	0.174	46%	0.459	C	S	.	.			trans	-94.1	110.5	-179.4	-55.6	170	0	0	0	107.7	L14 L36 I40 A51	L14-I49 HydrophobicContact CD2-CG2 4.11Å; L36-I49 WeakPolarHBondContact O-CD1 3.41Å; I40-I49 HydrophobicContact CD1-CG1 4.27Å; I40-I49 HydrophobicContact CG1-CG1 4.2Å; I49-A51 VanDerWaalsContact C-N 3.29Å; I49-A51 HydrophobicContact CG2-CB 3.83Å; I49-A51 PolarHBondContact O-N 3.27Å
50	D	91	Very high	92.3	Very high	124 Å²	124	83.1 Å²	83.1	66%	0.663	44%	0.438	S	S	*	.			trans	-67.9	88	167.1	176.9	34.9	0	0	0	109.6	A10 R13	A10-D50 VanDerWaalsContact CB-O 3.3Å; A10-D50 WeakPolarHBondContact CB-O 3.48Å; R13-D50 PolarHBondContact NH2-O 3.43Å; R13-D50 IonicContact NH2-OD2 3.01Å
51	A	94.3	Very high	92.8	Very high	24 Å²	24	81.8 Å²	81.8	20%	0.198	44%	0.44	C	S	.	.			trans	-154.6	142.1	176.7	0	0	0	0	0	110.5	A10 L14 I49 D55 Y56	A10-A51 HydrophobicContact CB-CB 3.87Å; L14-A51 HydrophobicContact CD1-CB 3.65Å; L14-A51 HydrophobicContact CG-CB 4.28Å; I49-A51 VanDerWaalsContact C-N 3.29Å; I49-A51 HydrophobicContact CG2-CB 3.83Å; I49-A51 PolarHBondContact O-N 3.27Å; A51-D55 HydrophobicContact CB-CB 4.27Å; A51-Y56 HydrophobicContact CB-CE2 3.87Å
52	T	95.5	Very high	93.3	Very high	77 Å²	77	77.3 Å²	77.3	47%	0.472	42%	0.415	S	S	.	.			trans	-82.2	161.9	177.1	66.1	0	0	0	0	111.3	E54 D55 Y56	T52-E54 PolarHBondContact O-N 2.85Å; T52-D55 WeakPolarHBondContact CB-OD2 3.32Å; T52-D55 PolarHBondContact N-OD2 3.45Å; T52-D55 WeakPolarHBondContact O-CB 3.48Å; T52-D55 PolarHBondContact O-N 3.28Å; T52-D55 VanDerWaalsContact O-N 3.09Å; T52-D55 VanDerWaalsContact OG1-CG 3.3Å; T52-D55 PolarHBondContact OG1-N 3.02Å; T52-D55 VanDerWaalsContact OG1-N 3.14Å; T52-D55 PolarHBondContact OG1-OD2 3.38Å; T52-Y56 WeakPolarHBondContact O-CD2 3.47Å; T52-Y56 PolarHBondContact O-N 2.86Å
53	A	96.2	Very high	94	Very high	78 Å²	78	76 Å²	76	65%	0.645	40%	0.402	S	S	*	.	H	α-helix	trans	-55.2	-37.6	171.2	0	0	0	0	0	112	D55 Y56 E57	A53-D55 PolarHBondContact O-N 3.2Å; A53-Y56 PolarHBondContact O-N 3.23Å; A53-E57 PolarHBondContact O-N 3.04Å
54	E	97.7	Very high	94.5	Very high	135 Å²	135	70.8 Å²	70.8	63%	0.631	38%	0.38	S	S	*	.	H	α-helix	trans	-62.9	-38.6	176.5	-170.1	-176	164.7	0	0	112.4	T52 Y56 E57 R58	T52-E54 PolarHBondContact O-N 2.85Å; E54-Y56 VanDerWaalsContact C-N 3.3Å; E54-Y56 PolarHBondContact O-N 2.74Å; E54-E57 PolarHBondContact O-N 3.24Å; E54-R58 HydrophobicContact CG-CG 4.43Å; E54-R58 WeakPolarHBondContact O-CB 3.48Å; E54-R58 VanDerWaalsContact O-CG 3.25Å; E54-R58 WeakPolarHBondContact O-CG 3.47Å; E54-R58 PolarHBondContact O-N 3.44Å
55	D	97.7	Very high	94.9	Very high	21 Å²	21	70.7 Å²	70.7	11%	0.112	37%	0.374	C	S	.	.	H	α-helix	trans	-60.4	-40.4	174.8	-67.4	-65.6	0	0	0	111.7	A10 Y11 L14 A51 T52 A53 V59	A10-D55 HydrophobicContact CB-CB 4.45Å; Y11-D55 PolarHBondContact N-OD1 2.93Å; L14-D55 HydrophobicContact CD1-CB 3.9Å; A51-D55 HydrophobicContact CB-CB 4.27Å; T52-D55 WeakPolarHBondContact CB-OD2 3.32Å; T52-D55 PolarHBondContact N-OD2 3.45Å; T52-D55 WeakPolarHBondContact O-CB 3.48Å; T52-D55 PolarHBondContact O-N 3.28Å; T52-D55 VanDerWaalsContact O-N 3.09Å; T52-D55 VanDerWaalsContact OG1-CG 3.3Å; T52-D55 PolarHBondContact OG1-N 3.02Å; T52-D55 VanDerWaalsContact OG1-N 3.14Å; T52-D55 PolarHBondContact OG1-OD2 3.38Å; A53-D55 PolarHBondContact O-N 3.2Å; D55-V59 WeakPolarHBondContact O-CG2 3.39Å; D55-V59 PolarHBondContact O-N 2.78Å; D55-V59 VanDerWaalsContact O-N 3.16Å
56	Y	98	Very high	95.2	Very high	39 Å²	39	73.9 Å²	73.9	15%	0.153	38%	0.382	C	S	.	.	H	α-helix	trans	-65	-48.3	175.5	-70.1	-82.4	0	0	0	111.4	L14 L36 A51 T52 A53 E54 R58 V59 I60	L14-Y56 HydrophobicContact CD1-CD1 3.88Å; L14-Y56 HydrophobicContact CD1-CD2 4.32Å; L14-Y56 HydrophobicContact CD1-CE1 3.89Å; L14-Y56 HydrophobicContact CD1-CE2 4.32Å; L14-Y56 HydrophobicContact CD1-CG 4.09Å; L14-Y56 HydrophobicContact CD2-CD1 4.29Å; L14-Y56 HydrophobicContact CD2-CE1 3.7Å; L14-Y56 HydrophobicContact CG-CE1 4.49Å; L36-Y56 HydrophobicContact CB-CD1 4.11Å; L36-Y56 HydrophobicContact CB-CE1 3.91Å; A51-Y56 HydrophobicContact CB-CE2 3.87Å; T52-Y56 WeakPolarHBondContact O-CD2 3.47Å; T52-Y56 PolarHBondContact O-N 2.86Å; A53-Y56 PolarHBondContact O-N 3.23Å; E54-Y56 VanDerWaalsContact C-N 3.3Å; E54-Y56 PolarHBondContact O-N 2.74Å; Y56-R58 VanDerWaalsContact C-N 3.3Å; Y56-R58 PolarHBondContact O-N 2.87Å; Y56-V59 PolarHBondContact O-N 3.4Å; Y56-I60 WeakPolarHBondContact O-CG1 3.35Å; Y56-I60 PolarHBondContact O-N 3.01Å
57	E	98.4	Very high	95.5	Very high	98 Å²	98	71.1 Å²	71.1	46%	0.458	37%	0.371	S	S	.	.	H	α-helix	trans	-59.4	-41.9	179.3	-65.4	-45.5	132.9	0	0	112	R33 A53 E54 V59 I60 A61	R33-E57 IonicContact CZ-OE1 2.86Å; R33-E57 IonicContact CZ-OE2 2.99Å; R33-E57 IonicContact NH1-OE1 2.91Å; R33-E57 PolarHBondContact NH1-OE1 3.16Å; R33-E57 IonicContact NH1-OE2 2.97Å; R33-E57 PolarHBondContact NH1-OE2 3.38Å; R33-E57 IonicContact NH2-OE1 3.74Å; R33-E57 IonicContact NH2-OE2 3.21Å; R33-E57 PolarHBondContact NH2-OE2 3.39Å; A53-E57 PolarHBondContact O-N 3.04Å; E54-E57 PolarHBondContact O-N 3.24Å; E57-V59 PolarHBondContact O-N 3.22Å; E57-I60 PolarHBondContact O-N 3.44Å; E57-A61 VanDerWaalsContact O-CB 3.32Å; E57-A61 WeakPolarHBondContact O-CB 3.31Å; E57-A61 PolarHBondContact O-N 2.95Å
58	R	98.3	Very high	95.9	Very high	116 Å²	116	71.9 Å²	71.9	44%	0.438	37%	0.371	S	S	.	.	H	α-helix	trans	-62.2	-40.5	177	-71.9	172.2	61.9	-155.9	-0.8	112.5	Y11 E54 Y56 W62	Y11-R58 HydrophobicContact CD2-CB 3.79Å; Y11-R58 HydrophobicContact CE2-CB 3.76Å; E54-R58 HydrophobicContact CG-CG 4.43Å; E54-R58 WeakPolarHBondContact O-CB 3.48Å; E54-R58 VanDerWaalsContact O-CG 3.25Å; E54-R58 WeakPolarHBondContact O-CG 3.47Å; E54-R58 PolarHBondContact O-N 3.44Å; Y56-R58 VanDerWaalsContact C-N 3.3Å; Y56-R58 PolarHBondContact O-N 2.87Å; R58-W62 WeakPolarHBondContact O-CB 3.36Å; R58-W62 PolarHBondContact O-N 3.46Å
59	V	98.5	Very high	96.5	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-68.5	-41.6	177.8	170	0	0	0	0	111.3	Y11 L14 L15 A18 L36 D55 Y56 E57 W62 C63	Y11-V59 HydrophobicContact CD2-CG2 3.6Å; Y11-V59 HydrophobicContact CE2-CG2 3.71Å; L14-V59 HydrophobicContact CB-CG2 3.77Å; L15-V59 HydrophobicContact CB-CG2 4.22Å; L15-V59 HydrophobicContact CD1-CG1 4.48Å; A18-V59 HydrophobicContact CB-CG1 3.65Å; L36-V59 HydrophobicContact CD1-CG1 4.09Å; D55-V59 WeakPolarHBondContact O-CG2 3.39Å; D55-V59 PolarHBondContact O-N 2.78Å; D55-V59 VanDerWaalsContact O-N 3.16Å; Y56-V59 PolarHBondContact O-N 3.4Å; E57-V59 PolarHBondContact O-N 3.22Å; V59-W62 PolarHBondContact O-N 3.31Å; V59-C63 PolarHBondContact O-N 3.49Å; V59-C63 PolarHBondContact O-SG 3.41Å
60	I	98.6	Very high	96.8	Very high	4 Å²	4	64.5 Å²	64.5	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-64.5	-46.2	177	-64.1	-60.7	0	0	0	110.9	E29 L32 R33 L36 Y56 E57 W62 C63 H64 L69	E29-I60 HydrophobicContact CG-CD1 4.41Å; E29-I60 HydrophobicContact CG-CG2 3.84Å; L32-I60 HydrophobicContact CD2-CD1 3.65Å; L32-I60 HydrophobicContact CG-CD1 4.16Å; R33-I60 HydrophobicContact CG-CD1 3.83Å; R33-I60 HydrophobicContact CG-CG1 4.08Å; L36-I60 HydrophobicContact CD1-CD1 4.25Å; Y56-I60 WeakPolarHBondContact O-CG1 3.35Å; Y56-I60 PolarHBondContact O-N 3.01Å; E57-I60 PolarHBondContact O-N 3.44Å; I60-W62 VanDerWaalsContact C-N 3.34Å; I60-W62 PolarHBondContact O-N 2.83Å; I60-C63 PolarHBondContact O-N 2.82Å; I60-C63 VanDerWaalsContact O-N 3.16Å; I60-H64 PolarHBondContact O-CD2 3.31Å; I60-H64 PolarHBondContact O-N 3.04Å; I60-L69 HydrophobicContact CD1-CD1 4.11Å; I60-L69 HydrophobicContact CG2-CD1 4.22Å
61	A	98.4	Very high	97.1	Very high	57 Å²	57	60.4 Å²	60.4	47%	0.471	32%	0.315	S	S	.	.	H	α-helix	trans	-57.6	-46.7	175.5	0	0	0	0	0	111.5	E57 C63 H64 E65	E57-A61 VanDerWaalsContact O-CB 3.32Å; E57-A61 WeakPolarHBondContact O-CB 3.31Å; E57-A61 PolarHBondContact O-N 2.95Å; A61-C63 VanDerWaalsContact C-N 3.32Å; A61-C63 PolarHBondContact O-N 3.11Å; A61-H64 PolarHBondContact O-N 2.74Å; A61-E65 WeakPolarHBondContact O-CB 3.29Å; A61-E65 PolarHBondContact O-N 3.4Å
62	W	98.5	Very high	97.2	Very high	58 Å²	58	63 Å²	63	22%	0.22	33%	0.332	C	S	.	.	H	α-helix	trans	-59.1	-42.7	176.2	-173.1	94.7	0	0	0	111.9	L15 V19 R58 V59 I60 H64 E65 H66 Y68	L15-W62 HydrophobicContact CD1-CD2 3.68Å; L15-W62 HydrophobicContact CD1-CE3 3.37Å; L15-W62 HydrophobicContact CD1-CG 4.25Å; L15-W62 HydrophobicContact CD1-CH2 4.38Å; L15-W62 HydrophobicContact CD1-CZ3 3.76Å; L15-W62 HydrophobicContact CD2-CD2 4.47Å; V19-W62 HydrophobicContact CG2-CZ3 4.15Å; R58-W62 WeakPolarHBondContact O-CB 3.36Å; R58-W62 PolarHBondContact O-N 3.46Å; V59-W62 PolarHBondContact O-N 3.31Å; I60-W62 VanDerWaalsContact C-N 3.34Å; I60-W62 PolarHBondContact O-N 2.83Å; W62-H64 VanDerWaalsContact C-N 3.34Å; W62-H64 PolarHBondContact O-N 3.14Å; W62-E65 PolarHBondContact O-N 3.33Å; W62-H66 AromaticContact CD1-CE1 3.42Å; W62-H66 VanDerWaalsContact CD1-CE1 3.42Å; W62-H66 AromaticContact CD1-ND1 3.7Å; W62-H66 AromaticContact CD2-CE1 3.98Å; W62-H66 AromaticContact CD2-ND1 3.58Å; W62-H66 AromaticContact CE2-CD2 3.87Å; W62-H66 AromaticContact CE2-CE1 3.49Å; W62-H66 VanDerWaalsContact CE2-CE1 3.49Å; W62-H66 AromaticContact CE2-CG 3.74Å; W62-H66 AromaticContact CE2-ND1 3.47Å; W62-H66 AromaticContact CE2-NE2 3.7Å; W62-H66 HydrophobicContact CE3-CB 4.39Å; W62-H66 AromaticContact CG-CE1 3.96Å; W62-H66 AromaticContact CG-ND1 3.76Å; W62-H66 HydrophobicContact CH2-CB 4.2Å; W62-H66 HydrophobicContact CZ2-CB 4.39Å; W62-H66 AromaticContact CZ2-CD2 3.67Å; W62-H66 AromaticContact CZ2-CG 3.77Å; W62-H66 AromaticContact CZ2-ND1 3.99Å; W62-H66 AromaticContact CZ2-NE2 3.85Å; W62-H66 HydrophobicContact CZ3-CB 4.19Å; W62-H66 AromaticContact NE1-CE1 3.11Å; W62-H66 PolarHBondContact NE1-CE1 2.66Å; W62-H66 AromaticContact NE1-ND1 3.53Å; W62-H66 AromaticContact NE1-NE2 3.47Å; W62-H66 PolarHBondContact NE1-NE2 3.08Å; W62-H66 WeakPolarHBondContact O-CB 3.49Å; W62-H66 PolarHBondContact O-N 2.69Å; W62-H66 PolarHBondContact O-ND1 3.11Å; W62-Y68 HydrophobicContact CH2-CD2 4.16Å; W62-Y68 AromaticContact CH2-CE2 3.64Å; W62-Y68 HydrophobicContact CH2-CE2 3.64Å; W62-Y68 AromaticContact CZ3-CD2 3.66Å; W62-Y68 HydrophobicContact CZ3-CD2 3.66Å; W62-Y68 AromaticContact CZ3-CE2 3.62Å; W62-Y68 HydrophobicContact CZ3-CE2 3.62Å
63	C	98.2	Very high	97.1	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65.2	-35.9	179.6	-68.3	0	0	0	0	112.7	L22 V59 I60 A61 G67 Y68 L69	L22-C63 HydrophobicContact CD1-CB 4.24Å; V59-C63 PolarHBondContact O-N 3.49Å; V59-C63 PolarHBondContact O-SG 3.41Å; I60-C63 PolarHBondContact O-N 2.82Å; I60-C63 VanDerWaalsContact O-N 3.16Å; A61-C63 VanDerWaalsContact C-N 3.32Å; A61-C63 PolarHBondContact O-N 3.11Å; C63-G67 PolarHBondContact O-N 3.05Å; C63-Y68 WeakPolarHBondContact O-CA 3.42Å; C63-Y68 WeakPolarHBondContact O-CB 3.36Å; C63-Y68 PolarHBondContact O-N 2.98Å; C63-L69 HydrophobicContact CB-CB 4.25Å; C63-L69 HydrophobicContact CB-CD1 3.58Å; C63-L69 HydrophobicContact CB-CG 3.74Å; C63-L69 PolarHBondContact O-N 2.9Å
64	H	97.8	Very high	97.2	Very high	73 Å²	73	61 Å²	61	34%	0.338	30%	0.299	S	S	.	.	H	α-helix	trans	-69.6	-49.1	172.8	-81.5	-67.7	0	0	0	111.7	E29 I60 A61 W62 H66 G67 L69	E29-H64 IonicContact OE2-CD2 3.54Å; E29-H64 IonicContact OE2-CE1 3.25Å; E29-H64 IonicContact OE2-NE2 2.69Å; E29-H64 PolarHBondContact OE2-NE2 2.77Å; I60-H64 PolarHBondContact O-CD2 3.31Å; I60-H64 PolarHBondContact O-N 3.04Å; A61-H64 PolarHBondContact O-N 2.74Å; W62-H64 VanDerWaalsContact C-N 3.34Å; W62-H64 PolarHBondContact O-N 3.14Å; H64-H66 PolarHBondContact O-N 2.9Å; H64-G67 PolarHBondContact O-N 2.86Å; H64-L69 PolarHBondContact ND1-O 2.68Å
65	E	98	Very high	97.2	Very high	155 Å²	155	54.6 Å²	54.6	72%	0.724	27%	0.27	S	S	*	.	H	α-helix	trans	-55.4	-37.7	-180	-177	-177.7	-170.9	0	0	112.1	A61 W62	A61-E65 WeakPolarHBondContact O-CB 3.29Å; A61-E65 PolarHBondContact O-N 3.4Å; W62-E65 PolarHBondContact O-N 3.33Å
66	H	97.2	Very high	97.2	Very high	92 Å²	92	56.2 Å²	56.2	43%	0.426	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	8.6	-178.9	-62.7	71.2	0	0	0	113.2	W62 H64 Y68	W62-H66 AromaticContact CD1-CE1 3.42Å; W62-H66 VanDerWaalsContact CD1-CE1 3.42Å; W62-H66 AromaticContact CD1-ND1 3.7Å; W62-H66 AromaticContact CD2-CE1 3.98Å; W62-H66 AromaticContact CD2-ND1 3.58Å; W62-H66 AromaticContact CE2-CD2 3.87Å; W62-H66 AromaticContact CE2-CE1 3.49Å; W62-H66 VanDerWaalsContact CE2-CE1 3.49Å; W62-H66 AromaticContact CE2-CG 3.74Å; W62-H66 AromaticContact CE2-ND1 3.47Å; W62-H66 AromaticContact CE2-NE2 3.7Å; W62-H66 HydrophobicContact CE3-CB 4.39Å; W62-H66 AromaticContact CG-CE1 3.96Å; W62-H66 AromaticContact CG-ND1 3.76Å; W62-H66 HydrophobicContact CH2-CB 4.2Å; W62-H66 HydrophobicContact CZ2-CB 4.39Å; W62-H66 AromaticContact CZ2-CD2 3.67Å; W62-H66 AromaticContact CZ2-CG 3.77Å; W62-H66 AromaticContact CZ2-ND1 3.99Å; W62-H66 AromaticContact CZ2-NE2 3.85Å; W62-H66 HydrophobicContact CZ3-CB 4.19Å; W62-H66 AromaticContact NE1-CE1 3.11Å; W62-H66 PolarHBondContact NE1-CE1 2.66Å; W62-H66 AromaticContact NE1-ND1 3.53Å; W62-H66 AromaticContact NE1-NE2 3.47Å; W62-H66 PolarHBondContact NE1-NE2 3.08Å; W62-H66 WeakPolarHBondContact O-CB 3.49Å; W62-H66 PolarHBondContact O-N 2.69Å; W62-H66 PolarHBondContact O-ND1 3.11Å; H64-H66 PolarHBondContact O-N 2.9Å; H66-Y68 VanDerWaalsContact C-N 3.28Å; H66-Y68 HydrophobicContact CB-CD2 3.71Å; H66-Y68 HydrophobicContact CB-CE2 3.88Å; H66-Y68 PolarHBondContact O-N 3.32Å
67	G	95	Very high	97.1	Very high	35 Å²	35	61.3 Å²	61.3	36%	0.361	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	13.8	173.9	0	0	0	0	0	115.9	C63 H64 R73	C63-G67 PolarHBondContact O-N 3.05Å; H64-G67 PolarHBondContact O-N 2.86Å; G67-R73 PolarHBondContact O-NH2 2.67Å
68	Y	95.3	Very high	97.1	Very high	104 Å²	104	57.5 Å²	57.5	41%	0.408	29%	0.287	S	S	.	.	S	Bend	trans	-74.1	-35.3	173.9	-74.5	-91.4	0	0	0	111.9	V19 W62 C63 H66	V19-Y68 HydrophobicContact CG1-CE1 4.49Å; W62-Y68 HydrophobicContact CH2-CD2 4.16Å; W62-Y68 AromaticContact CH2-CE2 3.64Å; W62-Y68 HydrophobicContact CH2-CE2 3.64Å; W62-Y68 AromaticContact CZ3-CD2 3.66Å; W62-Y68 HydrophobicContact CZ3-CD2 3.66Å; W62-Y68 AromaticContact CZ3-CE2 3.62Å; W62-Y68 HydrophobicContact CZ3-CE2 3.62Å; C63-Y68 WeakPolarHBondContact O-CA 3.42Å; C63-Y68 WeakPolarHBondContact O-CB 3.36Å; C63-Y68 PolarHBondContact O-N 2.98Å; H66-Y68 VanDerWaalsContact C-N 3.28Å; H66-Y68 HydrophobicContact CB-CD2 3.71Å; H66-Y68 HydrophobicContact CB-CE2 3.88Å; H66-Y68 PolarHBondContact O-N 3.32Å
69	L	96.3	Very high	97.1	Very high	3 Å²	3	52 Å²	52	2%	0.016	27%	0.267	C	S	.	.			trans	-105.3	135	169.9	-74.1	173.5	0	0	0	110.1	L22 E29 L32 I60 C63 H64	L22-L69 HydrophobicContact CD1-CD2 4.23Å; L22-L69 HydrophobicContact CD1-CG 4.12Å; L22-L69 HydrophobicContact CD2-CD2 3.73Å; L22-L69 HydrophobicContact CD2-CG 4.5Å; E29-L69 HydrophobicContact CG-CD1 4.42Å; L32-L69 HydrophobicContact CB-CD2 4.41Å; L32-L69 HydrophobicContact CD2-CD1 3.6Å; L32-L69 HydrophobicContact CD2-CD2 3.95Å; L32-L69 HydrophobicContact CD2-CG 4.04Å; I60-L69 HydrophobicContact CD1-CD1 4.11Å; I60-L69 HydrophobicContact CG2-CD1 4.22Å; C63-L69 HydrophobicContact CB-CB 4.25Å; C63-L69 HydrophobicContact CB-CD1 3.58Å; C63-L69 HydrophobicContact CB-CG 3.74Å; C63-L69 PolarHBondContact O-N 2.9Å; H64-L69 PolarHBondContact ND1-O 2.68Å
70	D	95.1	Very high	97.1	Very high	61 Å²	61	53.3 Å²	53.3	33%	0.326	28%	0.277	S	S	.	.			trans	-159.8	98.3	171.2	179	-16.3	0	0	0	107.1	S72 R73 F74	D70-S72 VanDerWaalsContact C-N 3.26Å; D70-S72 PolarHBondContact O-N 3.5Å; D70-S72 WeakPolarHBondContact OD1-CA 3.31Å; D70-S72 WeakPolarHBondContact OD1-CB 3.38Å; D70-S72 PolarHBondContact OD1-N 3.39Å; D70-R73 HydrophobicContact CB-CB 3.85Å; D70-R73 PolarHBondContact O-N 3.39Å; D70-R73 PolarHBondContact OD1-N 2.75Å; D70-R73 VanDerWaalsContact OD2-CB 3.3Å; D70-R73 WeakPolarHBondContact OD2-CB 3.43Å; D70-F74 WeakPolarHBondContact O-CB 3.35Å; D70-F74 PolarHBondContact O-N 3.4Å
71	D	96.4	Very high	97.1	Very high	38 Å²	38	55.5 Å²	55.5	20%	0.203	29%	0.293	C	S	.	.	H	α-helix	trans	-65.2	-31.3	-178.5	-90.1	9.8	0	0	0	111.7	S28 E29 F74 V75 I101	S28-D71 VanDerWaalsContact CA-OD1 3.25Å; S28-D71 WeakPolarHBondContact CA-OD1 3.49Å; E29-D71 PolarHBondContact N-OD1 2.89Å; D71-F74 PolarHBondContact O-N 3.24Å; D71-V75 WeakPolarHBondContact O-CB 3.49Å; D71-V75 WeakPolarHBondContact O-CG2 3.46Å; D71-V75 PolarHBondContact O-N 3.17Å; D71-I101 HydrophobicContact CB-CD1 4.2Å; D71-I101 WeakPolarHBondContact OD2-CD1 3.25Å
72	S	95.7	Very high	97.1	Very high	79 Å²	79	55.4 Å²	55.4	55%	0.552	28%	0.28	S	S	*	.	H	α-helix	trans	-66.4	-47.6	177.4	-61.2	0	0	0	0	110.7	D70 F74 V75 A76	D70-S72 VanDerWaalsContact C-N 3.26Å; D70-S72 PolarHBondContact O-N 3.5Å; D70-S72 WeakPolarHBondContact OD1-CA 3.31Å; D70-S72 WeakPolarHBondContact OD1-CB 3.38Å; D70-S72 PolarHBondContact OD1-N 3.39Å; S72-F74 VanDerWaalsContact C-N 3.34Å; S72-F74 PolarHBondContact O-N 3.08Å; S72-V75 PolarHBondContact O-N 2.86Å; S72-A76 PolarHBondContact O-N 2.75Å
73	R	94.9	Very high	97.1	Very high	99 Å²	99	53.2 Å²	53.2	37%	0.374	27%	0.274	S	S	.	.	H	α-helix	trans	-61.4	-43.2	173.8	-179.2	176.9	70.3	-162.4	-1.4	111.4	G67 D70 R77	G67-R73 PolarHBondContact O-NH2 2.67Å; D70-R73 HydrophobicContact CB-CB 3.85Å; D70-R73 PolarHBondContact O-N 3.39Å; D70-R73 PolarHBondContact OD1-N 2.75Å; D70-R73 VanDerWaalsContact OD2-CB 3.3Å; D70-R73 WeakPolarHBondContact OD2-CB 3.43Å; R73-R77 WeakPolarHBondContact O-CB 3.3Å; R73-R77 VanDerWaalsContact O-CG 3.29Å; R73-R77 WeakPolarHBondContact O-CG 3.4Å; R73-R77 PolarHBondContact O-N 2.84Å; R73-R77 VanDerWaalsContact O-N 3.1Å
74	F	97.1	Very high	97	Very high	13 Å²	13	62.4 Å²	62.4	6%	0.057	31%	0.309	C	S	.	.	H	α-helix	trans	-58.1	-50.6	177	174.3	-99	0	0	0	111.4	D26 D70 D71 S72 R77 F78 L96 K99 I101	D26-F74 HydrophobicContact CB-CD2 3.8Å; D26-F74 HydrophobicContact CB-CE2 4.42Å; D70-F74 WeakPolarHBondContact O-CB 3.35Å; D70-F74 PolarHBondContact O-N 3.4Å; D71-F74 PolarHBondContact O-N 3.24Å; S72-F74 VanDerWaalsContact C-N 3.34Å; S72-F74 PolarHBondContact O-N 3.08Å; F74-R77 PolarHBondContact O-N 3.42Å; F74-F78 HydrophobicContact CZ-CD2 4.05Å; F74-F78 VanDerWaalsContact O-CB 3.25Å; F74-F78 WeakPolarHBondContact O-CB 3.48Å; F74-F78 PolarHBondContact O-N 3.39Å; F74-L96 HydrophobicContact CE1-CD2 4.42Å; F74-K99 HydrophobicContact CE1-CD 3.84Å; F74-K99 HydrophobicContact CZ-CD 3.54Å; F74-I101 HydrophobicContact CD1-CD1 3.98Å; F74-I101 HydrophobicContact CD1-CG1 4.32Å; F74-I101 HydrophobicContact CE1-CD1 4.34Å; F74-I101 HydrophobicContact CE1-CG1 4.29Å
75	V	98.2	Very high	97	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.006	32%	0.318	C	S	.	.	H	α-helix	trans	-62.7	-47.9	-177.9	174.5	0	0	0	0	111.2	D71 S72 R77 F78 I79 L96 I101 A109	D71-V75 WeakPolarHBondContact O-CB 3.49Å; D71-V75 WeakPolarHBondContact O-CG2 3.46Å; D71-V75 PolarHBondContact O-N 3.17Å; S72-V75 PolarHBondContact O-N 2.86Å; V75-R77 PolarHBondContact O-N 3.42Å; V75-F78 WeakPolarHBondContact O-CB 3.42Å; V75-F78 PolarHBondContact O-N 3.05Å; V75-F78 VanDerWaalsContact O-N 3.11Å; V75-I79 HydrophobicContact CG1-CD1 3.86Å; V75-I79 HydrophobicContact CG1-CG1 4.35Å; V75-I79 WeakPolarHBondContact O-CG1 3.29Å; V75-I79 PolarHBondContact O-N 2.89Å; V75-L96 HydrophobicContact CB-CD2 4.47Å; V75-L96 HydrophobicContact CG1-CD1 3.95Å; V75-L96 HydrophobicContact CG1-CD2 4.22Å; V75-L96 HydrophobicContact CG2-CD2 4.11Å; V75-I101 HydrophobicContact CG2-CB 4.23Å; V75-I101 HydrophobicContact CG2-CD1 3.81Å; V75-I101 HydrophobicContact CG2-CG1 3.79Å; V75-I101 HydrophobicContact CG2-CG2 3.45Å; V75-I101 VanDerWaalsContact CG2-CG2 3.45Å; V75-A109 HydrophobicContact CB-CB 4.33Å; V75-A109 HydrophobicContact CG1-CB 3.35Å
76	A	97.5	Very high	97.1	Very high	56 Å²	56	57.5 Å²	57.5	46%	0.463	28%	0.284	S	S	.	.	H	α-helix	trans	-58.9	-46.4	179.2	0	0	0	0	0	111.9	S72 F78 I79 A80	S72-A76 PolarHBondContact O-N 2.75Å; A76-F78 VanDerWaalsContact C-N 3.3Å; A76-F78 PolarHBondContact O-N 3.49Å; A76-I79 PolarHBondContact O-N 2.9Å; A76-A80 WeakPolarHBondContact O-CB 3.5Å; A76-A80 PolarHBondContact O-N 3.23Å; A76-A80 VanDerWaalsContact O-N 3.09Å
77	R	96.5	Very high	97.1	Very high	146 Å²	146	55.6 Å²	55.6	55%	0.551	27%	0.273	S	S	*	.	H	α-helix	trans	-64.4	-36.6	175.7	-68.6	179.9	79.5	171.3	10.9	111.9	D26 R73 F74 V75 S81	D26-R77 IonicContact OD1-NH1 3.4Å; D26-R77 WeakPolarHBondContact OD2-CD 2.81Å; D26-R77 IonicContact OD2-CZ 3.52Å; D26-R77 VanDerWaalsContact OD2-CZ 3.3Å; D26-R77 IonicContact OD2-NE 3.52Å; D26-R77 PolarHBondContact OD2-NE 3.1Å; D26-R77 IonicContact OD2-NH1 2.77Å; D26-R77 PolarHBondContact OD2-NH1 3.49Å; R73-R77 WeakPolarHBondContact O-CB 3.3Å; R73-R77 VanDerWaalsContact O-CG 3.29Å; R73-R77 WeakPolarHBondContact O-CG 3.4Å; R73-R77 PolarHBondContact O-N 2.84Å; R73-R77 VanDerWaalsContact O-N 3.1Å; F74-R77 PolarHBondContact O-N 3.42Å; V75-R77 PolarHBondContact O-N 3.42Å; R77-S81 WeakPolarHBondContact O-CB 3.43Å; R77-S81 PolarHBondContact O-N 3.09Å
78	F	98.1	Very high	97.3	Very high	18 Å²	18	53.9 Å²	53.9	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-65.8	-47.9	178.4	-168.6	-93.7	0	0	0	111.7	F74 V75 A76 A80 S81 R82 I92 E95 L96 K99	F74-F78 HydrophobicContact CZ-CD2 4.05Å; F74-F78 VanDerWaalsContact O-CB 3.25Å; F74-F78 WeakPolarHBondContact O-CB 3.48Å; F74-F78 PolarHBondContact O-N 3.39Å; V75-F78 WeakPolarHBondContact O-CB 3.42Å; V75-F78 PolarHBondContact O-N 3.05Å; V75-F78 VanDerWaalsContact O-N 3.11Å; A76-F78 VanDerWaalsContact C-N 3.3Å; A76-F78 PolarHBondContact O-N 3.49Å; F78-A80 PolarHBondContact O-N 3.39Å; F78-S81 PolarHBondContact O-N 3.5Å; F78-R82 HydrophobicContact CD1-CG 3.99Å; F78-R82 HydrophobicContact CE1-CG 3.66Å; F78-R82 HydrophobicContact CE2-CG 4.38Å; F78-R82 HydrophobicContact CZ-CG 3.88Å; F78-R82 WeakPolarHBondContact O-CB 3.19Å; F78-R82 WeakPolarHBondContact O-CG 3.35Å; F78-R82 PolarHBondContact O-N 2.92Å; F78-I92 HydrophobicContact CD1-CG2 4.38Å; F78-E95 HydrophobicContact CE1-CB 3.76Å; F78-E95 HydrophobicContact CZ-CB 3.78Å; F78-E95 VanDerWaalsContact CZ-OE2 3.25Å; F78-E95 WeakPolarHBondContact CZ-OE2 3.44Å; F78-L96 HydrophobicContact CB-CD2 4.05Å; F78-L96 HydrophobicContact CD1-CD1 4.46Å; F78-L96 HydrophobicContact CD1-CD2 3.38Å; F78-L96 HydrophobicContact CD1-CG 3.71Å; F78-L96 HydrophobicContact CE1-CD2 4.02Å; F78-L96 HydrophobicContact CE1-CG 4.02Å; F78-L96 HydrophobicContact CG-CD2 3.85Å; F78-K99 HydrophobicContact CD2-CD 4.37Å; F78-K99 HydrophobicContact CE2-CD 3.95Å; F78-K99 HydrophobicContact CZ-CD 4.2Å
79	I	98.6	Very high	97.5	Very high	1 Å²	1	49 Å²	49	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-55.8	-52.2	175.3	-67.1	169	0	0	0	109.7	V75 A76 S81 R82 S83 I92 L96 A109 M110 C113 I115 W117	V75-I79 HydrophobicContact CG1-CD1 3.86Å; V75-I79 HydrophobicContact CG1-CG1 4.35Å; V75-I79 WeakPolarHBondContact O-CG1 3.29Å; V75-I79 PolarHBondContact O-N 2.89Å; A76-I79 PolarHBondContact O-N 2.9Å; I79-S81 VanDerWaalsContact C-N 3.3Å; I79-S81 PolarHBondContact O-N 3.22Å; I79-R82 PolarHBondContact O-N 3.33Å; I79-S83 WeakPolarHBondContact O-CB 3.25Å; I79-S83 PolarHBondContact O-N 2.88Å; I79-S83 PolarHBondContact O-OG 3.11Å; I79-I92 HydrophobicContact CB-CG2 4.45Å; I79-I92 HydrophobicContact CG1-CG2 3.83Å; I79-L96 HydrophobicContact CG1-CD1 4.17Å; I79-A109 HydrophobicContact CD1-CB 3.6Å; I79-M110 HydrophobicContact CD1-CG 4.25Å; I79-M110 HydrophobicContact CD1-SD 3.82Å; I79-M110 HydrophobicContact CG1-SD 4.09Å; I79-M110 HydrophobicContact CG2-SD 4.38Å; I79-C113 HydrophobicContact CG2-CB 4.15Å; I79-I115 HydrophobicContact CG2-CD1 3.62Å; I79-W117 HydrophobicContact CG2-CH2 4.16Å; I79-W117 HydrophobicContact CG2-CZ2 4.17Å
80	A	97.9	Very high	97.6	Very high	27 Å²	27	51 Å²	51	22%	0.223	25%	0.254	C	S	.	.	H	α-helix	trans	-63.7	-33.5	-179.8	0	0	0	0	0	113.1	A76 F78 S83 R84	A76-A80 WeakPolarHBondContact O-CB 3.5Å; A76-A80 PolarHBondContact O-N 3.23Å; A76-A80 VanDerWaalsContact O-N 3.09Å; F78-A80 PolarHBondContact O-N 3.39Å; A80-S83 WeakPolarHBondContact CA-OG 3.37Å; A80-S83 PolarHBondContact O-OG 2.99Å; A80-S83 VanDerWaalsContact O-OG 3.1Å; A80-R84 VanDerWaalsContact O-CG 3.3Å; A80-R84 WeakPolarHBondContact O-CG 3.39Å; A80-R84 PolarHBondContact O-N 3.19Å; A80-R84 PolarHBondContact O-NH1 2.87Å
81	S	97.7	Very high	97.7	Very high	50 Å²	50	51 Å²	51	35%	0.35	25%	0.25	S	C	.	.	H	α-helix	trans	-70.3	-39.9	176.8	-177.8	0	0	0	0	111.7	R77 F78 I79 K85	R77-S81 WeakPolarHBondContact O-CB 3.43Å; R77-S81 PolarHBondContact O-N 3.09Å; F78-S81 PolarHBondContact O-N 3.5Å; I79-S81 VanDerWaalsContact C-N 3.3Å; I79-S81 PolarHBondContact O-N 3.22Å; S81-K85 WeakPolarHBondContact O-CG 3.25Å; S81-K85 PolarHBondContact O-N 2.87Å
82	R	98.4	Very high	97.9	Very high	55 Å²	55	49.2 Å²	49.2	21%	0.208	24%	0.24	C	C	.	.	H	α-helix	trans	-77.8	-35.7	-179.7	-66.6	-52.8	-170.2	174.9	12.3	113.2	F78 I79 K85 G86 Y87 I92 E95	F78-R82 HydrophobicContact CD1-CG 3.99Å; F78-R82 HydrophobicContact CE1-CG 3.66Å; F78-R82 HydrophobicContact CE2-CG 4.38Å; F78-R82 HydrophobicContact CZ-CG 3.88Å; F78-R82 WeakPolarHBondContact O-CB 3.19Å; F78-R82 WeakPolarHBondContact O-CG 3.35Å; F78-R82 PolarHBondContact O-N 2.92Å; I79-R82 PolarHBondContact O-N 3.33Å; R82-K85 WeakPolarHBondContact O-CB 3.48Å; R82-K85 PolarHBondContact O-N 2.76Å; R82-K85 VanDerWaalsContact O-N 3.09Å; R82-G86 PolarHBondContact O-N 3.2Å; R82-Y87 HydrophobicContact CB-CD2 4.42Å; R82-Y87 PolarHBondContact O-N 2.88Å; R82-Y87 VanDerWaalsContact O-N 3.14Å; R82-I92 HydrophobicContact CB-CD1 3.72Å; R82-I92 HydrophobicContact CB-CG1 3.58Å; R82-I92 HydrophobicContact CG-CG1 4.34Å; R82-E95 IonicContact CZ-OE2 2.9Å; R82-E95 IonicContact NE-OE2 3.5Å; R82-E95 PolarHBondContact NE-OE2 3.1Å; R82-E95 IonicContact NH1-OE2 2.68Å; R82-E95 IonicContact NH2-OE2 3.3Å; R82-E95 PolarHBondContact NH2-OE2 3.42Å
83	S	98.5	Very high	98	Very high	12 Å²	12	48.8 Å²	48.8	8%	0.084	23%	0.226	C	C	.	.	H	α-helix	trans	-61.3	-44.4	174.7	66.7	0	0	0	0	111.7	I79 A80 K85 G86	I79-S83 WeakPolarHBondContact O-CB 3.25Å; I79-S83 PolarHBondContact O-N 2.88Å; I79-S83 PolarHBondContact O-OG 3.11Å; A80-S83 WeakPolarHBondContact CA-OG 3.37Å; A80-S83 PolarHBondContact O-OG 2.99Å; A80-S83 VanDerWaalsContact O-OG 3.1Å; S83-K85 PolarHBondContact O-N 3.14Å; S83-G86 WeakPolarHBondContact O-CA 3.1Å; S83-G86 PolarHBondContact O-N 3.46Å
84	R	97.8	Very high	98.2	Very high	193 Å²	193	49.5 Å²	49.5	73%	0.728	23%	0.234	S	C	*	.	H	α-helix	trans	-61	-25.3	173.9	-71	-179.6	-169.1	99.7	-5.3	113.9	A80 G86	A80-R84 VanDerWaalsContact O-CG 3.3Å; A80-R84 WeakPolarHBondContact O-CG 3.39Å; A80-R84 PolarHBondContact O-N 3.19Å; A80-R84 PolarHBondContact O-NH1 2.87Å; R84-G86 VanDerWaalsContact C-N 3.27Å
85	K	97.9	Very high	98.2	Very high	124 Å²	124	49.9 Å²	49.9	54%	0.539	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	1.3	174.4	-69.1	178	-177.6	-178.4	0	113	S81 R82 S83 Y87	S81-K85 WeakPolarHBondContact O-CG 3.25Å; S81-K85 PolarHBondContact O-N 2.87Å; R82-K85 WeakPolarHBondContact O-CB 3.48Å; R82-K85 PolarHBondContact O-N 2.76Å; R82-K85 VanDerWaalsContact O-N 3.09Å; S83-K85 PolarHBondContact O-N 3.14Å; K85-Y87 HydrophobicContact CB-CD2 3.89Å; K85-Y87 HydrophobicContact CB-CE2 3.95Å
86	G	98.2	Very high	98.2	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.01	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	24.8	178.8	0	0	0	0	0	114.1	R82 S83 R84 R150 Y152	R82-G86 PolarHBondContact O-N 3.2Å; S83-G86 WeakPolarHBondContact O-CA 3.1Å; S83-G86 PolarHBondContact O-N 3.46Å; R84-G86 VanDerWaalsContact C-N 3.27Å; G86-R150 VanDerWaalsContact O-CD 3.25Å; G86-R150 WeakPolarHBondContact O-CD 3.34Å; G86-Y152 WeakPolarHBondContact O-CE2 3.47Å; G86-Y152 PolarHBondContact O-OH 3.38Å
87	Y	98.8	Very high	98.3	Very high	51 Å²	51	52.4 Å²	52.4	20%	0.2	24%	0.242	C	C	.	.			trans	-96	136.4	173.3	-62.7	-55.7	0	0	0	111	R82 K85 R91 I92 W117 R150	R82-Y87 HydrophobicContact CB-CD2 4.42Å; R82-Y87 PolarHBondContact O-N 2.88Å; R82-Y87 VanDerWaalsContact O-N 3.14Å; K85-Y87 HydrophobicContact CB-CD2 3.89Å; K85-Y87 HydrophobicContact CB-CE2 3.95Å; Y87-R91 VanDerWaalsContact CD1-CD 3.44Å; Y87-R91 HydrophobicContact CD1-CG 4.5Å; Y87-R91 PolarHBondContact OH-NH2 3.1Å; Y87-I92 WeakPolarHBondContact O-CD1 3.5Å; Y87-W117 WeakPolarHBondContact O-CZ3 3.4Å; Y87-R150 WeakPolarHBondContact CA-O 3.35Å
88	G	98.7	Very high	98.3	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.241	C	C	.	.			trans	-89.6	175.5	-178.9	0	0	0	0	0	114.1	A90 R91 I92 R150 G151	G88-A90 PolarHBondContact O-N 3.23Å; G88-R91 PolarHBondContact O-N 3.23Å; G88-I92 WeakPolarHBondContact O-CG1 3.3Å; G88-I92 PolarHBondContact O-N 2.92Å; G88-I92 VanDerWaalsContact O-N 3.14Å; G88-R150 PolarHBondContact N-O 3.49Å; G88-G151 CarbonylContact C-O 3.08Å; G88-G151 WeakPolarHBondContact CA-O 3.5Å
89	P	98.6	Very high	98.2	Very high	2 Å²	2	52 Å²	52	1%	0.013	25%	0.246	C	C	.	.	H	α-helix	trans	-52.2	-45.3	-172.4	-30.9	37.7	0	0	0	115.3	R91 I92 R93 M110 W117 L153	P89-R91 PolarHBondContact O-N 3.49Å; P89-I92 PolarHBondContact O-N 3.24Å; P89-R93 VanDerWaalsContact O-CG 3.3Å; P89-R93 WeakPolarHBondContact O-CG 3.42Å; P89-R93 PolarHBondContact O-N 3.3Å; P89-M110 HydrophobicContact CB-CE 3.53Å; P89-M110 HydrophobicContact CG-CE 4.07Å; P89-W117 HydrophobicContact CG-CB 4.26Å; P89-W117 HydrophobicContact CG-CD2 3.47Å; P89-W117 VanDerWaalsContact CG-CD2 3.47Å; P89-W117 HydrophobicContact CG-CE3 3.93Å; P89-W117 HydrophobicContact CG-CG 3.6Å; P89-W117 HydrophobicContact CG-CZ2 4.31Å; P89-L153 HydrophobicContact CB-CD1 4.14Å; P89-L153 HydrophobicContact CB-CD2 4.42Å; P89-L153 HydrophobicContact CB-CG 4.11Å; P89-L153 HydrophobicContact CG-CD1 4.3Å; P89-L153 HydrophobicContact CG-CG 4.21Å
90	A	98.6	Very high	98.1	Very high	45 Å²	45	53.3 Å²	53.3	37%	0.372	26%	0.26	S	S	.	.	H	α-helix	trans	-64.9	-41	-174.7	0	0	0	0	0	111.9	G88 Q94 G151 L153	G88-A90 PolarHBondContact O-N 3.23Å; A90-Q94 PolarHBondContact O-N 3.03Å; A90-Q94 VanDerWaalsContact O-N 3.1Å; A90-G151 WeakPolarHBondContact CB-O 3.36Å; A90-G151 PolarHBondContact N-O 3.3Å; A90-L153 HydrophobicContact CB-CD2 3.98Å
91	R	98.7	Very high	98.1	Very high	61 Å²	61	52.2 Å²	52.2	23%	0.23	25%	0.25	C	C	.	.	H	α-helix	trans	-70.4	-40.7	177.8	-179.9	166	177.2	158.9	0.8	111.5	Y87 G88 P89 R93 Q94 E95	Y87-R91 VanDerWaalsContact CD1-CD 3.44Å; Y87-R91 HydrophobicContact CD1-CG 4.5Å; Y87-R91 PolarHBondContact OH-NH2 3.1Å; G88-R91 PolarHBondContact O-N 3.23Å; P89-R91 PolarHBondContact O-N 3.49Å; R91-R93 PolarHBondContact O-N 3.42Å; R91-Q94 WeakPolarHBondContact O-CB 3.39Å; R91-Q94 PolarHBondContact O-N 2.89Å; R91-E95 HydrophobicContact CG-CG 4.42Å; R91-E95 IonicContact NE-OE1 3.21Å; R91-E95 PolarHBondContact NE-OE1 3.09Å; R91-E95 WeakPolarHBondContact O-CG 3.49Å; R91-E95 PolarHBondContact O-N 3.36Å
92	I	98.8	Very high	98.1	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61	-46.5	177.4	-66.3	173.4	0	0	0	110.6	F78 I79 R82 Y87 G88 P89 Q94 E95 L96 M110 W117	F78-I92 HydrophobicContact CD1-CG2 4.38Å; I79-I92 HydrophobicContact CB-CG2 4.45Å; I79-I92 HydrophobicContact CG1-CG2 3.83Å; R82-I92 HydrophobicContact CB-CD1 3.72Å; R82-I92 HydrophobicContact CB-CG1 3.58Å; R82-I92 HydrophobicContact CG-CG1 4.34Å; Y87-I92 WeakPolarHBondContact O-CD1 3.5Å; G88-I92 WeakPolarHBondContact O-CG1 3.3Å; G88-I92 PolarHBondContact O-N 2.92Å; G88-I92 VanDerWaalsContact O-N 3.14Å; P89-I92 PolarHBondContact O-N 3.24Å; I92-Q94 VanDerWaalsContact C-N 3.33Å; I92-Q94 PolarHBondContact O-N 3.5Å; I92-E95 PolarHBondContact O-N 2.95Å; I92-L96 HydrophobicContact CG2-CD1 3.89Å; I92-L96 HydrophobicContact CG2-CG 4.37Å; I92-L96 WeakPolarHBondContact O-CB 3.44Å; I92-L96 WeakPolarHBondContact O-CG 3.23Å; I92-L96 PolarHBondContact O-N 3.46Å; I92-M110 HydrophobicContact CG2-SD 4.37Å; I92-W117 HydrophobicContact CD1-CH2 3.47Å; I92-W117 VanDerWaalsContact CD1-CH2 3.47Å; I92-W117 HydrophobicContact CD1-CZ3 3.84Å
93	R	98.7	Very high	98	Very high	69 Å²	69	60.1 Å²	60.1	26%	0.26	28%	0.282	S	S	.	.	H	α-helix	trans	-56.6	-45.5	174.1	-72.4	179.3	175.7	104.3	-1.4	112.3	P89 R91 E95 L96 N97 T106 E107 M110	P89-R93 VanDerWaalsContact O-CG 3.3Å; P89-R93 WeakPolarHBondContact O-CG 3.42Å; P89-R93 PolarHBondContact O-N 3.3Å; R91-R93 PolarHBondContact O-N 3.42Å; R93-E95 PolarHBondContact O-N 3.4Å; R93-L96 PolarHBondContact O-N 3.46Å; R93-N97 WeakPolarHBondContact O-CB 3.39Å; R93-N97 PolarHBondContact O-N 3.43Å; R93-T106 HydrophobicContact CB-CG2 4.28Å; R93-T106 HydrophobicContact CG-CG2 3.77Å; R93-E107 VanDerWaalsContact CD-OE1 3.29Å; R93-E107 WeakPolarHBondContact CD-OE1 3.23Å; R93-E107 IonicContact CZ-OE1 3.23Å; R93-E107 IonicContact CZ-OE2 3.8Å; R93-E107 IonicContact NE-OE1 2.79Å; R93-E107 PolarHBondContact NE-OE1 3.14Å; R93-E107 IonicContact NE-OE2 3.96Å; R93-E107 PolarHBondContact NE-OE2 3.26Å; R93-E107 IonicContact NH2-OE1 2.76Å; R93-E107 IonicContact NH2-OE2 3.49Å; R93-E107 PolarHBondContact NH2-OE2 3.1Å; R93-M110 HydrophobicContact CG-CG 4.37Å
94	Q	98.4	Very high	97.9	Very high	115 Å²	115	67.2 Å²	67.2	54%	0.537	31%	0.314	S	S	.	.	H	α-helix	trans	-61.2	-45.1	177.5	-174.2	-174.3	13.2	0	0	111.8	A90 R91 I92 N97 Q98	A90-Q94 PolarHBondContact O-N 3.03Å; A90-Q94 VanDerWaalsContact O-N 3.1Å; R91-Q94 WeakPolarHBondContact O-CB 3.39Å; R91-Q94 PolarHBondContact O-N 2.89Å; I92-Q94 VanDerWaalsContact C-N 3.33Å; I92-Q94 PolarHBondContact O-N 3.5Å; Q94-N97 PolarHBondContact O-N 2.83Å; Q94-Q98 WeakPolarHBondContact O-CG 3.49Å; Q94-Q98 PolarHBondContact O-N 2.99Å
95	E	98.3	Very high	97.9	Very high	20 Å²	20	59.5 Å²	59.5	9%	0.093	29%	0.292	C	S	.	.	H	α-helix	trans	-66.4	-39.9	179.2	-70.8	-173.5	-161.8	0	0	111.8	F78 R82 R91 I92 R93 Q98 K99	F78-E95 HydrophobicContact CE1-CB 3.76Å; F78-E95 HydrophobicContact CZ-CB 3.78Å; F78-E95 VanDerWaalsContact CZ-OE2 3.25Å; F78-E95 WeakPolarHBondContact CZ-OE2 3.44Å; R82-E95 IonicContact CZ-OE2 2.9Å; R82-E95 IonicContact NE-OE2 3.5Å; R82-E95 PolarHBondContact NE-OE2 3.1Å; R82-E95 IonicContact NH1-OE2 2.68Å; R82-E95 IonicContact NH2-OE2 3.3Å; R82-E95 PolarHBondContact NH2-OE2 3.42Å; R91-E95 HydrophobicContact CG-CG 4.42Å; R91-E95 IonicContact NE-OE1 3.21Å; R91-E95 PolarHBondContact NE-OE1 3.09Å; R91-E95 WeakPolarHBondContact O-CG 3.49Å; R91-E95 PolarHBondContact O-N 3.36Å; I92-E95 PolarHBondContact O-N 2.95Å; R93-E95 PolarHBondContact O-N 3.4Å; E95-Q98 PolarHBondContact O-N 2.97Å; E95-K99 VanDerWaalsContact O-CG 3.31Å; E95-K99 WeakPolarHBondContact O-CG 3.46Å; E95-K99 PolarHBondContact O-N 3.29Å
96	L	98.5	Very high	97.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.1	-42.3	174	-74.3	171.3	0	0	0	111.9	F74 V75 F78 I79 I92 R93 Q98 K99 G100 I101 T106	F74-L96 HydrophobicContact CE1-CD2 4.42Å; V75-L96 HydrophobicContact CB-CD2 4.47Å; V75-L96 HydrophobicContact CG1-CD1 3.95Å; V75-L96 HydrophobicContact CG1-CD2 4.22Å; V75-L96 HydrophobicContact CG2-CD2 4.11Å; F78-L96 HydrophobicContact CB-CD2 4.05Å; F78-L96 HydrophobicContact CD1-CD1 4.46Å; F78-L96 HydrophobicContact CD1-CD2 3.38Å; F78-L96 HydrophobicContact CD1-CG 3.71Å; F78-L96 HydrophobicContact CE1-CD2 4.02Å; F78-L96 HydrophobicContact CE1-CG 4.02Å; F78-L96 HydrophobicContact CG-CD2 3.85Å; I79-L96 HydrophobicContact CG1-CD1 4.17Å; I92-L96 HydrophobicContact CG2-CD1 3.89Å; I92-L96 HydrophobicContact CG2-CG 4.37Å; I92-L96 WeakPolarHBondContact O-CB 3.44Å; I92-L96 WeakPolarHBondContact O-CG 3.23Å; I92-L96 PolarHBondContact O-N 3.46Å; R93-L96 PolarHBondContact O-N 3.46Å; L96-Q98 PolarHBondContact O-N 2.86Å; L96-K99 CarbonylContact O-C 3.46Å; L96-K99 WeakPolarHBondContact O-CA 3.35Å; L96-K99 WeakPolarHBondContact O-CB 3.41Å; L96-K99 PolarHBondContact O-N 2.87Å; L96-K99 VanDerWaalsContact O-N 3.08Å; L96-G100 PolarHBondContact O-N 3.17Å; L96-I101 HydrophobicContact CB-CB 4.25Å; L96-I101 HydrophobicContact CD2-CG1 4.12Å; L96-I101 PolarHBondContact O-N 2.9Å; L96-I101 VanDerWaalsContact O-N 3.1Å; L96-T106 HydrophobicContact CB-CG2 4.48Å; L96-T106 HydrophobicContact CD1-CG2 3.78Å
97	N	98	Very high	97.9	Very high	111 Å²	111	56.4 Å²	56.4	59%	0.594	28%	0.279	S	S	*	.	H	α-helix	trans	-61.7	-41.3	174.8	-179	62.1	0	0	0	112.3	R93 Q94 K99 G100	R93-N97 WeakPolarHBondContact O-CB 3.39Å; R93-N97 PolarHBondContact O-N 3.43Å; Q94-N97 PolarHBondContact O-N 2.83Å; N97-K99 PolarHBondContact O-N 3.04Å; N97-G100 WeakPolarHBondContact O-CA 3.41Å; N97-G100 PolarHBondContact O-N 3.41Å
98	Q	96.7	Very high	97.9	Very high	116 Å²	116	58.9 Å²	58.9	54%	0.542	29%	0.291	S	S	.	.	H	α-helix	trans	-61.5	-29.7	175	-72.2	171.6	-1.5	0	0	112.5	R34 Q94 E95 L96 G100	R34-Q98 PolarHBondContact NH1-O 2.94Å; Q94-Q98 WeakPolarHBondContact O-CG 3.49Å; Q94-Q98 PolarHBondContact O-N 2.99Å; E95-Q98 PolarHBondContact O-N 2.97Å; L96-Q98 PolarHBondContact O-N 2.86Å; Q98-G100 PolarHBondContact O-N 2.89Å
99	K	96.7	Very high	97.9	Very high	39 Å²	39	59.5 Å²	59.5	17%	0.17	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	1.9	173.7	-63.7	-173	178.1	-53.7	0	113.9	S28 E31 F74 F78 E95 L96 N97 I101	S28-K99 PolarHBondContact OG-O 3.16Å; E31-K99 HydrophobicContact CG-CB 4.41Å; E31-K99 WeakPolarHBondContact OE1-CD 3.25Å; E31-K99 WeakPolarHBondContact OE1-CG 3.35Å; E31-K99 IonicContact OE1-NZ 2.99Å; E31-K99 PolarHBondContact OE1-NZ 3.43Å; F74-K99 HydrophobicContact CE1-CD 3.84Å; F74-K99 HydrophobicContact CZ-CD 3.54Å; F78-K99 HydrophobicContact CD2-CD 4.37Å; F78-K99 HydrophobicContact CE2-CD 3.95Å; F78-K99 HydrophobicContact CZ-CD 4.2Å; E95-K99 VanDerWaalsContact O-CG 3.31Å; E95-K99 WeakPolarHBondContact O-CG 3.46Å; E95-K99 PolarHBondContact O-N 3.29Å; L96-K99 CarbonylContact O-C 3.46Å; L96-K99 WeakPolarHBondContact O-CA 3.35Å; L96-K99 WeakPolarHBondContact O-CB 3.41Å; L96-K99 PolarHBondContact O-N 2.87Å; L96-K99 VanDerWaalsContact O-N 3.08Å; N97-K99 PolarHBondContact O-N 3.04Å; K99-I101 VanDerWaalsContact C-N 3.32Å
100	G	97	Very high	97.8	Very high	29 Å²	29	60.1 Å²	60.1	30%	0.299	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	16.2	176.6	0	0	0	0	0	114.7	L96 N97 Q98	L96-G100 PolarHBondContact O-N 3.17Å; N97-G100 WeakPolarHBondContact O-CA 3.41Å; N97-G100 PolarHBondContact O-N 3.41Å; Q98-G100 PolarHBondContact O-N 2.89Å
101	I	97.9	Very high	97.7	Very high	4 Å²	4	67.4 Å²	67.4	2%	0.021	32%	0.317	C	S	.	.			trans	-71.9	134	171.6	-59.7	-59.2	0	0	0	108.4	D71 F74 V75 L96 K99 A105 T106	D71-I101 HydrophobicContact CB-CD1 4.2Å; D71-I101 WeakPolarHBondContact OD2-CD1 3.25Å; F74-I101 HydrophobicContact CD1-CD1 3.98Å; F74-I101 HydrophobicContact CD1-CG1 4.32Å; F74-I101 HydrophobicContact CE1-CD1 4.34Å; F74-I101 HydrophobicContact CE1-CG1 4.29Å; V75-I101 HydrophobicContact CG2-CB 4.23Å; V75-I101 HydrophobicContact CG2-CD1 3.81Å; V75-I101 HydrophobicContact CG2-CG1 3.79Å; V75-I101 HydrophobicContact CG2-CG2 3.45Å; V75-I101 VanDerWaalsContact CG2-CG2 3.45Å; L96-I101 HydrophobicContact CB-CB 4.25Å; L96-I101 HydrophobicContact CD2-CG1 4.12Å; L96-I101 PolarHBondContact O-N 2.9Å; L96-I101 VanDerWaalsContact O-N 3.1Å; K99-I101 VanDerWaalsContact C-N 3.32Å; I101-A105 HydrophobicContact CG2-CB 3.94Å; I101-T106 WeakPolarHBondContact CG2-OG1 3.42Å
102	S	96.2	Very high	97.7	Very high	65 Å²	65	70.9 Å²	70.9	46%	0.455	34%	0.336	S	S	.	.			trans	-62.8	152.1	178.7	76	0	0	0	0	111.3	E104 A105 T106	S102-E104 PolarHBondContact O-N 3.44Å; S102-A105 PolarHBondContact O-N 3.38Å; S102-A105 WeakPolarHBondContact OG-CB 3.42Å; S102-A105 PolarHBondContact OG-N 2.99Å; S102-A105 VanDerWaalsContact OG-N 3.09Å; S102-T106 WeakPolarHBondContact O-CB 3.4Å; S102-T106 PolarHBondContact O-N 3.38Å; S102-T106 PolarHBondContact O-OG1 2.9Å
103	R	97	Very high	97.6	Very high	205 Å²	205	72.3 Å²	72.3	77%	0.774	35%	0.346	S	S	*	.	H	α-helix	trans	-57.5	-39.8	173.8	-176.8	178.5	178.6	-171.5	-1.4	111.2	T106 E107	R103-T106 PolarHBondContact O-N 3.09Å; R103-E107 HydrophobicContact CG-CG 4.23Å; R103-E107 WeakPolarHBondContact O-CG 3.25Å; R103-E107 PolarHBondContact O-N 2.9Å
104	E	97.5	Very high	97.5	Very high	161 Å²	161	77.1 Å²	77.1	75%	0.752	38%	0.376	S	S	*	.	H	α-helix	trans	-62.4	-50.7	179.5	-175.5	-179.1	176.4	0	0	112.2	S102 T106 E107 K108	S102-E104 PolarHBondContact O-N 3.44Å; E104-T106 VanDerWaalsContact C-N 3.27Å; E104-T106 PolarHBondContact O-N 3.33Å; E104-E107 PolarHBondContact O-N 3.06Å; E104-K108 WeakPolarHBondContact O-CB 3.4Å; E104-K108 PolarHBondContact O-N 2.97Å
105	A	96.8	Very high	97.5	Very high	32 Å²	32	73.5 Å²	73.5	26%	0.264	36%	0.36	S	S	.	.	H	α-helix	trans	-61.7	-39.2	177.6	0	0	0	0	0	111.4	I101 S102 A109	I101-A105 HydrophobicContact CG2-CB 3.94Å; S102-A105 PolarHBondContact O-N 3.38Å; S102-A105 WeakPolarHBondContact OG-CB 3.42Å; S102-A105 PolarHBondContact OG-N 2.99Å; S102-A105 VanDerWaalsContact OG-N 3.09Å; A105-A109 WeakPolarHBondContact O-CB 3.4Å; A105-A109 PolarHBondContact O-N 3.38Å
106	T	98.5	Very high	97.4	Very high	5 Å²	5	77.3 Å²	77.3	3%	0.031	38%	0.381	C	S	.	.	H	α-helix	trans	-61.6	-53	175.2	-60.1	0	0	0	0	111.6	R93 L96 I101 S102 R103 E104 K108 A109 M110	R93-T106 HydrophobicContact CB-CG2 4.28Å; R93-T106 HydrophobicContact CG-CG2 3.77Å; L96-T106 HydrophobicContact CB-CG2 4.48Å; L96-T106 HydrophobicContact CD1-CG2 3.78Å; I101-T106 WeakPolarHBondContact CG2-OG1 3.42Å; S102-T106 WeakPolarHBondContact O-CB 3.4Å; S102-T106 PolarHBondContact O-N 3.38Å; S102-T106 PolarHBondContact O-OG1 2.9Å; R103-T106 PolarHBondContact O-N 3.09Å; E104-T106 VanDerWaalsContact C-N 3.27Å; E104-T106 PolarHBondContact O-N 3.33Å; T106-K108 VanDerWaalsContact C-N 3.32Å; T106-K108 PolarHBondContact O-N 2.86Å; T106-A109 PolarHBondContact O-N 3.34Å; T106-M110 HydrophobicContact CG2-CG 4.21Å; T106-M110 WeakPolarHBondContact O-CB 3.39Å; T106-M110 VanDerWaalsContact O-CG 3.23Å; T106-M110 WeakPolarHBondContact O-CG 3.46Å; T106-M110 PolarHBondContact O-N 3.44Å
107	E	98	Very high	97.4	Very high	54 Å²	54	78.6 Å²	78.6	25%	0.252	39%	0.386	S	S	.	.	H	α-helix	trans	-70	-28.5	-178.2	-65.5	-46.9	135.8	0	0	112.9	R93 R103 E104 R111	R93-E107 VanDerWaalsContact CD-OE1 3.29Å; R93-E107 WeakPolarHBondContact CD-OE1 3.23Å; R93-E107 IonicContact CZ-OE1 3.23Å; R93-E107 IonicContact CZ-OE2 3.8Å; R93-E107 IonicContact NE-OE1 2.79Å; R93-E107 PolarHBondContact NE-OE1 3.14Å; R93-E107 IonicContact NE-OE2 3.96Å; R93-E107 PolarHBondContact NE-OE2 3.26Å; R93-E107 IonicContact NH2-OE1 2.76Å; R93-E107 IonicContact NH2-OE2 3.49Å; R93-E107 PolarHBondContact NH2-OE2 3.1Å; R103-E107 HydrophobicContact CG-CG 4.23Å; R103-E107 WeakPolarHBondContact O-CG 3.25Å; R103-E107 PolarHBondContact O-N 2.9Å; E104-E107 PolarHBondContact O-N 3.06Å; E107-R111 VanDerWaalsContact O-CG 3.31Å; E107-R111 WeakPolarHBondContact O-CG 3.36Å; E107-R111 PolarHBondContact O-N 3.3Å; E107-R111 PolarHBondContact O-NE 3.26Å; E107-R111 VanDerWaalsContact O-NE 3.16Å
108	K	98	Very high	97.3	Very high	103 Å²	103	74.7 Å²	74.7	45%	0.448	37%	0.367	S	S	.	.	H	α-helix	trans	-60.6	-55.8	168.7	-179.1	-178.7	173.7	-174.9	0	110.1	E104 T106 M110 R111 E112	E104-K108 WeakPolarHBondContact O-CB 3.4Å; E104-K108 PolarHBondContact O-N 2.97Å; T106-K108 VanDerWaalsContact C-N 3.32Å; T106-K108 PolarHBondContact O-N 2.86Å; K108-M110 VanDerWaalsContact C-N 3.33Å; K108-M110 PolarHBondContact O-N 3.17Å; K108-R111 PolarHBondContact O-N 3.43Å; K108-R111 VanDerWaalsContact O-N 3.1Å; K108-E112 WeakPolarHBondContact CE-OE1 3.35Å; K108-E112 WeakPolarHBondContact CG-OE1 3.33Å; K108-E112 WeakPolarHBondContact O-CG 3.39Å; K108-E112 PolarHBondContact O-N 3.39Å
109	A	98.2	Very high	97.3	Very high	13 Å²	13	71.4 Å²	71.4	11%	0.107	36%	0.36	C	S	.	.	H	α-helix	trans	-66	-32.8	-177.9	0	0	0	0	0	113.4	V75 I79 A105 T106 R111 E112 C113	V75-A109 HydrophobicContact CB-CB 4.33Å; V75-A109 HydrophobicContact CG1-CB 3.35Å; I79-A109 HydrophobicContact CD1-CB 3.6Å; A105-A109 WeakPolarHBondContact O-CB 3.4Å; A105-A109 PolarHBondContact O-N 3.38Å; T106-A109 PolarHBondContact O-N 3.34Å; A109-R111 VanDerWaalsContact C-N 3.3Å; A109-R111 PolarHBondContact O-N 2.98Å; A109-E112 PolarHBondContact O-N 3.35Å; A109-C113 WeakPolarHBondContact O-CB 3.42Å; A109-C113 PolarHBondContact O-N 2.91Å
110	M	97.9	Very high	97.4	Very high	15 Å²	15	71.9 Å²	71.9	7%	0.074	36%	0.364	C	S	.	.	H	α-helix	trans	-68.1	-27.7	174.1	-72.9	-63.7	-57.1	0	0	113	I79 P89 I92 R93 T106 K108 C113 W117	I79-M110 HydrophobicContact CD1-CG 4.25Å; I79-M110 HydrophobicContact CD1-SD 3.82Å; I79-M110 HydrophobicContact CG1-SD 4.09Å; I79-M110 HydrophobicContact CG2-SD 4.38Å; P89-M110 HydrophobicContact CB-CE 3.53Å; P89-M110 HydrophobicContact CG-CE 4.07Å; I92-M110 HydrophobicContact CG2-SD 4.37Å; R93-M110 HydrophobicContact CG-CG 4.37Å; T106-M110 HydrophobicContact CG2-CG 4.21Å; T106-M110 WeakPolarHBondContact O-CB 3.39Å; T106-M110 VanDerWaalsContact O-CG 3.23Å; T106-M110 WeakPolarHBondContact O-CG 3.46Å; T106-M110 PolarHBondContact O-N 3.44Å; K108-M110 VanDerWaalsContact C-N 3.33Å; K108-M110 PolarHBondContact O-N 3.17Å; M110-C113 PolarHBondContact O-SG 3.09Å; M110-W117 HydrophobicContact CE-CZ2 3.81Å; M110-W117 HydrophobicContact SD-CZ2 4.47Å
111	R	96.7	Very high	97.4	Very high	198 Å²	198	70.5 Å²	70.5	75%	0.747	35%	0.35	S	S	*	.	H	α-helix	trans	-81.1	-33.8	172.9	-74.8	-178.5	-68	179.4	2.6	112.4	E107 K108 A109	E107-R111 VanDerWaalsContact O-CG 3.31Å; E107-R111 WeakPolarHBondContact O-CG 3.36Å; E107-R111 PolarHBondContact O-N 3.3Å; E107-R111 PolarHBondContact O-NE 3.26Å; E107-R111 VanDerWaalsContact O-NE 3.16Å; K108-R111 PolarHBondContact O-N 3.43Å; K108-R111 VanDerWaalsContact O-N 3.1Å; A109-R111 VanDerWaalsContact C-N 3.3Å; A109-R111 PolarHBondContact O-N 2.98Å
112	E	97.4	Very high	97.4	Very high	134 Å²	134	72.6 Å²	72.6	63%	0.626	36%	0.358	S	S	*	.	H	α-helix	trans	-81.7	-17.4	-179.1	-70	172.2	174.3	0	0	113	K108 A109 D114	K108-E112 WeakPolarHBondContact CE-OE1 3.35Å; K108-E112 WeakPolarHBondContact CG-OE1 3.33Å; K108-E112 WeakPolarHBondContact O-CG 3.39Å; K108-E112 PolarHBondContact O-N 3.39Å; A109-E112 PolarHBondContact O-N 3.35Å; E112-D114 PolarHBondContact O-N 3.4Å
113	C	97.4	Very high	97.4	Very high	31 Å²	31	71.7 Å²	71.7	21%	0.209	35%	0.348	C	S	.	.			trans	-73.6	123.4	178.2	71.5	0	0	0	0	111.2	I79 A109 M110 I115	I79-C113 HydrophobicContact CG2-CB 4.15Å; A109-C113 WeakPolarHBondContact O-CB 3.42Å; A109-C113 PolarHBondContact O-N 2.91Å; M110-C113 PolarHBondContact O-SG 3.09Å; C113-I115 VanDerWaalsContact C-N 3.26Å; C113-I115 HydrophobicContact CB-CD1 4.02Å; C113-I115 HydrophobicContact CB-CG1 4.16Å; C113-I115 PolarHBondContact O-N 3.01Å
114	D	95.8	Very high	97.5	Very high	170 Å²	170	62.8 Å²	62.8	91%	0.909	32%	0.315	S	S	*	.			trans	-82.2	72	173.3	-171.5	27.7	0	0	0	110.1	E112	E112-D114 PolarHBondContact O-N 3.4Å
115	I	98.1	Very high	97.5	Very high	39 Å²	39	55.1 Å²	55.1	20%	0.2	28%	0.279	C	S	.	.			trans	-125.2	119.2	-178.5	-61.3	174.4	0	0	0	109.3	I79 C113 W117 L120	I79-I115 HydrophobicContact CG2-CD1 3.62Å; C113-I115 VanDerWaalsContact C-N 3.26Å; C113-I115 HydrophobicContact CB-CD1 4.02Å; C113-I115 HydrophobicContact CB-CG1 4.16Å; C113-I115 PolarHBondContact O-N 3.01Å; I115-W117 HydrophobicContact CB-CD2 4.39Å; I115-W117 HydrophobicContact CB-CH2 4.44Å; I115-W117 HydrophobicContact CB-CZ2 3.95Å; I115-W117 HydrophobicContact CD1-CH2 3.82Å; I115-W117 HydrophobicContact CD1-CZ2 3.79Å; I115-W117 HydrophobicContact CG1-CZ2 4.46Å; I115-W117 HydrophobicContact CG2-CD2 3.67Å; I115-W117 HydrophobicContact CG2-CE3 3.78Å; I115-W117 HydrophobicContact CG2-CG 4.31Å; I115-W117 HydrophobicContact CG2-CH2 3.92Å; I115-W117 HydrophobicContact CG2-CZ2 3.81Å; I115-W117 HydrophobicContact CG2-CZ3 3.91Å; I115-W117 PolarHBondContact O-N 3.4Å; I115-W117 VanDerWaalsContact O-N 3.17Å; I115-L120 HydrophobicContact CG2-CD1 3.53Å; I115-L120 HydrophobicContact CG2-CG 4.42Å
116	D	97.2	Very high	97.5	Very high	100 Å²	100	55.2 Å²	55.2	54%	0.535	28%	0.276	S	S	.	.			trans	-77.9	96.1	167.8	-173.6	-17.6	0	0	0	110.2	C118 A119 L120	D116-C118 VanDerWaalsContact C-N 3.32Å; D116-C118 PolarHBondContact O-N 3.21Å; D116-C118 WeakPolarHBondContact OD1-CB 3.39Å; D116-C118 PolarHBondContact OD1-N 2.96Å; D116-A119 HydrophobicContact CB-CB 3.89Å; D116-A119 PolarHBondContact O-N 3Å; D116-A119 PolarHBondContact OD1-N 3.5Å; D116-A119 WeakPolarHBondContact OD2-CB 3.3Å; D116-L120 WeakPolarHBondContact O-CG 3.4Å; D116-L120 PolarHBondContact O-N 3.36Å; D116-L120 VanDerWaalsContact O-N 3.09Å
117	W	97.7	Very high	97.5	Very high	26 Å²	26	63.2 Å²	63.2	10%	0.098	31%	0.306	C	S	.	.	H	α-helix	trans	-68.2	-30.3	180	-61.9	109	0	0	0	113	I79 Y87 P89 I92 M110 I115 L120 A121 Y152	I79-W117 HydrophobicContact CG2-CH2 4.16Å; I79-W117 HydrophobicContact CG2-CZ2 4.17Å; Y87-W117 WeakPolarHBondContact O-CZ3 3.4Å; P89-W117 HydrophobicContact CG-CB 4.26Å; P89-W117 HydrophobicContact CG-CD2 3.47Å; P89-W117 VanDerWaalsContact CG-CD2 3.47Å; P89-W117 HydrophobicContact CG-CE3 3.93Å; P89-W117 HydrophobicContact CG-CG 3.6Å; P89-W117 HydrophobicContact CG-CZ2 4.31Å; I92-W117 HydrophobicContact CD1-CH2 3.47Å; I92-W117 VanDerWaalsContact CD1-CH2 3.47Å; I92-W117 HydrophobicContact CD1-CZ3 3.84Å; M110-W117 HydrophobicContact CE-CZ2 3.81Å; M110-W117 HydrophobicContact SD-CZ2 4.47Å; I115-W117 HydrophobicContact CB-CD2 4.39Å; I115-W117 HydrophobicContact CB-CH2 4.44Å; I115-W117 HydrophobicContact CB-CZ2 3.95Å; I115-W117 HydrophobicContact CD1-CH2 3.82Å; I115-W117 HydrophobicContact CD1-CZ2 3.79Å; I115-W117 HydrophobicContact CG1-CZ2 4.46Å; I115-W117 HydrophobicContact CG2-CD2 3.67Å; I115-W117 HydrophobicContact CG2-CE3 3.78Å; I115-W117 HydrophobicContact CG2-CG 4.31Å; I115-W117 HydrophobicContact CG2-CH2 3.92Å; I115-W117 HydrophobicContact CG2-CZ2 3.81Å; I115-W117 HydrophobicContact CG2-CZ3 3.91Å; I115-W117 PolarHBondContact O-N 3.4Å; I115-W117 VanDerWaalsContact O-N 3.17Å; W117-L120 HydrophobicContact CE3-CD1 4.22Å; W117-L120 HydrophobicContact CZ3-CD1 4.29Å; W117-A121 VanDerWaalsContact O-CB 3.24Å; W117-A121 WeakPolarHBondContact O-CB 3.42Å; W117-A121 PolarHBondContact O-N 2.97Å; W117-Y152 HydrophobicContact CE3-CE1 4.38Å; W117-Y152 WeakPolarHBondContact O-CE1 3.48Å
118	C	96.8	Very high	97.5	Very high	30 Å²	30	66.1 Å²	66.1	20%	0.203	32%	0.318	C	S	.	.	H	α-helix	trans	-65.8	-49.2	174.8	178.1	0	0	0	0	110.4	D116 L120 A121 R122	D116-C118 VanDerWaalsContact C-N 3.32Å; D116-C118 PolarHBondContact O-N 3.21Å; D116-C118 WeakPolarHBondContact OD1-CB 3.39Å; D116-C118 PolarHBondContact OD1-N 2.96Å; C118-L120 VanDerWaalsContact C-N 3.34Å; C118-L120 PolarHBondContact O-N 2.86Å; C118-A121 WeakPolarHBondContact O-CB 3.39Å; C118-A121 PolarHBondContact O-N 2.99Å; C118-A121 VanDerWaalsContact O-N 3.15Å; C118-R122 PolarHBondContact O-N 2.91Å
119	A	96.8	Very high	97.4	Very high	46 Å²	46	64.9 Å²	64.9	38%	0.38	31%	0.31	S	S	.	.	H	α-helix	trans	-59.6	-43.6	176.7	0	0	0	0	0	111.9	D116 R122 D123	D116-A119 HydrophobicContact CB-CB 3.89Å; D116-A119 PolarHBondContact O-N 3Å; D116-A119 PolarHBondContact OD1-N 3.5Å; D116-A119 WeakPolarHBondContact OD2-CB 3.3Å; A119-R122 PolarHBondContact O-N 3.1Å; A119-D123 PolarHBondContact O-N 3.18Å
120	L	98.2	Very high	97.2	Very high	50 Å²	50	65.9 Å²	65.9	26%	0.262	32%	0.323	S	S	.	.	H	α-helix	trans	-65.2	-39	175.3	-69.1	-174.6	0	0	0	112.5	I115 D116 W117 C118 R122 D123 Q124 Y152	I115-L120 HydrophobicContact CG2-CD1 3.53Å; I115-L120 HydrophobicContact CG2-CG 4.42Å; D116-L120 WeakPolarHBondContact O-CG 3.4Å; D116-L120 PolarHBondContact O-N 3.36Å; D116-L120 VanDerWaalsContact O-N 3.09Å; W117-L120 HydrophobicContact CE3-CD1 4.22Å; W117-L120 HydrophobicContact CZ3-CD1 4.29Å; C118-L120 VanDerWaalsContact C-N 3.34Å; C118-L120 PolarHBondContact O-N 2.86Å; L120-R122 VanDerWaalsContact C-N 3.34Å; L120-D123 PolarHBondContact O-N 2.83Å; L120-Q124 WeakPolarHBondContact O-CG 3.43Å; L120-Q124 PolarHBondContact O-N 2.83Å; L120-Y152 HydrophobicContact CB-CE1 4.09Å; L120-Y152 PolarHBondContact O-OH 3.28Å
121	A	98.1	Very high	97	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-63.5	-42	176.1	0	0	0	0	0	111.2	W117 C118 Q124 A125 L147 Y152 I160	W117-A121 VanDerWaalsContact O-CB 3.24Å; W117-A121 WeakPolarHBondContact O-CB 3.42Å; W117-A121 PolarHBondContact O-N 2.97Å; C118-A121 WeakPolarHBondContact O-CB 3.39Å; C118-A121 PolarHBondContact O-N 2.99Å; C118-A121 VanDerWaalsContact O-N 3.15Å; A121-Q124 PolarHBondContact O-N 3.47Å; A121-A125 PolarHBondContact O-N 2.94Å; A121-L147 HydrophobicContact CB-CD1 4.36Å; A121-L147 HydrophobicContact CB-CD2 4.38Å; A121-L147 WeakPolarHBondContact O-CD2 3.41Å; A121-Y152 HydrophobicContact CB-CD1 3.51Å; A121-Y152 HydrophobicContact CB-CD2 4.32Å; A121-Y152 HydrophobicContact CB-CE1 3.68Å; A121-Y152 HydrophobicContact CB-CE2 4.49Å; A121-Y152 HydrophobicContact CB-CG 3.84Å; A121-I160 HydrophobicContact CB-CD1 3.65Å; A121-I160 HydrophobicContact CB-CG1 4.43Å
122	R	96.9	Very high	96.9	Very high	48 Å²	48	68.2 Å²	68.2	18%	0.181	35%	0.351	C	S	.	.	H	α-helix	trans	-62.4	-46.6	174	-176.5	179.1	178.7	81.3	-1.6	111.8	C118 A119 L120 Q124 A125 T126 E131 L133 I160	C118-R122 PolarHBondContact O-N 2.91Å; A119-R122 PolarHBondContact O-N 3.1Å; L120-R122 VanDerWaalsContact C-N 3.34Å; R122-Q124 VanDerWaalsContact C-N 3.29Å; R122-Q124 PolarHBondContact O-N 3.15Å; R122-A125 PolarHBondContact O-N 3.38Å; R122-A125 VanDerWaalsContact O-N 3.15Å; R122-T126 HydrophobicContact CG-CG2 4.14Å; R122-T126 WeakPolarHBondContact O-CB 3.35Å; R122-T126 WeakPolarHBondContact O-CG2 2.89Å; R122-T126 PolarHBondContact O-N 3.33Å; R122-T126 PolarHBondContact O-OG1 3.38Å; R122-E131 IonicContact CZ-OE1 3.96Å; R122-E131 IonicContact NH2-OE1 2.9Å; R122-E131 PolarHBondContact NH2-OE1 3.44Å; R122-L133 HydrophobicContact CG-CD1 4.46Å; R122-I160 HydrophobicContact CB-CG1 4.25Å; R122-I160 HydrophobicContact CB-CG2 4.25Å; R122-I160 HydrophobicContact CG-CG2 4.22Å
123	D	97.5	Very high	96.7	Very high	46 Å²	46	62.4 Å²	62.4	25%	0.246	33%	0.325	C	S	.	.	H	α-helix	trans	-57	-43.5	175.3	168.1	80.7	0	0	0	111.2	A119 L120 A125 T126 R127	A119-D123 PolarHBondContact O-N 3.18Å; L120-D123 PolarHBondContact O-N 2.83Å; D123-A125 PolarHBondContact O-N 3.48Å; D123-T126 WeakPolarHBondContact CA-OG1 3.24Å; D123-T126 PolarHBondContact O-N 2.98Å; D123-T126 PolarHBondContact O-OG1 2.87Å; D123-R127 VanDerWaalsContact CG-NE 3.25Å; D123-R127 VanDerWaalsContact CG-NH2 3.28Å; D123-R127 WeakPolarHBondContact O-CB 3.37Å; D123-R127 VanDerWaalsContact O-CG 3.23Å; D123-R127 WeakPolarHBondContact O-CG 3.49Å; D123-R127 PolarHBondContact O-N 3.15Å; D123-R127 IonicContact OD1-CZ 3.62Å; D123-R127 IonicContact OD1-NE 3.5Å; D123-R127 PolarHBondContact OD1-NE 2.91Å; D123-R127 IonicContact OD1-NH2 2.75Å; D123-R127 PolarHBondContact OD1-NH2 3.16Å; D123-R127 IonicContact OD2-CZ 2.75Å; D123-R127 IonicContact OD2-NE 3.8Å; D123-R127 PolarHBondContact OD2-NE 3.21Å; D123-R127 IonicContact OD2-NH1 4Å; D123-R127 IonicContact OD2-NH2 2.97Å; D123-R127 PolarHBondContact OD2-NH2 2.87Å
124	Q	98.3	Very high	96.5	Very high	18 Å²	18	62 Å²	62	8%	0.084	32%	0.322	C	S	.	.	H	α-helix	trans	-65.3	-39	176	-70.1	-54.9	-62.8	0	0	113.1	L120 A121 R122 F146 L147 Y152	L120-Q124 WeakPolarHBondContact O-CG 3.43Å; L120-Q124 PolarHBondContact O-N 2.83Å; A121-Q124 PolarHBondContact O-N 3.47Å; R122-Q124 VanDerWaalsContact C-N 3.29Å; R122-Q124 PolarHBondContact O-N 3.15Å; Q124-F146 HydrophobicContact CB-CE1 4.42Å; Q124-F146 WeakPolarHBondContact O-CE1 3.39Å; Q124-L147 HydrophobicContact CB-CD2 3.92Å; Q124-Y152 HydrophobicContact CB-CE2 4.49Å; Q124-Y152 HydrophobicContact CG-CE2 4.17Å; Q124-Y152 WeakPolarHBondContact CG-OH 3.39Å
125	A	97.9	Very high	96.3	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.2	-49.9	176.3	0	0	0	0	0	111.2	A121 R122 D123 K128 Y129 L133 I143 L147	A121-A125 PolarHBondContact O-N 2.94Å; R122-A125 PolarHBondContact O-N 3.38Å; R122-A125 VanDerWaalsContact O-N 3.15Å; D123-A125 PolarHBondContact O-N 3.48Å; A125-K128 PolarHBondContact O-N 3.32Å; A125-K128 VanDerWaalsContact O-N 3.17Å; A125-Y129 WeakPolarHBondContact O-CB 3.35Å; A125-Y129 WeakPolarHBondContact O-CD2 3.37Å; A125-Y129 PolarHBondContact O-N 3.05Å; A125-L133 HydrophobicContact CB-CD1 4.08Å; A125-L133 HydrophobicContact CB-CD2 3.74Å; A125-I143 HydrophobicContact CB-CG2 3.76Å; A125-L147 HydrophobicContact CB-CD1 4.35Å
126	T	96.9	Very high	96.1	Very high	33 Å²	33	61.1 Å²	61.1	20%	0.202	32%	0.324	C	S	.	.	H	α-helix	trans	-64.8	-41.2	-177.7	51.7	0	0	0	0	112.1	R122 D123 K128 G130 L133	R122-T126 HydrophobicContact CG-CG2 4.14Å; R122-T126 WeakPolarHBondContact O-CB 3.35Å; R122-T126 WeakPolarHBondContact O-CG2 2.89Å; R122-T126 PolarHBondContact O-N 3.33Å; R122-T126 PolarHBondContact O-OG1 3.38Å; D123-T126 WeakPolarHBondContact CA-OG1 3.24Å; D123-T126 PolarHBondContact O-N 2.98Å; D123-T126 PolarHBondContact O-OG1 2.87Å; T126-K128 PolarHBondContact O-N 2.83Å; T126-K128 VanDerWaalsContact O-N 3.16Å; T126-G130 VanDerWaalsContact O-CA 3.24Å; T126-G130 WeakPolarHBondContact O-CA 3.47Å; T126-G130 PolarHBondContact O-N 3.41Å; T126-L133 HydrophobicContact CG2-CD1 4.44Å; T126-L133 HydrophobicContact CG2-CD2 4.01Å; T126-L133 HydrophobicContact CG2-CG 4.12Å
127	R	97.3	Very high	96	Very high	174 Å²	174	64.2 Å²	64.2	66%	0.657	33%	0.333	S	S	*	.	H	α-helix	trans	-58	-30.2	174.3	-75.3	178.8	-168.5	-172.5	10.6	113.9	D123	D123-R127 VanDerWaalsContact CG-NE 3.25Å; D123-R127 VanDerWaalsContact CG-NH2 3.28Å; D123-R127 WeakPolarHBondContact O-CB 3.37Å; D123-R127 VanDerWaalsContact O-CG 3.23Å; D123-R127 WeakPolarHBondContact O-CG 3.49Å; D123-R127 PolarHBondContact O-N 3.15Å; D123-R127 IonicContact OD1-CZ 3.62Å; D123-R127 IonicContact OD1-NE 3.5Å; D123-R127 PolarHBondContact OD1-NE 2.91Å; D123-R127 IonicContact OD1-NH2 2.75Å; D123-R127 PolarHBondContact OD1-NH2 3.16Å; D123-R127 IonicContact OD2-CZ 2.75Å; D123-R127 IonicContact OD2-NE 3.8Å; D123-R127 PolarHBondContact OD2-NE 3.21Å; D123-R127 IonicContact OD2-NH1 4Å; D123-R127 IonicContact OD2-NH2 2.97Å; D123-R127 PolarHBondContact OD2-NH2 2.87Å
128	K	97.5	Very high	95.8	Very high	115 Å²	115	66.3 Å²	66.3	50%	0.5	35%	0.352	S	S	.	.	H	α-helix	trans	-98.1	-36.1	-176.5	-177.3	172.8	175.7	-167.4	0	113.5	A125 T126 F146	A125-K128 PolarHBondContact O-N 3.32Å; A125-K128 VanDerWaalsContact O-N 3.17Å; T126-K128 PolarHBondContact O-N 2.83Å; T126-K128 VanDerWaalsContact O-N 3.16Å; K128-F146 HydrophobicContact CB-CE1 4.16Å; K128-F146 HydrophobicContact CB-CZ 4.03Å; K128-F146 HydrophobicContact CD-CD1 4.15Å; K128-F146 HydrophobicContact CD-CD2 3.78Å; K128-F146 HydrophobicContact CD-CE1 3.77Å; K128-F146 HydrophobicContact CD-CE2 3.36Å; K128-F146 HydrophobicContact CD-CG 4.1Å; K128-F146 HydrophobicContact CD-CZ 3.3Å; K128-F146 HydrophobicContact CG-CZ 4.29Å
129	Y	96.4	Very high	95.7	Very high	76 Å²	76	68.8 Å²	68.8	30%	0.298	36%	0.361	S	S	.	.	H	α-helix	trans	-113.7	-4.6	-170.9	-65	-87	0	0	0	113.5	A125 I143 F146	A125-Y129 WeakPolarHBondContact O-CB 3.35Å; A125-Y129 WeakPolarHBondContact O-CD2 3.37Å; A125-Y129 PolarHBondContact O-N 3.05Å; Y129-I143 HydrophobicContact CD1-CD1 4.46Å; Y129-I143 HydrophobicContact CD1-CG1 3.97Å; Y129-I143 HydrophobicContact CD2-CD1 4.42Å; Y129-I143 HydrophobicContact CD2-CG1 3.73Å; Y129-I143 HydrophobicContact CE1-CG1 4.08Å; Y129-I143 HydrophobicContact CE2-CB 4.44Å; Y129-I143 HydrophobicContact CE2-CG1 3.84Å; Y129-I143 HydrophobicContact CG-CD1 4.17Å; Y129-I143 HydrophobicContact CG-CG1 3.8Å; Y129-F146 HydrophobicContact CE2-CB 4.34Å; Y129-F146 AromaticContact CE2-CD1 3.75Å; Y129-F146 HydrophobicContact CE2-CD1 3.75Å; Y129-F146 HydrophobicContact CE2-CE1 4.19Å; Y129-F146 HydrophobicContact CE2-CG 4.13Å
130	G	95.1	Very high	95.7	Very high	35 Å²	35	69.3 Å²	69.3	36%	0.361	35%	0.354	S	S	.	.			trans	79.6	-173.5	-178.3	0	0	0	0	0	113.7	T126	T126-G130 VanDerWaalsContact O-CA 3.24Å; T126-G130 WeakPolarHBondContact O-CA 3.47Å; T126-G130 PolarHBondContact O-N 3.41Å
131	E	93.7	Very high	95.6	Very high	146 Å²	146	68.4 Å²	68.4	68%	0.682	35%	0.351	S	S	*	.	S	Bend	trans	-127.8	141	174.7	-164.5	163.1	-141.6	0	0	109.4	R122	R122-E131 IonicContact CZ-OE1 3.96Å; R122-E131 IonicContact NH2-OE1 2.9Å; R122-E131 PolarHBondContact NH2-OE1 3.44Å
132	P	92.9	Very high	95.6	Very high	115 Å²	115	74.2 Å²	74.2	75%	0.747	38%	0.376	S	S	*	.	S	Bend	cis	-66.7	151.4	-5.4	30.7	-35.5	0	0	0	112.2
133	L	94.1	Very high	95.6	Very high	12 Å²	12	71.9 Å²	71.9	6%	0.063	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-63.2	136	173.8	-71.7	177.7	0	0	0	110	R122 A125 T126 T135 I143 I160	R122-L133 HydrophobicContact CG-CD1 4.46Å; A125-L133 HydrophobicContact CB-CD1 4.08Å; A125-L133 HydrophobicContact CB-CD2 3.74Å; T126-L133 HydrophobicContact CG2-CD1 4.44Å; T126-L133 HydrophobicContact CG2-CD2 4.01Å; T126-L133 HydrophobicContact CG2-CG 4.12Å; L133-T135 PolarHBondContact O-N 3.08Å; L133-I143 HydrophobicContact CD2-CD1 4.41Å; L133-I160 HydrophobicContact CD1-CG2 3.26Å
134	P	93.3	Very high	95.6	Very high	23 Å²	23	72 Å²	72	15%	0.149	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-49	132.9	176	-32.1	34.3	0	0	0	113.9	E139 K140 I143 W161	P134-E139 HydrophobicContact CB-CB 3.39Å; P134-E139 HydrophobicContact CB-CG 4.24Å; P134-E139 WeakPolarHBondContact CB-OE2 3.43Å; P134-E139 HydrophobicContact CG-CB 4.11Å; P134-K140 WeakPolarHBondContact O-CG 3.24Å; P134-I143 HydrophobicContact CB-CD1 4.23Å; P134-I143 HydrophobicContact CG-CD1 4Å; P134-W161 PolarHBondContact O-NE1 2.91Å
135	T	91.9	Very high	95.6	Very high	110 Å²	110	79.6 Å²	79.6	68%	0.675	39%	0.394	S	S	*	.			trans	-101.8	-15.5	177.3	56.3	0	0	0	0	112.8	L133 K140	L133-T135 PolarHBondContact O-N 3.08Å; T135-K140 VanDerWaalsContact O-CE 3.23Å; T135-K140 WeakPolarHBondContact O-CE 3.43Å
136	V	94.3	Very high	95.6	Very high	81 Å²	81	80.6 Å²	80.6	49%	0.491	40%	0.399	S	S	.	.	S	Bend	trans	-65.4	133.2	175.9	-178	0	0	0	0	109.9	S138 E139 K140	V136-S138 VanDerWaalsContact C-N 3.34Å; V136-S138 PolarHBondContact O-N 3.19Å; V136-E139 HydrophobicContact CB-CG 4.41Å; V136-E139 PolarHBondContact O-N 2.88Å; V136-K140 PolarHBondContact O-N 2.94Å
137	F	93.3	Very high	95.7	Very high	164 Å²	164	79 Å²	79	72%	0.719	39%	0.389	S	S	*	.	H	α-helix	trans	-52.5	-46.8	-173	177.2	-100.6	0	0	0	113.7	E139 K140 V141	F137-E139 VanDerWaalsContact C-N 3.26Å; F137-E139 PolarHBondContact O-N 2.79Å; F137-K140 PolarHBondContact O-N 3.24Å; F137-V141 HydrophobicContact CD1-CG2 4.46Å; F137-V141 HydrophobicContact CE1-CG2 4.04Å; F137-V141 HydrophobicContact CE2-CG2 4.23Å; F137-V141 HydrophobicContact CZ-CG2 3.92Å; F137-V141 WeakPolarHBondContact O-CG2 3.48Å; F137-V141 PolarHBondContact O-N 3.1Å
138	S	95.2	Very high	95.8	Very high	71 Å²	71	74.5 Å²	74.5	50%	0.497	38%	0.377	S	S	.	.	H	α-helix	trans	-62.7	-32.8	-178.9	57.8	0	0	0	0	112.8	V136 K142	V136-S138 VanDerWaalsContact C-N 3.34Å; V136-S138 PolarHBondContact O-N 3.19Å; S138-K142 PolarHBondContact O-N 3.35Å
139	E	94.8	Very high	95.8	Very high	81 Å²	81	77.5 Å²	77.5	38%	0.379	39%	0.387	S	S	.	.	H	α-helix	trans	-79.7	-40.3	177.2	-60.1	-171.3	110.5	0	0	111.7	P134 V136 F137 V141 K142 I143	P134-E139 HydrophobicContact CB-CB 3.39Å; P134-E139 HydrophobicContact CB-CG 4.24Å; P134-E139 WeakPolarHBondContact CB-OE2 3.43Å; P134-E139 HydrophobicContact CG-CB 4.11Å; V136-E139 HydrophobicContact CB-CG 4.41Å; V136-E139 PolarHBondContact O-N 2.88Å; F137-E139 VanDerWaalsContact C-N 3.26Å; F137-E139 PolarHBondContact O-N 2.79Å; E139-V141 VanDerWaalsContact C-N 3.27Å; E139-V141 PolarHBondContact O-N 3.1Å; E139-K142 WeakPolarHBondContact O-CB 3.42Å; E139-K142 PolarHBondContact O-N 3.15Å; E139-I143 WeakPolarHBondContact O-CG1 3.45Å; E139-I143 PolarHBondContact O-N 3.43Å; E139-I143 VanDerWaalsContact O-N 3.1Å
140	K	96	Very high	95.9	Very high	57 Å²	57	76.7 Å²	76.7	25%	0.248	38%	0.383	C	S	.	.	H	α-helix	trans	-53.2	-45.7	170.9	-72.8	-166.2	178.4	-167.5	0	111.4	P134 T135 V136 F137 K142 I143 Q144 W161	P134-K140 WeakPolarHBondContact O-CG 3.24Å; T135-K140 VanDerWaalsContact O-CE 3.23Å; T135-K140 WeakPolarHBondContact O-CE 3.43Å; V136-K140 PolarHBondContact O-N 2.94Å; F137-K140 PolarHBondContact O-N 3.24Å; K140-K142 VanDerWaalsContact C-N 3.29Å; K140-K142 PolarHBondContact O-N 3.16Å; K140-I143 PolarHBondContact O-N 2.99Å; K140-I143 VanDerWaalsContact O-N 3.15Å; K140-Q144 WeakPolarHBondContact O-CB 3.34Å; K140-Q144 VanDerWaalsContact O-CG 3.28Å; K140-Q144 WeakPolarHBondContact O-CG 3.29Å; K140-Q144 PolarHBondContact O-N 2.86Å; K140-W161 HydrophobicContact CB-CZ2 4.39Å; K140-W161 HydrophobicContact CD-CD2 4.3Å; K140-W161 HydrophobicContact CD-CG 4.4Å; K140-W161 HydrophobicContact CG-CZ2 4Å
141	V	96.3	Very high	96.1	Very high	32 Å²	32	75.3 Å²	75.3	19%	0.194	37%	0.369	C	S	.	.	H	α-helix	trans	-59.8	-37.9	177.4	171	0	0	0	0	112.1	F137 E139 R145	F137-V141 HydrophobicContact CD1-CG2 4.46Å; F137-V141 HydrophobicContact CE1-CG2 4.04Å; F137-V141 HydrophobicContact CE2-CG2 4.23Å; F137-V141 HydrophobicContact CZ-CG2 3.92Å; F137-V141 WeakPolarHBondContact O-CG2 3.48Å; F137-V141 PolarHBondContact O-N 3.1Å; E139-V141 VanDerWaalsContact C-N 3.27Å; E139-V141 PolarHBondContact O-N 3.1Å; V141-R145 HydrophobicContact CG1-CG 4.46Å; V141-R145 WeakPolarHBondContact O-CB 3.5Å; V141-R145 VanDerWaalsContact O-CG 3.29Å; V141-R145 WeakPolarHBondContact O-CG 3.32Å; V141-R145 PolarHBondContact O-N 2.85Å
142	K	97.5	Very high	96.3	Very high	121 Å²	121	68.5 Å²	68.5	53%	0.526	34%	0.337	S	S	.	.	H	α-helix	trans	-64.2	-42.7	176.3	-68.4	174.3	-175.6	174.2	0	111.4	S138 E139 K140 F146	S138-K142 PolarHBondContact O-N 3.35Å; E139-K142 WeakPolarHBondContact O-CB 3.42Å; E139-K142 PolarHBondContact O-N 3.15Å; K140-K142 VanDerWaalsContact C-N 3.29Å; K140-K142 PolarHBondContact O-N 3.16Å; K142-F146 WeakPolarHBondContact O-CB 3.37Å; K142-F146 PolarHBondContact O-N 2.88Å; K142-F146 VanDerWaalsContact O-N 3.1Å
143	I	97.6	Very high	96.6	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-46.1	178.6	-61	168.2	0	0	0	110.3	A125 Y129 L133 P134 E139 K140 R145 F146 L147 W161	A125-I143 HydrophobicContact CB-CG2 3.76Å; Y129-I143 HydrophobicContact CD1-CD1 4.46Å; Y129-I143 HydrophobicContact CD1-CG1 3.97Å; Y129-I143 HydrophobicContact CD2-CD1 4.42Å; Y129-I143 HydrophobicContact CD2-CG1 3.73Å; Y129-I143 HydrophobicContact CE1-CG1 4.08Å; Y129-I143 HydrophobicContact CE2-CB 4.44Å; Y129-I143 HydrophobicContact CE2-CG1 3.84Å; Y129-I143 HydrophobicContact CG-CD1 4.17Å; Y129-I143 HydrophobicContact CG-CG1 3.8Å; L133-I143 HydrophobicContact CD2-CD1 4.41Å; P134-I143 HydrophobicContact CB-CD1 4.23Å; P134-I143 HydrophobicContact CG-CD1 4Å; E139-I143 WeakPolarHBondContact O-CG1 3.45Å; E139-I143 PolarHBondContact O-N 3.43Å; E139-I143 VanDerWaalsContact O-N 3.1Å; K140-I143 PolarHBondContact O-N 2.99Å; K140-I143 VanDerWaalsContact O-N 3.15Å; I143-R145 PolarHBondContact O-N 3.48Å; I143-F146 WeakPolarHBondContact O-CB 3.29Å; I143-F146 PolarHBondContact O-N 3.47Å; I143-F146 VanDerWaalsContact O-N 3.16Å; I143-L147 HydrophobicContact CG2-CD1 3.94Å; I143-L147 HydrophobicContact CG2-CG 4.38Å; I143-L147 WeakPolarHBondContact O-CG 3.46Å; I143-L147 PolarHBondContact O-N 3.5Å; I143-W161 HydrophobicContact CB-CH2 4.01Å; I143-W161 HydrophobicContact CB-CZ2 4.28Å; I143-W161 HydrophobicContact CD1-CZ2 4.04Å; I143-W161 HydrophobicContact CG2-CH2 3.7Å; I143-W161 HydrophobicContact CG2-CZ2 4.14Å
144	Q	97.8	Very high	96.7	Very high	49 Å²	49	68.3 Å²	68.3	23%	0.229	33%	0.328	C	S	.	.	H	α-helix	trans	-56.4	-49.3	176.1	-71.4	178.4	-20.5	0	0	111.6	K140 F146 L147 L148 I157 W161	K140-Q144 WeakPolarHBondContact O-CB 3.34Å; K140-Q144 VanDerWaalsContact O-CG 3.28Å; K140-Q144 WeakPolarHBondContact O-CG 3.29Å; K140-Q144 PolarHBondContact O-N 2.86Å; Q144-F146 VanDerWaalsContact C-N 3.29Å; Q144-F146 PolarHBondContact O-N 3.06Å; Q144-L147 PolarHBondContact O-N 3.17Å; Q144-L148 WeakPolarHBondContact O-CB 3.4Å; Q144-L148 VanDerWaalsContact O-CG 3.32Å; Q144-L148 WeakPolarHBondContact O-CG 3.39Å; Q144-L148 PolarHBondContact O-N 3.43Å; Q144-I157 HydrophobicContact CB-CG2 4.22Å; Q144-I157 HydrophobicContact CG-CG2 3.65Å; Q144-W161 HydrophobicContact CG-CH2 4.37Å; Q144-W161 HydrophobicContact CG-CZ3 4.26Å
145	R	98.1	Very high	96.8	Very high	177 Å²	177	73.5 Å²	73.5	67%	0.668	35%	0.35	S	S	*	.	H	α-helix	trans	-58.7	-41.5	176.9	-74.7	175.9	-177.2	-179.2	2	112.3	V141 I143 Y149	V141-R145 HydrophobicContact CG1-CG 4.46Å; V141-R145 WeakPolarHBondContact O-CB 3.5Å; V141-R145 VanDerWaalsContact O-CG 3.29Å; V141-R145 WeakPolarHBondContact O-CG 3.32Å; V141-R145 PolarHBondContact O-N 2.85Å; I143-R145 PolarHBondContact O-N 3.48Å; R145-Y149 WeakPolarHBondContact O-CB 3.31Å; R145-Y149 PolarHBondContact O-N 3.28Å
146	F	98.4	Very high	97	Very high	20 Å²	20	69.2 Å²	69.2	9%	0.088	32%	0.323	C	S	.	.	H	α-helix	trans	-63.3	-44.5	177.6	162.9	-110	0	0	0	112.6	Q124 K128 Y129 K142 I143 Q144 Y149 R150	Q124-F146 HydrophobicContact CB-CE1 4.42Å; Q124-F146 WeakPolarHBondContact O-CE1 3.39Å; K128-F146 HydrophobicContact CB-CE1 4.16Å; K128-F146 HydrophobicContact CB-CZ 4.03Å; K128-F146 HydrophobicContact CD-CD1 4.15Å; K128-F146 HydrophobicContact CD-CD2 3.78Å; K128-F146 HydrophobicContact CD-CE1 3.77Å; K128-F146 HydrophobicContact CD-CE2 3.36Å; K128-F146 HydrophobicContact CD-CG 4.1Å; K128-F146 HydrophobicContact CD-CZ 3.3Å; K128-F146 HydrophobicContact CG-CZ 4.29Å; Y129-F146 HydrophobicContact CE2-CB 4.34Å; Y129-F146 AromaticContact CE2-CD1 3.75Å; Y129-F146 HydrophobicContact CE2-CD1 3.75Å; Y129-F146 HydrophobicContact CE2-CE1 4.19Å; Y129-F146 HydrophobicContact CE2-CG 4.13Å; K142-F146 WeakPolarHBondContact O-CB 3.37Å; K142-F146 PolarHBondContact O-N 2.88Å; K142-F146 VanDerWaalsContact O-N 3.1Å; I143-F146 WeakPolarHBondContact O-CB 3.29Å; I143-F146 PolarHBondContact O-N 3.47Å; I143-F146 VanDerWaalsContact O-N 3.16Å; Q144-F146 VanDerWaalsContact C-N 3.29Å; Q144-F146 PolarHBondContact O-N 3.06Å; F146-Y149 PolarHBondContact O-N 3.46Å; F146-R150 HydrophobicContact CE2-CG 4.4Å; F146-R150 VanDerWaalsContact CE2-NH1 3.31Å; F146-R150 VanDerWaalsContact CZ-CZ 3.42Å; F146-R150 WeakPolarHBondContact O-CG 3.45Å; F146-R150 PolarHBondContact O-N 3.03Å
147	L	98.6	Very high	97.2	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-71.2	-38.7	178.6	-66.1	173.8	0	0	0	112.1	A121 Q124 A125 I143 Q144 Y149 R150 G151 Y152 I157 I160	A121-L147 HydrophobicContact CB-CD1 4.36Å; A121-L147 HydrophobicContact CB-CD2 4.38Å; A121-L147 WeakPolarHBondContact O-CD2 3.41Å; Q124-L147 HydrophobicContact CB-CD2 3.92Å; A125-L147 HydrophobicContact CB-CD1 4.35Å; I143-L147 HydrophobicContact CG2-CD1 3.94Å; I143-L147 HydrophobicContact CG2-CG 4.38Å; I143-L147 WeakPolarHBondContact O-CG 3.46Å; I143-L147 PolarHBondContact O-N 3.5Å; Q144-L147 PolarHBondContact O-N 3.17Å; L147-Y149 VanDerWaalsContact C-N 3.33Å; L147-Y149 PolarHBondContact O-N 2.9Å; L147-R150 CarbonylContact O-C 3.47Å; L147-R150 WeakPolarHBondContact O-CA 3.15Å; L147-R150 WeakPolarHBondContact O-CB 3.47Å; L147-R150 PolarHBondContact O-N 2.87Å; L147-G151 PolarHBondContact O-N 3.24Å; L147-Y152 HydrophobicContact CB-CD2 4.11Å; L147-Y152 HydrophobicContact CD2-CD2 3.91Å; L147-Y152 HydrophobicContact CD2-CE2 4.1Å; L147-Y152 WeakPolarHBondContact O-CD2 3.5Å; L147-Y152 PolarHBondContact O-N 3.5Å; L147-Y152 VanDerWaalsContact O-N 3.08Å; L147-I157 HydrophobicContact CB-CD1 3.66Å; L147-I157 HydrophobicContact CB-CG1 3.78Å; L147-I157 HydrophobicContact CD1-CG1 4.02Å; L147-I157 HydrophobicContact CD1-CG2 4.18Å; L147-I160 HydrophobicContact CD1-CD1 3.53Å
148	L	98.5	Very high	97.3	Very high	79 Å²	79	61.4 Å²	61.4	41%	0.414	28%	0.284	S	S	.	.	H	α-helix	trans	-59.7	-42.5	171.9	-76.4	172	0	0	0	111.8	Q144 R150 G151 M154 I157	Q144-L148 WeakPolarHBondContact O-CB 3.4Å; Q144-L148 VanDerWaalsContact O-CG 3.32Å; Q144-L148 WeakPolarHBondContact O-CG 3.39Å; Q144-L148 PolarHBondContact O-N 3.43Å; L148-R150 PolarHBondContact O-N 3.48Å; L148-G151 WeakPolarHBondContact O-CA 3.21Å; L148-G151 PolarHBondContact O-N 3.28Å; L148-M154 HydrophobicContact CD1-SD 3.8Å; L148-M154 HydrophobicContact CD2-CG 4.08Å; L148-M154 HydrophobicContact CD2-SD 3.71Å; L148-M154 HydrophobicContact CG-SD 4.02Å; L148-I157 HydrophobicContact CD2-CD1 3.83Å; L148-I157 HydrophobicContact CG-CD1 3.76Å
149	Y	98.1	Very high	97.2	Very high	178 Å²	178	62 Å²	62	70%	0.698	28%	0.279	S	S	*	.	H	α-helix	trans	-64	-27.3	174.8	-179.5	-100.7	0	0	0	113.1	R145 F146 L147 G151	R145-Y149 WeakPolarHBondContact O-CB 3.31Å; R145-Y149 PolarHBondContact O-N 3.28Å; F146-Y149 PolarHBondContact O-N 3.46Å; L147-Y149 VanDerWaalsContact C-N 3.33Å; L147-Y149 PolarHBondContact O-N 2.9Å; Y149-G151 VanDerWaalsContact C-N 3.27Å
150	R	98.3	Very high	97.2	Very high	60 Å²	60	58.3 Å²	58.3	23%	0.226	26%	0.262	C	S	.	.	H	α-helix	trans	-79.7	-9.8	171.6	-69	-98.3	175.2	88.9	-8	112.8	G86 Y87 G88 F146 L147 L148 Y152	G86-R150 VanDerWaalsContact O-CD 3.25Å; G86-R150 WeakPolarHBondContact O-CD 3.34Å; Y87-R150 WeakPolarHBondContact CA-O 3.35Å; G88-R150 PolarHBondContact N-O 3.49Å; F146-R150 HydrophobicContact CE2-CG 4.4Å; F146-R150 VanDerWaalsContact CE2-NH1 3.31Å; F146-R150 VanDerWaalsContact CZ-CZ 3.42Å; F146-R150 WeakPolarHBondContact O-CG 3.45Å; F146-R150 PolarHBondContact O-N 3.03Å; L147-R150 CarbonylContact O-C 3.47Å; L147-R150 WeakPolarHBondContact O-CA 3.15Å; L147-R150 WeakPolarHBondContact O-CB 3.47Å; L147-R150 PolarHBondContact O-N 2.87Å; L148-R150 PolarHBondContact O-N 3.48Å; R150-Y152 HydrophobicContact CB-CD2 3.81Å; R150-Y152 HydrophobicContact CB-CE2 3.85Å
151	G	98.7	Very high	96.9	Very high	6 Å²	6	57.8 Å²	57.8	6%	0.062	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	16.1	176.1	0	0	0	0	0	115.1	G88 A90 L147 L148 Y149	G88-G151 CarbonylContact C-O 3.08Å; G88-G151 WeakPolarHBondContact CA-O 3.5Å; A90-G151 WeakPolarHBondContact CB-O 3.36Å; A90-G151 PolarHBondContact N-O 3.3Å; L147-G151 PolarHBondContact O-N 3.24Å; L148-G151 WeakPolarHBondContact O-CA 3.21Å; L148-G151 PolarHBondContact O-N 3.28Å; Y149-G151 VanDerWaalsContact C-N 3.27Å
152	Y	98.7	Very high	96.2	Very high	3 Å²	3	63.5 Å²	63.5	1%	0.012	28%	0.276	C	S	.	.			trans	-70.7	150.3	171.5	-68.8	-81.8	0	0	0	110.9	G86 W117 L120 A121 Q124 L147 R150	G86-Y152 WeakPolarHBondContact O-CE2 3.47Å; G86-Y152 PolarHBondContact O-OH 3.38Å; W117-Y152 HydrophobicContact CE3-CE1 4.38Å; W117-Y152 WeakPolarHBondContact O-CE1 3.48Å; L120-Y152 HydrophobicContact CB-CE1 4.09Å; L120-Y152 PolarHBondContact O-OH 3.28Å; A121-Y152 HydrophobicContact CB-CD1 3.51Å; A121-Y152 HydrophobicContact CB-CD2 4.32Å; A121-Y152 HydrophobicContact CB-CE1 3.68Å; A121-Y152 HydrophobicContact CB-CE2 4.49Å; A121-Y152 HydrophobicContact CB-CG 3.84Å; Q124-Y152 HydrophobicContact CB-CE2 4.49Å; Q124-Y152 HydrophobicContact CG-CE2 4.17Å; Q124-Y152 WeakPolarHBondContact CG-OH 3.39Å; L147-Y152 HydrophobicContact CB-CD2 4.11Å; L147-Y152 HydrophobicContact CD2-CD2 3.91Å; L147-Y152 HydrophobicContact CD2-CE2 4.1Å; L147-Y152 WeakPolarHBondContact O-CD2 3.5Å; L147-Y152 PolarHBondContact O-N 3.5Å; L147-Y152 VanDerWaalsContact O-N 3.08Å; R150-Y152 HydrophobicContact CB-CD2 3.81Å; R150-Y152 HydrophobicContact CB-CE2 3.85Å
153	L	98.1	Very high	94.4	Very high	48 Å²	48	64.1 Å²	64.1	25%	0.251	29%	0.285	S	S	.	.			trans	-82.9	154.4	-179.7	-54.9	179.1	0	0	0	110.3	P89 A90 E155 D156 I157	P89-L153 HydrophobicContact CB-CD1 4.14Å; P89-L153 HydrophobicContact CB-CD2 4.42Å; P89-L153 HydrophobicContact CB-CG 4.11Å; P89-L153 HydrophobicContact CG-CD1 4.3Å; P89-L153 HydrophobicContact CG-CG 4.21Å; A90-L153 HydrophobicContact CB-CD2 3.98Å; L153-E155 HydrophobicContact CB-CG 3.85Å; L153-E155 PolarHBondContact O-N 3.32Å; L153-D156 WeakPolarHBondContact CB-OD2 3.5Å; L153-D156 PolarHBondContact N-OD2 2.95Å; L153-D156 PolarHBondContact O-N 3.02Å; L153-I157 WeakPolarHBondContact O-CD1 3.39Å; L153-I157 WeakPolarHBondContact O-CG1 3.21Å; L153-I157 PolarHBondContact O-N 3.03Å
154	M	97.2	Very high	92.4	Very high	75 Å²	75	70.2 Å²	70.2	37%	0.369	31%	0.312	S	S	.	.	H	α-helix	trans	-61.3	-32.1	-179.9	-79.8	-58.2	-59	0	0	112.7	L148 I157 Q158	L148-M154 HydrophobicContact CD1-SD 3.8Å; L148-M154 HydrophobicContact CD2-CG 4.08Å; L148-M154 HydrophobicContact CD2-SD 3.71Å; L148-M154 HydrophobicContact CG-SD 4.02Å; M154-I157 PolarHBondContact O-N 3.31Å; M154-I157 HydrophobicContact SD-CD1 4.4Å; M154-Q158 HydrophobicContact CE-CG 4.35Å; M154-Q158 WeakPolarHBondContact O-CB 3.41Å; M154-Q158 WeakPolarHBondContact O-CG 3.28Å; M154-Q158 PolarHBondContact O-N 2.94Å
155	E	96	Very high	89.5	Confident	131 Å²	131	72.2 Å²	72.2	61%	0.612	34%	0.337	S	S	*	.	H	α-helix	trans	-61.5	-52.6	173.9	59.3	-163	-159.5	0	0	111.6	L153 I157 Q158 E159	L153-E155 HydrophobicContact CB-CG 3.85Å; L153-E155 PolarHBondContact O-N 3.32Å; E155-I157 VanDerWaalsContact C-N 3.26Å; E155-I157 PolarHBondContact O-N 3.04Å; E155-Q158 PolarHBondContact O-N 3.37Å; E155-E159 PolarHBondContact O-N 3.08Å; E155-E159 VanDerWaalsContact O-N 3.09Å
156	D	96.3	Very high	86.7	Confident	20 Å²	20	74.9 Å²	74.9	11%	0.107	36%	0.364	C	S	.	.	H	α-helix	trans	-56.2	-43.5	176.2	-53.5	-44.9	0	0	0	111.1	L153 E159 I160	L153-D156 WeakPolarHBondContact CB-OD2 3.5Å; L153-D156 PolarHBondContact N-OD2 2.95Å; L153-D156 PolarHBondContact O-N 3.02Å; D156-E159 PolarHBondContact O-N 3.33Å; D156-I160 WeakPolarHBondContact O-CG1 3.4Å
157	I	97.2	Very high	86.1	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-69	-41.6	-176.7	-66	167.6	0	0	0	111.2	Q144 L147 L148 L153 M154 E155 E159 I160 W161	Q144-I157 HydrophobicContact CB-CG2 4.22Å; Q144-I157 HydrophobicContact CG-CG2 3.65Å; L147-I157 HydrophobicContact CB-CD1 3.66Å; L147-I157 HydrophobicContact CB-CG1 3.78Å; L147-I157 HydrophobicContact CD1-CG1 4.02Å; L147-I157 HydrophobicContact CD1-CG2 4.18Å; L148-I157 HydrophobicContact CD2-CD1 3.83Å; L148-I157 HydrophobicContact CG-CD1 3.76Å; L153-I157 WeakPolarHBondContact O-CD1 3.39Å; L153-I157 WeakPolarHBondContact O-CG1 3.21Å; L153-I157 PolarHBondContact O-N 3.03Å; M154-I157 PolarHBondContact O-N 3.31Å; M154-I157 HydrophobicContact SD-CD1 4.4Å; E155-I157 VanDerWaalsContact C-N 3.26Å; E155-I157 PolarHBondContact O-N 3.04Å; I157-E159 VanDerWaalsContact C-N 3.29Å; I157-E159 PolarHBondContact O-N 3.24Å; I157-I160 WeakPolarHBondContact O-CB 3.36Å; I157-I160 PolarHBondContact O-N 3.04Å; I157-W161 HydrophobicContact CG2-CZ3 3.97Å; I157-W161 WeakPolarHBondContact O-CZ3 3.26Å
158	Q	94.8	Very high	85.4	Confident	81 Å²	81	81.7 Å²	81.7	38%	0.379	40%	0.398	S	S	.	.	H	α-helix	trans	-66.7	-35.2	179.3	-76.9	175	0.8	0	0	111.7	M154 E155 I160 W161 R162	M154-Q158 HydrophobicContact CE-CG 4.35Å; M154-Q158 WeakPolarHBondContact O-CB 3.41Å; M154-Q158 WeakPolarHBondContact O-CG 3.28Å; M154-Q158 PolarHBondContact O-N 2.94Å; E155-Q158 PolarHBondContact O-N 3.37Å; Q158-I160 PolarHBondContact O-N 3.37Å; Q158-W161 PolarHBondContact O-N 3.24Å; Q158-W161 VanDerWaalsContact O-N 3.08Å; Q158-R162 PolarHBondContact O-N 3.23Å
159	E	94	Very high	84.7	Confident	85 Å²	85	81.8 Å²	81.8	40%	0.397	40%	0.397	S	S	.	.	H	α-helix	trans	-63.9	-27.6	-179.5	-160.4	63.5	-165	0	0	112.4	E155 D156 I157 W161 R162	E155-E159 PolarHBondContact O-N 3.08Å; E155-E159 VanDerWaalsContact O-N 3.09Å; D156-E159 PolarHBondContact O-N 3.33Å; I157-E159 VanDerWaalsContact C-N 3.29Å; I157-E159 PolarHBondContact O-N 3.24Å; E159-W161 PolarHBondContact O-N 3.29Å; E159-R162 PolarHBondContact O-N 3.09Å
160	I	94.2	Very high	83.9	Confident	3 Å²	3	76.2 Å²	76.2	2%	0.015	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-17.7	173	-56.4	169.4	0	0	0	113	A121 R122 L133 L147 D156 I157 Q158 F164	A121-I160 HydrophobicContact CB-CD1 3.65Å; A121-I160 HydrophobicContact CB-CG1 4.43Å; R122-I160 HydrophobicContact CB-CG1 4.25Å; R122-I160 HydrophobicContact CB-CG2 4.25Å; R122-I160 HydrophobicContact CG-CG2 4.22Å; L133-I160 HydrophobicContact CD1-CG2 3.26Å; L147-I160 HydrophobicContact CD1-CD1 3.53Å; D156-I160 WeakPolarHBondContact O-CG1 3.4Å; I157-I160 WeakPolarHBondContact O-CB 3.36Å; I157-I160 PolarHBondContact O-N 3.04Å; Q158-I160 PolarHBondContact O-N 3.37Å; I160-F164 VanDerWaalsContact O-CE2 3.26Å; I160-F164 WeakPolarHBondContact O-CE2 3.23Å
161	W	90.7	Very high	83	Confident	45 Å²	45	77.2 Å²	77.2	17%	0.17	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119	-2.8	174.4	-67.5	-83.8	0	0	0	114.2	P134 K140 I143 Q144 I157 Q158 E159 N163	P134-W161 PolarHBondContact O-NE1 2.91Å; K140-W161 HydrophobicContact CB-CZ2 4.39Å; K140-W161 HydrophobicContact CD-CD2 4.3Å; K140-W161 HydrophobicContact CD-CG 4.4Å; K140-W161 HydrophobicContact CG-CZ2 4Å; I143-W161 HydrophobicContact CB-CH2 4.01Å; I143-W161 HydrophobicContact CB-CZ2 4.28Å; I143-W161 HydrophobicContact CD1-CZ2 4.04Å; I143-W161 HydrophobicContact CG2-CH2 3.7Å; I143-W161 HydrophobicContact CG2-CZ2 4.14Å; Q144-W161 HydrophobicContact CG-CH2 4.37Å; Q144-W161 HydrophobicContact CG-CZ3 4.26Å; I157-W161 HydrophobicContact CG2-CZ3 3.97Å; I157-W161 WeakPolarHBondContact O-CZ3 3.26Å; Q158-W161 PolarHBondContact O-N 3.24Å; Q158-W161 VanDerWaalsContact O-N 3.08Å; E159-W161 PolarHBondContact O-N 3.29Å; W161-N163 PolarHBondContact O-N 3.45Å
162	R	80.7	Confident	81.9	Confident	153 Å²	153	81.9 Å²	81.9	58%	0.577	41%	0.41	S	S	*	.	S	Bend	trans	-87.1	107.2	172.2	-73.9	-178.3	170.4	167.9	-1	106.8	Q158 E159	Q158-R162 PolarHBondContact O-N 3.23Å; E159-R162 PolarHBondContact O-N 3.09Å
163	N	61.2	Low	80.7	Confident	133 Å²	133	87.6 Å²	87.6	71%	0.711	44%	0.439	S	S	*	.			trans	81.4	75.9	175.2	-49.1	-31.2	0	0	0	117.4	W161	W161-N163 PolarHBondContact O-N 3.45Å
164	F	53.7	Low	79.4	Confident	129 Å²	129	90.6 Å²	90.6	57%	0.566	45%	0.453	S	S	*	.			trans	-111	50.9	143.1	-68.8	-76	0	0	0	110	I160	I160-F164 VanDerWaalsContact O-CE2 3.26Å; I160-F164 WeakPolarHBondContact O-CE2 3.23Å
165	A	38.3	Very low	77.9	Confident	90 Å²	90	91.9 Å²	91.9	74%	0.744	46%	0.46	S	S	*	.			trans	-103	70.4	156.1	0	0	0	0	0	106.4
166	D	37.9	Very low	76.3	Confident	233 Å²	233	88.4 Å²	88.4	100%	1.246	45%	0.447	S	S	*	.			trans	-95.3	0	147.5	-78.8	-25.4	0	0	0	107

Retrieved 166 of 166 residues in 69.1 ms (Link to these results)

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