A0A077YVV4_TRITR Loading...

Secreted protein

AlphaFold DB , UniProt , Accession A0A077YVV4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 211 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	46	Very low	44.3	Very low	197 Å²	197	111.1 Å²	111.1	97%	0.97	57%	0.568	S	S	*	*				0	-46.7	0	-144.1	164.5	84.6	0	0	112.1	V3 R4 L5	M1-V3 PolarHBondContact O-N 3.45Å; M1-R4 PolarHBondContact O-N 3.26Å; M1-L5 PolarHBondContact O-N 3.49Å
2	I	38.8	Very low	44.6	Very low	145 Å²	145	114 Å²	114	74%	0.744	57%	0.574	S	S	*	*	H	α-helix	trans	-58.8	-42.4	179.4	-65	157.3	0	0	0	113.4	R4 L5 F6	I2-R4 VanDerWaalsContact C-N 3.34Å; I2-R4 PolarHBondContact O-N 3.05Å; I2-L5 PolarHBondContact O-N 3.31Å; I2-F6 PolarHBondContact O-N 3.48Å
3	V	38.8	Very low	44.7	Very low	106 Å²	106	111.2 Å²	111.2	64%	0.642	55%	0.553	S	S	*	*	H	α-helix	trans	-63.2	-37.5	179.6	-177.3	0	0	0	0	112.3	M1 F6 I7	M1-V3 PolarHBondContact O-N 3.45Å; V3-F6 PolarHBondContact O-N 2.9Å; V3-I7 HydrophobicContact CG1-CD1 3.99Å; V3-I7 WeakPolarHBondContact O-CG1 3.38Å; V3-I7 PolarHBondContact O-N 3.35Å
4	R	37.3	Very low	44.8	Very low	207 Å²	207	109.1 Å²	109.1	78%	0.781	54%	0.544	S	S	*	.	H	α-helix	trans	-67.5	-40.8	176.1	-79.8	-172.3	173.3	163.7	-1.5	111.8	M1 I2 F6 I7 V8	M1-R4 PolarHBondContact O-N 3.26Å; I2-R4 VanDerWaalsContact C-N 3.34Å; I2-R4 PolarHBondContact O-N 3.05Å; R4-F6 VanDerWaalsContact C-N 3.32Å; R4-F6 PolarHBondContact O-N 3.2Å; R4-I7 PolarHBondContact O-N 3.4Å; R4-V8 WeakPolarHBondContact O-CB 3.31Å; R4-V8 VanDerWaalsContact O-CG2 3.25Å; R4-V8 WeakPolarHBondContact O-CG2 3.3Å; R4-V8 PolarHBondContact O-N 3.42Å
5	L	42.4	Very low	45	Very low	109 Å²	109	108.2 Å²	108.2	57%	0.571	55%	0.547	S	S	*	.	H	α-helix	trans	-62.5	-40.5	174.4	-84.5	155.7	0	0	0	111.6	M1 I2 V8 S9	M1-L5 PolarHBondContact O-N 3.49Å; I2-L5 PolarHBondContact O-N 3.31Å; L5-V8 PolarHBondContact O-N 3Å; L5-S9 WeakPolarHBondContact O-CB 3.33Å; L5-S9 PolarHBondContact O-N 3.37Å
6	F	43.8	Very low	45	Very low	69 Å²	69	105.3 Å²	105.3	30%	0.303	54%	0.536	S	S	.	.	H	α-helix	trans	-63.8	-46	177.5	-162.1	-91.2	0	0	0	111.9	I2 V3 R4 S9 L10 M30	I2-F6 PolarHBondContact O-N 3.48Å; V3-F6 PolarHBondContact O-N 2.9Å; R4-F6 VanDerWaalsContact C-N 3.32Å; R4-F6 PolarHBondContact O-N 3.2Å; F6-S9 PolarHBondContact O-N 2.94Å; F6-L10 VanDerWaalsContact O-CB 3.3Å; F6-L10 WeakPolarHBondContact O-CB 3.31Å; F6-L10 PolarHBondContact O-N 3.44Å; F6-M30 HydrophobicContact CD2-CE 3.89Å; F6-M30 HydrophobicContact CD2-CG 4.32Å; F6-M30 HydrophobicContact CD2-SD 3.37Å; F6-M30 WeakPolarHBondContact CD2-SD 3.37Å; F6-M30 HydrophobicContact CE2-CE 4.33Å; F6-M30 HydrophobicContact CE2-CG 3.81Å; F6-M30 HydrophobicContact CE2-SD 3.34Å; F6-M30 WeakPolarHBondContact CE2-SD 3.29Å; F6-M30 HydrophobicContact CG-SD 4.49Å; F6-M30 HydrophobicContact CZ-SD 4.44Å
7	I	45.4	Very low	45	Very low	75 Å²	75	105.7 Å²	105.7	39%	0.385	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-41.7	177.8	-65.6	167.4	0	0	0	111	V3 R4 L10 L11	V3-I7 HydrophobicContact CG1-CD1 3.99Å; V3-I7 WeakPolarHBondContact O-CG1 3.38Å; V3-I7 PolarHBondContact O-N 3.35Å; R4-I7 PolarHBondContact O-N 3.4Å; I7-L10 PolarHBondContact O-N 3.04Å; I7-L11 HydrophobicContact CG2-CD1 3.8Å; I7-L11 HydrophobicContact CG2-CG 4.27Å; I7-L11 WeakPolarHBondContact O-CB 3.4Å; I7-L11 WeakPolarHBondContact O-CG 3.4Å; I7-L11 PolarHBondContact O-N 2.76Å
8	V	47.9	Very low	45	Very low	97 Å²	97	108.1 Å²	108.1	59%	0.588	55%	0.553	S	S	*	*	H	α-helix	trans	-65.2	-43.5	177.5	173.7	0	0	0	0	111.3	R4 L5 L11 F12	R4-V8 WeakPolarHBondContact O-CB 3.31Å; R4-V8 VanDerWaalsContact O-CG2 3.25Å; R4-V8 WeakPolarHBondContact O-CG2 3.3Å; R4-V8 PolarHBondContact O-N 3.42Å; L5-V8 PolarHBondContact O-N 3Å; V8-L11 PolarHBondContact O-N 3.16Å; V8-F12 VanDerWaalsContact O-CB 3.3Å; V8-F12 WeakPolarHBondContact O-CB 3.45Å; V8-F12 PolarHBondContact O-N 3.37Å
9	S	48	Very low	44.7	Very low	70 Å²	70	104.8 Å²	104.8	49%	0.49	55%	0.549	S	S	.	.	H	α-helix	trans	-64	-39.9	175.4	-97.8	0	0	0	0	112.5	L5 F6 F12 Y13	L5-S9 WeakPolarHBondContact O-CB 3.33Å; L5-S9 PolarHBondContact O-N 3.37Å; F6-S9 PolarHBondContact O-N 2.94Å; S9-F12 PolarHBondContact O-N 3.39Å; S9-Y13 WeakPolarHBondContact O-CB 3.47Å; S9-Y13 PolarHBondContact O-N 3.08Å
10	L	52.2	Low	44.2	Very low	45 Å²	45	106 Å²	106	24%	0.236	57%	0.567	C	S	.	*	H	α-helix	trans	-69.3	-42.2	178.8	-161.4	85.6	0	0	0	111.6	F6 I7 Y13 L14 F31 V54	F6-L10 VanDerWaalsContact O-CB 3.3Å; F6-L10 WeakPolarHBondContact O-CB 3.31Å; F6-L10 PolarHBondContact O-N 3.44Å; I7-L10 PolarHBondContact O-N 3.04Å; L10-Y13 PolarHBondContact O-N 3.36Å; L10-L14 WeakPolarHBondContact O-CG 3.35Å; L10-L14 PolarHBondContact O-N 3.4Å; L10-F31 HydrophobicContact CD1-CZ 4.38Å; L10-V54 HydrophobicContact CD2-CG2 3.92Å
11	L	46.3	Very low	43.7	Very low	102 Å²	102	103.7 Å²	103.7	53%	0.534	57%	0.568	S	S	.	*	H	α-helix	trans	-63.2	-43.2	174.4	-78.2	171.5	0	0	0	111.2	I7 V8 Y13 L14 T15	I7-L11 HydrophobicContact CG2-CD1 3.8Å; I7-L11 HydrophobicContact CG2-CG 4.27Å; I7-L11 WeakPolarHBondContact O-CB 3.4Å; I7-L11 WeakPolarHBondContact O-CG 3.4Å; I7-L11 PolarHBondContact O-N 2.76Å; V8-L11 PolarHBondContact O-N 3.16Å; L11-Y13 VanDerWaalsContact C-N 3.28Å; L11-Y13 PolarHBondContact O-N 3.14Å; L11-L14 PolarHBondContact O-N 3.29Å; L11-T15 PolarHBondContact O-N 3.29Å; L11-T15 PolarHBondContact O-OG1 3.24Å
12	F	47.8	Very low	43.2	Very low	146 Å²	146	101.6 Å²	101.6	64%	0.64	57%	0.567	S	S	*	*	H	α-helix	trans	-59.2	-40.2	174.7	-172	-96.1	0	0	0	111.5	V8 S9 T15 V16	V8-F12 VanDerWaalsContact O-CB 3.3Å; V8-F12 WeakPolarHBondContact O-CB 3.45Å; V8-F12 PolarHBondContact O-N 3.37Å; S9-F12 PolarHBondContact O-N 3.39Å; F12-T15 WeakPolarHBondContact CA-OG1 3.31Å; F12-T15 PolarHBondContact O-N 2.84Å; F12-T15 PolarHBondContact O-OG1 3.42Å; F12-T15 VanDerWaalsContact O-OG1 3.1Å; F12-V16 HydrophobicContact CD1-CG2 4.32Å; F12-V16 HydrophobicContact CE1-CG2 4.08Å; F12-V16 VanDerWaalsContact O-CG2 3.27Å; F12-V16 WeakPolarHBondContact O-CG2 3.41Å; F12-V16 PolarHBondContact O-N 3.05Å
13	Y	46.4	Very low	43	Very low	77 Å²	77	98 Å²	98	30%	0.302	56%	0.558	S	S	.	*	H	α-helix	trans	-67.3	-40.4	175.6	-168.4	-99.7	0	0	0	112.4	S9 L10 L11 V16 L17	S9-Y13 WeakPolarHBondContact O-CB 3.47Å; S9-Y13 PolarHBondContact O-N 3.08Å; L10-Y13 PolarHBondContact O-N 3.36Å; L11-Y13 VanDerWaalsContact C-N 3.28Å; L11-Y13 PolarHBondContact O-N 3.14Å; Y13-V16 PolarHBondContact O-N 3.41Å; Y13-L17 HydrophobicContact CD1-CD1 4.25Å; Y13-L17 HydrophobicContact CE1-CD1 3.6Å; Y13-L17 PolarHBondContact O-N 2.94Å
14	L	46	Very low	42.8	Very low	83 Å²	83	99.4 Å²	99.4	44%	0.435	57%	0.567	S	S	.	*	H	α-helix	trans	-66	-37.6	176.1	-75.9	164	0	0	0	112.4	L10 L11 L17 N18	L10-L14 WeakPolarHBondContact O-CG 3.35Å; L10-L14 PolarHBondContact O-N 3.4Å; L11-L14 PolarHBondContact O-N 3.29Å; L14-L17 PolarHBondContact O-N 3.13Å; L14-N18 PolarHBondContact O-N 3.3Å
15	T	48.5	Very low	42.6	Very low	95 Å²	95	96.2 Å²	96.2	58%	0.583	57%	0.565	S	S	*	*	H	α-helix	trans	-66.3	-37.8	172.3	21.4	0	0	0	0	112	L11 F12 L17 N18 G19	L11-T15 PolarHBondContact O-N 3.29Å; L11-T15 PolarHBondContact O-OG1 3.24Å; F12-T15 WeakPolarHBondContact CA-OG1 3.31Å; F12-T15 PolarHBondContact O-N 2.84Å; F12-T15 PolarHBondContact O-OG1 3.42Å; F12-T15 VanDerWaalsContact O-OG1 3.1Å; T15-L17 VanDerWaalsContact C-N 3.32Å; T15-N18 PolarHBondContact O-N 3.32Å; T15-G19 PolarHBondContact O-N 3.49Å
16	V	44.7	Very low	42.3	Very low	61 Å²	61	96.1 Å²	96.1	37%	0.37	57%	0.572	S	S	.	*	H	α-helix	trans	-63.7	-39	173.3	171.4	0	0	0	0	111.1	F12 Y13 G19 A23	F12-V16 HydrophobicContact CD1-CG2 4.32Å; F12-V16 HydrophobicContact CE1-CG2 4.08Å; F12-V16 VanDerWaalsContact O-CG2 3.27Å; F12-V16 WeakPolarHBondContact O-CG2 3.41Å; F12-V16 PolarHBondContact O-N 3.05Å; Y13-V16 PolarHBondContact O-N 3.41Å; V16-G19 PolarHBondContact O-N 3.29Å; V16-A23 HydrophobicContact CG1-CB 4.47Å
17	L	44.4	Very low	42	Very low	113 Å²	113	97.3 Å²	97.3	59%	0.592	59%	0.585	S	S	*	*	H	α-helix	trans	-68.2	-37.2	178.9	-130.5	89.3	0	0	0	113.1	Y13 L14 T15 G19	Y13-L17 HydrophobicContact CD1-CD1 4.25Å; Y13-L17 HydrophobicContact CE1-CD1 3.6Å; Y13-L17 PolarHBondContact O-N 2.94Å; L14-L17 PolarHBondContact O-N 3.13Å; T15-L17 VanDerWaalsContact C-N 3.32Å; L17-G19 VanDerWaalsContact C-N 3.32Å
18	N	46	Very low	41.5	Very low	148 Å²	148	96.1 Å²	96.1	79%	0.791	58%	0.582	S	S	*	*	H	α-helix	trans	-76.1	-22.6	175.8	-80.4	-8	0	0	0	112.6	L14 T15 S20	L14-N18 PolarHBondContact O-N 3.3Å; T15-N18 PolarHBondContact O-N 3.32Å; N18-S20 PolarHBondContact O-N 3.01Å; N18-S20 VanDerWaalsContact O-N 3.17Å
19	G	38	Very low	41.1	Very low	47 Å²	47	96.3 Å²	96.3	49%	0.485	59%	0.585	S	S	.	*	S	Bend	trans	-84.5	80.3	177.1	0	0	0	0	0	112	T15 V16 L17 G21	T15-G19 PolarHBondContact O-N 3.49Å; V16-G19 PolarHBondContact O-N 3.29Å; L17-G19 VanDerWaalsContact C-N 3.32Å; G19-G21 PolarHBondContact O-N 3.1Å
20	S	35.3	Very low	40.6	Very low	128 Å²	128	96.8 Å²	96.8	90%	0.895	58%	0.581	S	S	*	*			trans	3	83.2	151.8	162.4	0	0	0	0	114.9	N18	N18-S20 PolarHBondContact O-N 3.01Å; N18-S20 VanDerWaalsContact O-N 3.17Å
21	G	34.1	Very low	40.1	Very low	57 Å²	57	98.8 Å²	98.8	59%	0.588	59%	0.588	S	S	*	*			trans	-172.5	126.8	176.8	0	0	0	0	0	108.8	G19 A23	G19-G21 PolarHBondContact O-N 3.1Å; G21-A23 PolarHBondContact O-N 2.82Å
22	T	34.4	Very low	39.7	Very low	154 Å²	154	101 Å²	101	95%	0.945	60%	0.599	S	S	*	*			trans	-64.5	67.7	178	41.9	0	0	0	0	110.8	T24	T22-T24 PolarHBondContact O-N 3.08Å
23	A	34.4	Very low	39.1	Very low	68 Å²	68	99.5 Å²	99.5	56%	0.562	60%	0.597	S	S	*	*			trans	-82.8	110.5	176.8	0	0	0	0	0	108.2	V16 G21 L25	V16-A23 HydrophobicContact CG1-CB 4.47Å; G21-A23 PolarHBondContact O-N 2.82Å; A23-L25 PolarHBondContact O-N 3.26Å
24	T	35.5	Very low	38.7	Very low	137 Å²	137	101.5 Å²	101.5	84%	0.84	62%	0.62	S	S	*	*			trans	-43.4	121	168	22.8	0	0	0	0	110.1	T22 C26	T22-T24 PolarHBondContact O-N 3.08Å; T24-C26 PolarHBondContact O-N 3.19Å
25	L	33.6	Very low	38.6	Very low	140 Å²	140	104 Å²	104	73%	0.733	62%	0.624	S	S	*	*			trans	-60.4	74.7	-177.9	-107.3	146.1	0	0	0	111.4	A23 V27	A23-L25 PolarHBondContact O-N 3.26Å; L25-V27 PolarHBondContact O-N 3.25Å; L25-V27 VanDerWaalsContact O-N 3.14Å
26	C	34.9	Very low	38.2	Very low	107 Å²	107	104.6 Å²	104.6	72%	0.723	63%	0.629	S	S	*	*			trans	-80.9	92	170.7	-150.9	0	0	0	0	107.2	T24 P28	T24-C26 PolarHBondContact O-N 3.19Å; C26-P28 WeakPolarHBondContact O-CD 3.37Å; C26-P28 VanDerWaalsContact O-N 3.13Å
27	V	37.3	Very low	38.1	Very low	93 Å²	93	108.7 Å²	108.7	56%	0.564	65%	0.648	S	S	*	*			trans	-61.8	111.6	173.6	179	0	0	0	0	107.2	L25 F31	L25-V27 PolarHBondContact O-N 3.25Å; L25-V27 VanDerWaalsContact O-N 3.14Å; V27-F31 HydrophobicContact CG1-CB 4.14Å; V27-F31 HydrophobicContact CG1-CD2 4.21Å; V27-F31 HydrophobicContact CG1-CG 4.49Å
28	P	35	Very low	38.4	Very low	50 Å²	50	109 Å²	109	33%	0.325	66%	0.657	S	S	.	*			trans	-64.3	141.6	-176.9	-11.3	21.8	0	0	0	109.8	C26 M30 F31	C26-P28 WeakPolarHBondContact O-CD 3.37Å; C26-P28 VanDerWaalsContact O-N 3.13Å; P28-M30 PolarHBondContact O-N 2.89Å; P28-F31 PolarHBondContact O-N 3.42Å
29	P	41.1	Very low	38.5	Very low	101 Å²	101	105.8 Å²	105.8	66%	0.656	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-59.1	-12.4	-176.7	21.2	-32	0	0	0	114	F31 L32	P29-F31 PolarHBondContact O-N 3.44Å; P29-L32 HydrophobicContact CB-CD1 4.49Å; P29-L32 VanDerWaalsContact O-CB 3.28Å; P29-L32 WeakPolarHBondContact O-CB 3.34Å; P29-L32 PolarHBondContact O-N 3.47Å
30	M	36.7	Very low	38.9	Very low	81 Å²	81	107.6 Å²	107.6	40%	0.399	64%	0.642	S	S	.	*	G	3₁₀ helix	trans	-58	-31.8	171.7	170.2	174.5	-85.9	0	0	113.5	F6 P28 L32 L33	F6-M30 HydrophobicContact CD2-CE 3.89Å; F6-M30 HydrophobicContact CD2-CG 4.32Å; F6-M30 HydrophobicContact CD2-SD 3.37Å; F6-M30 WeakPolarHBondContact CD2-SD 3.37Å; F6-M30 HydrophobicContact CE2-CE 4.33Å; F6-M30 HydrophobicContact CE2-CG 3.81Å; F6-M30 HydrophobicContact CE2-SD 3.34Å; F6-M30 WeakPolarHBondContact CE2-SD 3.29Å; F6-M30 HydrophobicContact CG-SD 4.49Å; F6-M30 HydrophobicContact CZ-SD 4.44Å; P28-M30 PolarHBondContact O-N 2.89Å; M30-L32 PolarHBondContact O-N 3.38Å; M30-L33 WeakPolarHBondContact O-CB 3.22Å; M30-L33 PolarHBondContact O-N 3.12Å
31	F	42.4	Very low	39.7	Very low	87 Å²	87	104.4 Å²	104.4	38%	0.382	62%	0.624	S	S	.	*	G	3₁₀ helix	trans	-72.1	-11.4	174.5	-75.2	-79.7	0	0	0	113.3	L10 V27 P28 P29 W35	L10-F31 HydrophobicContact CD1-CZ 4.38Å; V27-F31 HydrophobicContact CG1-CB 4.14Å; V27-F31 HydrophobicContact CG1-CD2 4.21Å; V27-F31 HydrophobicContact CG1-CG 4.49Å; P28-F31 PolarHBondContact O-N 3.42Å; P29-F31 PolarHBondContact O-N 3.44Å; F31-W35 HydrophobicContact CD1-CH2 4.18Å; F31-W35 HydrophobicContact CD1-CZ3 4.07Å; F31-W35 HydrophobicContact CE1-CH2 4.18Å
32	L	37.8	Very low	40.5	Very low	149 Å²	149	109.1 Å²	109.1	78%	0.78	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-87.9	-7	172.9	-59.1	170.3	0	0	0	112.6	P29 M30	P29-L32 HydrophobicContact CB-CD1 4.49Å; P29-L32 VanDerWaalsContact O-CB 3.28Å; P29-L32 WeakPolarHBondContact O-CB 3.34Å; P29-L32 PolarHBondContact O-N 3.47Å; M30-L32 PolarHBondContact O-N 3.38Å
33	L	34.5	Very low	41.1	Very low	114 Å²	114	104.7 Å²	104.7	60%	0.597	60%	0.603	S	S	*	*	S	Bend	trans	-75.8	139.4	176	-70.5	169	0	0	0	110.2	M30 W35	M30-L33 WeakPolarHBondContact O-CB 3.22Å; M30-L33 PolarHBondContact O-N 3.12Å; L33-W35 PolarHBondContact O-N 3.34Å
34	P	38.4	Very low	41.5	Very low	119 Å²	119	106 Å²	106	77%	0.773	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-56.6	126.4	173.2	22.9	-31.1	0	0	0	109.3
35	W	43.8	Very low	41.9	Very low	136 Å²	136	108.4 Å²	108.4	52%	0.515	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-58.5	132.6	-172.6	-143.4	-98.7	0	0	0	110.3	F31 L33 L58	F31-W35 HydrophobicContact CD1-CH2 4.18Å; F31-W35 HydrophobicContact CD1-CZ3 4.07Å; F31-W35 HydrophobicContact CE1-CH2 4.18Å; L33-W35 PolarHBondContact O-N 3.34Å; W35-L58 HydrophobicContact CH2-CD2 4.1Å; W35-L58 HydrophobicContact CZ2-CD1 4Å; W35-L58 HydrophobicContact CZ2-CD2 3.65Å; W35-L58 HydrophobicContact CZ2-CG 4.11Å
36	P	40.1	Very low	42.6	Very low	106 Å²	106	108.8 Å²	108.8	69%	0.688	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-65.2	154	178.7	26.8	-32.1	0	0	0	110.8
37	D	43.2	Very low	43.2	Very low	147 Å²	147	108.3 Å²	108.3	79%	0.786	57%	0.573	S	S	*	*	S	Bend	trans	-42.8	150.9	-177.8	-68.6	-50.7	0	0	0	114	I39	D37-I39 PolarHBondContact O-N 2.89Å
38	P	49.2	Very low	43.7	Very low	119 Å²	119	108.8 Å²	108.8	77%	0.773	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-50.9	126.4	-175.7	18.5	-31.4	0	0	0	112
39	I	48.9	Very low	44.8	Very low	81 Å²	81	112.8 Å²	112.8	42%	0.415	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-56.6	127	-178.9	-57.8	169.6	0	0	0	109.3	D37 V43 Q44 L51	D37-I39 PolarHBondContact O-N 2.89Å; I39-V43 HydrophobicContact CG2-CB 3.93Å; I39-V43 HydrophobicContact CG2-CG1 4.07Å; I39-Q44 HydrophobicContact CB-CG 4.17Å; I39-Q44 HydrophobicContact CG2-CG 3.95Å; I39-Q44 PolarHBondContact O-NE2 3.46Å; I39-L51 HydrophobicContact CD1-CD2 4.32Å
40	P	46.3	Very low	45.5	Very low	85 Å²	85	114.1 Å²	114.1	55%	0.552	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-52.8	140.4	177.5	-25.8	33	0	0	0	112.7	E42 V43 Q44	P40-E42 VanDerWaalsContact C-N 3.29Å; P40-E42 PolarHBondContact O-N 3.34Å; P40-V43 HydrophobicContact CB-CG2 4.47Å; P40-V43 PolarHBondContact O-N 2.96Å; P40-Q44 PolarHBondContact O-N 2.87Å
41	A	52.3	Low	45.9	Very low	62 Å²	62	112.5 Å²	112.5	51%	0.512	58%	0.577	S	S	.	*	H	α-helix	trans	-58	-37.8	-172.2	0	0	0	0	0	113.2	V43 Q44 W45	A41-V43 VanDerWaalsContact C-N 3.29Å; A41-V43 PolarHBondContact O-N 2.93Å; A41-Q44 PolarHBondContact O-N 3.47Å; A41-W45 PolarHBondContact O-N 2.77Å
42	E	50.3	Low	46.3	Very low	155 Å²	155	112.4 Å²	112.4	72%	0.724	58%	0.58	S	S	*	*	H	α-helix	trans	-53.6	-43.4	173.9	-89.4	65	-152.2	0	0	112.8	P40 W45 Q46	P40-E42 VanDerWaalsContact C-N 3.29Å; P40-E42 PolarHBondContact O-N 3.34Å; E42-W45 PolarHBondContact O-N 3.39Å; E42-Q46 PolarHBondContact O-N 2.78Å
43	V	47.6	Very low	46.9	Very low	61 Å²	61	108.9 Å²	108.9	37%	0.37	57%	0.566	S	S	.	*	H	α-helix	trans	-73.8	-35.5	-178.3	-175.8	0	0	0	0	110.5	I39 P40 A41 W45 Q46 Y47	I39-V43 HydrophobicContact CG2-CB 3.93Å; I39-V43 HydrophobicContact CG2-CG1 4.07Å; P40-V43 HydrophobicContact CB-CG2 4.47Å; P40-V43 PolarHBondContact O-N 2.96Å; A41-V43 VanDerWaalsContact C-N 3.29Å; A41-V43 PolarHBondContact O-N 2.93Å; V43-W45 VanDerWaalsContact C-N 3.28Å; V43-W45 PolarHBondContact O-N 3.24Å; V43-Q46 PolarHBondContact O-N 3.47Å; V43-Y47 HydrophobicContact CG1-CD2 3.77Å; V43-Y47 HydrophobicContact CG1-CE2 4.15Å; V43-Y47 WeakPolarHBondContact O-CD2 3.31Å; V43-Y47 PolarHBondContact O-N 3.15Å; V43-Y47 VanDerWaalsContact O-N 3.15Å
44	Q	42.2	Very low	47.7	Very low	96 Å²	96	105.3 Å²	105.3	45%	0.449	55%	0.549	S	S	.	.	H	α-helix	trans	-62.2	-36.4	176.5	-68.3	-172.2	14.6	0	0	112.5	I39 P40 A41 K48 L51	I39-Q44 HydrophobicContact CB-CG 4.17Å; I39-Q44 HydrophobicContact CG2-CG 3.95Å; I39-Q44 PolarHBondContact O-NE2 3.46Å; P40-Q44 PolarHBondContact O-N 2.87Å; A41-Q44 PolarHBondContact O-N 3.47Å; Q44-K48 WeakPolarHBondContact O-CA 3.48Å; Q44-K48 WeakPolarHBondContact O-CB 3.48Å; Q44-K48 PolarHBondContact O-N 3.49Å; Q44-K48 VanDerWaalsContact O-N 3.07Å; Q44-L51 HydrophobicContact CB-CD1 4.5Å
45	W	44.6	Very low	48.1	Very low	188 Å²	188	107 Å²	107	71%	0.712	54%	0.544	S	S	*	.	H	α-helix	trans	-72.2	-44.2	177.6	-100.9	107.6	0	0	0	112.5	A41 E42 V43 Y47 K48	A41-W45 PolarHBondContact O-N 2.77Å; E42-W45 PolarHBondContact O-N 3.39Å; V43-W45 VanDerWaalsContact C-N 3.28Å; V43-W45 PolarHBondContact O-N 3.24Å; W45-Y47 VanDerWaalsContact C-N 3.25Å; W45-Y47 PolarHBondContact O-N 3.25Å; W45-K48 HydrophobicContact CE3-CD 4.07Å; W45-K48 HydrophobicContact CZ3-CD 3.98Å; W45-K48 WeakPolarHBondContact O-CB 3.42Å; W45-K48 PolarHBondContact O-N 2.86Å
46	Q	48.5	Very low	48.5	Very low	148 Å²	148	104.6 Å²	104.6	69%	0.692	54%	0.541	S	S	*	.	H	α-helix	trans	-62.7	-34.8	-178.4	-162.3	178	19.4	0	0	112.3	E42 V43	E42-Q46 PolarHBondContact O-N 2.78Å; V43-Q46 PolarHBondContact O-N 3.47Å
47	Y	46.7	Very low	48.7	Very low	97 Å²	97	103.2 Å²	103.2	38%	0.38	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	20.6	-177.7	-63.1	-81	0	0	0	113.2	V43 W45 N49 E50 L51	V43-Y47 HydrophobicContact CG1-CD2 3.77Å; V43-Y47 HydrophobicContact CG1-CE2 4.15Å; V43-Y47 WeakPolarHBondContact O-CD2 3.31Å; V43-Y47 PolarHBondContact O-N 3.15Å; V43-Y47 VanDerWaalsContact O-N 3.15Å; W45-Y47 VanDerWaalsContact C-N 3.25Å; W45-Y47 PolarHBondContact O-N 3.25Å; Y47-N49 VanDerWaalsContact C-N 3.26Å; Y47-N49 PolarHBondContact O-N 3.12Å; Y47-N49 VanDerWaalsContact O-N 3.13Å; Y47-E50 PolarHBondContact O-N 3.5Å; Y47-L51 WeakPolarHBondContact O-CB 3.18Å; Y47-L51 WeakPolarHBondContact O-CG 3.32Å; Y47-L51 PolarHBondContact O-N 3.29Å
48	K	48.5	Very low	48.9	Very low	102 Å²	102	98.6 Å²	98.6	44%	0.443	51%	0.506	S	S	.	.	H	α-helix	trans	-50.5	-43.6	-172.7	-175.9	179.1	177.7	-178.2	0	113.5	Q44 W45 L51 L52	Q44-K48 WeakPolarHBondContact O-CA 3.48Å; Q44-K48 WeakPolarHBondContact O-CB 3.48Å; Q44-K48 PolarHBondContact O-N 3.49Å; Q44-K48 VanDerWaalsContact O-N 3.07Å; W45-K48 HydrophobicContact CE3-CD 4.07Å; W45-K48 HydrophobicContact CZ3-CD 3.98Å; W45-K48 WeakPolarHBondContact O-CB 3.42Å; W45-K48 PolarHBondContact O-N 2.86Å; K48-L51 PolarHBondContact O-N 3.42Å; K48-L52 PolarHBondContact O-N 3.23Å
49	N	58.3	Low	48.9	Very low	135 Å²	135	96.1 Å²	96.1	72%	0.722	49%	0.492	S	S	*	.	H	α-helix	trans	-71.5	-32.3	-179.2	-65.9	-18.8	0	0	0	112.5	Y47	Y47-N49 VanDerWaalsContact C-N 3.26Å; Y47-N49 PolarHBondContact O-N 3.12Å; Y47-N49 VanDerWaalsContact O-N 3.13Å
50	E	55	Low	48.5	Very low	128 Å²	128	96.1 Å²	96.1	60%	0.598	49%	0.492	S	S	*	.	H	α-helix	trans	-79	-30	177.2	-63.5	178.5	-155.1	0	0	111.9	Y47 P53	Y47-E50 PolarHBondContact O-N 3.5Å; E50-P53 WeakPolarHBondContact O-CD 2.95Å; E50-P53 WeakPolarHBondContact O-CG 3.15Å
51	L	44.8	Very low	48.2	Very low	47 Å²	47	95.9 Å²	95.9	25%	0.246	49%	0.488	C	S	.	.	H	α-helix	trans	-82.1	-18.6	-179.3	-77	162.7	0	0	0	113.9	I39 Q44 Y47 K48 V54 K55	I39-L51 HydrophobicContact CD1-CD2 4.32Å; Q44-L51 HydrophobicContact CB-CD1 4.5Å; Y47-L51 WeakPolarHBondContact O-CB 3.18Å; Y47-L51 WeakPolarHBondContact O-CG 3.32Å; Y47-L51 PolarHBondContact O-N 3.29Å; K48-L51 PolarHBondContact O-N 3.42Å; L51-V54 PolarHBondContact O-N 3.23Å; L51-K55 WeakPolarHBondContact O-CB 3.42Å; L51-K55 PolarHBondContact O-N 3.26Å
52	L	52.1	Low	47.7	Very low	85 Å²	85	101.2 Å²	101.2	45%	0.445	50%	0.495	S	S	.	.	H	α-helix	trans	-53.4	-55.7	177.6	-112.5	138.5	0	0	0	113.1	K48 V54 K55 D56	K48-L52 PolarHBondContact O-N 3.23Å; L52-V54 VanDerWaalsContact C-N 3.27Å; L52-V54 PolarHBondContact O-N 3.37Å; L52-K55 WeakPolarHBondContact O-CB 3.43Å; L52-K55 PolarHBondContact O-N 3.02Å; L52-K55 VanDerWaalsContact O-N 3.12Å; L52-D56 PolarHBondContact O-N 3.1Å
53	P	49.4	Very low	47.5	Very low	75 Å²	75	96.6 Å²	96.6	49%	0.487	48%	0.48	S	S	.	.	H	α-helix	trans	-64.8	-31	178.5	23.3	-33.1	0	0	0	112.9	E50 D56 T57	E50-P53 WeakPolarHBondContact O-CD 2.95Å; E50-P53 WeakPolarHBondContact O-CG 3.15Å; P53-D56 PolarHBondContact O-N 2.82Å; P53-T57 WeakPolarHBondContact O-CG2 3.45Å; P53-T57 PolarHBondContact O-N 3.29Å; P53-T57 PolarHBondContact O-OG1 3.48Å
54	V	51	Low	46.9	Very low	39 Å²	39	101.9 Å²	101.9	24%	0.236	49%	0.493	C	S	.	.	H	α-helix	trans	-67.3	-40	175	-178.4	0	0	0	0	110.7	L10 L51 L52 T57 L58	L10-V54 HydrophobicContact CD2-CG2 3.92Å; L51-V54 PolarHBondContact O-N 3.23Å; L52-V54 VanDerWaalsContact C-N 3.27Å; L52-V54 PolarHBondContact O-N 3.37Å; V54-T57 WeakPolarHBondContact CA-OG1 3.45Å; V54-T57 PolarHBondContact O-OG1 2.77Å; V54-L58 HydrophobicContact CG1-CD1 3.96Å; V54-L58 VanDerWaalsContact O-CB 3.26Å; V54-L58 WeakPolarHBondContact O-CB 3.36Å; V54-L58 WeakPolarHBondContact O-CD1 3.43Å; V54-L58 PolarHBondContact O-N 3.17Å
55	K	47.1	Very low	46.9	Very low	154 Å²	154	101.4 Å²	101.4	67%	0.67	49%	0.494	S	S	*	.	H	α-helix	trans	-66	-40.8	176.4	-171.1	-178	177.6	-177	0	111.5	L51 L52 L58 S59	L51-K55 WeakPolarHBondContact O-CB 3.42Å; L51-K55 PolarHBondContact O-N 3.26Å; L52-K55 WeakPolarHBondContact O-CB 3.43Å; L52-K55 PolarHBondContact O-N 3.02Å; L52-K55 VanDerWaalsContact O-N 3.12Å; K55-L58 PolarHBondContact O-N 3.16Å; K55-S59 WeakPolarHBondContact O-CB 3.33Å; K55-S59 PolarHBondContact O-N 3.31Å
56	D	52.3	Low	46.9	Very low	86 Å²	86	99.8 Å²	99.8	46%	0.46	49%	0.492	S	S	.	.	H	α-helix	trans	-67.5	-46.1	178.9	-67.4	-18.9	0	0	0	111	L52 P53 L58 S59 I60	L52-D56 PolarHBondContact O-N 3.1Å; P53-D56 PolarHBondContact O-N 2.82Å; D56-L58 PolarHBondContact O-N 3.39Å; D56-S59 WeakPolarHBondContact O-CB 3.34Å; D56-S59 PolarHBondContact O-N 2.9Å; D56-S59 VanDerWaalsContact O-N 3.11Å; D56-S59 PolarHBondContact O-OG 2.67Å; D56-I60 WeakPolarHBondContact O-CG1 3.44Å; D56-I60 PolarHBondContact O-N 2.94Å; D56-I60 VanDerWaalsContact O-N 3.1Å
57	T	45.1	Very low	46.8	Very low	78 Å²	78	96.5 Å²	96.5	48%	0.479	48%	0.482	S	S	.	.	H	α-helix	trans	-61.7	-42.1	173.7	46.5	0	0	0	0	112.4	P53 V54 S59 I60 V61	P53-T57 WeakPolarHBondContact O-CG2 3.45Å; P53-T57 PolarHBondContact O-N 3.29Å; P53-T57 PolarHBondContact O-OG1 3.48Å; V54-T57 WeakPolarHBondContact CA-OG1 3.45Å; V54-T57 PolarHBondContact O-OG1 2.77Å; T57-S59 VanDerWaalsContact C-N 3.27Å; T57-S59 PolarHBondContact O-N 2.98Å; T57-I60 PolarHBondContact O-N 3.08Å; T57-V61 WeakPolarHBondContact O-CG2 3.3Å; T57-V61 PolarHBondContact O-N 3.27Å
58	L	46.2	Very low	46.6	Very low	50 Å²	50	96 Å²	96	26%	0.262	48%	0.483	S	S	.	.	H	α-helix	trans	-59.8	-36.7	172.8	-95.5	155.7	0	0	0	112.7	W35 V54 K55 D56 I60 V61 R62	W35-L58 HydrophobicContact CH2-CD2 4.1Å; W35-L58 HydrophobicContact CZ2-CD1 4Å; W35-L58 HydrophobicContact CZ2-CD2 3.65Å; W35-L58 HydrophobicContact CZ2-CG 4.11Å; V54-L58 HydrophobicContact CG1-CD1 3.96Å; V54-L58 VanDerWaalsContact O-CB 3.26Å; V54-L58 WeakPolarHBondContact O-CB 3.36Å; V54-L58 WeakPolarHBondContact O-CD1 3.43Å; V54-L58 PolarHBondContact O-N 3.17Å; K55-L58 PolarHBondContact O-N 3.16Å; D56-L58 PolarHBondContact O-N 3.39Å; L58-I60 VanDerWaalsContact C-N 3.34Å; L58-V61 PolarHBondContact O-N 2.88Å; L58-R62 VanDerWaalsContact O-CB 3.26Å; L58-R62 WeakPolarHBondContact O-CB 3.49Å; L58-R62 PolarHBondContact O-N 3.13Å
59	S	48.7	Very low	46.6	Very low	67 Å²	67	95.6 Å²	95.6	47%	0.469	49%	0.486	S	S	.	.	H	α-helix	trans	-67.2	-37	177.6	82.3	0	0	0	0	111.9	K55 D56 T57 R62 S63	K55-S59 WeakPolarHBondContact O-CB 3.33Å; K55-S59 PolarHBondContact O-N 3.31Å; D56-S59 WeakPolarHBondContact O-CB 3.34Å; D56-S59 PolarHBondContact O-N 2.9Å; D56-S59 VanDerWaalsContact O-N 3.11Å; D56-S59 PolarHBondContact O-OG 2.67Å; T57-S59 VanDerWaalsContact C-N 3.27Å; T57-S59 PolarHBondContact O-N 2.98Å; S59-R62 PolarHBondContact O-N 2.78Å; S59-S63 WeakPolarHBondContact O-CB 3.28Å; S59-S63 PolarHBondContact O-N 3.45Å
60	I	41.3	Very low	46.1	Very low	81 Å²	81	91.4 Å²	91.4	42%	0.415	47%	0.47	S	S	.	.	H	α-helix	trans	-68	-46.4	174.9	-63.9	165	0	0	0	110.3	D56 T57 L58 R62 S63 W64	D56-I60 WeakPolarHBondContact O-CG1 3.44Å; D56-I60 PolarHBondContact O-N 2.94Å; D56-I60 VanDerWaalsContact O-N 3.1Å; T57-I60 PolarHBondContact O-N 3.08Å; L58-I60 VanDerWaalsContact C-N 3.34Å; I60-R62 VanDerWaalsContact C-N 3.31Å; I60-R62 PolarHBondContact O-N 3.07Å; I60-S63 PolarHBondContact O-N 3.1Å; I60-S63 PolarHBondContact O-OG 3.45Å; I60-W64 HydrophobicContact CG2-CD2 4.23Å; I60-W64 HydrophobicContact CG2-CZ2 3.93Å; I60-W64 PolarHBondContact O-N 3.49Å
61	V	41	Very low	45.6	Very low	79 Å²	79	90.9 Å²	90.9	48%	0.479	47%	0.471	S	S	.	.	H	α-helix	trans	-62.2	-40.6	176.9	175	0	0	0	0	111	T57 L58 S63 W64 N65	T57-V61 WeakPolarHBondContact O-CG2 3.3Å; T57-V61 PolarHBondContact O-N 3.27Å; L58-V61 PolarHBondContact O-N 2.88Å; V61-S63 VanDerWaalsContact C-N 3.34Å; V61-S63 PolarHBondContact O-N 3.04Å; V61-W64 PolarHBondContact O-N 3.18Å; V61-N65 PolarHBondContact O-N 3.18Å
62	R	40.5	Very low	45.7	Very low	174 Å²	174	95.7 Å²	95.7	66%	0.657	49%	0.485	S	S	*	.	H	α-helix	trans	-68.5	-32.6	177.7	-165.7	-177.3	-80.2	163.1	-7.4	112.1	L58 S59 I60 K66	L58-R62 VanDerWaalsContact O-CB 3.26Å; L58-R62 WeakPolarHBondContact O-CB 3.49Å; L58-R62 PolarHBondContact O-N 3.13Å; S59-R62 PolarHBondContact O-N 2.78Å; I60-R62 VanDerWaalsContact C-N 3.31Å; I60-R62 PolarHBondContact O-N 3.07Å; R62-K66 PolarHBondContact O-N 3.17Å
63	S	45.9	Very low	45.8	Very low	58 Å²	58	94.7 Å²	94.7	41%	0.406	49%	0.486	S	S	.	.	H	α-helix	trans	-70.5	-39.4	173.8	75.1	0	0	0	0	111.3	S59 I60 V61 N65 K66 T67	S59-S63 WeakPolarHBondContact O-CB 3.28Å; S59-S63 PolarHBondContact O-N 3.45Å; I60-S63 PolarHBondContact O-N 3.1Å; I60-S63 PolarHBondContact O-OG 3.45Å; V61-S63 VanDerWaalsContact C-N 3.34Å; V61-S63 PolarHBondContact O-N 3.04Å; S63-N65 PolarHBondContact O-N 3.16Å; S63-K66 PolarHBondContact O-N 3.48Å; S63-T67 WeakPolarHBondContact O-CG2 3.33Å; S63-T67 PolarHBondContact O-N 3.44Å; S63-T67 VanDerWaalsContact O-N 3.08Å
64	W	36.6	Very low	45.8	Very low	172 Å²	172	97.2 Å²	97.2	65%	0.652	49%	0.489	S	S	*	.	H	α-helix	trans	-61.8	-41.4	172.6	-70.3	-4.9	0	0	0	112.6	I60 V61 K66 T67 E68	I60-W64 HydrophobicContact CG2-CD2 4.23Å; I60-W64 HydrophobicContact CG2-CZ2 3.93Å; I60-W64 PolarHBondContact O-N 3.49Å; V61-W64 PolarHBondContact O-N 3.18Å; W64-K66 VanDerWaalsContact C-N 3.35Å; W64-K66 PolarHBondContact O-N 3.41Å; W64-T67 VanDerWaalsContact CA-OG1 3.31Å; W64-T67 WeakPolarHBondContact CA-OG1 3.09Å; W64-T67 WeakPolarHBondContact O-CA 3.33Å; W64-T67 PolarHBondContact O-N 3.31Å; W64-T67 PolarHBondContact O-OG1 3.32Å; W64-E68 PolarHBondContact O-N 3.18Å
65	N	41.7	Very low	45.5	Very low	87 Å²	87	98.4 Å²	98.4	47%	0.465	49%	0.492	S	S	.	.	H	α-helix	trans	-65	-39.9	178.5	-156.1	32.7	0	0	0	111.8	V61 S63 T67 E68 D69	V61-N65 PolarHBondContact O-N 3.18Å; S63-N65 PolarHBondContact O-N 3.16Å; N65-T67 VanDerWaalsContact C-N 3.27Å; N65-T67 PolarHBondContact O-N 2.85Å; N65-E68 PolarHBondContact O-N 2.99Å; N65-D69 PolarHBondContact O-N 3.43Å
66	K	45.3	Very low	45.6	Very low	153 Å²	153	99.5 Å²	99.5	67%	0.665	49%	0.492	S	S	*	.	H	α-helix	trans	-59.6	-37.5	171.4	-75	-179.9	178.6	-176.8	0	112.2	R62 S63 W64 A70	R62-K66 PolarHBondContact O-N 3.17Å; S63-K66 PolarHBondContact O-N 3.48Å; W64-K66 VanDerWaalsContact C-N 3.35Å; W64-K66 PolarHBondContact O-N 3.41Å; K66-A70 WeakPolarHBondContact O-CB 3.37Å; K66-A70 PolarHBondContact O-N 3.18Å; K66-A70 VanDerWaalsContact O-N 3.08Å
67	T	45.1	Very low	45.6	Very low	80 Å²	80	105.1 Å²	105.1	49%	0.491	51%	0.507	S	S	.	.	H	α-helix	trans	-70.5	-35.4	175.9	56.9	0	0	0	0	112.5	S63 W64 N65 A70 L71	S63-T67 WeakPolarHBondContact O-CG2 3.33Å; S63-T67 PolarHBondContact O-N 3.44Å; S63-T67 VanDerWaalsContact O-N 3.08Å; W64-T67 VanDerWaalsContact CA-OG1 3.31Å; W64-T67 WeakPolarHBondContact CA-OG1 3.09Å; W64-T67 WeakPolarHBondContact O-CA 3.33Å; W64-T67 PolarHBondContact O-N 3.31Å; W64-T67 PolarHBondContact O-OG1 3.32Å; N65-T67 VanDerWaalsContact C-N 3.27Å; N65-T67 PolarHBondContact O-N 2.85Å; T67-A70 PolarHBondContact O-N 2.98Å; T67-L71 WeakPolarHBondContact O-CB 3.12Å; T67-L71 WeakPolarHBondContact O-CD1 3.36Å; T67-L71 WeakPolarHBondContact O-CG 2.86Å; T67-L71 PolarHBondContact O-N 3.5Å
68	E	42.8	Very low	45.6	Very low	85 Å²	85	103 Å²	103	40%	0.397	49%	0.492	S	S	.	.	H	α-helix	trans	-67.5	-44.1	175.6	-165.7	-175.7	154.8	0	0	111.7	W64 N65 A70 L71 R72	W64-E68 PolarHBondContact O-N 3.18Å; N65-E68 PolarHBondContact O-N 2.99Å; E68-A70 VanDerWaalsContact C-N 3.33Å; E68-A70 PolarHBondContact O-N 3.01Å; E68-L71 CarbonylContact O-C 3.59Å; E68-L71 WeakPolarHBondContact O-CA 3.4Å; E68-L71 WeakPolarHBondContact O-CB 3.35Å; E68-L71 PolarHBondContact O-N 3.18Å; E68-L71 VanDerWaalsContact O-N 3.12Å; E68-R72 WeakPolarHBondContact O-CG 3.47Å; E68-R72 PolarHBondContact O-N 3.39Å; E68-R72 IonicContact OE1-CZ 3.46Å; E68-R72 IonicContact OE1-NE 3.19Å; E68-R72 PolarHBondContact OE1-NE 2.86Å; E68-R72 IonicContact OE1-NH2 2.83Å; E68-R72 PolarHBondContact OE1-NH2 3.18Å
69	D	49	Very low	45.3	Very low	95 Å²	95	104 Å²	104	51%	0.508	50%	0.496	S	S	.	.	H	α-helix	trans	-63.5	-39.3	175.8	-77.3	-30.5	0	0	0	112	N65 L71 R72 S73	N65-D69 PolarHBondContact O-N 3.43Å; D69-L71 VanDerWaalsContact C-N 3.31Å; D69-L71 PolarHBondContact O-N 3.26Å; D69-R72 PolarHBondContact O-N 2.91Å; D69-S73 PolarHBondContact O-N 3.45Å; D69-S73 PolarHBondContact O-OG 3.22Å; D69-S73 VanDerWaalsContact O-OG 3.12Å
70	A	47.1	Very low	45.2	Very low	47 Å²	47	108.4 Å²	108.4	39%	0.388	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-38.3	172.7	0	0	0	0	0	111.8	K66 T67 E68 S73 K74	K66-A70 WeakPolarHBondContact O-CB 3.37Å; K66-A70 PolarHBondContact O-N 3.18Å; K66-A70 VanDerWaalsContact O-N 3.08Å; T67-A70 PolarHBondContact O-N 2.98Å; E68-A70 VanDerWaalsContact C-N 3.33Å; E68-A70 PolarHBondContact O-N 3.01Å; A70-S73 PolarHBondContact O-OG 2.82Å; A70-K74 WeakPolarHBondContact O-CG 3.42Å; A70-K74 PolarHBondContact O-N 3.13Å; A70-K74 VanDerWaalsContact O-N 3.13Å
71	L	45	Very low	45.4	Very low	116 Å²	116	110.4 Å²	110.4	61%	0.607	52%	0.518	S	S	*	.	H	α-helix	trans	-66	-45.1	173.5	-81.4	159.5	0	0	0	111.6	T67 E68 D69 S73 K74 Q75	T67-L71 WeakPolarHBondContact O-CB 3.12Å; T67-L71 WeakPolarHBondContact O-CD1 3.36Å; T67-L71 WeakPolarHBondContact O-CG 2.86Å; T67-L71 PolarHBondContact O-N 3.5Å; E68-L71 CarbonylContact O-C 3.59Å; E68-L71 WeakPolarHBondContact O-CA 3.4Å; E68-L71 WeakPolarHBondContact O-CB 3.35Å; E68-L71 PolarHBondContact O-N 3.18Å; E68-L71 VanDerWaalsContact O-N 3.12Å; D69-L71 VanDerWaalsContact C-N 3.31Å; D69-L71 PolarHBondContact O-N 3.26Å; L71-S73 PolarHBondContact O-N 2.98Å; L71-K74 PolarHBondContact O-N 3.34Å; L71-Q75 WeakPolarHBondContact O-CB 3.36Å; L71-Q75 PolarHBondContact O-N 2.83Å
72	R	47	Very low	45.6	Very low	148 Å²	148	108.5 Å²	108.5	56%	0.558	50%	0.504	S	S	*	.	H	α-helix	trans	-64.9	-37.1	178.8	-73.3	-175.9	-176	-130.5	5.4	113	E68 D69 Q75 R76	E68-R72 WeakPolarHBondContact O-CG 3.47Å; E68-R72 PolarHBondContact O-N 3.39Å; E68-R72 IonicContact OE1-CZ 3.46Å; E68-R72 IonicContact OE1-NE 3.19Å; E68-R72 PolarHBondContact OE1-NE 2.86Å; E68-R72 IonicContact OE1-NH2 2.83Å; E68-R72 PolarHBondContact OE1-NH2 3.18Å; D69-R72 PolarHBondContact O-N 2.91Å; R72-Q75 WeakPolarHBondContact O-CB 3.44Å; R72-Q75 PolarHBondContact O-N 3.21Å; R72-R76 PolarHBondContact O-N 2.9Å; R72-R76 VanDerWaalsContact O-N 3.14Å
73	S	52.9	Low	45.2	Very low	64 Å²	64	107.4 Å²	107.4	45%	0.448	51%	0.509	S	S	.	.	H	α-helix	trans	-71	-39.9	176.5	59.9	0	0	0	0	112.4	D69 A70 L71 Q75 R76 R77	D69-S73 PolarHBondContact O-N 3.45Å; D69-S73 PolarHBondContact O-OG 3.22Å; D69-S73 VanDerWaalsContact O-OG 3.12Å; A70-S73 PolarHBondContact O-OG 2.82Å; L71-S73 PolarHBondContact O-N 2.98Å; S73-Q75 VanDerWaalsContact C-N 3.28Å; S73-Q75 PolarHBondContact O-N 2.86Å; S73-R76 PolarHBondContact O-N 3.33Å; S73-R77 PolarHBondContact O-N 2.81Å
74	K	49.9	Very low	45.1	Very low	129 Å²	129	107.6 Å²	107.6	56%	0.561	52%	0.52	S	S	*	.	H	α-helix	trans	-58.1	-43	169.1	-77.2	-177	178.9	-175.7	0	111	A70 L71 R76 R77 I78	A70-K74 WeakPolarHBondContact O-CG 3.42Å; A70-K74 PolarHBondContact O-N 3.13Å; A70-K74 VanDerWaalsContact O-N 3.13Å; L71-K74 PolarHBondContact O-N 3.34Å; K74-R76 PolarHBondContact O-N 3.4Å; K74-R77 PolarHBondContact O-N 2.99Å; K74-I78 WeakPolarHBondContact O-CD1 3.25Å; K74-I78 VanDerWaalsContact O-CG1 3.29Å; K74-I78 WeakPolarHBondContact O-CG1 3.44Å; K74-I78 PolarHBondContact O-N 2.86Å
75	Q	44.4	Very low	45.3	Very low	64 Å²	64	107.1 Å²	107.1	30%	0.299	52%	0.522	S	S	.	.	H	α-helix	trans	-58.1	-44.5	177.7	-169.9	65.5	26.8	0	0	112.9	L71 R72 S73 I78 E79	L71-Q75 WeakPolarHBondContact O-CB 3.36Å; L71-Q75 PolarHBondContact O-N 2.83Å; R72-Q75 WeakPolarHBondContact O-CB 3.44Å; R72-Q75 PolarHBondContact O-N 3.21Å; S73-Q75 VanDerWaalsContact C-N 3.28Å; S73-Q75 PolarHBondContact O-N 2.86Å; Q75-I78 WeakPolarHBondContact O-CB 3.48Å; Q75-I78 PolarHBondContact O-N 3.13Å; Q75-E79 WeakPolarHBondContact O-CG 3.44Å; Q75-E79 PolarHBondContact O-N 3.07Å
76	R	49.6	Very low	45	Very low	176 Å²	176	108.6 Å²	108.6	66%	0.664	53%	0.53	S	S	*	.	H	α-helix	trans	-67.9	-37.1	179.8	-81.6	-168.3	-110	154.6	-5.9	113.8	R72 S73 K74 I78 E79 Q80	R72-R76 PolarHBondContact O-N 2.9Å; R72-R76 VanDerWaalsContact O-N 3.14Å; S73-R76 PolarHBondContact O-N 3.33Å; K74-R76 PolarHBondContact O-N 3.4Å; R76-I78 PolarHBondContact O-N 3.45Å; R76-E79 PolarHBondContact O-N 3.19Å; R76-Q80 PolarHBondContact O-N 3.4Å
77	R	51.8	Low	44.8	Very low	204 Å²	204	108 Å²	108	77%	0.77	53%	0.532	S	S	*	.	H	α-helix	trans	-62.8	-36.6	175.5	-83	-173.3	178.8	171.7	1.1	111.7	S73 K74 M81	S73-R77 PolarHBondContact O-N 2.81Å; K74-R77 PolarHBondContact O-N 2.99Å; R77-M81 PolarHBondContact O-N 3.35Å
78	I	46	Very low	44.6	Very low	33 Å²	33	108.8 Å²	108.8	17%	0.169	53%	0.533	C	S	.	.	H	α-helix	trans	-64.3	-44	177.1	-74.9	165.1	0	0	0	111.4	K74 Q75 R76 Q80 M81 L82 M179 A180	K74-I78 WeakPolarHBondContact O-CD1 3.25Å; K74-I78 VanDerWaalsContact O-CG1 3.29Å; K74-I78 WeakPolarHBondContact O-CG1 3.44Å; K74-I78 PolarHBondContact O-N 2.86Å; Q75-I78 WeakPolarHBondContact O-CB 3.48Å; Q75-I78 PolarHBondContact O-N 3.13Å; R76-I78 PolarHBondContact O-N 3.45Å; I78-Q80 VanDerWaalsContact C-N 3.3Å; I78-Q80 PolarHBondContact O-N 3.46Å; I78-M81 PolarHBondContact O-N 2.96Å; I78-L82 HydrophobicContact CG2-CD1 4.08Å; I78-L82 PolarHBondContact O-N 2.84Å; I78-M179 WeakPolarHBondContact CD1-O 3.48Å; I78-A180 HydrophobicContact CB-CB 4.33Å; I78-A180 HydrophobicContact CG1-CB 4.45Å; I78-A180 HydrophobicContact CG2-CB 3.08Å
79	E	40.3	Very low	44.5	Very low	73 Å²	73	109.1 Å²	109.1	34%	0.341	54%	0.543	S	S	.	.	H	α-helix	trans	-56.6	-42.5	179	-71.6	178	156.2	0	0	112.4	Q75 R76 M81 M83 R183	Q75-E79 WeakPolarHBondContact O-CG 3.44Å; Q75-E79 PolarHBondContact O-N 3.07Å; R76-E79 PolarHBondContact O-N 3.19Å; E79-M81 VanDerWaalsContact C-N 3.35Å; E79-M81 PolarHBondContact O-N 3.41Å; E79-M83 WeakPolarHBondContact O-CG 3.36Å; E79-M83 PolarHBondContact O-N 3.46Å; E79-R183 IonicContact OE1-NH1 3.29Å; E79-R183 PolarHBondContact OE1-NH1 3.02Å
80	Q	45.9	Very low	44.2	Very low	159 Å²	159	111.8 Å²	111.8	74%	0.743	55%	0.552	S	S	*	*	H	α-helix	trans	-68.5	-33.1	-179.7	-70.6	-177.1	-16.7	0	0	112.9	R76 I78	R76-Q80 PolarHBondContact O-N 3.4Å; I78-Q80 VanDerWaalsContact C-N 3.3Å; I78-Q80 PolarHBondContact O-N 3.46Å
81	M	44.8	Very low	43.9	Very low	122 Å²	122	114 Å²	114	60%	0.601	56%	0.557	S	S	*	*	H	α-helix	trans	-74.9	-34.9	-177.4	-166	176.6	148	0	0	112.2	R77 I78 E79 G84	R77-M81 PolarHBondContact O-N 3.35Å; I78-M81 PolarHBondContact O-N 2.96Å; E79-M81 VanDerWaalsContact C-N 3.35Å; E79-M81 PolarHBondContact O-N 3.41Å; M81-G84 PolarHBondContact O-N 2.83Å
82	L	44.8	Very low	43.5	Very low	39 Å²	39	112 Å²	112	20%	0.204	55%	0.547	C	S	.	.	H	α-helix	trans	-70.4	-40.4	178.4	-76.7	168.5	0	0	0	112.9	I78 G84 K85 L86 A180	I78-L82 HydrophobicContact CG2-CD1 4.08Å; I78-L82 PolarHBondContact O-N 2.84Å; L82-G84 PolarHBondContact O-N 2.71Å; L82-G84 VanDerWaalsContact O-N 3.12Å; L82-K85 PolarHBondContact O-N 2.99Å; L82-K85 VanDerWaalsContact O-N 3.08Å; L82-L86 HydrophobicContact CD2-CD1 4.13Å; L82-L86 PolarHBondContact O-N 3.29Å; L82-A180 HydrophobicContact CD1-CB 3.97Å
83	M	34.1	Very low	43.1	Very low	151 Å²	151	113.5 Å²	113.5	74%	0.744	56%	0.557	S	S	*	*	H	α-helix	trans	-59.7	-26.4	178.4	-69.2	-61.6	-65.8	0	0	112.7	E79	E79-M83 WeakPolarHBondContact O-CG 3.36Å; E79-M83 PolarHBondContact O-N 3.46Å
84	G	42.9	Very low	42.6	Very low	62 Å²	62	114.9 Å²	114.9	64%	0.639	57%	0.567	S	S	*	*	H	α-helix	trans	-79.6	-23.8	177.8	0	0	0	0	0	115.1	M81 L82	M81-G84 PolarHBondContact O-N 2.83Å; L82-G84 PolarHBondContact O-N 2.71Å; L82-G84 VanDerWaalsContact O-N 3.12Å
85	K	40.3	Very low	41.8	Very low	163 Å²	163	112.4 Å²	112.4	71%	0.709	56%	0.558	S	S	*	*	H	α-helix	trans	-108.6	-19.3	-172.6	-73.9	-161.3	175	-169.1	0	115	L82 I87	L82-K85 PolarHBondContact O-N 2.99Å; L82-K85 VanDerWaalsContact O-N 3.08Å; K85-I87 VanDerWaalsContact C-N 3.26Å; K85-I87 PolarHBondContact O-N 2.78Å
86	L	36.5	Very low	41.7	Very low	117 Å²	117	111.1 Å²	111.1	61%	0.613	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	8.8	-173.2	-117.5	85.5	0	0	0	115.5	L82 D88	L82-L86 HydrophobicContact CD2-CD1 4.13Å; L82-L86 PolarHBondContact O-N 3.29Å; L86-D88 VanDerWaalsContact C-N 3.29Å; L86-D88 PolarHBondContact O-N 3.32Å
87	I	40.3	Very low	41.5	Very low	141 Å²	141	106.3 Å²	106.3	72%	0.723	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-17.9	-176.1	-64.9	173.5	0	0	0	112.4	K85 P89	K85-I87 VanDerWaalsContact C-N 3.26Å; K85-I87 PolarHBondContact O-N 2.78Å; I87-P89 WeakPolarHBondContact O-CD 3.36Å
88	D	41	Very low	41.1	Very low	96 Å²	96	103 Å²	103	51%	0.513	54%	0.538	S	S	.	.			trans	-115.8	102.7	-172.8	-126.6	-36.3	0	0	0	115.4	L86 E90 L91	L86-D88 VanDerWaalsContact C-N 3.29Å; L86-D88 PolarHBondContact O-N 3.32Å; D88-E90 VanDerWaalsContact C-N 3.26Å; D88-E90 PolarHBondContact O-N 3.14Å; D88-L91 WeakPolarHBondContact O-CB 3.3Å; D88-L91 PolarHBondContact O-N 3.34Å
89	P	41.2	Very low	41.1	Very low	92 Å²	92	109.2 Å²	109.2	60%	0.597	56%	0.563	S	S	*	*	H	α-helix	trans	-69.1	-16.1	-178.5	25.9	-33	0	0	0	114.6	I87 L92 K93	I87-P89 WeakPolarHBondContact O-CD 3.36Å; P89-L92 PolarHBondContact O-N 3.33Å; P89-K93 PolarHBondContact O-N 3.35Å
90	E	41.9	Very low	41.2	Very low	151 Å²	151	109.2 Å²	109.2	71%	0.706	56%	0.562	S	S	*	*	H	α-helix	trans	-68.9	-36.2	173.3	-74.3	-158.6	152	0	0	112.3	D88 L92 K93 S94	D88-E90 VanDerWaalsContact C-N 3.26Å; D88-E90 PolarHBondContact O-N 3.14Å; E90-L92 PolarHBondContact O-N 3.42Å; E90-K93 PolarHBondContact O-N 3.46Å; E90-K93 VanDerWaalsContact O-N 3.14Å; E90-S94 PolarHBondContact O-N 3.4Å
91	L	40.4	Very low	41.2	Very low	94 Å²	94	102.6 Å²	102.6	49%	0.492	53%	0.532	S	S	.	.	H	α-helix	trans	-62.6	-34.9	176.2	-120.2	149.3	0	0	0	111.4	D88 S94 M95	D88-L91 WeakPolarHBondContact O-CB 3.3Å; D88-L91 PolarHBondContact O-N 3.34Å; L91-S94 PolarHBondContact O-N 2.91Å; L91-S94 PolarHBondContact O-OG 2.82Å; L91-M95 HydrophobicContact CD2-CE 3.75Å; L91-M95 HydrophobicContact CD2-SD 4.39Å; L91-M95 WeakPolarHBondContact O-CG 3.33Å; L91-M95 PolarHBondContact O-N 3.03Å
92	L	37.4	Very low	41.1	Very low	75 Å²	75	99 Å²	99	39%	0.393	52%	0.519	S	S	.	.	H	α-helix	trans	-68	-36.9	176.4	-162.6	73.6	0	0	0	112.1	P89 E90 M95 I96 L191	P89-L92 PolarHBondContact O-N 3.33Å; E90-L92 PolarHBondContact O-N 3.42Å; L92-M95 PolarHBondContact O-N 3.23Å; L92-I96 HydrophobicContact CD1-CD1 4.11Å; L92-I96 HydrophobicContact CD2-CD1 4.35Å; L92-I96 HydrophobicContact CG-CD1 3.77Å; L92-I96 WeakPolarHBondContact O-CG1 3.49Å; L92-I96 PolarHBondContact O-N 3.23Å; L92-L191 HydrophobicContact CD2-CD1 4.12Å
93	K	38.5	Very low	41.2	Very low	179 Å²	179	101.7 Å²	101.7	78%	0.778	53%	0.532	S	S	*	.	H	α-helix	trans	-67.1	-34.7	176.4	-83.4	-179.7	180	170	0	112.6	P89 E90	P89-K93 PolarHBondContact O-N 3.35Å; E90-K93 PolarHBondContact O-N 3.46Å; E90-K93 VanDerWaalsContact O-N 3.14Å
94	S	41.4	Very low	41.7	Very low	93 Å²	93	94.8 Å²	94.8	65%	0.65	50%	0.498	S	S	*	.	H	α-helix	trans	-75.1	-27.8	178.4	56.7	0	0	0	0	113.2	E90 L91	E90-S94 PolarHBondContact O-N 3.4Å; L91-S94 PolarHBondContact O-N 2.91Å; L91-S94 PolarHBondContact O-OG 2.82Å
95	M	33.3	Very low	41.8	Very low	77 Å²	77	92.5 Å²	92.5	38%	0.379	47%	0.473	S	S	.	.	H	α-helix	trans	-81.9	-25.9	-177.9	-74.1	-175	167.4	0	0	113.9	L91 L92 E174	L91-M95 HydrophobicContact CD2-CE 3.75Å; L91-M95 HydrophobicContact CD2-SD 4.39Å; L91-M95 WeakPolarHBondContact O-CG 3.33Å; L91-M95 PolarHBondContact O-N 3.03Å; L92-M95 PolarHBondContact O-N 3.23Å; M95-E174 WeakPolarHBondContact CE-OE2 3.44Å
96	I	43.1	Very low	42.1	Very low	36 Å²	36	88.7 Å²	88.7	19%	0.185	46%	0.46	C	S	.	.			trans	-93	111	-170.5	-65.8	172.1	0	0	0	111.8	L92 L98 L101 L171	L92-I96 HydrophobicContact CD1-CD1 4.11Å; L92-I96 HydrophobicContact CD2-CD1 4.35Å; L92-I96 HydrophobicContact CG-CD1 3.77Å; L92-I96 WeakPolarHBondContact O-CG1 3.49Å; L92-I96 PolarHBondContact O-N 3.23Å; I96-L98 PolarHBondContact O-N 2.75Å; I96-L98 VanDerWaalsContact O-N 3.12Å; I96-L101 HydrophobicContact CG2-CB 4.17Å; I96-L101 HydrophobicContact CG2-CD2 4.01Å; I96-L171 HydrophobicContact CB-CD2 4.39Å; I96-L171 HydrophobicContact CG1-CD2 4.28Å; I96-L171 HydrophobicContact CG2-CD2 3.53Å
97	D	46.1	Very low	42.6	Very low	76 Å²	76	86.2 Å²	86.2	41%	0.406	45%	0.449	S	S	.	.			trans	-67	106.8	168	-177.7	-14	0	0	0	110.3	K99 K100 L101	D97-K99 PolarHBondContact O-N 2.88Å; D97-K99 VanDerWaalsContact O-N 3.15Å; D97-K99 VanDerWaalsContact OD1-CB 3.32Å; D97-K99 WeakPolarHBondContact OD1-CB 3.49Å; D97-K99 PolarHBondContact OD1-N 2.91Å; D97-K100 HydrophobicContact CB-CB 4.28Å; D97-K100 HydrophobicContact CB-CD 4.05Å; D97-K100 HydrophobicContact CB-CG 4.1Å; D97-K100 PolarHBondContact O-N 3.47Å; D97-K100 VanDerWaalsContact O-N 3.1Å; D97-L101 PolarHBondContact O-N 2.9Å
98	L	43.7	Very low	42.9	Very low	134 Å²	134	81.9 Å²	81.9	70%	0.702	43%	0.428	S	S	*	.	H	α-helix	trans	-57.2	-28.8	-178.7	-70.1	171.8	0	0	0	113.5	I96 L101 S102	I96-L98 PolarHBondContact O-N 2.75Å; I96-L98 VanDerWaalsContact O-N 3.12Å; L98-L101 HydrophobicContact CD2-CD2 4.42Å; L98-S102 PolarHBondContact O-N 3.32Å
99	K	44.2	Very low	43.2	Very low	164 Å²	164	80 Å²	80	71%	0.713	42%	0.419	S	S	*	.	H	α-helix	trans	-69.6	-43.9	178.2	-170.1	178.9	179	-176.9	0	110.3	D97 S102 I103	D97-K99 PolarHBondContact O-N 2.88Å; D97-K99 VanDerWaalsContact O-N 3.15Å; D97-K99 VanDerWaalsContact OD1-CB 3.32Å; D97-K99 WeakPolarHBondContact OD1-CB 3.49Å; D97-K99 PolarHBondContact OD1-N 2.91Å; K99-S102 PolarHBondContact O-N 3.23Å; K99-I103 WeakPolarHBondContact O-CG1 3.48Å; K99-I103 PolarHBondContact O-N 3.43Å; K99-I103 VanDerWaalsContact O-N 3.16Å
100	K	44.2	Very low	43.4	Very low	73 Å²	73	82.5 Å²	82.5	32%	0.317	42%	0.421	S	S	.	.	H	α-helix	trans	-64.9	-42.3	175	-64.9	-176.7	-177.3	-178	0	111.4	D97 S102 I103 M104 L170	D97-K100 HydrophobicContact CB-CB 4.28Å; D97-K100 HydrophobicContact CB-CD 4.05Å; D97-K100 HydrophobicContact CB-CG 4.1Å; D97-K100 PolarHBondContact O-N 3.47Å; D97-K100 VanDerWaalsContact O-N 3.1Å; K100-S102 VanDerWaalsContact C-N 3.32Å; K100-S102 PolarHBondContact O-N 3.03Å; K100-I103 PolarHBondContact O-N 3.4Å; K100-I103 VanDerWaalsContact O-N 3.17Å; K100-M104 PolarHBondContact O-N 3.23Å; K100-L170 HydrophobicContact CB-CD2 4.25Å; K100-L170 HydrophobicContact CD-CD2 4.49Å; K100-L170 HydrophobicContact CD-CG 4.27Å; K100-L170 WeakPolarHBondContact CD-O 3.49Å
101	L	44	Very low	43.6	Very low	19 Å²	19	79.5 Å²	79.5	10%	0.099	41%	0.406	C	S	.	.	H	α-helix	trans	-60.6	-39.2	174.5	-172.7	66.2	0	0	0	112.3	I96 D97 L98 I103 M104 C105 L171 L195	I96-L101 HydrophobicContact CG2-CB 4.17Å; I96-L101 HydrophobicContact CG2-CD2 4.01Å; D97-L101 PolarHBondContact O-N 2.9Å; L98-L101 HydrophobicContact CD2-CD2 4.42Å; L101-I103 VanDerWaalsContact C-N 3.34Å; L101-I103 PolarHBondContact O-N 2.84Å; L101-M104 HydrophobicContact CD1-SD 4.44Å; L101-M104 WeakPolarHBondContact O-CB 3.18Å; L101-M104 PolarHBondContact O-N 2.85Å; L101-C105 PolarHBondContact O-N 3.06Å; L101-C105 PolarHBondContact O-SG 3.25Å; L101-L171 HydrophobicContact CB-CD2 4.2Å; L101-L171 HydrophobicContact CD1-CD1 4.24Å; L101-L171 HydrophobicContact CD1-CD2 4Å; L101-L195 HydrophobicContact CD2-CD1 3.61Å; L101-L195 HydrophobicContact CG-CD1 4.32Å
102	S	42.7	Very low	43.9	Very low	48 Å²	48	79.7 Å²	79.7	34%	0.336	41%	0.407	S	S	.	.	H	α-helix	trans	-65.1	-37.4	175.9	-177	0	0	0	0	112.7	L98 K99 K100 M104 N106	L98-S102 PolarHBondContact O-N 3.32Å; K99-S102 PolarHBondContact O-N 3.23Å; K100-S102 VanDerWaalsContact C-N 3.32Å; K100-S102 PolarHBondContact O-N 3.03Å; S102-M104 VanDerWaalsContact C-N 3.34Å; S102-N106 PolarHBondContact O-N 3.38Å; S102-N106 VanDerWaalsContact O-N 3.13Å
103	I	46.9	Very low	44.3	Very low	95 Å²	95	82.7 Å²	82.7	49%	0.487	42%	0.417	S	S	.	.	H	α-helix	trans	-64	-45.8	175	-66	166.3	0	0	0	109	K99 K100 L101 N106 T107	K99-I103 WeakPolarHBondContact O-CG1 3.48Å; K99-I103 PolarHBondContact O-N 3.43Å; K99-I103 VanDerWaalsContact O-N 3.16Å; K100-I103 PolarHBondContact O-N 3.4Å; K100-I103 VanDerWaalsContact O-N 3.17Å; L101-I103 VanDerWaalsContact C-N 3.34Å; L101-I103 PolarHBondContact O-N 2.84Å; I103-N106 WeakPolarHBondContact O-CB 3.47Å; I103-N106 PolarHBondContact O-N 2.87Å; I103-T107 PolarHBondContact O-N 3.31Å; I103-T107 PolarHBondContact O-OG1 2.83Å; I103-T107 VanDerWaalsContact O-OG1 3.07Å
104	M	46.2	Very low	44.5	Very low	6 Å²	6	76.2 Å²	76.2	3%	0.03	40%	0.397	C	S	.	.	H	α-helix	trans	-57.7	-50.5	176	178.6	178.2	-45.2	0	0	112.9	K100 L101 S102 N106 T107 L108 L167 L171 I192	K100-M104 PolarHBondContact O-N 3.23Å; L101-M104 HydrophobicContact CD1-SD 4.44Å; L101-M104 WeakPolarHBondContact O-CB 3.18Å; L101-M104 PolarHBondContact O-N 2.85Å; S102-M104 VanDerWaalsContact C-N 3.34Å; M104-N106 PolarHBondContact O-N 3.35Å; M104-T107 CarbonylContact O-C 3.6Å; M104-T107 PolarHBondContact O-N 3Å; M104-T107 VanDerWaalsContact O-N 3.08Å; M104-L108 WeakPolarHBondContact O-CB 3.33Å; M104-L108 PolarHBondContact O-N 3.04Å; M104-L167 HydrophobicContact CB-CD2 4.3Å; M104-L167 HydrophobicContact CE-CB 3.78Å; M104-L167 HydrophobicContact CE-CD2 3.88Å; M104-L167 HydrophobicContact CE-CG 4.34Å; M104-L167 WeakPolarHBondContact CE-O 3.49Å; M104-L167 HydrophobicContact CG-CD1 4.24Å; M104-L167 HydrophobicContact CG-CD2 3.92Å; M104-L167 HydrophobicContact SD-CB 4.24Å; M104-L167 HydrophobicContact SD-CD2 4.41Å; M104-L171 HydrophobicContact CE-CD1 3.13Å; M104-L171 HydrophobicContact CE-CD2 4.33Å; M104-L171 HydrophobicContact CE-CG 3.4Å; M104-L171 VanDerWaalsContact CE-CG 3.4Å; M104-L171 HydrophobicContact SD-CD1 3.66Å; M104-I192 HydrophobicContact SD-CD1 4.2Å
105	C	43.8	Very low	44.7	Very low	14 Å²	14	76.8 Å²	76.8	10%	0.095	39%	0.388	C	S	.	.	H	α-helix	trans	-58.7	-38	177.9	-73.4	0	0	0	0	111.7	L101 T109	L101-C105 PolarHBondContact O-N 3.06Å; L101-C105 PolarHBondContact O-SG 3.25Å; C105-T109 VanDerWaalsContact O-CB 3.3Å; C105-T109 WeakPolarHBondContact O-CB 3.46Å; C105-T109 PolarHBondContact O-N 3.45Å; C105-T109 PolarHBondContact O-OG1 2.9Å
106	N	46.6	Very low	45.3	Very low	82 Å²	82	75.7 Å²	75.7	44%	0.439	39%	0.391	S	S	.	.	H	α-helix	trans	-67	-42	175.2	-79.3	-10.5	0	0	0	111.8	S102 I103 M104 T109 K110	S102-N106 PolarHBondContact O-N 3.38Å; S102-N106 VanDerWaalsContact O-N 3.13Å; I103-N106 WeakPolarHBondContact O-CB 3.47Å; I103-N106 PolarHBondContact O-N 2.87Å; M104-N106 PolarHBondContact O-N 3.35Å; N106-T109 PolarHBondContact O-N 3.24Å; N106-K110 WeakPolarHBondContact O-CG 3.37Å; N106-K110 PolarHBondContact O-N 2.98Å
107	T	46.7	Very low	45.3	Very low	65 Å²	65	77.2 Å²	77.2	40%	0.399	40%	0.399	S	S	.	.	H	α-helix	trans	-65.7	-44.4	176.6	-56.8	0	0	0	0	111.5	I103 M104 T109 K110 F111	I103-T107 PolarHBondContact O-N 3.31Å; I103-T107 PolarHBondContact O-OG1 2.83Å; I103-T107 VanDerWaalsContact O-OG1 3.07Å; M104-T107 CarbonylContact O-C 3.6Å; M104-T107 PolarHBondContact O-N 3Å; M104-T107 VanDerWaalsContact O-N 3.08Å; T107-T109 VanDerWaalsContact C-N 3.34Å; T107-T109 PolarHBondContact O-N 3.5Å; T107-K110 CarbonylContact O-C 3.56Å; T107-K110 WeakPolarHBondContact O-CA 3.49Å; T107-K110 WeakPolarHBondContact O-CB 3.35Å; T107-K110 PolarHBondContact O-N 3.31Å; T107-K110 VanDerWaalsContact O-N 3.1Å; T107-F111 PolarHBondContact O-N 3.33Å
108	L	47	Very low	45.1	Very low	50 Å²	50	76.6 Å²	76.6	26%	0.262	40%	0.398	S	S	.	.	H	α-helix	trans	-66.8	-36.2	178	-156	79.3	0	0	0	111.8	M104 K110 F111 N112 I192	M104-L108 WeakPolarHBondContact O-CB 3.33Å; M104-L108 PolarHBondContact O-N 3.04Å; L108-K110 VanDerWaalsContact C-N 3.29Å; L108-K110 PolarHBondContact O-N 3.38Å; L108-F111 WeakPolarHBondContact O-CB 3.29Å; L108-F111 PolarHBondContact O-N 2.64Å; L108-N112 PolarHBondContact O-N 2.74Å; L108-I192 HydrophobicContact CD2-CD1 4.21Å; L108-I192 HydrophobicContact CD2-CG2 3.77Å
109	T	47.9	Very low	45.3	Very low	56 Å²	56	75.4 Å²	75.4	34%	0.344	39%	0.389	S	S	.	.	H	α-helix	trans	-62.7	-39.2	172	-57.7	0	0	0	0	111	C105 N106 T107 K113	C105-T109 VanDerWaalsContact O-CB 3.3Å; C105-T109 WeakPolarHBondContact O-CB 3.46Å; C105-T109 PolarHBondContact O-N 3.45Å; C105-T109 PolarHBondContact O-OG1 2.9Å; N106-T109 PolarHBondContact O-N 3.24Å; T107-T109 VanDerWaalsContact C-N 3.34Å; T107-T109 PolarHBondContact O-N 3.5Å; T109-K113 WeakPolarHBondContact O-CG 3.36Å; T109-K113 PolarHBondContact O-N 3.21Å; T109-K113 VanDerWaalsContact O-N 3.16Å
110	K	44.7	Very low	45.5	Very low	145 Å²	145	73.5 Å²	73.5	63%	0.63	38%	0.382	S	S	*	.	H	α-helix	trans	-66.1	-39.5	172.9	-70.6	173.6	179.4	-174.9	0	111.4	N106 T107 L108 K113 A114	N106-K110 WeakPolarHBondContact O-CG 3.37Å; N106-K110 PolarHBondContact O-N 2.98Å; T107-K110 CarbonylContact O-C 3.56Å; T107-K110 WeakPolarHBondContact O-CA 3.49Å; T107-K110 WeakPolarHBondContact O-CB 3.35Å; T107-K110 PolarHBondContact O-N 3.31Å; T107-K110 VanDerWaalsContact O-N 3.1Å; L108-K110 VanDerWaalsContact C-N 3.29Å; L108-K110 PolarHBondContact O-N 3.38Å; K110-K113 PolarHBondContact O-N 2.74Å; K110-A114 PolarHBondContact O-N 3.48Å
111	F	47.2	Very low	45.4	Very low	88 Å²	88	71.5 Å²	71.5	39%	0.386	38%	0.38	S	S	.	.	H	α-helix	trans	-62.5	-48.4	176.2	-169.9	-90.5	0	0	0	112.3	T107 L108 K113 A114 K115	T107-F111 PolarHBondContact O-N 3.33Å; L108-F111 WeakPolarHBondContact O-CB 3.29Å; L108-F111 PolarHBondContact O-N 2.64Å; F111-K113 VanDerWaalsContact C-N 3.27Å; F111-K113 PolarHBondContact O-N 3.01Å; F111-A114 PolarHBondContact O-N 3.06Å; F111-A114 VanDerWaalsContact O-N 3.13Å; F111-K115 WeakPolarHBondContact O-CB 3.36Å; F111-K115 PolarHBondContact O-N 2.78Å
112	N	45.3	Very low	45.5	Very low	98 Å²	98	74.8 Å²	74.8	52%	0.524	40%	0.396	S	S	.	.	H	α-helix	trans	-61	-37.1	176.6	-83.1	-15.4	0	0	0	112.1	L108 A116	L108-N112 PolarHBondContact O-N 2.74Å; N112-A116 WeakPolarHBondContact O-CB 3.29Å; N112-A116 PolarHBondContact O-N 3.3Å
113	K	47.3	Very low	45.8	Very low	138 Å²	138	75.8 Å²	75.8	60%	0.6	40%	0.403	S	S	*	.	H	α-helix	trans	-65.9	-44.5	173.4	-75.4	-179.7	177.7	-172.2	0	111.9	T109 K110 F111 A116 I117	T109-K113 WeakPolarHBondContact O-CG 3.36Å; T109-K113 PolarHBondContact O-N 3.21Å; T109-K113 VanDerWaalsContact O-N 3.16Å; K110-K113 PolarHBondContact O-N 2.74Å; F111-K113 VanDerWaalsContact C-N 3.27Å; F111-K113 PolarHBondContact O-N 3.01Å; K113-A116 PolarHBondContact O-N 3.13Å; K113-I117 WeakPolarHBondContact O-CD1 3.34Å; K113-I117 VanDerWaalsContact O-CG1 3.25Å; K113-I117 WeakPolarHBondContact O-CG1 3.42Å; K113-I117 PolarHBondContact O-N 3.1Å; K113-I117 VanDerWaalsContact O-N 3.07Å
114	A	41.4	Very low	45.5	Very low	44 Å²	44	74 Å²	74	36%	0.364	39%	0.394	S	S	.	.	H	α-helix	trans	-61.4	-49.2	177.1	0	0	0	0	0	110.9	K110 F111 A116 I117 T118	K110-A114 PolarHBondContact O-N 3.48Å; F111-A114 PolarHBondContact O-N 3.06Å; F111-A114 VanDerWaalsContact O-N 3.13Å; A114-A116 PolarHBondContact O-N 3.37Å; A114-I117 PolarHBondContact O-N 2.58Å; A114-I117 VanDerWaalsContact O-N 3.13Å; A114-T118 PolarHBondContact O-N 3.28Å; A114-T118 PolarHBondContact O-OG1 2.87Å
115	K	45.4	Very low	45.1	Very low	105 Å²	105	76.2 Å²	76.2	46%	0.457	41%	0.411	S	S	.	.	H	α-helix	trans	-56.7	-46.8	176.7	-177.5	177.3	171.1	-179.8	0	112.3	F111 I117 T118 E119	F111-K115 WeakPolarHBondContact O-CB 3.36Å; F111-K115 PolarHBondContact O-N 2.78Å; K115-I117 VanDerWaalsContact C-N 3.31Å; K115-I117 PolarHBondContact O-N 3.05Å; K115-T118 PolarHBondContact O-N 3.31Å; K115-E119 WeakPolarHBondContact CE-OE1 3.5Å; K115-E119 HydrophobicContact CG-CG 4.39Å; K115-E119 IonicContact NZ-OE1 3.73Å; K115-E119 WeakPolarHBondContact O-CB 3.34Å; K115-E119 WeakPolarHBondContact O-CG 3.24Å; K115-E119 PolarHBondContact O-N 3.13Å
116	A	47.6	Very low	45.3	Very low	53 Å²	53	81 Å²	81	44%	0.438	44%	0.436	S	S	.	.	H	α-helix	trans	-61.1	-39.7	177.8	0	0	0	0	0	112.2	N112 K113 A114 Q120	N112-A116 WeakPolarHBondContact O-CB 3.29Å; N112-A116 PolarHBondContact O-N 3.3Å; K113-A116 PolarHBondContact O-N 3.13Å; A114-A116 PolarHBondContact O-N 3.37Å; A116-Q120 VanDerWaalsContact O-CB 3.3Å; A116-Q120 WeakPolarHBondContact O-CB 3.25Å; A116-Q120 PolarHBondContact O-N 3.48Å
117	I	42.4	Very low	45.1	Very low	68 Å²	68	83 Å²	83	35%	0.349	45%	0.446	S	S	.	.	H	α-helix	trans	-67	-41.8	175.5	-65.6	163.6	0	0	0	110.6	K113 A114 K115 Q120 A121 L146	K113-I117 WeakPolarHBondContact O-CD1 3.34Å; K113-I117 VanDerWaalsContact O-CG1 3.25Å; K113-I117 WeakPolarHBondContact O-CG1 3.42Å; K113-I117 PolarHBondContact O-N 3.1Å; K113-I117 VanDerWaalsContact O-N 3.07Å; A114-I117 PolarHBondContact O-N 2.58Å; A114-I117 VanDerWaalsContact O-N 3.13Å; K115-I117 VanDerWaalsContact C-N 3.31Å; K115-I117 PolarHBondContact O-N 3.05Å; I117-Q120 PolarHBondContact O-N 2.83Å; I117-A121 WeakPolarHBondContact O-CB 3.15Å; I117-A121 PolarHBondContact O-N 3Å; I117-L146 HydrophobicContact CD1-CD2 4.42Å; I117-L146 HydrophobicContact CG2-CD1 3.83Å; I117-L146 HydrophobicContact CG2-CD2 3.74Å; I117-L146 HydrophobicContact CG2-CG 4.44Å
118	T	42.3	Very low	44.9	Very low	64 Å²	64	83.6 Å²	83.6	39%	0.393	45%	0.451	S	S	.	.	H	α-helix	trans	-65.1	-44.4	177.3	-52.9	0	0	0	0	111.7	A114 K115 Q120 A121 I122	A114-T118 PolarHBondContact O-N 3.28Å; A114-T118 PolarHBondContact O-OG1 2.87Å; K115-T118 PolarHBondContact O-N 3.31Å; T118-Q120 VanDerWaalsContact C-N 3.31Å; T118-Q120 PolarHBondContact O-N 3.12Å; T118-A121 PolarHBondContact O-N 3.12Å; T118-I122 HydrophobicContact CG2-CD1 3.91Å; T118-I122 HydrophobicContact CG2-CG1 4.44Å; T118-I122 WeakPolarHBondContact O-CB 3.49Å; T118-I122 VanDerWaalsContact O-CG1 3.24Å; T118-I122 WeakPolarHBondContact O-CG1 3.09Å; T118-I122 PolarHBondContact O-N 3.19Å
119	E	47.8	Very low	44.7	Very low	108 Å²	108	87.1 Å²	87.1	51%	0.505	48%	0.475	S	S	.	.	H	α-helix	trans	-62.2	-40.4	174.9	-75.2	176.1	169.3	0	0	111.2	K115 I122 S123	K115-E119 WeakPolarHBondContact CE-OE1 3.5Å; K115-E119 HydrophobicContact CG-CG 4.39Å; K115-E119 IonicContact NZ-OE1 3.73Å; K115-E119 WeakPolarHBondContact O-CB 3.34Å; K115-E119 WeakPolarHBondContact O-CG 3.24Å; K115-E119 PolarHBondContact O-N 3.13Å; E119-I122 PolarHBondContact O-N 2.94Å; E119-S123 WeakPolarHBondContact O-CB 3.22Å; E119-S123 PolarHBondContact O-N 3.45Å; E119-S123 PolarHBondContact O-OG 3.33Å
120	Q	47.8	Very low	44.2	Very low	124 Å²	124	87.9 Å²	87.9	58%	0.579	48%	0.477	S	S	*	.	H	α-helix	trans	-64.1	-43.4	174.3	-168	175	10.1	0	0	111.3	A116 I117 T118 S123 L124	A116-Q120 VanDerWaalsContact O-CB 3.3Å; A116-Q120 WeakPolarHBondContact O-CB 3.25Å; A116-Q120 PolarHBondContact O-N 3.48Å; I117-Q120 PolarHBondContact O-N 2.83Å; T118-Q120 VanDerWaalsContact C-N 3.31Å; T118-Q120 PolarHBondContact O-N 3.12Å; Q120-S123 WeakPolarHBondContact CA-OG 3.48Å; Q120-S123 PolarHBondContact O-N 2.94Å; Q120-S123 PolarHBondContact O-OG 3.09Å; Q120-L124 HydrophobicContact CG-CD1 4.19Å; Q120-L124 WeakPolarHBondContact O-CB 3.45Å; Q120-L124 WeakPolarHBondContact O-CD1 3.46Å; Q120-L124 WeakPolarHBondContact O-CG 3.46Å; Q120-L124 PolarHBondContact O-N 2.83Å
121	A	42.6	Very low	44	Very low	32 Å²	32	86.1 Å²	86.1	26%	0.264	48%	0.48	S	S	.	.	H	α-helix	trans	-62.9	-42.1	175.9	0	0	0	0	0	112.2	I117 T118 L124 S125 L137	I117-A121 WeakPolarHBondContact O-CB 3.15Å; I117-A121 PolarHBondContact O-N 3Å; T118-A121 PolarHBondContact O-N 3.12Å; A121-L124 PolarHBondContact O-N 3.01Å; A121-S125 PolarHBondContact O-N 3.14Å; A121-L137 HydrophobicContact CB-CD2 3.88Å
122	I	45	Very low	43.8	Very low	87 Å²	87	89 Å²	89	45%	0.446	49%	0.493	S	S	.	.	H	α-helix	trans	-65	-41.4	174.9	-67.9	165.3	0	0	0	110.8	T118 E119 L124 S125 N126	T118-I122 HydrophobicContact CG2-CD1 3.91Å; T118-I122 HydrophobicContact CG2-CG1 4.44Å; T118-I122 WeakPolarHBondContact O-CB 3.49Å; T118-I122 VanDerWaalsContact O-CG1 3.24Å; T118-I122 WeakPolarHBondContact O-CG1 3.09Å; T118-I122 PolarHBondContact O-N 3.19Å; E119-I122 PolarHBondContact O-N 2.94Å; I122-L124 VanDerWaalsContact C-N 3.26Å; I122-L124 PolarHBondContact O-N 2.75Å; I122-S125 WeakPolarHBondContact CA-OG 3.46Å; I122-S125 PolarHBondContact O-N 3.29Å; I122-S125 PolarHBondContact O-OG 3.01Å; I122-N126 WeakPolarHBondContact O-CB 3.45Å; I122-N126 VanDerWaalsContact O-CG 3.24Å; I122-N126 PolarHBondContact O-N 2.71Å; I122-N126 PolarHBondContact O-ND2 2.84Å
123	S	49.3	Very low	43.5	Very low	69 Å²	69	86.9 Å²	86.9	48%	0.483	48%	0.481	S	S	.	.	H	α-helix	trans	-63.3	-35.9	177.5	75.4	0	0	0	0	111.9	E119 Q120 N127	E119-S123 WeakPolarHBondContact O-CB 3.22Å; E119-S123 PolarHBondContact O-N 3.45Å; E119-S123 PolarHBondContact O-OG 3.33Å; Q120-S123 WeakPolarHBondContact CA-OG 3.48Å; Q120-S123 PolarHBondContact O-N 2.94Å; Q120-S123 PolarHBondContact O-OG 3.09Å; S123-N127 PolarHBondContact O-N 3.11Å
124	L	41.4	Very low	42.8	Very low	57 Å²	57	85 Å²	85	30%	0.298	47%	0.473	S	S	.	.	H	α-helix	trans	-73.9	-35.7	175.3	-72.8	163.3	0	0	0	112	Q120 A121 I122 N126 N127 L137	Q120-L124 HydrophobicContact CG-CD1 4.19Å; Q120-L124 WeakPolarHBondContact O-CB 3.45Å; Q120-L124 WeakPolarHBondContact O-CD1 3.46Å; Q120-L124 WeakPolarHBondContact O-CG 3.46Å; Q120-L124 PolarHBondContact O-N 2.83Å; A121-L124 PolarHBondContact O-N 3.01Å; I122-L124 VanDerWaalsContact C-N 3.26Å; I122-L124 PolarHBondContact O-N 2.75Å; L124-N126 VanDerWaalsContact C-N 3.33Å; L124-N127 CarbonylContact O-C 3.32Å; L124-N127 PolarHBondContact O-N 2.78Å; L124-L137 HydrophobicContact CB-CD1 3.89Å; L124-L137 HydrophobicContact CD1-CD1 3.75Å; L124-L137 HydrophobicContact CD1-CD2 4.49Å; L124-L137 HydrophobicContact CD1-CG 4.16Å; L124-L137 HydrophobicContact CG-CD1 4.45Å
125	S	38.6	Very low	42.7	Very low	53 Å²	53	87.9 Å²	87.9	37%	0.371	48%	0.482	S	S	.	.	H	α-helix	trans	-68.8	-32	175.8	72.5	0	0	0	0	112.8	A121 I122 P128	A121-S125 PolarHBondContact O-N 3.14Å; I122-S125 WeakPolarHBondContact CA-OG 3.46Å; I122-S125 PolarHBondContact O-N 3.29Å; I122-S125 PolarHBondContact O-OG 3.01Å; S125-P128 WeakPolarHBondContact O-CD 3.33Å
126	N	47	Very low	42.3	Very low	116 Å²	116	90.7 Å²	90.7	62%	0.62	49%	0.49	S	S	*	.	H	α-helix	trans	-79.4	-18.5	-179.2	-69.7	-18.1	0	0	0	113.4	I122 L124	I122-N126 WeakPolarHBondContact O-CB 3.45Å; I122-N126 VanDerWaalsContact O-CG 3.24Å; I122-N126 PolarHBondContact O-N 2.71Å; I122-N126 PolarHBondContact O-ND2 2.84Å; L124-N126 VanDerWaalsContact C-N 3.33Å
127	N	42	Very low	41.6	Very low	122 Å²	122	90.4 Å²	90.4	65%	0.652	48%	0.481	S	S	*	.			trans	-134.7	71.5	172.3	-92.3	-35.9	0	0	0	110.1	S123 L124 T129	S123-N127 PolarHBondContact O-N 3.11Å; L124-N127 CarbonylContact O-C 3.32Å; L124-N127 PolarHBondContact O-N 2.78Å; N127-T129 PolarHBondContact O-N 2.74Å; N127-T129 PolarHBondContact O-OG1 2.74Å
128	P	43.1	Very low	41.2	Very low	79 Å²	79	93 Å²	93	51%	0.513	49%	0.494	S	S	.	.			trans	-74.9	71.7	178.9	32.8	-32.8	0	0	0	108.6	S125 N130 F134	S125-P128 WeakPolarHBondContact O-CD 3.33Å; P128-N130 PolarHBondContact O-N 3.47Å; P128-F134 HydrophobicContact CB-CE2 4.3Å
129	T	42.1	Very low	40.9	Very low	124 Å²	124	94.9 Å²	94.9	76%	0.761	51%	0.506	S	S	*	.			trans	-74.2	-13.7	-175.7	-35.3	0	0	0	0	110.7	N127	N127-T129 PolarHBondContact O-N 2.74Å; N127-T129 PolarHBondContact O-OG1 2.74Å
130	N	37	Very low	40.2	Very low	72 Å²	72	96.3 Å²	96.3	39%	0.385	52%	0.516	S	S	.	.			trans	-147.7	122.9	172.9	-161.5	-26.6	0	0	0	111.3	P128 K132 D133	P128-N130 PolarHBondContact O-N 3.47Å; N130-K132 PolarHBondContact O-N 2.73Å; N130-K132 WeakPolarHBondContact OD1-CB 3.38Å; N130-K132 PolarHBondContact OD1-N 3.45Å; N130-K132 VanDerWaalsContact OD1-N 3.13Å; N130-D133 WeakPolarHBondContact CB-OD2 3.47Å; N130-D133 WeakPolarHBondContact O-CB 3.48Å; N130-D133 PolarHBondContact O-N 2.81Å
131	P	40.7	Very low	39.5	Very low	107 Å²	107	92.5 Å²	92.5	70%	0.695	51%	0.51	S	S	*	.	H	α-helix	trans	-53.6	-26	172.9	-26	33.5	0	0	0	113.7	D133 F134	P131-D133 PolarHBondContact O-N 3.24Å; P131-F134 WeakPolarHBondContact O-CB 3.36Å; P131-F134 PolarHBondContact O-N 3.08Å
132	K	44	Very low	39.1	Very low	150 Å²	150	94 Å²	94	65%	0.652	53%	0.529	S	S	*	.	H	α-helix	trans	-68	-17	174.3	-68.2	-173.8	176.4	-178	0	114	N130 F134 R136	N130-K132 PolarHBondContact O-N 2.73Å; N130-K132 WeakPolarHBondContact OD1-CB 3.38Å; N130-K132 PolarHBondContact OD1-N 3.45Å; N130-K132 VanDerWaalsContact OD1-N 3.13Å; K132-F134 VanDerWaalsContact C-N 3.33Å; K132-R136 PolarHBondContact O-N 3.36Å; K132-R136 VanDerWaalsContact O-N 3.1Å
133	D	39	Very low	39	Very low	52 Å²	52	97.5 Å²	97.5	28%	0.278	55%	0.549	S	S	.	.	H	α-helix	trans	-74.9	-26.5	174.4	-66.6	-34	0	0	0	111.7	N130 P131 R136 L137	N130-D133 WeakPolarHBondContact CB-OD2 3.47Å; N130-D133 WeakPolarHBondContact O-CB 3.48Å; N130-D133 PolarHBondContact O-N 2.81Å; P131-D133 PolarHBondContact O-N 3.24Å; D133-R136 WeakPolarHBondContact O-CB 3.42Å; D133-R136 PolarHBondContact O-N 2.87Å; D133-L137 PolarHBondContact O-N 3.47Å
134	F	32.2	Very low	38.4	Very low	100 Å²	100	99.6 Å²	99.6	44%	0.439	56%	0.555	S	S	.	*	H	α-helix	trans	-68.6	-44.8	170.8	-102	-87.1	0	0	0	111.5	P128 P131 K132 R136 L137 I138	P128-F134 HydrophobicContact CB-CE2 4.3Å; P131-F134 WeakPolarHBondContact O-CB 3.36Å; P131-F134 PolarHBondContact O-N 3.08Å; K132-F134 VanDerWaalsContact C-N 3.33Å; F134-R136 PolarHBondContact O-N 2.95Å; F134-L137 WeakPolarHBondContact O-CB 3.13Å; F134-L137 PolarHBondContact O-N 2.89Å; F134-I138 WeakPolarHBondContact O-CG1 3.44Å; F134-I138 PolarHBondContact O-N 3.19Å
135	D	38.6	Very low	38.3	Very low	103 Å²	103	102.1 Å²	102.1	55%	0.551	57%	0.568	S	S	*	*	H	α-helix	trans	-59.2	-36.4	171.9	-91.7	-14.9	0	0	0	110.7	I138 T139	D135-I138 PolarHBondContact O-N 3.32Å; D135-T139 WeakPolarHBondContact O-CA 3.5Å; D135-T139 WeakPolarHBondContact O-CB 3.35Å; D135-T139 PolarHBondContact O-N 2.87Å; D135-T139 PolarHBondContact O-OG1 3.45Å
136	R	37	Very low	38.1	Very low	165 Å²	165	103 Å²	103	62%	0.623	57%	0.568	S	S	*	*	H	α-helix	trans	-65.4	-38.6	173.3	-82.8	179.4	164.8	-174.8	-4.2	113.3	K132 D133 F134 I138 T139 L140	K132-R136 PolarHBondContact O-N 3.36Å; K132-R136 VanDerWaalsContact O-N 3.1Å; D133-R136 WeakPolarHBondContact O-CB 3.42Å; D133-R136 PolarHBondContact O-N 2.87Å; F134-R136 PolarHBondContact O-N 2.95Å; R136-I138 VanDerWaalsContact C-N 3.3Å; R136-I138 PolarHBondContact O-N 2.97Å; R136-T139 PolarHBondContact O-N 3.32Å; R136-L140 HydrophobicContact CB-CD1 4.24Å; R136-L140 WeakPolarHBondContact O-CB 3.14Å; R136-L140 WeakPolarHBondContact O-CD1 3.03Å; R136-L140 PolarHBondContact O-N 3.17Å
137	L	33.6	Very low	37.5	Very low	47 Å²	47	104.5 Å²	104.5	25%	0.246	57%	0.572	C	S	.	*	H	α-helix	trans	-64.5	-35.3	174.3	-95.1	153.6	0	0	0	112.4	A121 L124 D133 F134	A121-L137 HydrophobicContact CB-CD2 3.88Å; L124-L137 HydrophobicContact CB-CD1 3.89Å; L124-L137 HydrophobicContact CD1-CD1 3.75Å; L124-L137 HydrophobicContact CD1-CD2 4.49Å; L124-L137 HydrophobicContact CD1-CG 4.16Å; L124-L137 HydrophobicContact CG-CD1 4.45Å; D133-L137 PolarHBondContact O-N 3.47Å; F134-L137 WeakPolarHBondContact O-CB 3.13Å; F134-L137 PolarHBondContact O-N 2.89Å
138	I	35.3	Very low	37.3	Very low	123 Å²	123	106.8 Å²	106.8	63%	0.631	57%	0.571	S	S	*	*	H	α-helix	trans	-79.1	-33	176.9	-61.5	173.2	0	0	0	111.1	F134 D135 R136	F134-I138 WeakPolarHBondContact O-CG1 3.44Å; F134-I138 PolarHBondContact O-N 3.19Å; D135-I138 PolarHBondContact O-N 3.32Å; R136-I138 VanDerWaalsContact C-N 3.3Å; R136-I138 PolarHBondContact O-N 2.97Å
139	T	34.9	Very low	36.9	Very low	103 Å²	103	106.3 Å²	106.3	63%	0.632	56%	0.563	S	S	*	*	H	α-helix	trans	-94.1	-21.3	-173.7	-44.6	0	0	0	0	113.7	D135 R136 G141	D135-T139 WeakPolarHBondContact O-CA 3.5Å; D135-T139 WeakPolarHBondContact O-CB 3.35Å; D135-T139 PolarHBondContact O-N 2.87Å; D135-T139 PolarHBondContact O-OG1 3.45Å; R136-T139 PolarHBondContact O-N 3.32Å; T139-G141 PolarHBondContact O-N 3.14Å
140	L	32.1	Very low	36.5	Very low	137 Å²	137	101.9 Å²	101.9	72%	0.717	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	71.4	169.4	-95.1	140.2	0	0	0	110	R136	R136-L140 HydrophobicContact CB-CD1 4.24Å; R136-L140 WeakPolarHBondContact O-CB 3.14Å; R136-L140 WeakPolarHBondContact O-CD1 3.03Å; R136-L140 PolarHBondContact O-N 3.17Å
141	G	33.4	Very low	36.3	Very low	44 Å²	44	102.2 Å²	102.2	45%	0.454	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	138.4	18.2	161.8	0	0	0	0	0	116.9	T139 N143 N144	T139-G141 PolarHBondContact O-N 3.14Å; G141-N143 PolarHBondContact O-N 2.8Å; G141-N144 PolarHBondContact O-N 3.18Å
142	G	35.2	Very low	36.1	Very low	65 Å²	65	101.2 Å²	101.2	67%	0.67	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	34.2	-0.1	143.9	0	0	0	0	0	124.2
143	N	42.3	Very low	35.8	Very low	160 Å²	160	100.2 Å²	100.2	86%	0.856	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-162.1	-2.9	173.3	-87.8	-30.9	0	0	0	112.4	G141	G141-N143 PolarHBondContact O-N 2.8Å
144	N	37.6	Very low	35.4	Very low	113 Å²	113	103.2 Å²	103.2	60%	0.604	55%	0.547	S	S	*	.	S	Bend	trans	-127.4	79.8	-176.8	-66.3	-33.9	0	0	0	108.5	G141 L146 I149	G141-N144 PolarHBondContact O-N 3.18Å; N144-L146 PolarHBondContact O-N 3.21Å; N144-I149 HydrophobicContact CB-CD1 4.02Å
145	N	38	Very low	35.6	Very low	109 Å²	109	101.3 Å²	101.3	58%	0.583	56%	0.556	S	S	*	*			trans	-48.7	106.9	174.2	-92.1	1	0	0	0	108.7	E147 R148 I149	N145-E147 PolarHBondContact O-N 3.43Å; N145-R148 HydrophobicContact CB-CB 3.54Å; N145-R148 CarbonylContact O-C 3.52Å; N145-R148 WeakPolarHBondContact O-CA 3.4Å; N145-R148 WeakPolarHBondContact O-CB 3.45Å; N145-R148 PolarHBondContact O-N 3.33Å; N145-I149 PolarHBondContact O-N 2.63Å
146	L	35.9	Very low	35.6	Very low	71 Å²	71	104 Å²	104	37%	0.372	57%	0.565	S	S	.	*	H	α-helix	trans	-57.2	-33	174.6	-87	166	0	0	0	110.6	I117 N144 I149 A150	I117-L146 HydrophobicContact CD1-CD2 4.42Å; I117-L146 HydrophobicContact CG2-CD1 3.83Å; I117-L146 HydrophobicContact CG2-CD2 3.74Å; I117-L146 HydrophobicContact CG2-CG 4.44Å; N144-L146 PolarHBondContact O-N 3.21Å; L146-I149 PolarHBondContact O-N 3.08Å; L146-A150 WeakPolarHBondContact O-CB 3.47Å; L146-A150 PolarHBondContact O-N 3.06Å
147	E	33.9	Very low	35.6	Very low	148 Å²	148	99 Å²	99	69%	0.692	55%	0.55	S	S	*	.	H	α-helix	trans	-63.9	-40.6	170.9	-169.5	177.4	-159.3	0	0	111.9	N145 A150 C151	N145-E147 PolarHBondContact O-N 3.43Å; E147-A150 PolarHBondContact O-N 3.49Å; E147-C151 WeakPolarHBondContact O-CB 3.11Å; E147-C151 PolarHBondContact O-N 3.21Å; E147-C151 PolarHBondContact O-SG 2.94Å
148	R	36.9	Very low	36.1	Very low	171 Å²	171	104.5 Å²	104.5	65%	0.645	58%	0.579	S	S	*	*	H	α-helix	trans	-72.2	-37.7	175.6	-170.6	175	130	-172.3	-4.5	111.8	N145 D152	N145-R148 HydrophobicContact CB-CB 3.54Å; N145-R148 CarbonylContact O-C 3.52Å; N145-R148 WeakPolarHBondContact O-CA 3.4Å; N145-R148 WeakPolarHBondContact O-CB 3.45Å; N145-R148 PolarHBondContact O-N 3.33Å; R148-D152 IonicContact NE-OD2 3.65Å; R148-D152 WeakPolarHBondContact O-CA 3.09Å; R148-D152 WeakPolarHBondContact O-CB 3.46Å; R148-D152 PolarHBondContact O-N 3.33Å
149	I	35.6	Very low	36.3	Very low	68 Å²	68	100.1 Å²	100.1	35%	0.349	56%	0.56	S	S	.	*	H	α-helix	trans	-64.6	-47.5	172.7	-66.2	174.1	0	0	0	109	N144 N145 L146 F153	N144-I149 HydrophobicContact CB-CD1 4.02Å; N145-I149 PolarHBondContact O-N 2.63Å; L146-I149 PolarHBondContact O-N 3.08Å; I149-F153 HydrophobicContact CG2-CD2 3.66Å; I149-F153 HydrophobicContact CG2-CE2 4.02Å; I149-F153 WeakPolarHBondContact O-CB 3.39Å; I149-F153 WeakPolarHBondContact O-CD2 3.46Å; I149-F153 PolarHBondContact O-N 3.06Å
150	A	33.3	Very low	36.5	Very low	32 Å²	32	99.7 Å²	99.7	26%	0.264	56%	0.559	S	S	.	*	H	α-helix	trans	-65.1	-40.8	179	0	0	0	0	0	111.6	L146 E147 L154	L146-A150 WeakPolarHBondContact O-CB 3.47Å; L146-A150 PolarHBondContact O-N 3.06Å; E147-A150 PolarHBondContact O-N 3.49Å; A150-L154 HydrophobicContact CB-CD1 4.32Å; A150-L154 WeakPolarHBondContact O-CA 3.34Å; A150-L154 WeakPolarHBondContact O-CB 3.45Å; A150-L154 WeakPolarHBondContact O-CD1 3.48Å; A150-L154 WeakPolarHBondContact O-CG 3.5Å; A150-L154 PolarHBondContact O-N 2.73Å
151	C	32.3	Very low	37	Very low	78 Å²	78	96 Å²	96	53%	0.527	55%	0.548	S	S	.	.	H	α-helix	trans	-76	-38.4	178.4	-70.4	0	0	0	0	112.8	E147 F153 G155	E147-C151 WeakPolarHBondContact O-CB 3.11Å; E147-C151 PolarHBondContact O-N 3.21Å; E147-C151 PolarHBondContact O-SG 2.94Å; C151-F153 VanDerWaalsContact C-N 3.33Å; C151-G155 WeakPolarHBondContact O-CA 3.28Å; C151-G155 PolarHBondContact O-N 3.38Å
152	D	37.7	Very low	37.5	Very low	87 Å²	87	97 Å²	97	47%	0.465	54%	0.543	S	S	.	.	H	α-helix	trans	-66.1	-39.2	172.8	-75.6	-12	0	0	0	109.9	R148 H156	R148-D152 IonicContact NE-OD2 3.65Å; R148-D152 WeakPolarHBondContact O-CA 3.09Å; R148-D152 WeakPolarHBondContact O-CB 3.46Å; R148-D152 PolarHBondContact O-N 3.33Å; D152-H156 PolarHBondContact O-ND1 2.94Å
153	F	36.2	Very low	37.7	Very low	129 Å²	129	95.4 Å²	95.4	57%	0.566	52%	0.52	S	S	*	.	H	α-helix	trans	-80.3	-40.6	179.1	-85.4	-87	0	0	0	113.7	I149 C151 L157	I149-F153 HydrophobicContact CG2-CD2 3.66Å; I149-F153 HydrophobicContact CG2-CE2 4.02Å; I149-F153 WeakPolarHBondContact O-CB 3.39Å; I149-F153 WeakPolarHBondContact O-CD2 3.46Å; I149-F153 PolarHBondContact O-N 3.06Å; C151-F153 VanDerWaalsContact C-N 3.33Å; F153-L157 VanDerWaalsContact O-CD1 3.25Å; F153-L157 WeakPolarHBondContact O-CD1 3.11Å; F153-L157 WeakPolarHBondContact O-CG 3.22Å
154	L	32.2	Very low	37.8	Very low	114 Å²	114	89.7 Å²	89.7	60%	0.597	49%	0.49	S	S	*	.	H	α-helix	trans	-81.1	-32.5	179.2	-66.1	166.9	0	0	0	111.5	A150 H156 L157	A150-L154 HydrophobicContact CB-CD1 4.32Å; A150-L154 WeakPolarHBondContact O-CA 3.34Å; A150-L154 WeakPolarHBondContact O-CB 3.45Å; A150-L154 WeakPolarHBondContact O-CD1 3.48Å; A150-L154 WeakPolarHBondContact O-CG 3.5Å; A150-L154 PolarHBondContact O-N 2.73Å; L154-H156 PolarHBondContact O-N 3.19Å; L154-H156 VanDerWaalsContact O-N 3.14Å; L154-L157 PolarHBondContact O-N 2.71Å
155	G	35	Very low	38.3	Very low	61 Å²	61	89.5 Å²	89.5	63%	0.629	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.1	176.2	0	0	0	0	0	114	C151	C151-G155 WeakPolarHBondContact O-CA 3.28Å; C151-G155 PolarHBondContact O-N 3.38Å
156	H	39.1	Very low	38.6	Very low	159 Å²	159	87.6 Å²	87.6	74%	0.736	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	0.2	172.9	-72.5	81.4	0	0	0	113.5	D152 L154	D152-H156 PolarHBondContact O-ND1 2.94Å; L154-H156 PolarHBondContact O-N 3.19Å; L154-H156 VanDerWaalsContact O-N 3.14Å
157	L	37.5	Very low	38.8	Very low	59 Å²	59	85.7 Å²	85.7	31%	0.309	47%	0.47	S	S	.	.			trans	-125.2	81.6	-174.2	-62.8	178	0	0	0	109.1	F153 L154 S159 V163	F153-L157 VanDerWaalsContact O-CD1 3.25Å; F153-L157 WeakPolarHBondContact O-CD1 3.11Å; F153-L157 WeakPolarHBondContact O-CG 3.22Å; L154-L157 PolarHBondContact O-N 2.71Å; L157-S159 PolarHBondContact O-N 2.95Å; L157-S159 VanDerWaalsContact O-N 3.09Å; L157-V163 HydrophobicContact CB-CG2 4.41Å; L157-V163 HydrophobicContact CD1-CG2 3.78Å; L157-V163 HydrophobicContact CD2-CG2 3.33Å; L157-V163 HydrophobicContact CG-CG2 4.01Å
158	D	44.1	Very low	39.3	Very low	163 Å²	163	79.5 Å²	79.5	87%	0.872	44%	0.442	S	S	*	.	S	Bend	trans	-57	-24.3	177.8	-79	-38.6	0	0	0	112.2
159	S	39.3	Very low	39.8	Very low	32 Å²	32	76.5 Å²	76.5	22%	0.224	44%	0.436	C	S	.	.			trans	-155.7	152.8	160.9	104.4	0	0	0	0	114.5	L157 A161 D162	L157-S159 PolarHBondContact O-N 2.95Å; L157-S159 VanDerWaalsContact O-N 3.09Å; S159-A161 PolarHBondContact O-N 3.5Å; S159-A161 WeakPolarHBondContact OG-CB 3.31Å; S159-A161 PolarHBondContact OG-N 2.82Å; S159-D162 PolarHBondContact N-OD2 3.38Å; S159-D162 WeakPolarHBondContact O-CB 3.5Å; S159-D162 PolarHBondContact O-N 3.21Å; S159-D162 VanDerWaalsContact O-N 3.11Å; S159-D162 VanDerWaalsContact OG-CG 3.25Å; S159-D162 PolarHBondContact OG-N 3.48Å; S159-D162 PolarHBondContact OG-OD1 3.19Å
160	P	39	Very low	40	Very low	93 Å²	93	77.1 Å²	77.1	60%	0.604	44%	0.439	S	S	*	.	H	α-helix	trans	-63.7	-18.5	171.3	24.7	-32.5	0	0	0	113.5	L164	P160-L164 PolarHBondContact O-N 2.94Å
161	A	42.5	Very low	40.2	Very low	59 Å²	59	76.2 Å²	76.2	49%	0.488	43%	0.43	S	S	.	.	H	α-helix	trans	-70.9	-36.6	173	0	0	0	0	0	111.1	S159 V163 L164 E165	S159-A161 PolarHBondContact O-N 3.5Å; S159-A161 WeakPolarHBondContact OG-CB 3.31Å; S159-A161 PolarHBondContact OG-N 2.82Å; A161-V163 VanDerWaalsContact C-N 3.28Å; A161-V163 PolarHBondContact O-N 3.49Å; A161-L164 WeakPolarHBondContact O-CA 3.37Å; A161-L164 WeakPolarHBondContact O-CB 3.14Å; A161-L164 PolarHBondContact O-N 3.19Å; A161-E165 PolarHBondContact O-N 3.38Å
162	D	43.2	Very low	40.7	Very low	66 Å²	66	73.4 Å²	73.4	35%	0.353	41%	0.409	S	S	.	.	H	α-helix	trans	-67.2	-34.5	-178.6	-48	-8.9	0	0	0	110.7	S159 L164 S166	S159-D162 PolarHBondContact N-OD2 3.38Å; S159-D162 WeakPolarHBondContact O-CB 3.5Å; S159-D162 PolarHBondContact O-N 3.21Å; S159-D162 VanDerWaalsContact O-N 3.11Å; S159-D162 VanDerWaalsContact OG-CG 3.25Å; S159-D162 PolarHBondContact OG-N 3.48Å; S159-D162 PolarHBondContact OG-OD1 3.19Å; D162-L164 VanDerWaalsContact C-N 3.33Å; D162-S166 VanDerWaalsContact O-CB 3.29Å; D162-S166 WeakPolarHBondContact O-CB 3.34Å; D162-S166 PolarHBondContact O-N 2.96Å; D162-S166 PolarHBondContact O-OG 2.91Å
163	V	40.7	Very low	40.9	Very low	31 Å²	31	73.4 Å²	73.4	19%	0.188	41%	0.414	C	S	.	.	H	α-helix	trans	-60.6	-46.4	170.7	179.4	0	0	0	0	110.2	L157 A161 S166 L167	L157-V163 HydrophobicContact CB-CG2 4.41Å; L157-V163 HydrophobicContact CD1-CG2 3.78Å; L157-V163 HydrophobicContact CD2-CG2 3.33Å; L157-V163 HydrophobicContact CG-CG2 4.01Å; A161-V163 VanDerWaalsContact C-N 3.28Å; A161-V163 PolarHBondContact O-N 3.49Å; V163-S166 PolarHBondContact O-N 3.5Å; V163-L167 HydrophobicContact CG1-CD1 3.78Å; V163-L167 HydrophobicContact CG1-CG 4.28Å; V163-L167 WeakPolarHBondContact O-CB 3.26Å; V163-L167 WeakPolarHBondContact O-CG 3.26Å; V163-L167 PolarHBondContact O-N 2.92Å
164	L	43.7	Very low	41.1	Very low	41 Å²	41	74.5 Å²	74.5	22%	0.215	42%	0.421	C	S	.	.	H	α-helix	trans	-67.4	-42.2	-178.2	-124.1	110.5	0	0	0	111.8	P160 A161 D162 L167 V168 H185	P160-L164 PolarHBondContact O-N 2.94Å; A161-L164 WeakPolarHBondContact O-CA 3.37Å; A161-L164 WeakPolarHBondContact O-CB 3.14Å; A161-L164 PolarHBondContact O-N 3.19Å; D162-L164 VanDerWaalsContact C-N 3.33Å; L164-L167 PolarHBondContact O-N 3.1Å; L164-V168 WeakPolarHBondContact O-CB 3.42Å; L164-V168 VanDerWaalsContact O-CG2 3.28Å; L164-V168 WeakPolarHBondContact O-CG2 3.45Å; L164-V168 PolarHBondContact O-N 3.35Å; L164-H185 WeakPolarHBondContact CD1-CE1 3.33Å; L164-H185 WeakPolarHBondContact CD1-NE2 3.3Å; L164-H185 HydrophobicContact CD2-CB 4.14Å; L164-H185 VanDerWaalsContact CD2-CD2 3.42Å; L164-H185 WeakPolarHBondContact CD2-CD2 3.45Å; L164-H185 VanDerWaalsContact CD2-CG 3.47Å
165	E	47.7	Very low	41.4	Very low	109 Å²	109	71.7 Å²	71.7	51%	0.509	41%	0.406	S	S	.	.	H	α-helix	trans	-60.2	-48.2	176.1	-167.7	162.2	-155.7	0	0	110.5	A161 L167 V168 E169	A161-E165 PolarHBondContact O-N 3.38Å; E165-L167 VanDerWaalsContact C-N 3.3Å; E165-L167 PolarHBondContact O-N 3.23Å; E165-V168 PolarHBondContact O-N 3.43Å; E165-E169 WeakPolarHBondContact O-CB 3.5Å; E165-E169 PolarHBondContact O-N 2.88Å
166	S	43.8	Very low	41.6	Very low	69 Å²	69	71.2 Å²	71.2	48%	0.483	40%	0.395	S	S	.	.	H	α-helix	trans	-59.4	-38.4	174.3	-62.8	0	0	0	0	112.6	D162 V163 L170	D162-S166 VanDerWaalsContact O-CB 3.29Å; D162-S166 WeakPolarHBondContact O-CB 3.34Å; D162-S166 PolarHBondContact O-N 2.96Å; D162-S166 PolarHBondContact O-OG 2.91Å; V163-S166 PolarHBondContact O-N 3.5Å; S166-L170 WeakPolarHBondContact O-CB 3.27Å; S166-L170 PolarHBondContact O-N 3.12Å
167	L	41.2	Very low	41.7	Very low	30 Å²	30	71.3 Å²	71.3	16%	0.157	40%	0.402	C	S	.	.	H	α-helix	trans	-72	-37.3	178.9	-72.3	173.2	0	0	0	112.2	M104 V163 L164 E165 L170 L171	M104-L167 HydrophobicContact CB-CD2 4.3Å; M104-L167 HydrophobicContact CE-CB 3.78Å; M104-L167 HydrophobicContact CE-CD2 3.88Å; M104-L167 HydrophobicContact CE-CG 4.34Å; M104-L167 WeakPolarHBondContact CE-O 3.49Å; M104-L167 HydrophobicContact CG-CD1 4.24Å; M104-L167 HydrophobicContact CG-CD2 3.92Å; M104-L167 HydrophobicContact SD-CB 4.24Å; M104-L167 HydrophobicContact SD-CD2 4.41Å; V163-L167 HydrophobicContact CG1-CD1 3.78Å; V163-L167 HydrophobicContact CG1-CG 4.28Å; V163-L167 WeakPolarHBondContact O-CB 3.26Å; V163-L167 WeakPolarHBondContact O-CG 3.26Å; V163-L167 PolarHBondContact O-N 2.92Å; L164-L167 PolarHBondContact O-N 3.1Å; E165-L167 VanDerWaalsContact C-N 3.3Å; E165-L167 PolarHBondContact O-N 3.23Å; L167-L170 PolarHBondContact O-N 2.65Å; L167-L171 PolarHBondContact O-N 3.11Å
168	V	45.1	Very low	41.6	Very low	18 Å²	18	70.5 Å²	70.5	11%	0.109	40%	0.401	C	S	.	.	H	α-helix	trans	-66.9	-44.2	174.1	170.2	0	0	0	0	110.2	L164 E165 L170 L171 I172 M175 A181 I188	L164-V168 WeakPolarHBondContact O-CB 3.42Å; L164-V168 VanDerWaalsContact O-CG2 3.28Å; L164-V168 WeakPolarHBondContact O-CG2 3.45Å; L164-V168 PolarHBondContact O-N 3.35Å; E165-V168 PolarHBondContact O-N 3.43Å; V168-L170 VanDerWaalsContact C-N 3.28Å; V168-L170 PolarHBondContact O-N 3Å; V168-L171 PolarHBondContact O-N 3.5Å; V168-I172 PolarHBondContact O-N 2.93Å; V168-M175 HydrophobicContact CG1-CE 3.95Å; V168-A181 HydrophobicContact CG2-CB 4.45Å; V168-I188 HydrophobicContact CG2-CD1 4.2Å
169	E	45.8	Very low	41.1	Very low	109 Å²	109	69.5 Å²	69.5	51%	0.509	39%	0.392	S	S	.	.	H	α-helix	trans	-60.5	-38.2	175.6	-163.6	178.2	-171.1	0	0	111.6	E165 L171 A176	E165-E169 WeakPolarHBondContact O-CB 3.5Å; E165-E169 PolarHBondContact O-N 2.88Å; E169-L171 PolarHBondContact O-N 2.84Å; E169-A176 HydrophobicContact CG-CB 4.03Å
170	L	40.7	Very low	41.2	Very low	80 Å²	80	68.3 Å²	68.3	42%	0.419	38%	0.384	S	S	.	.	H	α-helix	trans	-68.1	-33.7	177	-158.3	90.1	0	0	0	113.3	K100 S166 L167 V168	K100-L170 HydrophobicContact CB-CD2 4.25Å; K100-L170 HydrophobicContact CD-CD2 4.49Å; K100-L170 HydrophobicContact CD-CG 4.27Å; K100-L170 WeakPolarHBondContact CD-O 3.49Å; S166-L170 WeakPolarHBondContact O-CB 3.27Å; S166-L170 PolarHBondContact O-N 3.12Å; L167-L170 PolarHBondContact O-N 2.65Å; V168-L170 VanDerWaalsContact C-N 3.28Å; V168-L170 PolarHBondContact O-N 3Å
171	L	38.4	Very low	41.3	Very low	14 Å²	14	65.4 Å²	65.4	7%	0.073	37%	0.369	C	S	.	.	H	α-helix	trans	-80.8	-35.5	-178.9	-90.6	167.4	0	0	0	112.8	I96 L101 M104 L167 V168 E169	I96-L171 HydrophobicContact CB-CD2 4.39Å; I96-L171 HydrophobicContact CG1-CD2 4.28Å; I96-L171 HydrophobicContact CG2-CD2 3.53Å; L101-L171 HydrophobicContact CB-CD2 4.2Å; L101-L171 HydrophobicContact CD1-CD1 4.24Å; L101-L171 HydrophobicContact CD1-CD2 4Å; M104-L171 HydrophobicContact CE-CD1 3.13Å; M104-L171 HydrophobicContact CE-CD2 4.33Å; M104-L171 HydrophobicContact CE-CG 3.4Å; M104-L171 VanDerWaalsContact CE-CG 3.4Å; M104-L171 HydrophobicContact SD-CD1 3.66Å; L167-L171 PolarHBondContact O-N 3.11Å; V168-L171 PolarHBondContact O-N 3.5Å; E169-L171 PolarHBondContact O-N 2.84Å
172	I	41.6	Very low	41.2	Very low	18 Å²	18	71.1 Å²	71.1	9%	0.092	38%	0.382	C	S	.	.			trans	-136.3	86.1	-173.6	-49.8	171.4	0	0	0	109.1	V168 E174 M175	V168-I172 PolarHBondContact O-N 2.93Å; I172-E174 HydrophobicContact CG2-CB 4.47Å; I172-E174 PolarHBondContact O-N 3.46Å; I172-M175 HydrophobicContact CB-CB 4.02Å; I172-M175 HydrophobicContact CB-CE 4.04Å; I172-M175 HydrophobicContact CB-CG 4.1Å; I172-M175 HydrophobicContact CB-SD 4.33Å; I172-M175 HydrophobicContact CD1-CE 3.33Å; I172-M175 HydrophobicContact CD1-SD 3.78Å; I172-M175 HydrophobicContact CG1-CE 4.19Å; I172-M175 HydrophobicContact CG2-CB 3.79Å; I172-M175 HydrophobicContact CG2-CE 4.31Å; I172-M175 HydrophobicContact CG2-CG 3.45Å; I172-M175 VanDerWaalsContact CG2-CG 3.45Å; I172-M175 HydrophobicContact CG2-SD 3.93Å; I172-M175 PolarHBondContact O-N 3.45Å
173	P	41.6	Very low	40.9	Very low	87 Å²	87	76.6 Å²	76.6	57%	0.565	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-56.9	-32.8	177.8	-23.4	33	0	0	0	112.6	M175 A176	P173-M175 PolarHBondContact O-N 2.91Å; P173-A176 WeakPolarHBondContact O-CB 3.47Å; P173-A176 PolarHBondContact O-N 3.01Å
174	E	41.2	Very low	40.8	Very low	153 Å²	153	76.3 Å²	76.3	72%	0.715	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-67.8	-16	176.4	-72.5	-163.6	155.8	0	0	113.8	M95 I172	M95-E174 WeakPolarHBondContact CE-OE2 3.44Å; I172-E174 HydrophobicContact CG2-CB 4.47Å; I172-E174 PolarHBondContact O-N 3.46Å
175	M	39.2	Very low	40.6	Very low	55 Å²	55	78.7 Å²	78.7	27%	0.271	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-96.7	-2.5	176.1	-70.9	-172	-10.5	0	0	113.7	V168 I172 P173 N177 S178	V168-M175 HydrophobicContact CG1-CE 3.95Å; I172-M175 HydrophobicContact CB-CB 4.02Å; I172-M175 HydrophobicContact CB-CE 4.04Å; I172-M175 HydrophobicContact CB-CG 4.1Å; I172-M175 HydrophobicContact CB-SD 4.33Å; I172-M175 HydrophobicContact CD1-CE 3.33Å; I172-M175 HydrophobicContact CD1-SD 3.78Å; I172-M175 HydrophobicContact CG1-CE 4.19Å; I172-M175 HydrophobicContact CG2-CB 3.79Å; I172-M175 HydrophobicContact CG2-CE 4.31Å; I172-M175 HydrophobicContact CG2-CG 3.45Å; I172-M175 VanDerWaalsContact CG2-CG 3.45Å; I172-M175 HydrophobicContact CG2-SD 3.93Å; I172-M175 PolarHBondContact O-N 3.45Å; P173-M175 PolarHBondContact O-N 2.91Å; M175-N177 PolarHBondContact O-N 3.47Å; M175-S178 CarbonylContact O-C 3.59Å; M175-S178 PolarHBondContact O-N 2.95Å
176	A	37.2	Very low	40.4	Very low	50 Å²	50	81.2 Å²	81.2	41%	0.413	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-23.2	169.3	0	0	0	0	0	112	E169 P173	E169-A176 HydrophobicContact CG-CB 4.03Å; P173-A176 WeakPolarHBondContact O-CB 3.47Å; P173-A176 PolarHBondContact O-N 3.01Å
177	N	42.9	Very low	40.4	Very low	162 Å²	162	80.6 Å²	80.6	87%	0.866	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	6.3	174.1	-71.7	-29.3	0	0	0	114.9	M175	M175-N177 PolarHBondContact O-N 3.47Å
178	S	34.6	Very low	40.5	Very low	41 Å²	41	81.4 Å²	81.4	29%	0.287	42%	0.42	S	S	.	.			trans	-139	84.8	-172.6	172.9	0	0	0	0	111.4	M175 A180	M175-S178 CarbonylContact O-C 3.59Å; M175-S178 PolarHBondContact O-N 2.95Å; S178-A180 PolarHBondContact O-N 2.8Å
179	M	34.4	Very low	40.5	Very low	142 Å²	142	83.8 Å²	83.8	70%	0.7	44%	0.437	S	S	*	.			trans	-57.7	56	179.3	-73.1	179.6	-86.8	0	0	115.8	I78	I78-M179 WeakPolarHBondContact CD1-O 3.48Å
180	A	41	Very low	40.7	Very low	7 Å²	7	81.7 Å²	81.7	6%	0.058	44%	0.435	C	S	.	.			trans	-119.7	11.7	-162.3	0	0	0	0	0	116.7	I78 L82 S178 K182	I78-A180 HydrophobicContact CB-CB 4.33Å; I78-A180 HydrophobicContact CG1-CB 4.45Å; I78-A180 HydrophobicContact CG2-CB 3.08Å; L82-A180 HydrophobicContact CD1-CB 3.97Å; S178-A180 PolarHBondContact O-N 2.8Å; A180-K182 VanDerWaalsContact C-N 3.28Å; A180-K182 PolarHBondContact O-N 2.98Å
181	A	41.8	Very low	40.8	Very low	33 Å²	33	81.4 Å²	81.4	27%	0.273	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	4.3	-159.2	0	0	0	0	0	117.9	V168	V168-A181 HydrophobicContact CG2-CB 4.45Å
182	K	39.8	Very low	41.1	Very low	178 Å²	178	81.5 Å²	81.5	77%	0.774	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-24.8	-168.1	-116.5	178.6	-176	176.1	0	116.2	A180	A180-K182 VanDerWaalsContact C-N 3.28Å; A180-K182 PolarHBondContact O-N 2.98Å
183	R	35.6	Very low	41.2	Very low	182 Å²	182	82.1 Å²	82.1	69%	0.687	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-20.7	172.5	-86.6	-167.5	172.3	139.9	0.5	113.7	E79 H185 E186	E79-R183 IonicContact OE1-NH1 3.29Å; E79-R183 PolarHBondContact OE1-NH1 3.02Å; R183-H185 PolarHBondContact O-N 3.28Å; R183-E186 PolarHBondContact O-N 3.36Å
184	D	39.9	Very low	41.3	Very low	25 Å²	25	84 Å²	84	13%	0.134	45%	0.446	C	S	.	.	H	α-helix	trans	-66.8	-19.8	173.9	-60.7	-32.9	0	0	0	112	E186 A187 I188	D184-E186 PolarHBondContact O-N 3.43Å; D184-A187 PolarHBondContact O-N 3.42Å; D184-I188 HydrophobicContact CB-CD1 3.88Å; D184-I188 HydrophobicContact CB-CG1 4.44Å; D184-I188 WeakPolarHBondContact O-CB 3.42Å; D184-I188 WeakPolarHBondContact O-CG1 3.34Å; D184-I188 PolarHBondContact O-N 2.97Å
185	H	39	Very low	41.3	Very low	90 Å²	90	79.9 Å²	79.9	42%	0.417	43%	0.428	S	S	.	.	H	α-helix	trans	-59.3	-36	178.2	-160.5	-9.1	0	0	0	112.6	L164 R183 S189	L164-H185 WeakPolarHBondContact CD1-CE1 3.33Å; L164-H185 WeakPolarHBondContact CD1-NE2 3.3Å; L164-H185 HydrophobicContact CD2-CB 4.14Å; L164-H185 VanDerWaalsContact CD2-CD2 3.42Å; L164-H185 WeakPolarHBondContact CD2-CD2 3.45Å; L164-H185 VanDerWaalsContact CD2-CG 3.47Å; R183-H185 PolarHBondContact O-N 3.28Å; H185-S189 WeakPolarHBondContact O-CA 3.49Å; H185-S189 WeakPolarHBondContact O-CB 3.3Å; H185-S189 PolarHBondContact O-N 2.9Å
186	E	43.5	Very low	41.6	Very low	163 Å²	163	80.3 Å²	80.3	76%	0.762	43%	0.434	S	S	*	.	H	α-helix	trans	-78.2	-40	-178.6	-154.4	168.4	-157	0	0	111.5	R183 D184 S189 S190	R183-E186 PolarHBondContact O-N 3.36Å; D184-E186 PolarHBondContact O-N 3.43Å; E186-S189 PolarHBondContact O-N 3.44Å; E186-S190 VanDerWaalsContact O-CB 3.29Å; E186-S190 WeakPolarHBondContact O-CB 3.34Å; E186-S190 PolarHBondContact O-N 2.84Å
187	A	43.4	Very low	42.1	Very low	55 Å²	55	82.6 Å²	82.6	46%	0.455	44%	0.439	S	S	.	.	H	α-helix	trans	-65.6	-47	173.8	0	0	0	0	0	111.5	D184 S190 L191	D184-A187 PolarHBondContact O-N 3.42Å; A187-S190 PolarHBondContact O-N 2.9Å; A187-L191 WeakPolarHBondContact O-CB 3.45Å; A187-L191 PolarHBondContact O-N 3.29Å
188	I	43.8	Very low	41.7	Very low	47 Å²	47	76.9 Å²	76.9	24%	0.241	41%	0.414	C	S	.	.	H	α-helix	trans	-65.6	-41.8	176.5	-65.7	168.5	0	0	0	110.2	V168 D184 S190 L191 I192	V168-I188 HydrophobicContact CG2-CD1 4.2Å; D184-I188 HydrophobicContact CB-CD1 3.88Å; D184-I188 HydrophobicContact CB-CG1 4.44Å; D184-I188 WeakPolarHBondContact O-CB 3.42Å; D184-I188 WeakPolarHBondContact O-CG1 3.34Å; D184-I188 PolarHBondContact O-N 2.97Å; I188-S190 VanDerWaalsContact C-N 3.35Å; I188-S190 PolarHBondContact O-N 3.38Å; I188-L191 PolarHBondContact O-N 2.84Å; I188-I192 HydrophobicContact CG2-CD1 3.58Å; I188-I192 HydrophobicContact CG2-CG1 4.11Å; I188-I192 WeakPolarHBondContact O-CB 3.32Å; I188-I192 WeakPolarHBondContact O-CG1 3.25Å; I188-I192 PolarHBondContact O-N 3.19Å
189	S	46	Very low	42.1	Very low	68 Å²	68	80.7 Å²	80.7	48%	0.476	43%	0.426	S	S	.	.	H	α-helix	trans	-61.5	-42.8	175.4	-178.6	0	0	0	0	111.5	H185 E186 I192 G193	H185-S189 WeakPolarHBondContact O-CA 3.49Å; H185-S189 WeakPolarHBondContact O-CB 3.3Å; H185-S189 PolarHBondContact O-N 2.9Å; E186-S189 PolarHBondContact O-N 3.44Å; S189-I192 PolarHBondContact O-N 2.92Å; S189-G193 PolarHBondContact O-N 3.49Å
190	S	48.4	Very low	42.3	Very low	66 Å²	66	76.8 Å²	76.8	46%	0.462	41%	0.413	S	S	.	.	H	α-helix	trans	-61.6	-45	174.1	-177.3	0	0	0	0	111.5	E186 A187 I188 G193 Q194	E186-S190 VanDerWaalsContact O-CB 3.29Å; E186-S190 WeakPolarHBondContact O-CB 3.34Å; E186-S190 PolarHBondContact O-N 2.84Å; A187-S190 PolarHBondContact O-N 2.9Å; I188-S190 VanDerWaalsContact C-N 3.35Å; I188-S190 PolarHBondContact O-N 3.38Å; S190-G193 PolarHBondContact O-N 3.4Å; S190-Q194 WeakPolarHBondContact O-CG 3.42Å; S190-Q194 PolarHBondContact O-N 3.26Å
191	L	43.1	Very low	42.1	Very low	73 Å²	73	81.9 Å²	81.9	38%	0.382	44%	0.438	S	S	.	.	H	α-helix	trans	-67	-40.7	179.8	-138	147.3	0	0	0	111.9	L92 A187 I188 Q194 L195	L92-L191 HydrophobicContact CD2-CD1 4.12Å; A187-L191 WeakPolarHBondContact O-CB 3.45Å; A187-L191 PolarHBondContact O-N 3.29Å; I188-L191 PolarHBondContact O-N 2.84Å; L191-Q194 PolarHBondContact O-N 2.9Å; L191-L195 HydrophobicContact CD2-CD1 3.91Å; L191-L195 HydrophobicContact CD2-CG 4.47Å; L191-L195 WeakPolarHBondContact O-CB 3.48Å; L191-L195 VanDerWaalsContact O-CG 3.31Å; L191-L195 WeakPolarHBondContact O-CG 3.43Å; L191-L195 PolarHBondContact O-N 2.92Å
192	I	45.8	Very low	42.1	Very low	17 Å²	17	87.9 Å²	87.9	9%	0.087	46%	0.457	C	S	.	.	H	α-helix	trans	-64.8	-43.2	172.4	-68.9	172.4	0	0	0	110.3	M104 L108 I188 S189 Q194 L195 V196	M104-I192 HydrophobicContact SD-CD1 4.2Å; L108-I192 HydrophobicContact CD2-CD1 4.21Å; L108-I192 HydrophobicContact CD2-CG2 3.77Å; I188-I192 HydrophobicContact CG2-CD1 3.58Å; I188-I192 HydrophobicContact CG2-CG1 4.11Å; I188-I192 WeakPolarHBondContact O-CB 3.32Å; I188-I192 WeakPolarHBondContact O-CG1 3.25Å; I188-I192 PolarHBondContact O-N 3.19Å; S189-I192 PolarHBondContact O-N 2.92Å; I192-Q194 VanDerWaalsContact C-N 3.32Å; I192-Q194 PolarHBondContact O-N 3.06Å; I192-L195 PolarHBondContact O-N 3.46Å; I192-L195 VanDerWaalsContact O-N 3.13Å; I192-V196 HydrophobicContact CG2-CG2 4.09Å; I192-V196 WeakPolarHBondContact O-CB 3.39Å; I192-V196 VanDerWaalsContact O-CG2 3.31Å; I192-V196 WeakPolarHBondContact O-CG2 3.41Å; I192-V196 PolarHBondContact O-N 3.06Å
193	G	43.8	Very low	42.1	Very low	30 Å²	30	82.6 Å²	82.6	31%	0.309	44%	0.443	S	S	.	.	H	α-helix	trans	-58	-44.4	175.3	0	0	0	0	0	111.9	S189 S190 N197	S189-G193 PolarHBondContact O-N 3.49Å; S190-G193 PolarHBondContact O-N 3.4Å; G193-N197 WeakPolarHBondContact O-CB 3.44Å; G193-N197 VanDerWaalsContact O-CG 3.28Å; G193-N197 PolarHBondContact O-N 3.5Å; G193-N197 PolarHBondContact O-ND2 3.05Å
194	Q	44.2	Very low	42.3	Very low	127 Å²	127	77.7 Å²	77.7	59%	0.593	43%	0.433	S	S	*	.	H	α-helix	trans	-63.2	-41	174	-71.4	179.4	13	0	0	112.2	S190 L191 I192 N197 A198	S190-Q194 WeakPolarHBondContact O-CG 3.42Å; S190-Q194 PolarHBondContact O-N 3.26Å; L191-Q194 PolarHBondContact O-N 2.9Å; I192-Q194 VanDerWaalsContact C-N 3.32Å; I192-Q194 PolarHBondContact O-N 3.06Å; Q194-N197 PolarHBondContact O-N 3.31Å; Q194-A198 VanDerWaalsContact O-CB 3.31Å; Q194-A198 WeakPolarHBondContact O-CB 3.44Å; Q194-A198 PolarHBondContact O-N 3.27Å
195	L	40.6	Very low	42.2	Very low	67 Å²	67	79.8 Å²	79.8	35%	0.351	45%	0.45	S	S	.	.	H	α-helix	trans	-69.8	-41.2	179.1	-76.4	166.2	0	0	0	113.4	L101 L191 I192 N197 A198 K199	L101-L195 HydrophobicContact CD2-CD1 3.61Å; L101-L195 HydrophobicContact CG-CD1 4.32Å; L191-L195 HydrophobicContact CD2-CD1 3.91Å; L191-L195 HydrophobicContact CD2-CG 4.47Å; L191-L195 WeakPolarHBondContact O-CB 3.48Å; L191-L195 VanDerWaalsContact O-CG 3.31Å; L191-L195 WeakPolarHBondContact O-CG 3.43Å; L191-L195 PolarHBondContact O-N 2.92Å; I192-L195 PolarHBondContact O-N 3.46Å; I192-L195 VanDerWaalsContact O-N 3.13Å; L195-N197 VanDerWaalsContact C-N 3.32Å; L195-A198 PolarHBondContact O-N 3.27Å; L195-K199 PolarHBondContact O-N 3.33Å
196	V	45.9	Very low	42.4	Very low	63 Å²	63	82.9 Å²	82.9	38%	0.382	46%	0.464	S	S	.	.	H	α-helix	trans	-61.9	-44.2	175	171	0	0	0	0	109.7	I192 K199 S200	I192-V196 HydrophobicContact CG2-CG2 4.09Å; I192-V196 WeakPolarHBondContact O-CB 3.39Å; I192-V196 VanDerWaalsContact O-CG2 3.31Å; I192-V196 WeakPolarHBondContact O-CG2 3.41Å; I192-V196 PolarHBondContact O-N 3.06Å; V196-K199 PolarHBondContact O-N 3.25Å; V196-S200 PolarHBondContact O-N 3.1Å; V196-S200 VanDerWaalsContact O-N 3.1Å
197	N	46.1	Very low	42.3	Very low	99 Å²	99	85.1 Å²	85.1	53%	0.529	47%	0.466	S	S	.	.	H	α-helix	trans	-65.8	-39.2	175.3	-73.8	-21.2	0	0	0	112.3	G193 Q194 L195 K199 S200 I201	G193-N197 WeakPolarHBondContact O-CB 3.44Å; G193-N197 VanDerWaalsContact O-CG 3.28Å; G193-N197 PolarHBondContact O-N 3.5Å; G193-N197 PolarHBondContact O-ND2 3.05Å; Q194-N197 PolarHBondContact O-N 3.31Å; L195-N197 VanDerWaalsContact C-N 3.32Å; N197-K199 VanDerWaalsContact C-N 3.3Å; N197-K199 PolarHBondContact O-N 3.02Å; N197-S200 VanDerWaalsContact O-CB 3.3Å; N197-S200 WeakPolarHBondContact O-CB 3.49Å; N197-S200 PolarHBondContact O-N 3.31Å; N197-I201 VanDerWaalsContact O-CG1 3.31Å; N197-I201 WeakPolarHBondContact O-CG1 3.47Å; N197-I201 PolarHBondContact O-N 3.17Å
198	A	35.4	Very low	42.4	Very low	42 Å²	42	90.5 Å²	90.5	35%	0.347	48%	0.479	S	S	.	.	H	α-helix	trans	-63.3	-35.2	176.4	0	0	0	0	0	112.4	Q194 L195 I201 K202	Q194-A198 VanDerWaalsContact O-CB 3.31Å; Q194-A198 WeakPolarHBondContact O-CB 3.44Å; Q194-A198 PolarHBondContact O-N 3.27Å; L195-A198 PolarHBondContact O-N 3.27Å; A198-I201 PolarHBondContact O-N 3.2Å; A198-K202 PolarHBondContact O-N 3.02Å
199	K	42.2	Very low	42.6	Very low	120 Å²	120	97.2 Å²	97.2	52%	0.522	51%	0.507	S	S	.	.	H	α-helix	trans	-69.8	-39.2	175.3	-133.4	175.6	-172.9	178.7	0	111.5	L195 V196 N197 K202 S203	L195-K199 PolarHBondContact O-N 3.33Å; V196-K199 PolarHBondContact O-N 3.25Å; N197-K199 VanDerWaalsContact C-N 3.3Å; N197-K199 PolarHBondContact O-N 3.02Å; K199-K202 PolarHBondContact O-N 3.25Å; K199-S203 PolarHBondContact O-N 3.47Å; K199-S203 VanDerWaalsContact O-N 3.08Å
200	S	39	Very low	42.5	Very low	61 Å²	61	103.2 Å²	103.2	43%	0.427	52%	0.524	S	S	.	.	H	α-helix	trans	-55.7	-50.7	170.1	150.7	0	0	0	0	110.8	V196 N197 K202 S203 V204	V196-S200 PolarHBondContact O-N 3.1Å; V196-S200 VanDerWaalsContact O-N 3.1Å; N197-S200 VanDerWaalsContact O-CB 3.3Å; N197-S200 WeakPolarHBondContact O-CB 3.49Å; N197-S200 PolarHBondContact O-N 3.31Å; S200-K202 PolarHBondContact O-N 3.4Å; S200-S203 PolarHBondContact O-N 3.31Å; S200-S203 VanDerWaalsContact O-N 3.16Å; S200-S203 PolarHBondContact O-OG 3.25Å; S200-V204 WeakPolarHBondContact O-CG2 3.21Å; S200-V204 PolarHBondContact O-N 2.87Å
201	I	37.7	Very low	42.2	Very low	114 Å²	114	112.1 Å²	112.1	59%	0.585	55%	0.554	S	S	*	*	H	α-helix	trans	-65.8	-38	-177.6	-63	160.4	0	0	0	111.9	N197 A198 V204 S205	N197-I201 VanDerWaalsContact O-CG1 3.31Å; N197-I201 WeakPolarHBondContact O-CG1 3.47Å; N197-I201 PolarHBondContact O-N 3.17Å; A198-I201 PolarHBondContact O-N 3.2Å; I201-V204 PolarHBondContact O-N 3.37Å; I201-S205 WeakPolarHBondContact O-CB 3.39Å; I201-S205 PolarHBondContact O-N 3.07Å
202	K	40.6	Very low	42.1	Very low	158 Å²	158	114.1 Å²	114.1	69%	0.687	56%	0.563	S	S	*	*	H	α-helix	trans	-65.1	-38.5	174.6	-77.5	-173.1	179.5	-178.3	0	112.5	A198 K199 S200 S205 Q206	A198-K202 PolarHBondContact O-N 3.02Å; K199-K202 PolarHBondContact O-N 3.25Å; S200-K202 PolarHBondContact O-N 3.4Å; K202-S205 PolarHBondContact O-N 3.2Å; K202-Q206 PolarHBondContact O-N 2.95Å
203	S	39.4	Very low	42	Very low	67 Å²	67	119.2 Å²	119.2	47%	0.469	59%	0.588	S	S	.	*	H	α-helix	trans	-68.8	-34.4	177.2	75.6	0	0	0	0	112.7	K199 S200 R207	K199-S203 PolarHBondContact O-N 3.47Å; K199-S203 VanDerWaalsContact O-N 3.08Å; S200-S203 PolarHBondContact O-N 3.31Å; S200-S203 VanDerWaalsContact O-N 3.16Å; S200-S203 PolarHBondContact O-OG 3.25Å; S203-R207 PolarHBondContact O-N 3.18Å
204	V	40.4	Very low	41.9	Very low	80 Å²	80	124.1 Å²	124.1	49%	0.485	60%	0.603	S	S	.	*	H	α-helix	trans	-71.8	-40.2	175	175.7	0	0	0	0	111.4	S200 I201 R207 K208	S200-V204 WeakPolarHBondContact O-CG2 3.21Å; S200-V204 PolarHBondContact O-N 2.87Å; I201-V204 PolarHBondContact O-N 3.37Å; V204-R207 PolarHBondContact O-N 3.37Å; V204-K208 PolarHBondContact O-N 3.33Å
205	S	38.4	Very low	41.7	Very low	69 Å²	69	123.9 Å²	123.9	48%	0.483	60%	0.604	S	S	.	*	H	α-helix	trans	-69.8	-33.4	179.7	-156.2	0	0	0	0	112.5	I201 K202 R207 K208	I201-S205 WeakPolarHBondContact O-CB 3.39Å; I201-S205 PolarHBondContact O-N 3.07Å; K202-S205 PolarHBondContact O-N 3.2Å; S205-R207 VanDerWaalsContact C-N 3.35Å; S205-R207 PolarHBondContact O-N 3.5Å; S205-K208 PolarHBondContact O-N 3.15Å
206	Q	43.2	Very low	41.8	Very low	154 Å²	154	127.5 Å²	127.5	72%	0.72	62%	0.62	S	S	*	*	H	α-helix	trans	-68.1	-30.4	172.4	-79.5	-166.4	-37	0	0	113.5	K202 K208 K209	K202-Q206 PolarHBondContact O-N 2.95Å; Q206-K208 VanDerWaalsContact C-N 3.34Å; Q206-K209 PolarHBondContact O-N 3.13Å
207	R	40.8	Very low	41.5	Very low	211 Å²	211	131.8 Å²	131.8	80%	0.796	64%	0.636	S	S	*	*	H	α-helix	trans	-71.1	-26.4	174.3	-82.4	-176.8	173.5	171.2	-1.4	113.3	S203 V204 S205	S203-R207 PolarHBondContact O-N 3.18Å; V204-R207 PolarHBondContact O-N 3.37Å; S205-R207 VanDerWaalsContact C-N 3.35Å; S205-R207 PolarHBondContact O-N 3.5Å
208	K	45.5	Very low	41.2	Very low	168 Å²	168	134.1 Å²	134.1	73%	0.73	64%	0.643	S	S	*	*	H	α-helix	trans	-78.6	-18.3	176.1	-77.9	-168.6	175.7	-176.8	0	114.5	V204 S205 Q206	V204-K208 PolarHBondContact O-N 3.33Å; S205-K208 PolarHBondContact O-N 3.15Å; Q206-K208 VanDerWaalsContact C-N 3.34Å
209	K	48.7	Very low	41.6	Very low	188 Å²	188	141.2 Å²	141.2	82%	0.817	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	1	175.2	-78.8	-169.7	174.4	-175.1	0	114.6	Q206	Q206-K209 PolarHBondContact O-N 3.13Å
210	K	44.2	Very low	41.6	Very low	194 Å²	194	143 Å²	143	84%	0.843	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	15.6	177.2	-83.1	-166.7	173.9	-172.4	0	113.9
211	K	41.3	Very low	41.8	Very low	252 Å²	252	150.5 Å²	150.5	100%	1.096	70%	0.701	S	S	*	*			trans	-113.4	0	161.8	-77.9	-169.9	173.3	-170.6	0	107.7

Retrieved 211 of 211 residues in 53.8 ms (Link to these results)

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