A0A077ZK13_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZK13, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 159 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	40.9	Very low	50.3	Low	240 Å²	240	167 Å²	167	100%	1.182	88%	0.876	S	S	*	*				0	128	0	-62	-166.5	-170.9	0	0	107.7
2	C	46.7	Very low	49.8	Very low	135 Å²	135	168.8 Å²	168.8	91%	0.912	87%	0.872	S	S	*	*			trans	48.1	74.1	177.4	-59.3	0	0	0	0	118.8	G4	C2-G4 PolarHBondContact O-N 3.41Å
3	E	48.3	Very low	49.3	Very low	192 Å²	192	173.5 Å²	173.5	90%	0.897	87%	0.872	S	S	*	*			trans	-81.9	101.5	157.6	-68.4	-167.5	131.5	0	0	109.8	K5	E3-K5 PolarHBondContact O-N 3.18Å
4	G	47.5	Very low	49	Very low	76 Å²	76	172.4 Å²	172.4	78%	0.784	87%	0.87	S	S	*	*			trans	-72.9	100	175	0	0	0	0	0	111.7	C2 K6	C2-G4 PolarHBondContact O-N 3.41Å; G4-K6 PolarHBondContact O-N 3.23Å
5	K	55.3	Low	48.5	Very low	204 Å²	204	169 Å²	169	89%	0.887	86%	0.855	S	S	*	*			trans	-63.8	113.7	170.8	-70.8	-178.1	177.3	177.9	0	110.1	E3	E3-K5 PolarHBondContact O-N 3.18Å
6	K	59.5	Low	48.5	Very low	199 Å²	199	164.1 Å²	164.1	87%	0.865	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-64.1	136.3	166.5	-76.5	178.2	178	174.9	0	109.8	G4	G4-K6 PolarHBondContact O-N 3.23Å
7	P	54.8	Low	47.9	Very low	116 Å²	116	158.5 Å²	158.5	75%	0.753	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-67.3	147.7	173.7	26.2	-31.3	0	0	0	111.2
8	P	51	Low	47.4	Very low	122 Å²	122	153.8 Å²	153.8	79%	0.792	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.2	132	-175.9	26.6	-32.7	0	0	0	111.6	Q10	P8-Q10 PolarHBondContact O-N 3.26Å
9	M	52.5	Low	47.1	Very low	187 Å²	187	156.7 Å²	156.7	92%	0.921	80%	0.801	S	S	*	*			trans	-55.8	109.5	168.8	-87.6	-175.4	151.4	0	0	110.1	K11	M9-K11 PolarHBondContact O-N 2.92Å; M9-K11 VanDerWaalsContact O-N 3.11Å
10	Q	49	Very low	47	Very low	170 Å²	170	156.7 Å²	156.7	79%	0.794	80%	0.795	S	S	*	*			trans	-62.1	111.5	162.9	-101.6	-179.3	8.6	0	0	108.3	P8 F12	P8-Q10 PolarHBondContact O-N 3.26Å; Q10-F12 PolarHBondContact O-N 3.23Å
11	K	47.4	Very low	46.8	Very low	196 Å²	196	157.6 Å²	157.6	85%	0.852	79%	0.789	S	S	*	*			trans	-65.4	102.6	168.8	-66.6	-179.1	179.8	178.2	0	107.6	M9 R13	M9-K11 PolarHBondContact O-N 2.92Å; M9-K11 VanDerWaalsContact O-N 3.11Å; K11-R13 PolarHBondContact O-N 3.24Å
12	F	45.1	Very low	47.1	Very low	189 Å²	189	148 Å²	148	83%	0.829	74%	0.743	S	S	*	*			trans	-58	104.3	162.1	-77.7	-86.8	0	0	0	107.2	Q10 N14	Q10-F12 PolarHBondContact O-N 3.23Å; F12-N14 PolarHBondContact O-N 2.81Å
13	R	42.5	Very low	47.1	Very low	230 Å²	230	146.5 Å²	146.5	87%	0.868	72%	0.724	S	S	*	*			trans	-58.7	111.7	169.1	-88.5	-178.7	167.1	-178.7	-2.9	106.6	K11 N15	K11-R13 PolarHBondContact O-N 3.24Å; R13-N15 PolarHBondContact O-N 3.22Å
14	N	44.9	Very low	47.3	Very low	157 Å²	157	143.1 Å²	143.1	84%	0.84	71%	0.709	S	S	*	*			trans	-52.5	99.1	167.9	-90.5	-26.5	0	0	0	108.8	F12 S16	F12-N14 PolarHBondContact O-N 2.81Å; N14-S16 PolarHBondContact O-N 3.39Å
15	N	42.6	Very low	47.5	Very low	122 Å²	122	141.6 Å²	141.6	65%	0.652	69%	0.688	S	S	*	*			trans	-69.8	79.3	171.1	-98.4	-11.4	0	0	0	108.8	R13 C17 C18	R13-N15 PolarHBondContact O-N 3.22Å; N15-C17 PolarHBondContact O-N 3.4Å; N15-C18 PolarHBondContact O-N 2.82Å
16	S	47.4	Very low	47.3	Very low	91 Å²	91	133.4 Å²	133.4	64%	0.636	66%	0.655	S	S	*	*	H	α-helix	trans	-63.7	-15.7	177.9	70.7	0	0	0	0	113.1	N14	N14-S16 PolarHBondContact O-N 3.39Å
17	C	39.1	Very low	46.9	Very low	69 Å²	69	129.7 Å²	129.7	47%	0.466	64%	0.641	S	S	.	*	H	α-helix	trans	-68.3	-36.7	174.4	-169.3	0	0	0	0	112.6	N15	N15-C17 PolarHBondContact O-N 3.4Å
18	C	39.4	Very low	46.9	Very low	73 Å²	73	130.5 Å²	130.5	49%	0.493	64%	0.635	S	S	.	*	H	α-helix	trans	-71.4	-35.5	-179.2	-66.8	0	0	0	0	111.7	N15 K20 T22	N15-C18 PolarHBondContact O-N 2.82Å; C18-K20 PolarHBondContact O-N 3.36Å; C18-T22 PolarHBondContact O-N 3.41Å; C18-T22 PolarHBondContact O-OG1 2.9Å
19	R	41.8	Very low	46.8	Very low	209 Å²	209	125.8 Å²	125.8	79%	0.789	60%	0.604	S	S	*	*	H	α-helix	trans	-65.4	-35.9	-177.7	-131.9	179.9	-171.7	-174.5	2.4	113.3	M23	R19-M23 VanDerWaalsContact O-CG 3.29Å; R19-M23 WeakPolarHBondContact O-CG 3.38Å; R19-M23 PolarHBondContact O-N 3.29Å
20	K	43.8	Very low	46.5	Very low	157 Å²	157	125.8 Å²	125.8	68%	0.683	59%	0.593	S	S	*	*	H	α-helix	trans	-69.8	-45.7	179.3	-75.3	-171.6	175.7	-173.3	0	112.4	C18 T22 M23 E24	C18-K20 PolarHBondContact O-N 3.36Å; K20-T22 VanDerWaalsContact C-N 3.34Å; K20-T22 PolarHBondContact O-N 3.4Å; K20-M23 PolarHBondContact O-N 3.06Å; K20-E24 PolarHBondContact O-N 2.84Å; K20-E24 VanDerWaalsContact O-N 3.09Å
21	R	43.4	Very low	46.6	Very low	176 Å²	176	120.4 Å²	120.4	66%	0.664	58%	0.578	S	S	*	*	H	α-helix	trans	-65.5	-36.8	179.8	-65.2	-173.2	-162.5	-177.7	3.6	112.6	A25	R21-A25 WeakPolarHBondContact O-CB 3.44Å; R21-A25 PolarHBondContact O-N 3.42Å; R21-A25 VanDerWaalsContact O-N 3.15Å
22	T	47.6	Very low	46.6	Very low	38 Å²	38	117 Å²	117	23%	0.233	57%	0.565	C	S	.	*	H	α-helix	trans	-68.4	-39	177.5	-50.5	0	0	0	0	111.7	C18 K20 A25 V26	C18-T22 PolarHBondContact O-N 3.41Å; C18-T22 PolarHBondContact O-OG1 2.9Å; K20-T22 VanDerWaalsContact C-N 3.34Å; K20-T22 PolarHBondContact O-N 3.4Å; T22-A25 PolarHBondContact O-N 3.45Å; T22-V26 VanDerWaalsContact O-CG2 3.23Å; T22-V26 WeakPolarHBondContact O-CG2 3.14Å; T22-V26 PolarHBondContact O-N 3.05Å
23	M	46	Very low	46.7	Very low	103 Å²	103	112.3 Å²	112.3	51%	0.507	55%	0.552	S	S	.	*	H	α-helix	trans	-68.8	-41.7	177.8	-70.5	-66.6	-67.9	0	0	112.4	R19 K20 A25 V26 E27	R19-M23 VanDerWaalsContact O-CG 3.29Å; R19-M23 WeakPolarHBondContact O-CG 3.38Å; R19-M23 PolarHBondContact O-N 3.29Å; K20-M23 PolarHBondContact O-N 3.06Å; M23-A25 VanDerWaalsContact C-N 3.31Å; M23-A25 PolarHBondContact O-N 3.02Å; M23-V26 PolarHBondContact O-N 3.11Å; M23-E27 WeakPolarHBondContact O-CB 3.37Å; M23-E27 WeakPolarHBondContact O-CG 3.38Å; M23-E27 PolarHBondContact O-N 2.82Å
24	E	52.8	Low	46.9	Very low	122 Å²	122	107 Å²	107	57%	0.57	55%	0.546	S	S	*	.	H	α-helix	trans	-60.4	-40.1	174.4	-74.6	173.6	172	0	0	112	K20 E27 Q28	K20-E24 PolarHBondContact O-N 2.84Å; K20-E24 VanDerWaalsContact O-N 3.09Å; E24-E27 PolarHBondContact O-N 3.37Å; E24-Q28 WeakPolarHBondContact O-CG 3.47Å; E24-Q28 PolarHBondContact O-N 3Å
25	A	51.5	Low	47	Very low	43 Å²	43	105 Å²	105	36%	0.355	54%	0.539	S	S	.	.	H	α-helix	trans	-67	-41.6	176	0	0	0	0	0	112.1	R21 T22 M23 Q28 V29	R21-A25 WeakPolarHBondContact O-CB 3.44Å; R21-A25 PolarHBondContact O-N 3.42Å; R21-A25 VanDerWaalsContact O-N 3.15Å; T22-A25 PolarHBondContact O-N 3.45Å; M23-A25 VanDerWaalsContact C-N 3.31Å; M23-A25 PolarHBondContact O-N 3.02Å; A25-Q28 PolarHBondContact O-N 2.99Å; A25-V29 VanDerWaalsContact O-CG2 3.31Å; A25-V29 WeakPolarHBondContact O-CG2 3.26Å; A25-V29 PolarHBondContact O-N 2.89Å; A25-V29 VanDerWaalsContact O-N 3.09Å
26	V	50.1	Low	46.7	Very low	32 Å²	32	104.6 Å²	104.6	19%	0.194	55%	0.546	C	S	.	.	H	α-helix	trans	-65.4	-40.4	176.5	170.5	0	0	0	0	111.1	T22 M23 V29 R30	T22-V26 VanDerWaalsContact O-CG2 3.23Å; T22-V26 WeakPolarHBondContact O-CG2 3.14Å; T22-V26 PolarHBondContact O-N 3.05Å; M23-V26 PolarHBondContact O-N 3.11Å; V26-V29 PolarHBondContact O-N 3.39Å; V26-R30 WeakPolarHBondContact O-CB 3.49Å; V26-R30 PolarHBondContact O-N 3.46Å
27	E	52.8	Low	46.1	Very low	122 Å²	122	103.8 Å²	103.8	57%	0.57	55%	0.551	S	S	*	*	H	α-helix	trans	-66.9	-38.7	175.9	-76.3	-175.8	167	0	0	112.4	M23 E24 V29 R30 A31	M23-E27 WeakPolarHBondContact O-CB 3.37Å; M23-E27 WeakPolarHBondContact O-CG 3.38Å; M23-E27 PolarHBondContact O-N 2.82Å; E24-E27 PolarHBondContact O-N 3.37Å; E27-V29 VanDerWaalsContact C-N 3.33Å; E27-V29 PolarHBondContact O-N 2.69Å; E27-R30 PolarHBondContact O-N 3.15Å; E27-A31 WeakPolarHBondContact O-CB 3.36Å; E27-A31 PolarHBondContact O-N 3.34Å
28	Q	54.8	Low	46	Very low	133 Å²	133	104 Å²	104	62%	0.621	57%	0.565	S	S	*	*	H	α-helix	trans	-61.5	-39.9	172.6	-81.2	-177.4	1.1	0	0	112.5	E24 A25 A31 Q32	E24-Q28 WeakPolarHBondContact O-CG 3.47Å; E24-Q28 PolarHBondContact O-N 3Å; A25-Q28 PolarHBondContact O-N 2.99Å; Q28-A31 PolarHBondContact O-N 3.02Å; Q28-Q32 WeakPolarHBondContact O-CG 3.18Å; Q28-Q32 PolarHBondContact O-N 2.91Å; Q28-Q32 VanDerWaalsContact O-N 3.16Å
29	V	48.6	Very low	46.1	Very low	23 Å²	23	109.7 Å²	109.7	14%	0.139	58%	0.582	C	S	.	*	H	α-helix	trans	-71.2	-36.2	177.2	177.2	0	0	0	0	111.5	A25 V26 E27 Q32 T33 L48 I84	A25-V29 VanDerWaalsContact O-CG2 3.31Å; A25-V29 WeakPolarHBondContact O-CG2 3.26Å; A25-V29 PolarHBondContact O-N 2.89Å; A25-V29 VanDerWaalsContact O-N 3.09Å; V26-V29 PolarHBondContact O-N 3.39Å; E27-V29 VanDerWaalsContact C-N 3.33Å; E27-V29 PolarHBondContact O-N 2.69Å; V29-Q32 PolarHBondContact O-N 3.31Å; V29-T33 PolarHBondContact O-N 3.32Å; V29-T33 PolarHBondContact O-OG1 3.19Å; V29-L48 HydrophobicContact CG2-CD1 3.79Å; V29-I84 HydrophobicContact CG1-CD1 3.96Å
30	R	45	Very low	46.2	Very low	186 Å²	186	110.4 Å²	110.4	70%	0.702	59%	0.591	S	S	*	*	H	α-helix	trans	-63.6	-43.5	172.6	-116.7	179.7	177.8	-176.6	-1	112	V26 E27 Q32 T33 T34	V26-R30 WeakPolarHBondContact O-CB 3.49Å; V26-R30 PolarHBondContact O-N 3.46Å; E27-R30 PolarHBondContact O-N 3.15Å; R30-Q32 VanDerWaalsContact C-N 3.27Å; R30-Q32 PolarHBondContact O-N 3.01Å; R30-T33 WeakPolarHBondContact CA-OG1 3.39Å; R30-T33 PolarHBondContact O-N 3.23Å; R30-T33 PolarHBondContact O-OG1 2.8Å; R30-T34 PolarHBondContact O-OG1 2.94Å
31	A	51.7	Low	46.1	Very low	58 Å²	58	113.7 Å²	113.7	48%	0.479	60%	0.599	S	S	.	*	H	α-helix	trans	-65.1	-31.6	178.1	0	0	0	0	0	112.4	E27 Q28 T34 V35	E27-A31 WeakPolarHBondContact O-CB 3.36Å; E27-A31 PolarHBondContact O-N 3.34Å; Q28-A31 PolarHBondContact O-N 3.02Å; A31-T34 PolarHBondContact O-OG1 3.44Å; A31-V35 WeakPolarHBondContact O-CG2 3.39Å
32	Q	48.4	Very low	46.4	Very low	123 Å²	123	109.6 Å²	109.6	58%	0.575	60%	0.602	S	S	*	*	H	α-helix	trans	-78.9	-18.2	177.7	-72.5	180	13.4	0	0	114	Q28 V29 R30 P44	Q28-Q32 WeakPolarHBondContact O-CG 3.18Å; Q28-Q32 PolarHBondContact O-N 2.91Å; Q28-Q32 VanDerWaalsContact O-N 3.16Å; V29-Q32 PolarHBondContact O-N 3.31Å; R30-Q32 VanDerWaalsContact C-N 3.27Å; R30-Q32 PolarHBondContact O-N 3.01Å; Q32-P44 HydrophobicContact CB-CG 4.09Å
33	T	46.9	Very low	46.2	Very low	92 Å²	92	109.2 Å²	109.2	56%	0.564	60%	0.601	S	S	*	*	H	α-helix	trans	-87.4	-14.4	-179.4	33.8	0	0	0	0	113.5	V29 R30	V29-T33 PolarHBondContact O-N 3.32Å; V29-T33 PolarHBondContact O-OG1 3.19Å; R30-T33 WeakPolarHBondContact CA-OG1 3.39Å; R30-T33 PolarHBondContact O-N 3.23Å; R30-T33 PolarHBondContact O-OG1 2.8Å
34	T	46.6	Very low	46.3	Very low	118 Å²	118	105.7 Å²	105.7	72%	0.724	59%	0.586	S	S	*	*	S	Bend	trans	-100.8	2.6	-176.2	44.3	0	0	0	0	115.7	R30 A31	R30-T34 PolarHBondContact O-OG1 2.94Å; A31-T34 PolarHBondContact O-OG1 3.44Å
35	V	46.8	Very low	45.8	Very low	115 Å²	115	100.4 Å²	100.4	70%	0.697	56%	0.561	S	S	*	*			trans	-105.6	92.5	-177.4	-159.6	0	0	0	0	112.2	A31	A31-V35 WeakPolarHBondContact O-CG2 3.39Å
36	S	35.9	Very low	45.6	Very low	114 Å²	114	101.8 Å²	101.8	80%	0.797	56%	0.56	S	S	*	*			trans	45.3	117.7	135.9	-157.8	0	0	0	0	120.4
37	G	36.1	Very low	45.7	Very low	73 Å²	73	102.5 Å²	102.5	75%	0.753	57%	0.569	S	S	*	*				73.7	107.7	129.8	0	0	0	0	0	118.9
38	G	36.2	Very low	45.6	Very low	74 Å²	74	98.3 Å²	98.3	76%	0.763	55%	0.551	S	S	*	*	S	Bend	trans	66.8	72	140.1	0	0	0	0	0	117.7
39	K	41.6	Very low	45.5	Very low	192 Å²	192	92.4 Å²	92.4	84%	0.835	52%	0.523	S	S	*	.	S	Bend	trans	171.9	137.7	145	-96.9	161.9	-172.7	-178.2	0	106.4	R41	K39-R41 PolarHBondContact O-N 3.46Å
40	K	43	Very low	45.9	Very low	225 Å²	225	94.2 Å²	94.2	98%	0.978	53%	0.532	S	S	*	.			trans	-55.6	80.4	178.4	-67.7	177.6	178.7	178.3	0	110.8
41	R	43.1	Very low	46.3	Very low	226 Å²	226	94.3 Å²	94.3	85%	0.853	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-89	121.9	175	-79.3	-173.8	174	-179.9	-0.6	107.1	K39 C43	K39-R41 PolarHBondContact O-N 3.46Å; R41-C43 PolarHBondContact O-N 3.26Å
42	A	48.5	Very low	46.5	Very low	89 Å²	89	92.4 Å²	92.4	74%	0.736	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-46.5	126.9	173.5	0	0	0	0	0	109.3
43	C	43.9	Very low	46.9	Very low	30 Å²	30	89.1 Å²	89.1	20%	0.203	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-58	132.2	-177.5	-174.6	0	0	0	0	108.8	R41 F45 Q46 A47 I81	R41-C43 PolarHBondContact O-N 3.26Å; C43-F45 PolarHBondContact O-N 2.82Å; C43-F45 WeakPolarHBondContact SG-CB 3.31Å; C43-Q46 HydrophobicContact CB-CB 4.21Å; C43-Q46 WeakPolarHBondContact O-CA 3.33Å; C43-Q46 VanDerWaalsContact O-CB 3.31Å; C43-Q46 WeakPolarHBondContact O-CB 3.42Å; C43-Q46 PolarHBondContact O-N 3.11Å; C43-A47 PolarHBondContact O-N 2.85Å; C43-A47 VanDerWaalsContact O-N 3.11Å; C43-I81 HydrophobicContact CB-CD1 3.81Å; C43-I81 HydrophobicContact CB-CG1 4.42Å
44	P	48.3	Very low	47.1	Very low	30 Å²	30	92.7 Å²	92.7	20%	0.195	51%	0.509	C	S	.	.	H	α-helix	trans	-56.8	-25.7	175.7	20.9	-31.5	0	0	0	112.2	Q32 A47 L48	Q32-P44 HydrophobicContact CB-CG 4.09Å; P44-A47 PolarHBondContact O-N 3.01Å; P44-L48 WeakPolarHBondContact O-CG 3.24Å; P44-L48 PolarHBondContact O-N 3.16Å
45	F	42.4	Very low	47.3	Very low	10 Å²	10	89.6 Å²	89.6	4%	0.044	50%	0.495	C	S	.	.	H	α-helix	trans	-65.5	-40.5	170.1	-167.8	-98.6	0	0	0	113.2	C43 A47 L48 L49 I81 L82 I84 M87 L123	C43-F45 PolarHBondContact O-N 2.82Å; C43-F45 WeakPolarHBondContact SG-CB 3.31Å; F45-A47 VanDerWaalsContact C-N 3.32Å; F45-L48 PolarHBondContact O-N 3.3Å; F45-L49 HydrophobicContact CD1-CD1 3.59Å; F45-L49 HydrophobicContact CD1-CG 4.12Å; F45-L49 HydrophobicContact CE1-CD1 3.46Å; F45-L49 VanDerWaalsContact CE1-CD1 3.46Å; F45-L49 HydrophobicContact CE1-CD2 4.27Å; F45-L49 HydrophobicContact CE1-CG 3.95Å; F45-L49 HydrophobicContact CZ-CD1 4.46Å; F45-L49 VanDerWaalsContact O-CG 3.31Å; F45-L49 WeakPolarHBondContact O-CG 3.36Å; F45-L49 PolarHBondContact O-N 2.94Å; F45-I81 HydrophobicContact CD1-CG2 4.14Å; F45-L82 VanDerWaalsContact CD1-O 3.25Å; F45-L82 WeakPolarHBondContact CD1-O 3.48Å; F45-L82 HydrophobicContact CE1-CB 4.21Å; F45-L82 WeakPolarHBondContact CE1-O 3.47Å; F45-L82 WeakPolarHBondContact CZ-O 3.37Å; F45-I84 HydrophobicContact CD2-CD1 4.31Å; F45-I84 HydrophobicContact CD2-CG1 3.57Å; F45-I84 HydrophobicContact CE2-CB 4.23Å; F45-I84 HydrophobicContact CE2-CD1 4.48Å; F45-I84 HydrophobicContact CE2-CG1 3.34Å; F45-M87 HydrophobicContact CE2-CG 4.45Å; F45-M87 HydrophobicContact CZ-CG 4.03Å; F45-M87 HydrophobicContact CZ-SD 3.77Å; F45-L123 HydrophobicContact CD2-CD2 3.71Å; F45-L123 HydrophobicContact CE2-CD2 3.17Å; F45-L123 HydrophobicContact CZ-CD2 3.78Å
46	Q	47.7	Very low	47.4	Very low	72 Å²	72	92.3 Å²	92.3	34%	0.336	50%	0.498	S	S	.	.	H	α-helix	trans	-64.5	-40	173.8	-168.2	63	42.9	0	0	110.6	C43 L48 L49 D50	C43-Q46 HydrophobicContact CB-CB 4.21Å; C43-Q46 WeakPolarHBondContact O-CA 3.33Å; C43-Q46 VanDerWaalsContact O-CB 3.31Å; C43-Q46 WeakPolarHBondContact O-CB 3.42Å; C43-Q46 PolarHBondContact O-N 3.11Å; Q46-L48 VanDerWaalsContact C-N 3.3Å; Q46-L48 PolarHBondContact O-N 3.39Å; Q46-L49 PolarHBondContact O-N 3.24Å; Q46-D50 PolarHBondContact NE2-OD1 3.03Å; Q46-D50 VanDerWaalsContact O-CB 3.31Å; Q46-D50 WeakPolarHBondContact O-CB 2.97Å; Q46-D50 PolarHBondContact O-N 3.18Å
47	A	51.7	Low	48.1	Very low	47 Å²	47	90.6 Å²	90.6	39%	0.388	48%	0.479	S	S	.	.	H	α-helix	trans	-64	-33.3	174.8	0	0	0	0	0	113	C43 P44 F45 R51	C43-A47 PolarHBondContact O-N 2.85Å; C43-A47 VanDerWaalsContact O-N 3.11Å; P44-A47 PolarHBondContact O-N 3.01Å; F45-A47 VanDerWaalsContact C-N 3.32Å; A47-R51 WeakPolarHBondContact O-CG 3.45Å; A47-R51 PolarHBondContact O-N 3.29Å
48	L	50.8	Low	48.5	Very low	35 Å²	35	90.3 Å²	90.3	18%	0.183	48%	0.477	C	S	.	.	H	α-helix	trans	-70	-44.3	173.1	-73.9	168.4	0	0	0	111.9	V29 P44 F45 Q46 D50 R51 V52	V29-L48 HydrophobicContact CG2-CD1 3.79Å; P44-L48 WeakPolarHBondContact O-CG 3.24Å; P44-L48 PolarHBondContact O-N 3.16Å; F45-L48 PolarHBondContact O-N 3.3Å; Q46-L48 VanDerWaalsContact C-N 3.3Å; Q46-L48 PolarHBondContact O-N 3.39Å; L48-D50 VanDerWaalsContact C-N 3.31Å; L48-D50 PolarHBondContact O-N 3.5Å; L48-R51 WeakPolarHBondContact O-CB 3.29Å; L48-R51 PolarHBondContact O-N 3.07Å; L48-R51 VanDerWaalsContact O-N 3.15Å; L48-V52 PolarHBondContact O-N 3.17Å
49	L	52.1	Low	49.4	Very low	9 Å²	9	95.3 Å²	95.3	5%	0.047	48%	0.48	C	S	.	.	H	α-helix	trans	-61	-42	173.5	-68.6	169.7	0	0	0	111.7	F45 Q46 R51 V52 D53 R75 L123	F45-L49 HydrophobicContact CD1-CD1 3.59Å; F45-L49 HydrophobicContact CD1-CG 4.12Å; F45-L49 HydrophobicContact CE1-CD1 3.46Å; F45-L49 VanDerWaalsContact CE1-CD1 3.46Å; F45-L49 HydrophobicContact CE1-CD2 4.27Å; F45-L49 HydrophobicContact CE1-CG 3.95Å; F45-L49 HydrophobicContact CZ-CD1 4.46Å; F45-L49 VanDerWaalsContact O-CG 3.31Å; F45-L49 WeakPolarHBondContact O-CG 3.36Å; F45-L49 PolarHBondContact O-N 2.94Å; Q46-L49 PolarHBondContact O-N 3.24Å; L49-R51 VanDerWaalsContact C-N 3.26Å; L49-R51 PolarHBondContact O-N 3.12Å; L49-V52 PolarHBondContact O-N 2.96Å; L49-D53 WeakPolarHBondContact O-CB 3.2Å; L49-D53 PolarHBondContact O-N 3.39Å; L49-R75 VanDerWaalsContact CD1-CZ 3.42Å; L49-L123 HydrophobicContact CD2-CD1 3.8Å
50	D	58	Low	50.4	Low	60 Å²	60	87.3 Å²	87.3	32%	0.321	45%	0.448	S	S	.	.	H	α-helix	trans	-65.8	-29.5	177	-66.9	-10.6	0	0	0	111.5	Q46 L48 D53 K54	Q46-D50 PolarHBondContact NE2-OD1 3.03Å; Q46-D50 VanDerWaalsContact O-CB 3.31Å; Q46-D50 WeakPolarHBondContact O-CB 2.97Å; Q46-D50 PolarHBondContact O-N 3.18Å; L48-D50 VanDerWaalsContact C-N 3.31Å; L48-D50 PolarHBondContact O-N 3.5Å; D50-D53 PolarHBondContact O-N 2.9Å; D50-K54 VanDerWaalsContact O-CB 3.23Å; D50-K54 WeakPolarHBondContact O-CB 3.22Å; D50-K54 WeakPolarHBondContact O-CG 3.44Å; D50-K54 PolarHBondContact O-N 2.93Å
51	R	53.8	Low	51.8	Low	189 Å²	189	80.1 Å²	80.1	71%	0.713	42%	0.424	S	S	*	.	H	α-helix	trans	-70.7	-40.3	172.6	-80.5	178.5	-178.8	-165.1	1.6	112.1	A47 L48 L49 D53 K54 A55	A47-R51 WeakPolarHBondContact O-CG 3.45Å; A47-R51 PolarHBondContact O-N 3.29Å; L48-R51 WeakPolarHBondContact O-CB 3.29Å; L48-R51 PolarHBondContact O-N 3.07Å; L48-R51 VanDerWaalsContact O-N 3.15Å; L49-R51 VanDerWaalsContact C-N 3.26Å; L49-R51 PolarHBondContact O-N 3.12Å; R51-D53 VanDerWaalsContact C-N 3.29Å; R51-K54 PolarHBondContact O-N 3.05Å; R51-A55 PolarHBondContact O-N 3.46Å; R51-A55 VanDerWaalsContact O-N 3.17Å
52	V	55.2	Low	53.4	Low	18 Å²	18	74.3 Å²	74.3	11%	0.109	42%	0.416	C	S	.	.	H	α-helix	trans	-62.8	-40.8	171.7	177.5	0	0	0	0	110.2	L48 L49 K54 A121 L123	L48-V52 PolarHBondContact O-N 3.17Å; L49-V52 PolarHBondContact O-N 2.96Å; V52-K54 PolarHBondContact O-N 3.35Å; V52-A121 HydrophobicContact CG2-CB 3.54Å; V52-L123 HydrophobicContact CG2-CD1 4.5Å
53	D	55.7	Low	54.6	Low	53 Å²	53	71 Å²	71	28%	0.283	39%	0.387	S	S	.	.	H	α-helix	trans	-67.4	-32.2	176.4	-85.6	-17.6	0	0	0	113.2	L49 D50 R51 R72	L49-D53 WeakPolarHBondContact O-CB 3.2Å; L49-D53 PolarHBondContact O-N 3.39Å; D50-D53 PolarHBondContact O-N 2.9Å; R51-D53 VanDerWaalsContact C-N 3.29Å; D53-R72 WeakPolarHBondContact OD1-CD 3.49Å; D53-R72 VanDerWaalsContact OD1-CG 3.32Å; D53-R72 WeakPolarHBondContact OD1-CG 3.43Å
54	K	52.4	Low	56.2	Low	167 Å²	167	71.2 Å²	71.2	73%	0.726	39%	0.387	S	S	*	.	H	α-helix	trans	-88.6	-3.9	-179.3	-75.4	175.4	-176.7	178.5	0	114.7	D50 R51 V52 K56	D50-K54 VanDerWaalsContact O-CB 3.23Å; D50-K54 WeakPolarHBondContact O-CB 3.22Å; D50-K54 WeakPolarHBondContact O-CG 3.44Å; D50-K54 PolarHBondContact O-N 2.93Å; R51-K54 PolarHBondContact O-N 3.05Å; V52-K54 PolarHBondContact O-N 3.35Å; K54-K56 VanDerWaalsContact C-N 3.27Å; K54-K56 PolarHBondContact O-N 3Å
55	A	50.7	Low	57.7	Low	53 Å²	53	73.4 Å²	73.4	44%	0.438	39%	0.393	S	S	.	.	S	Bend	trans	-64.3	88.7	173.3	0	0	0	0	0	110.6	R51 K68	R51-A55 PolarHBondContact O-N 3.46Å; R51-A55 VanDerWaalsContact O-N 3.17Å; A55-K68 PolarHBondContact O-NZ 2.82Å
56	K	49.3	Very low	59.6	Low	172 Å²	172	77.3 Å²	77.3	75%	0.748	41%	0.411	S	S	*	.			trans	26.7	84.6	167.5	-66.8	-176.3	177.6	-175.5	0	115.9	K54 G58 C60	K54-K56 VanDerWaalsContact C-N 3.27Å; K54-K56 PolarHBondContact O-N 3Å; K56-G58 PolarHBondContact O-N 3.22Å; K56-C60 PolarHBondContact O-SG 2.93Å; K56-C60 VanDerWaalsContact O-SG 3.4Å
57	L	49.1	Very low	61.4	Low	78 Å²	78	74 Å²	74	41%	0.408	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-8.7	171.7	-79	162.2	0	0	0	114.7	K65 K68	L57-K65 WeakPolarHBondContact O-CE 3.26Å; L57-K65 PolarHBondContact O-NZ 3.15Å; L57-K68 HydrophobicContact CD2-CD 4.5Å
58	G	45	Very low	62.9	Low	68 Å²	68	73.3 Å²	73.3	70%	0.701	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-42.8	-176.5	0	0	0	0	0	113.8	K56	K56-G58 PolarHBondContact O-N 3.22Å
59	E	56.2	Low	64.5	Low	179 Å²	179	78.9 Å²	78.9	84%	0.836	40%	0.402	S	S	*	.	S	Bend	trans	-113.1	0.5	-168.8	-69.2	169.9	-172.7	0	0	114.1
60	C	61.8	Low	66.1	Low	23 Å²	23	80.3 Å²	80.3	16%	0.155	41%	0.409	C	S	.	.			trans	-66.4	134.7	-179.6	-68	0	0	0	0	111.6	K56 V64 K65	K56-C60 PolarHBondContact O-SG 2.93Å; K56-C60 VanDerWaalsContact O-SG 3.4Å; C60-V64 HydrophobicContact CB-CB 4.26Å; C60-V64 HydrophobicContact CB-CG1 4.11Å; C60-K65 HydrophobicContact CB-CG 3.88Å; C60-K65 WeakPolarHBondContact O-CD 3.48Å; C60-K65 WeakPolarHBondContact O-CE 3.49Å; C60-K65 PolarHBondContact O-NZ 3.21Å
61	P	71.5	Confident	67.5	Low	75 Å²	75	77.7 Å²	77.7	49%	0.487	40%	0.395	S	S	.	.			trans	-52.8	148.5	171.1	-27.3	34.7	0	0	0	112.2	P63 V64 K65	P61-P63 VanDerWaalsContact C-CD 3.4Å; P61-P63 VanDerWaalsContact C-N 3.31Å; P61-V64 HydrophobicContact CB-CG2 4.34Å; P61-V64 HydrophobicContact CG-CG2 4.39Å; P61-V64 PolarHBondContact O-N 3.31Å; P61-K65 PolarHBondContact O-N 3.39Å
62	P	76.7	Confident	69	Low	104 Å²	104	72.3 Å²	72.3	68%	0.675	38%	0.375	S	S	*	.	H	α-helix	trans	-50.8	-40.3	179.5	-22.9	30.8	0	0	0	114.8	V64 K65 K66	P62-V64 PolarHBondContact O-N 3.26Å; P62-K65 WeakPolarHBondContact O-CB 3.31Å; P62-K65 PolarHBondContact O-N 3.18Å; P62-K66 PolarHBondContact O-N 3.44Å
63	P	74.6	Confident	70.4	Confident	19 Å²	19	74.9 Å²	74.9	12%	0.123	39%	0.388	C	S	.	.	H	α-helix	trans	-60.6	-43.9	176	-25.7	36	0	0	0	113.2	P61 K65 K66 V67 E106 L107 A110	P61-P63 VanDerWaalsContact C-CD 3.4Å; P61-P63 VanDerWaalsContact C-N 3.31Å; P63-K65 VanDerWaalsContact C-N 3.35Å; P63-K65 PolarHBondContact O-N 3.02Å; P63-K66 WeakPolarHBondContact O-CB 3.19Å; P63-K66 PolarHBondContact O-N 3.38Å; P63-K66 VanDerWaalsContact O-N 3.15Å; P63-V67 PolarHBondContact O-N 3.04Å; P63-E106 HydrophobicContact CB-CB 3.93Å; P63-E106 WeakPolarHBondContact CB-O 3.38Å; P63-E106 HydrophobicContact CG-CB 3.59Å; P63-E106 WeakPolarHBondContact CG-OE2 3.46Å; P63-L107 HydrophobicContact CB-CD2 3.82Å; P63-L107 HydrophobicContact CB-CG 4.36Å; P63-A110 HydrophobicContact CB-CB 4.21Å
64	V	77.8	Confident	71.8	Confident	35 Å²	35	72.8 Å²	72.8	21%	0.212	38%	0.376	C	S	.	.	H	α-helix	trans	-63.2	-41.4	176.2	179.7	0	0	0	0	111.1	C60 P61 P62 K66 V67 K68 A110	C60-V64 HydrophobicContact CB-CB 4.26Å; C60-V64 HydrophobicContact CB-CG1 4.11Å; P61-V64 HydrophobicContact CB-CG2 4.34Å; P61-V64 HydrophobicContact CG-CG2 4.39Å; P61-V64 PolarHBondContact O-N 3.31Å; P62-V64 PolarHBondContact O-N 3.26Å; V64-K66 VanDerWaalsContact C-N 3.31Å; V64-K66 PolarHBondContact O-N 3.48Å; V64-V67 PolarHBondContact O-N 3.36Å; V64-K68 HydrophobicContact CG1-CD 4.34Å; V64-K68 HydrophobicContact CG1-CG 4.46Å; V64-K68 WeakPolarHBondContact O-CB 3.45Å; V64-K68 WeakPolarHBondContact O-CG 3.36Å; V64-K68 PolarHBondContact O-N 3.03Å; V64-A110 HydrophobicContact CB-CB 4.49Å; V64-A110 HydrophobicContact CG2-CB 3.98Å
65	K	79.2	Confident	73.3	Confident	75 Å²	75	66.3 Å²	66.3	33%	0.326	35%	0.347	S	S	.	.	H	α-helix	trans	-61.8	-38.8	174.8	-72.5	175	172.1	164.5	0	111.8	L57 C60 P61 P62 P63 R69	L57-K65 WeakPolarHBondContact O-CE 3.26Å; L57-K65 PolarHBondContact O-NZ 3.15Å; C60-K65 HydrophobicContact CB-CG 3.88Å; C60-K65 WeakPolarHBondContact O-CD 3.48Å; C60-K65 WeakPolarHBondContact O-CE 3.49Å; C60-K65 PolarHBondContact O-NZ 3.21Å; P61-K65 PolarHBondContact O-N 3.39Å; P62-K65 WeakPolarHBondContact O-CB 3.31Å; P62-K65 PolarHBondContact O-N 3.18Å; P63-K65 VanDerWaalsContact C-N 3.35Å; P63-K65 PolarHBondContact O-N 3.02Å; K65-R69 WeakPolarHBondContact O-CB 3.24Å; K65-R69 PolarHBondContact O-N 3.36Å; K65-R69 VanDerWaalsContact O-N 3.13Å
66	K	82.3	Confident	74.9	Confident	93 Å²	93	72.2 Å²	72.2	40%	0.404	36%	0.358	S	S	.	.	H	α-helix	trans	-65.5	-51	176.7	-172.6	175.6	176	-171.7	0	110.8	P62 P63 V64 K68 R69 L70 L107	P62-K66 PolarHBondContact O-N 3.44Å; P63-K66 WeakPolarHBondContact O-CB 3.19Å; P63-K66 PolarHBondContact O-N 3.38Å; P63-K66 VanDerWaalsContact O-N 3.15Å; V64-K66 VanDerWaalsContact C-N 3.31Å; V64-K66 PolarHBondContact O-N 3.48Å; K66-K68 PolarHBondContact O-N 2.88Å; K66-R69 WeakPolarHBondContact O-CA 3.43Å; K66-R69 WeakPolarHBondContact O-CB 3.27Å; K66-R69 PolarHBondContact O-N 2.86Å; K66-L70 HydrophobicContact CG-CD1 4.43Å; K66-L70 WeakPolarHBondContact O-CG 3.44Å; K66-L70 PolarHBondContact O-N 3.17Å; K66-L107 HydrophobicContact CB-CD2 4Å; K66-L107 HydrophobicContact CD-CD1 4.13Å; K66-L107 HydrophobicContact CD-CD2 3.83Å; K66-L107 HydrophobicContact CG-CD2 4.21Å
67	V	84.8	Confident	76.2	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.006	35%	0.354	C	S	.	.	H	α-helix	trans	-61	-44.8	178.8	172	0	0	0	0	112	P63 V64 R69 L70 W71 F94 L107 A110 V111 L114	P63-V67 PolarHBondContact O-N 3.04Å; V64-V67 PolarHBondContact O-N 3.36Å; V67-R69 PolarHBondContact O-N 3.05Å; V67-L70 PolarHBondContact O-N 3.47Å; V67-L70 VanDerWaalsContact O-N 3.17Å; V67-W71 WeakPolarHBondContact O-CB 3.4Å; V67-W71 PolarHBondContact O-N 3.41Å; V67-F94 HydrophobicContact CG1-CE1 4.33Å; V67-F94 HydrophobicContact CG1-CZ 4.27Å; V67-L107 HydrophobicContact CG2-CD2 4.04Å; V67-A110 HydrophobicContact CB-CB 4.08Å; V67-A110 HydrophobicContact CG2-CB 3.57Å; V67-V111 HydrophobicContact CG1-CG2 3.87Å; V67-V111 HydrophobicContact CG2-CG2 3.82Å; V67-L114 HydrophobicContact CG1-CB 4.16Å; V67-L114 HydrophobicContact CG1-CD2 3.97Å
68	K	83.3	Confident	77.5	Confident	34 Å²	34	70.4 Å²	70.4	15%	0.148	35%	0.351	C	S	.	.	H	α-helix	trans	-58.3	-36	174	-77.1	-174.7	175	-175.7	0	112.4	A55 L57 V64 K66 R72	A55-K68 PolarHBondContact O-NZ 2.82Å; L57-K68 HydrophobicContact CD2-CD 4.5Å; V64-K68 HydrophobicContact CG1-CD 4.34Å; V64-K68 HydrophobicContact CG1-CG 4.46Å; V64-K68 WeakPolarHBondContact O-CB 3.45Å; V64-K68 WeakPolarHBondContact O-CG 3.36Å; V64-K68 PolarHBondContact O-N 3.03Å; K66-K68 PolarHBondContact O-N 2.88Å; K68-R72 WeakPolarHBondContact O-CG 3.39Å; K68-R72 PolarHBondContact O-N 2.84Å; K68-R72 VanDerWaalsContact O-N 3.09Å; K68-R72 PolarHBondContact O-NE 3.07Å
69	R	85.5	Confident	78.4	Confident	151 Å²	151	75.9 Å²	75.9	57%	0.57	36%	0.358	S	S	*	.	H	α-helix	trans	-69.4	-45	176	-167.6	-173.8	-50.2	-169.4	2.9	111.6	K65 K66 V67 W71 R72 N73	K65-R69 WeakPolarHBondContact O-CB 3.24Å; K65-R69 PolarHBondContact O-N 3.36Å; K65-R69 VanDerWaalsContact O-N 3.13Å; K66-R69 WeakPolarHBondContact O-CA 3.43Å; K66-R69 WeakPolarHBondContact O-CB 3.27Å; K66-R69 PolarHBondContact O-N 2.86Å; V67-R69 PolarHBondContact O-N 3.05Å; R69-W71 VanDerWaalsContact C-N 3.33Å; R69-W71 PolarHBondContact O-N 3.38Å; R69-R72 PolarHBondContact O-N 3.2Å; R69-N73 PolarHBondContact O-N 3.06Å
70	L	85.8	Confident	78.9	Confident	39 Å²	39	69.7 Å²	69.7	20%	0.204	34%	0.342	C	S	.	.	H	α-helix	trans	-58.8	-46.8	175.5	-69.5	173.1	0	0	0	110.8	K66 V67 R72 N73 Y74 F94 I101	K66-L70 HydrophobicContact CG-CD1 4.43Å; K66-L70 WeakPolarHBondContact O-CG 3.44Å; K66-L70 PolarHBondContact O-N 3.17Å; V67-L70 PolarHBondContact O-N 3.47Å; V67-L70 VanDerWaalsContact O-N 3.17Å; L70-R72 PolarHBondContact O-N 3.29Å; L70-N73 PolarHBondContact O-N 3.29Å; L70-Y74 WeakPolarHBondContact O-CB 3.25Å; L70-Y74 PolarHBondContact O-N 2.95Å; L70-F94 HydrophobicContact CB-CE2 3.94Å; L70-F94 HydrophobicContact CB-CZ 4.08Å; L70-I101 HydrophobicContact CD1-CG2 4.5Å; L70-I101 HydrophobicContact CD2-CD1 4.49Å
71	W	88.1	Confident	79.2	Confident	6 Å²	6	73.7 Å²	73.7	2%	0.023	36%	0.361	C	S	.	.	H	α-helix	trans	-58.1	-47.5	176.9	178.2	-108.5	0	0	0	112.2	V67 R69 N73 Y74 R75 M87 F94 L114 L118	V67-W71 WeakPolarHBondContact O-CB 3.4Å; V67-W71 PolarHBondContact O-N 3.41Å; R69-W71 VanDerWaalsContact C-N 3.33Å; R69-W71 PolarHBondContact O-N 3.38Å; W71-N73 VanDerWaalsContact C-N 3.32Å; W71-N73 PolarHBondContact O-N 3.26Å; W71-Y74 HydrophobicContact CE3-CD1 4.16Å; W71-Y74 AromaticContact CZ3-CD1 3.98Å; W71-Y74 HydrophobicContact CZ3-CD1 3.98Å; W71-Y74 HydrophobicContact CZ3-CE1 4.2Å; W71-Y74 WeakPolarHBondContact O-CB 3.47Å; W71-Y74 PolarHBondContact O-N 3.43Å; W71-R75 HydrophobicContact CD2-CG 4.21Å; W71-R75 HydrophobicContact CG-CG 4.48Å; W71-R75 HydrophobicContact CZ2-CG 4.04Å; W71-R75 WeakPolarHBondContact O-CB 3.23Å; W71-R75 VanDerWaalsContact O-CG 3.3Å; W71-R75 WeakPolarHBondContact O-CG 3.27Å; W71-R75 PolarHBondContact O-N 3.06Å; W71-M87 HydrophobicContact CH2-CE 4.05Å; W71-M87 HydrophobicContact CZ2-CE 3.9Å; W71-F94 VanDerWaalsContact CA-CE2 3.49Å; W71-F94 HydrophobicContact CB-CE2 4.09Å; W71-F94 HydrophobicContact CB-CZ 3.95Å; W71-F94 HydrophobicContact CE3-CB 4Å; W71-F94 AromaticContact CE3-CD1 3.69Å; W71-F94 HydrophobicContact CE3-CD1 3.69Å; W71-F94 AromaticContact CE3-CD2 3.68Å; W71-F94 HydrophobicContact CE3-CD2 3.68Å; W71-F94 HydrophobicContact CE3-CE1 4.04Å; W71-F94 HydrophobicContact CE3-CE2 4.03Å; W71-F94 AromaticContact CE3-CG 3.48Å; W71-F94 HydrophobicContact CE3-CG 3.48Å; W71-F94 VanDerWaalsContact CE3-CG 3.48Å; W71-F94 HydrophobicContact CE3-CZ 4.19Å; W71-F94 HydrophobicContact CZ3-CB 3.69Å; W71-F94 HydrophobicContact CZ3-CD1 4.04Å; W71-F94 HydrophobicContact CZ3-CD2 4.24Å; W71-F94 AromaticContact CZ3-CG 3.72Å; W71-F94 HydrophobicContact CZ3-CG 3.72Å; W71-L114 HydrophobicContact CB-CD2 3.88Å; W71-L114 HydrophobicContact CD2-CD2 3.91Å; W71-L114 HydrophobicContact CE3-CD2 3.94Å; W71-L114 HydrophobicContact CG-CD1 4.23Å; W71-L114 HydrophobicContact CG-CD2 3.89Å; W71-L118 HydrophobicContact CH2-CD1 4.2Å; W71-L118 HydrophobicContact CZ2-CD1 4.06Å; W71-L118 HydrophobicContact CZ2-CD2 4.34Å
72	R	84.8	Confident	79.3	Confident	75 Å²	75	70.8 Å²	70.8	28%	0.283	34%	0.341	S	S	.	.	H	α-helix	trans	-61.2	-40.2	176.5	-75	-176.2	-59.9	166.1	1.7	112.5	D53 K68 R69 L70 R75 R76	D53-R72 WeakPolarHBondContact OD1-CD 3.49Å; D53-R72 VanDerWaalsContact OD1-CG 3.32Å; D53-R72 WeakPolarHBondContact OD1-CG 3.43Å; K68-R72 WeakPolarHBondContact O-CG 3.39Å; K68-R72 PolarHBondContact O-N 2.84Å; K68-R72 VanDerWaalsContact O-N 3.09Å; K68-R72 PolarHBondContact O-NE 3.07Å; R69-R72 PolarHBondContact O-N 3.2Å; L70-R72 PolarHBondContact O-N 3.29Å; R72-R75 PolarHBondContact O-N 2.94Å; R72-R76 VanDerWaalsContact O-CG 3.32Å; R72-R76 WeakPolarHBondContact O-CG 3.33Å; R72-R76 PolarHBondContact O-N 3.44Å
73	N	84.1	Confident	79.3	Confident	73 Å²	73	67.9 Å²	67.9	39%	0.39	32%	0.322	S	S	.	.	H	α-helix	trans	-65.3	-45.4	176.8	-72.5	-8.6	0	0	0	111.2	R69 L70 W71 R75 R76 M77	R69-N73 PolarHBondContact O-N 3.06Å; L70-N73 PolarHBondContact O-N 3.29Å; W71-N73 VanDerWaalsContact C-N 3.32Å; W71-N73 PolarHBondContact O-N 3.26Å; N73-R75 PolarHBondContact O-N 2.86Å; N73-R76 PolarHBondContact O-N 3.31Å; N73-R76 VanDerWaalsContact O-N 3.17Å; N73-M77 WeakPolarHBondContact O-CG 3.32Å; N73-M77 PolarHBondContact O-N 3.11Å; N73-M77 VanDerWaalsContact O-N 3.14Å
74	Y	86.1	Confident	79.3	Confident	9 Å²	9	69 Å²	69	4%	0.035	33%	0.327	C	S	.	.	H	α-helix	trans	-55.3	-49.5	173.7	175.5	-101.8	0	0	0	111.9	L70 W71 R76 M77 K78 E90 E93 F94 L97	L70-Y74 WeakPolarHBondContact O-CB 3.25Å; L70-Y74 PolarHBondContact O-N 2.95Å; W71-Y74 HydrophobicContact CE3-CD1 4.16Å; W71-Y74 AromaticContact CZ3-CD1 3.98Å; W71-Y74 HydrophobicContact CZ3-CD1 3.98Å; W71-Y74 HydrophobicContact CZ3-CE1 4.2Å; W71-Y74 WeakPolarHBondContact O-CB 3.47Å; W71-Y74 PolarHBondContact O-N 3.43Å; Y74-R76 VanDerWaalsContact C-N 3.28Å; Y74-R76 PolarHBondContact O-N 2.73Å; Y74-M77 PolarHBondContact O-N 3.06Å; Y74-M77 VanDerWaalsContact O-N 3.1Å; Y74-K78 HydrophobicContact CE1-CG 4.33Å; Y74-K78 HydrophobicContact CE2-CG 4.49Å; Y74-K78 PolarHBondContact O-N 2.96Å; Y74-K78 WeakPolarHBondContact OH-CE 3.33Å; Y74-E90 HydrophobicContact CE1-CB 4.36Å; Y74-E90 PolarHBondContact OH-O 2.96Å; Y74-E90 PolarHBondContact OH-OE2 3.25Å; Y74-E93 HydrophobicContact CE2-CB 4.4Å; Y74-E93 WeakPolarHBondContact OH-CB 3.35Å; Y74-E93 PolarHBondContact OH-OE2 3.06Å; Y74-F94 HydrophobicContact CD1-CB 4.2Å; Y74-F94 HydrophobicContact CD1-CD2 4.15Å; Y74-F94 HydrophobicContact CD2-CD2 4.49Å; Y74-F94 HydrophobicContact CE1-CB 4.16Å; Y74-F94 HydrophobicContact CG-CB 4.5Å; Y74-F94 AromaticContact CG-CD2 3.92Å; Y74-F94 HydrophobicContact CG-CD2 3.92Å; Y74-L97 HydrophobicContact CD2-CD1 3.4Å; Y74-L97 VanDerWaalsContact CD2-CD1 3.4Å; Y74-L97 HydrophobicContact CE2-CD1 3.59Å
75	R	83.7	Confident	79.3	Confident	30 Å²	30	77.1 Å²	77.1	11%	0.113	35%	0.354	C	S	.	.	H	α-helix	trans	-58	-36.6	176.7	-76.4	-63.6	-50.1	-147.4	4.1	113.5	L49 W71 R72 N73	L49-R75 VanDerWaalsContact CD1-CZ 3.42Å; W71-R75 HydrophobicContact CD2-CG 4.21Å; W71-R75 HydrophobicContact CG-CG 4.48Å; W71-R75 HydrophobicContact CZ2-CG 4.04Å; W71-R75 WeakPolarHBondContact O-CB 3.23Å; W71-R75 VanDerWaalsContact O-CG 3.3Å; W71-R75 WeakPolarHBondContact O-CG 3.27Å; W71-R75 PolarHBondContact O-N 3.06Å; R72-R75 PolarHBondContact O-N 2.94Å; N73-R75 PolarHBondContact O-N 2.86Å
76	R	82.4	Confident	79.6	Confident	178 Å²	178	74 Å²	74	67%	0.672	34%	0.342	S	S	*	.	H	α-helix	trans	-70.4	-35.1	177.3	-73.5	173.9	-171.5	179.4	0.4	112.3	R72 N73 Y74 K78	R72-R76 VanDerWaalsContact O-CG 3.32Å; R72-R76 WeakPolarHBondContact O-CG 3.33Å; R72-R76 PolarHBondContact O-N 3.44Å; N73-R76 PolarHBondContact O-N 3.31Å; N73-R76 VanDerWaalsContact O-N 3.17Å; Y74-R76 VanDerWaalsContact C-N 3.28Å; Y74-R76 PolarHBondContact O-N 2.73Å; R76-K78 VanDerWaalsContact C-N 3.3Å; R76-K78 PolarHBondContact O-N 3Å
77	M	77.1	Confident	79.8	Confident	136 Å²	136	69.6 Å²	69.6	67%	0.67	32%	0.323	S	S	*	.	H	α-helix	trans	-66.7	-32.7	178.7	-69.3	-174.3	-74.5	0	0	112.3	N73 Y74 Q79	N73-M77 WeakPolarHBondContact O-CG 3.32Å; N73-M77 PolarHBondContact O-N 3.11Å; N73-M77 VanDerWaalsContact O-N 3.14Å; Y74-M77 PolarHBondContact O-N 3.06Å; Y74-M77 VanDerWaalsContact O-N 3.1Å; M77-Q79 PolarHBondContact O-N 3.49Å; M77-Q79 VanDerWaalsContact O-N 3.11Å
78	K	77.6	Confident	80	Confident	75 Å²	75	70.5 Å²	70.5	33%	0.326	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	7	-177.3	-72.6	-69.5	-168.2	167.2	0	116.2	Y74 R76 G80 L82 E90 E93	Y74-K78 HydrophobicContact CE1-CG 4.33Å; Y74-K78 HydrophobicContact CE2-CG 4.49Å; Y74-K78 PolarHBondContact O-N 2.96Å; Y74-K78 WeakPolarHBondContact OH-CE 3.33Å; R76-K78 VanDerWaalsContact C-N 3.3Å; R76-K78 PolarHBondContact O-N 3Å; K78-G80 PolarHBondContact O-N 3.01Å; K78-G80 VanDerWaalsContact O-N 3.16Å; K78-L82 HydrophobicContact CB-CD2 4.48Å; K78-E90 WeakPolarHBondContact CE-OE2 3.49Å; K78-E90 IonicContact NZ-OE2 3.87Å; K78-E93 WeakPolarHBondContact CE-OE2 3.38Å; K78-E93 IonicContact NZ-OE1 3.68Å; K78-E93 IonicContact NZ-OE2 2.64Å; K78-E93 PolarHBondContact NZ-OE2 3.34Å
79	Q	62.5	Low	80.3	Confident	184 Å²	184	73.5 Å²	73.5	86%	0.86	35%	0.345	S	S	*	.			trans	21.5	76.8	176.3	-65.6	-168.9	2.9	0	0	114.7	M77	M77-Q79 PolarHBondContact O-N 3.49Å; M77-Q79 VanDerWaalsContact O-N 3.11Å
80	G	66.4	Low	80.5	Confident	49 Å²	49	67.3 Å²	67.3	51%	0.505	32%	0.322	S	S	.	.	S	Bend	trans	160.2	167.6	178.3	0	0	0	0	0	114.1	K78 L82	K78-G80 PolarHBondContact O-N 3.01Å; K78-G80 VanDerWaalsContact O-N 3.16Å; G80-L82 PolarHBondContact O-N 3.38Å
81	I	68.4	Low	80.7	Confident	106 Å²	106	65.4 Å²	65.4	54%	0.544	31%	0.313	S	S	.	.			trans	-77.2	111.8	168.8	-61.2	166.3	0	0	0	106.5	C43 F45 P83	C43-I81 HydrophobicContact CB-CD1 3.81Å; C43-I81 HydrophobicContact CB-CG1 4.42Å; F45-I81 HydrophobicContact CD1-CG2 4.14Å; I81-P83 WeakPolarHBondContact O-CD 3.45Å
82	L	73.5	Confident	80.8	Confident	14 Å²	14	67.4 Å²	67.4	7%	0.073	32%	0.323	C	S	.	.			trans	-71.2	126.8	170.5	-64.5	176.9	0	0	0	109	F45 K78 G80 E90	F45-L82 VanDerWaalsContact CD1-O 3.25Å; F45-L82 WeakPolarHBondContact CD1-O 3.48Å; F45-L82 HydrophobicContact CE1-CB 4.21Å; F45-L82 WeakPolarHBondContact CE1-O 3.47Å; F45-L82 WeakPolarHBondContact CZ-O 3.37Å; K78-L82 HydrophobicContact CB-CD2 4.48Å; G80-L82 PolarHBondContact O-N 3.38Å; L82-E90 HydrophobicContact CD1-CB 4.16Å; L82-E90 HydrophobicContact CD1-CG 3.66Å; L82-E90 HydrophobicContact CD2-CG 3.99Å; L82-E90 HydrophobicContact CG-CG 4.32Å
83	P	76.4	Confident	81	Confident	43 Å²	43	67 Å²	67	28%	0.279	33%	0.325	S	S	.	.			trans	-69.4	151	172.1	24.8	-30	0	0	0	111.6	I81 W85 S86	I81-P83 WeakPolarHBondContact O-CD 3.45Å; P83-W85 HydrophobicContact CB-CD2 4.03Å; P83-W85 VanDerWaalsContact CB-CE2 3.46Å; P83-W85 HydrophobicContact CB-CG 4.04Å; P83-W85 HydrophobicContact CB-CZ2 4.02Å; P83-W85 HydrophobicContact CG-CD2 3.92Å; P83-W85 VanDerWaalsContact CG-CE2 3.41Å; P83-W85 HydrophobicContact CG-CE3 4.49Å; P83-W85 HydrophobicContact CG-CG 4.41Å; P83-W85 HydrophobicContact CG-CH2 4.17Å; P83-W85 HydrophobicContact CG-CZ2 3.55Å; P83-W85 PolarHBondContact O-N 3.2Å; P83-W85 VanDerWaalsContact O-N 3.15Å; P83-S86 WeakPolarHBondContact CD-OG 3.34Å; P83-S86 PolarHBondContact O-N 3.11Å; P83-S86 PolarHBondContact O-OG 3.12Å
84	I	75	Confident	81.2	Confident	44 Å²	44	63.8 Å²	63.8	23%	0.226	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-52.3	-40.6	176.7	-65.2	164.1	0	0	0	111.2	V29 F45 S86 M87 L123	V29-I84 HydrophobicContact CG1-CD1 3.96Å; F45-I84 HydrophobicContact CD2-CD1 4.31Å; F45-I84 HydrophobicContact CD2-CG1 3.57Å; F45-I84 HydrophobicContact CE2-CB 4.23Å; F45-I84 HydrophobicContact CE2-CD1 4.48Å; F45-I84 HydrophobicContact CE2-CG1 3.34Å; I84-S86 PolarHBondContact O-N 3.44Å; I84-M87 VanDerWaalsContact O-CB 3.25Å; I84-M87 WeakPolarHBondContact O-CB 3.33Å; I84-M87 WeakPolarHBondContact O-CG 3.4Å; I84-M87 PolarHBondContact O-N 3.02Å; I84-L123 HydrophobicContact CG1-CD2 4.5Å
85	W	77.9	Confident	81.3	Confident	205 Å²	205	63.8 Å²	63.8	78%	0.777	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-67.9	-18.2	-178.1	54.4	-94.7	0	0	0	114.1	P83	P83-W85 HydrophobicContact CB-CD2 4.03Å; P83-W85 VanDerWaalsContact CB-CE2 3.46Å; P83-W85 HydrophobicContact CB-CG 4.04Å; P83-W85 HydrophobicContact CB-CZ2 4.02Å; P83-W85 HydrophobicContact CG-CD2 3.92Å; P83-W85 VanDerWaalsContact CG-CE2 3.41Å; P83-W85 HydrophobicContact CG-CE3 4.49Å; P83-W85 HydrophobicContact CG-CG 4.41Å; P83-W85 HydrophobicContact CG-CH2 4.17Å; P83-W85 HydrophobicContact CG-CZ2 3.55Å; P83-W85 PolarHBondContact O-N 3.2Å; P83-W85 VanDerWaalsContact O-N 3.15Å
86	S	85.3	Confident	81.3	Confident	10 Å²	10	70.6 Å²	70.6	7%	0.07	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-88.7	-13.7	172.6	74.7	0	0	0	0	113	P83 I84 P88 I89 E90	P83-S86 WeakPolarHBondContact CD-OG 3.34Å; P83-S86 PolarHBondContact O-N 3.11Å; P83-S86 PolarHBondContact O-OG 3.12Å; I84-S86 PolarHBondContact O-N 3.44Å; S86-P88 VanDerWaalsContact C-CD 3.47Å; S86-P88 VanDerWaalsContact C-N 3.35Å; S86-I89 WeakPolarHBondContact O-CA 3.45Å; S86-I89 WeakPolarHBondContact O-CB 3.48Å; S86-I89 PolarHBondContact O-N 3.4Å; S86-E90 WeakPolarHBondContact O-CG 3.18Å; S86-E90 PolarHBondContact O-N 3.15Å
87	M	87.8	Confident	81.2	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-52.9	-40.8	-174.8	-73.7	-65.7	-54.2	0	0	114.5	F45 W71 I84 I89 E90 C91 L118 L123 L124	F45-M87 HydrophobicContact CE2-CG 4.45Å; F45-M87 HydrophobicContact CZ-CG 4.03Å; F45-M87 HydrophobicContact CZ-SD 3.77Å; W71-M87 HydrophobicContact CH2-CE 4.05Å; W71-M87 HydrophobicContact CZ2-CE 3.9Å; I84-M87 VanDerWaalsContact O-CB 3.25Å; I84-M87 WeakPolarHBondContact O-CB 3.33Å; I84-M87 WeakPolarHBondContact O-CG 3.4Å; I84-M87 PolarHBondContact O-N 3.02Å; M87-I89 VanDerWaalsContact C-N 3.32Å; M87-I89 PolarHBondContact O-N 3.05Å; M87-E90 PolarHBondContact O-N 3.45Å; M87-C91 WeakPolarHBondContact O-CB 3.23Å; M87-C91 PolarHBondContact O-N 3.48Å; M87-C91 PolarHBondContact O-SG 3.17Å; M87-L118 HydrophobicContact CE-CD1 3.82Å; M87-L118 HydrophobicContact CE-CD2 3.94Å; M87-L118 HydrophobicContact CE-CG 4.39Å; M87-L123 WeakPolarHBondContact CB-O 3.36Å; M87-L123 HydrophobicContact CE-CB 4.12Å; M87-L123 HydrophobicContact CE-CD1 4.47Å; M87-L123 HydrophobicContact CG-CB 4.26Å; M87-L123 WeakPolarHBondContact CG-O 3.38Å; M87-L124 HydrophobicContact CB-CD2 3.91Å
88	P	88.1	Confident	81.2	Confident	19 Å²	19	59.1 Å²	59.1	12%	0.123	29%	0.288	C	S	.	.	H	α-helix	trans	-60.2	-40.9	174.8	-25.2	35.9	0	0	0	113.1	S86 C91 L92 L124 D128	S86-P88 VanDerWaalsContact C-CD 3.47Å; S86-P88 VanDerWaalsContact C-N 3.35Å; P88-C91 PolarHBondContact O-N 2.91Å; P88-L92 WeakPolarHBondContact O-CG 3.33Å; P88-L92 PolarHBondContact O-N 3.42Å; P88-L124 HydrophobicContact CB-CD2 4.38Å; P88-L124 HydrophobicContact CG-CD2 3.95Å; P88-D128 HydrophobicContact CB-CB 4.07Å; P88-D128 HydrophobicContact CG-CB 3.94Å; P88-D128 WeakPolarHBondContact CG-OD2 3.25Å
89	I	89.1	Confident	81	Confident	98 Å²	98	58.6 Å²	58.6	50%	0.503	29%	0.287	S	S	.	.	H	α-helix	trans	-68.5	-44.8	178.8	-60.4	170.9	0	0	0	110.1	S86 M87 C91 L92 E93	S86-I89 WeakPolarHBondContact O-CA 3.45Å; S86-I89 WeakPolarHBondContact O-CB 3.48Å; S86-I89 PolarHBondContact O-N 3.4Å; M87-I89 VanDerWaalsContact C-N 3.32Å; M87-I89 PolarHBondContact O-N 3.05Å; I89-C91 VanDerWaalsContact C-N 3.29Å; I89-C91 PolarHBondContact O-N 2.95Å; I89-L92 WeakPolarHBondContact O-CB 3.38Å; I89-L92 PolarHBondContact O-N 3.42Å; I89-L92 VanDerWaalsContact O-N 3.12Å; I89-E93 PolarHBondContact O-N 2.96Å
90	E	90.2	Very high	81.1	Confident	20 Å²	20	57.5 Å²	57.5	9%	0.093	28%	0.282	C	S	.	.	H	α-helix	trans	-63.7	-35.7	177.3	-60.4	-67.3	147.1	0	0	111.7	Y74 K78 L82 S86 M87 E93 F94	Y74-E90 HydrophobicContact CE1-CB 4.36Å; Y74-E90 PolarHBondContact OH-O 2.96Å; Y74-E90 PolarHBondContact OH-OE2 3.25Å; K78-E90 WeakPolarHBondContact CE-OE2 3.49Å; K78-E90 IonicContact NZ-OE2 3.87Å; L82-E90 HydrophobicContact CD1-CB 4.16Å; L82-E90 HydrophobicContact CD1-CG 3.66Å; L82-E90 HydrophobicContact CD2-CG 3.99Å; L82-E90 HydrophobicContact CG-CG 4.32Å; S86-E90 WeakPolarHBondContact O-CG 3.18Å; S86-E90 PolarHBondContact O-N 3.15Å; M87-E90 PolarHBondContact O-N 3.45Å; E90-E93 PolarHBondContact O-N 2.98Å; E90-F94 VanDerWaalsContact O-CB 3.29Å; E90-F94 WeakPolarHBondContact O-CB 3.18Å; E90-F94 PolarHBondContact O-N 2.93Å
91	C	91.1	Very high	81.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-67.6	-36.9	173.8	-69.4	0	0	0	0	112.1	M87 P88 I89 L95 F115 L118 L132	M87-C91 WeakPolarHBondContact O-CB 3.23Å; M87-C91 PolarHBondContact O-N 3.48Å; M87-C91 PolarHBondContact O-SG 3.17Å; P88-C91 PolarHBondContact O-N 2.91Å; I89-C91 VanDerWaalsContact C-N 3.29Å; I89-C91 PolarHBondContact O-N 2.95Å; C91-L95 WeakPolarHBondContact O-CB 3.34Å; C91-L95 PolarHBondContact O-N 3.12Å; C91-F115 HydrophobicContact CB-CD1 4.07Å; C91-F115 HydrophobicContact CB-CE1 3.54Å; C91-F115 HydrophobicContact CB-CZ 4.12Å; C91-L118 VanDerWaalsContact SG-CD1 3.57Å; C91-L132 HydrophobicContact CB-CD1 3.52Å; C91-L132 HydrophobicContact CB-CD2 3.71Å; C91-L132 HydrophobicContact CB-CG 4.28Å
92	L	89.2	Confident	80.9	Confident	47 Å²	47	54.6 Å²	54.6	25%	0.246	26%	0.255	C	S	.	.	H	α-helix	trans	-65.8	-43.6	174.4	-74.4	169.3	0	0	0	111.7	P88 I89 L95 R96 M131 L132 K135	P88-L92 WeakPolarHBondContact O-CG 3.33Å; P88-L92 PolarHBondContact O-N 3.42Å; I89-L92 WeakPolarHBondContact O-CB 3.38Å; I89-L92 PolarHBondContact O-N 3.42Å; I89-L92 VanDerWaalsContact O-N 3.12Å; L92-L95 PolarHBondContact O-N 3.06Å; L92-R96 WeakPolarHBondContact O-CG 3.46Å; L92-R96 PolarHBondContact O-N 3.42Å; L92-M131 HydrophobicContact CD1-CE 4.41Å; L92-L132 HydrophobicContact CD2-CD2 3.7Å; L92-L132 HydrophobicContact CG-CD2 3.8Å; L92-K135 HydrophobicContact CD2-CD 3.39Å
93	E	88.1	Confident	80.6	Confident	68 Å²	68	63 Å²	63	32%	0.318	29%	0.293	S	S	.	.	H	α-helix	trans	-64.6	-43.2	175.3	-75.6	-171.1	-176.4	0	0	112	Y74 K78 I89 E90 L95 R96 L97	Y74-E93 HydrophobicContact CE2-CB 4.4Å; Y74-E93 WeakPolarHBondContact OH-CB 3.35Å; Y74-E93 PolarHBondContact OH-OE2 3.06Å; K78-E93 WeakPolarHBondContact CE-OE2 3.38Å; K78-E93 IonicContact NZ-OE1 3.68Å; K78-E93 IonicContact NZ-OE2 2.64Å; K78-E93 PolarHBondContact NZ-OE2 3.34Å; I89-E93 PolarHBondContact O-N 2.96Å; E90-E93 PolarHBondContact O-N 2.98Å; E93-L95 VanDerWaalsContact C-N 3.28Å; E93-L95 PolarHBondContact O-N 3.39Å; E93-R96 PolarHBondContact O-N 3.33Å; E93-L97 PolarHBondContact O-N 3.07Å; E93-L97 VanDerWaalsContact O-N 3.1Å
94	F	89.8	Confident	80.4	Confident	4 Å²	4	64.5 Å²	64.5	2%	0.018	30%	0.299	C	S	.	.	H	α-helix	trans	-60	-40.1	174.1	176.7	-107	0	0	0	112.1	V67 L70 W71 Y74 E90 L97 C98 L114 F115	V67-F94 HydrophobicContact CG1-CE1 4.33Å; V67-F94 HydrophobicContact CG1-CZ 4.27Å; L70-F94 HydrophobicContact CB-CE2 3.94Å; L70-F94 HydrophobicContact CB-CZ 4.08Å; W71-F94 VanDerWaalsContact CA-CE2 3.49Å; W71-F94 HydrophobicContact CB-CE2 4.09Å; W71-F94 HydrophobicContact CB-CZ 3.95Å; W71-F94 HydrophobicContact CE3-CB 4Å; W71-F94 AromaticContact CE3-CD1 3.69Å; W71-F94 HydrophobicContact CE3-CD1 3.69Å; W71-F94 AromaticContact CE3-CD2 3.68Å; W71-F94 HydrophobicContact CE3-CD2 3.68Å; W71-F94 HydrophobicContact CE3-CE1 4.04Å; W71-F94 HydrophobicContact CE3-CE2 4.03Å; W71-F94 AromaticContact CE3-CG 3.48Å; W71-F94 HydrophobicContact CE3-CG 3.48Å; W71-F94 VanDerWaalsContact CE3-CG 3.48Å; W71-F94 HydrophobicContact CE3-CZ 4.19Å; W71-F94 HydrophobicContact CZ3-CB 3.69Å; W71-F94 HydrophobicContact CZ3-CD1 4.04Å; W71-F94 HydrophobicContact CZ3-CD2 4.24Å; W71-F94 AromaticContact CZ3-CG 3.72Å; W71-F94 HydrophobicContact CZ3-CG 3.72Å; Y74-F94 HydrophobicContact CD1-CB 4.2Å; Y74-F94 HydrophobicContact CD1-CD2 4.15Å; Y74-F94 HydrophobicContact CD2-CD2 4.49Å; Y74-F94 HydrophobicContact CE1-CB 4.16Å; Y74-F94 HydrophobicContact CG-CB 4.5Å; Y74-F94 AromaticContact CG-CD2 3.92Å; Y74-F94 HydrophobicContact CG-CD2 3.92Å; E90-F94 VanDerWaalsContact O-CB 3.29Å; E90-F94 WeakPolarHBondContact O-CB 3.18Å; E90-F94 PolarHBondContact O-N 2.93Å; F94-L97 PolarHBondContact O-N 3.1Å; F94-C98 VanDerWaalsContact CE1-SG 3.5Å; F94-C98 WeakPolarHBondContact CZ-SG 3.32Å; F94-C98 WeakPolarHBondContact O-CB 3.4Å; F94-C98 PolarHBondContact O-N 3.48Å; F94-C98 PolarHBondContact O-SG 3.43Å; F94-L114 HydrophobicContact CD1-CD2 4.14Å; F94-L114 HydrophobicContact CE1-CD2 3.52Å; F94-L114 HydrophobicContact CZ-CD2 4.12Å; F94-F115 HydrophobicContact CD1-CE1 4.38Å
95	L	87.7	Confident	80.3	Confident	10 Å²	10	67.9 Å²	67.9	5%	0.052	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-44.7	176.3	-176.7	60.4	0	0	0	111.4	C91 L92 E93 L97 C98 E99 V111 F115 K135 V136	C91-L95 WeakPolarHBondContact O-CB 3.34Å; C91-L95 PolarHBondContact O-N 3.12Å; L92-L95 PolarHBondContact O-N 3.06Å; E93-L95 VanDerWaalsContact C-N 3.28Å; E93-L95 PolarHBondContact O-N 3.39Å; L95-L97 PolarHBondContact O-N 2.95Å; L95-C98 CarbonylContact O-C 3.53Å; L95-C98 WeakPolarHBondContact O-CA 3.45Å; L95-C98 WeakPolarHBondContact O-CB 3.48Å; L95-C98 PolarHBondContact O-N 3.34Å; L95-E99 WeakPolarHBondContact CG-OE1 3.33Å; L95-E99 WeakPolarHBondContact O-CG 3.33Å; L95-E99 PolarHBondContact O-N 3.38Å; L95-V111 HydrophobicContact CD1-CG1 3.99Å; L95-F115 HydrophobicContact CB-CZ 4.3Å; L95-K135 HydrophobicContact CD2-CB 3.72Å; L95-V136 HydrophobicContact CD1-CG2 3.63Å; L95-V136 HydrophobicContact CD2-CG2 4.17Å
96	R	83.6	Confident	80.2	Confident	172 Å²	172	63.6 Å²	63.6	65%	0.649	30%	0.303	S	S	*	.	H	α-helix	trans	-59	-44.1	175.8	-71.3	176.3	179.9	174.7	-0.3	112.7	L92 E93 C98 E99 E100	L92-R96 WeakPolarHBondContact O-CG 3.46Å; L92-R96 PolarHBondContact O-N 3.42Å; E93-R96 PolarHBondContact O-N 3.33Å; R96-C98 VanDerWaalsContact C-N 3.26Å; R96-C98 PolarHBondContact O-N 2.9Å; R96-E99 PolarHBondContact O-N 2.89Å; R96-E100 PolarHBondContact O-N 3.08Å
97	L	81.1	Confident	79.9	Confident	69 Å²	69	63.6 Å²	63.6	36%	0.361	30%	0.302	S	S	.	.	H	α-helix	trans	-64.6	-33.9	175.2	-69.1	171.5	0	0	0	112.1	Y74 E93 F94 L95 I101	Y74-L97 HydrophobicContact CD2-CD1 3.4Å; Y74-L97 VanDerWaalsContact CD2-CD1 3.4Å; Y74-L97 HydrophobicContact CE2-CD1 3.59Å; E93-L97 PolarHBondContact O-N 3.07Å; E93-L97 VanDerWaalsContact O-N 3.1Å; F94-L97 PolarHBondContact O-N 3.1Å; L95-L97 PolarHBondContact O-N 2.95Å; L97-I101 WeakPolarHBondContact O-CD1 3.35Å; L97-I101 WeakPolarHBondContact O-CG1 3.49Å
98	C	77.1	Confident	79.7	Confident	4 Å²	4	64.7 Å²	64.7	3%	0.027	31%	0.307	C	S	.	.	H	α-helix	trans	-71.6	-36.6	176.4	-77	0	0	0	0	112	F94 L95 R96 E100 I101 I102	F94-C98 VanDerWaalsContact CE1-SG 3.5Å; F94-C98 WeakPolarHBondContact CZ-SG 3.32Å; F94-C98 WeakPolarHBondContact O-CB 3.4Å; F94-C98 PolarHBondContact O-N 3.48Å; F94-C98 PolarHBondContact O-SG 3.43Å; L95-C98 CarbonylContact O-C 3.53Å; L95-C98 WeakPolarHBondContact O-CA 3.45Å; L95-C98 WeakPolarHBondContact O-CB 3.48Å; L95-C98 PolarHBondContact O-N 3.34Å; R96-C98 VanDerWaalsContact C-N 3.26Å; R96-C98 PolarHBondContact O-N 2.9Å; C98-E100 PolarHBondContact O-N 3.44Å; C98-I101 CarbonylContact O-C 3.53Å; C98-I101 PolarHBondContact O-N 2.88Å; C98-I102 HydrophobicContact CB-CD1 3.49Å; C98-I102 VanDerWaalsContact CB-CD1 3.49Å; C98-I102 HydrophobicContact CB-CG1 4.14Å; C98-I102 WeakPolarHBondContact O-CA 3.35Å; C98-I102 WeakPolarHBondContact O-CB 3.2Å; C98-I102 WeakPolarHBondContact O-CG1 3.29Å; C98-I102 PolarHBondContact O-N 3.35Å
99	E	72.2	Confident	79.4	Confident	64 Å²	64	67.2 Å²	67.2	30%	0.299	32%	0.32	S	S	.	.	H	α-helix	trans	-58.7	-34.7	176.3	-74.5	163.7	-158.9	0	0	112.2	L95 R96 I101 H139	L95-E99 WeakPolarHBondContact CG-OE1 3.33Å; L95-E99 WeakPolarHBondContact O-CG 3.33Å; L95-E99 PolarHBondContact O-N 3.38Å; R96-E99 PolarHBondContact O-N 2.89Å; E99-I101 PolarHBondContact O-N 3.23Å; E99-H139 VanDerWaalsContact CD-ND1 3.31Å; E99-H139 IonicContact OE1-CD2 3.07Å; E99-H139 PolarHBondContact OE1-CD2 3.05Å; E99-H139 IonicContact OE1-CE1 3.01Å; E99-H139 PolarHBondContact OE1-CE1 3.29Å; E99-H139 IonicContact OE1-CG 3.12Å; E99-H139 IonicContact OE1-ND1 3.3Å; E99-H139 PolarHBondContact OE1-ND1 3.46Å; E99-H139 IonicContact OE1-NE2 3.39Å; E99-H139 PolarHBondContact OE1-NE2 2.86Å; E99-H139 VanDerWaalsContact OE1-NE2 3.07Å; E99-H139 IonicContact OE2-CE1 3.79Å; E99-H139 PolarHBondContact OE2-CE1 3.49Å; E99-H139 IonicContact OE2-ND1 3.16Å; E99-H139 PolarHBondContact OE2-ND1 2.92Å; E99-H139 IonicContact OE2-NE2 3.73Å
100	E	65.1	Low	79.3	Confident	162 Å²	162	62.8 Å²	62.8	76%	0.757	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.1	174.9	-65.9	177.1	-175.8	0	0	113.4	R96 C98	R96-E100 PolarHBondContact O-N 3.08Å; C98-E100 PolarHBondContact O-N 3.44Å
101	I	66.2	Low	79.1	Confident	84 Å²	84	62 Å²	62	43%	0.431	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-23.8	-170.6	-61	171.2	0	0	0	112.1	L70 L97 C98 E99	L70-I101 HydrophobicContact CD1-CG2 4.5Å; L70-I101 HydrophobicContact CD2-CD1 4.49Å; L97-I101 WeakPolarHBondContact O-CD1 3.35Å; L97-I101 WeakPolarHBondContact O-CG1 3.49Å; C98-I101 CarbonylContact O-C 3.53Å; C98-I101 PolarHBondContact O-N 2.88Å; E99-I101 PolarHBondContact O-N 3.23Å
102	I	64.1	Low	79	Confident	9 Å²	9	62.1 Å²	62.1	5%	0.046	30%	0.295	C	S	.	.			trans	-108.6	101.6	-167.1	-59.6	178.8	0	0	0	110.4	C98 N104 L107 H108 V111	C98-I102 HydrophobicContact CB-CD1 3.49Å; C98-I102 VanDerWaalsContact CB-CD1 3.49Å; C98-I102 HydrophobicContact CB-CG1 4.14Å; C98-I102 WeakPolarHBondContact O-CA 3.35Å; C98-I102 WeakPolarHBondContact O-CB 3.2Å; C98-I102 WeakPolarHBondContact O-CG1 3.29Å; C98-I102 PolarHBondContact O-N 3.35Å; I102-N104 WeakPolarHBondContact CG2-O 3.32Å; I102-L107 HydrophobicContact CB-CB 4.3Å; I102-L107 HydrophobicContact CD1-CB 4.11Å; I102-L107 HydrophobicContact CG1-CB 4.17Å; I102-L107 HydrophobicContact CG1-CD1 4.26Å; I102-L107 HydrophobicContact CG2-CB 3.2Å; I102-L107 HydrophobicContact CG2-CD1 3.92Å; I102-L107 HydrophobicContact CG2-CG 4.19Å; I102-H108 WeakPolarHBondContact CG2-CD2 3.34Å; I102-H108 PolarHBondContact O-NE2 3.41Å; I102-V111 HydrophobicContact CD1-CG2 3.65Å
103	E	68.2	Low	78.9	Confident	190 Å²	190	62 Å²	62	89%	0.888	30%	0.301	S	S	*	.			trans	-95.2	-15.7	171.3	-63.1	172.3	177.2	0	0	112	R140	E103-R140 PolarHBondContact O-NH2 3.16Å
104	N	71.4	Confident	78.9	Confident	75 Å²	75	59.3 Å²	59.3	40%	0.401	29%	0.289	S	S	.	.			trans	-97.5	141.3	-170.7	-171.2	-13.7	0	0	0	112.8	I102 E106 L107 H108	I102-N104 WeakPolarHBondContact CG2-O 3.32Å; N104-E106 PolarHBondContact OD1-N 3.45Å; N104-L107 HydrophobicContact CB-CD1 4.12Å; N104-L107 HydrophobicContact CB-CG 4.35Å; N104-L107 WeakPolarHBondContact O-CB 3.5Å; N104-L107 PolarHBondContact O-N 2.95Å; N104-H108 PolarHBondContact O-N 3.46Å
105	E	72.6	Confident	79	Confident	115 Å²	115	59.1 Å²	59.1	54%	0.537	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-44.2	-179.8	-169.1	151.1	-178	0	0	112.6	L107 H108 D109 R140	E105-L107 PolarHBondContact O-N 3.26Å; E105-H108 WeakPolarHBondContact O-CB 3.41Å; E105-H108 PolarHBondContact O-N 2.93Å; E105-D109 PolarHBondContact O-N 3.44Å; E105-R140 IonicContact OE1-NH1 2.94Å; E105-R140 IonicContact OE2-NH1 3.46Å; E105-R140 PolarHBondContact OE2-NH1 3.39Å
106	E	76.2	Confident	78.9	Confident	115 Å²	115	62.4 Å²	62.4	54%	0.537	31%	0.305	S	S	.	.	H	α-helix	trans	-62.6	-24.3	-178.2	-53	-178.4	140.6	0	0	112.1	P63 N104 A110	P63-E106 HydrophobicContact CB-CB 3.93Å; P63-E106 WeakPolarHBondContact CB-O 3.38Å; P63-E106 HydrophobicContact CG-CB 3.59Å; P63-E106 WeakPolarHBondContact CG-OE2 3.46Å; N104-E106 PolarHBondContact OD1-N 3.45Å; E106-A110 WeakPolarHBondContact O-CB 3.49Å; E106-A110 PolarHBondContact O-N 3.41Å; E106-A110 VanDerWaalsContact O-N 3.15Å
107	L	80	Confident	79	Confident	11 Å²	11	55.8 Å²	55.8	6%	0.058	29%	0.287	C	S	.	.	H	α-helix	trans	-82	-31.4	176.2	-72.3	174.5	0	0	0	111.8	P63 K66 V67 I102 N104 E105 A110 V111	P63-L107 HydrophobicContact CB-CD2 3.82Å; P63-L107 HydrophobicContact CB-CG 4.36Å; K66-L107 HydrophobicContact CB-CD2 4Å; K66-L107 HydrophobicContact CD-CD1 4.13Å; K66-L107 HydrophobicContact CD-CD2 3.83Å; K66-L107 HydrophobicContact CG-CD2 4.21Å; V67-L107 HydrophobicContact CG2-CD2 4.04Å; I102-L107 HydrophobicContact CB-CB 4.3Å; I102-L107 HydrophobicContact CD1-CB 4.11Å; I102-L107 HydrophobicContact CG1-CB 4.17Å; I102-L107 HydrophobicContact CG1-CD1 4.26Å; I102-L107 HydrophobicContact CG2-CB 3.2Å; I102-L107 HydrophobicContact CG2-CD1 3.92Å; I102-L107 HydrophobicContact CG2-CG 4.19Å; N104-L107 HydrophobicContact CB-CD1 4.12Å; N104-L107 HydrophobicContact CB-CG 4.35Å; N104-L107 WeakPolarHBondContact O-CB 3.5Å; N104-L107 PolarHBondContact O-N 2.95Å; E105-L107 PolarHBondContact O-N 3.26Å; L107-A110 PolarHBondContact O-N 3Å; L107-V111 WeakPolarHBondContact O-CG2 3.4Å; L107-V111 PolarHBondContact O-N 2.86Å
108	H	82	Confident	79.3	Confident	22 Å²	22	52.5 Å²	52.5	10%	0.102	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-45.9	170.4	-73.4	-166.4	0	0	0	111	I102 N104 E105 A110 V111 A112 V136 R140	I102-H108 WeakPolarHBondContact CG2-CD2 3.34Å; I102-H108 PolarHBondContact O-NE2 3.41Å; N104-H108 PolarHBondContact O-N 3.46Å; E105-H108 WeakPolarHBondContact O-CB 3.41Å; E105-H108 PolarHBondContact O-N 2.93Å; H108-A110 PolarHBondContact O-N 3.42Å; H108-V111 PolarHBondContact O-N 3.44Å; H108-A112 PolarHBondContact O-N 3.06Å; H108-V136 HydrophobicContact CB-CG1 3.77Å; H108-V136 WeakPolarHBondContact O-CG1 3.23Å; H108-R140 VanDerWaalsContact CE1-CG 3.48Å; H108-R140 WeakPolarHBondContact CE1-CG 3.47Å; H108-R140 PolarHBondContact CE1-NE 3.01Å; H108-R140 VanDerWaalsContact CE1-NE 3.26Å; H108-R140 WeakPolarHBondContact ND1-CD 3.48Å; H108-R140 VanDerWaalsContact ND1-CG 3.26Å; H108-R140 WeakPolarHBondContact ND1-CG 3.47Å; H108-R140 PolarHBondContact ND1-NE 3.24Å
109	D	83.5	Confident	79.8	Confident	73 Å²	73	54.1 Å²	54.1	39%	0.39	28%	0.277	S	S	.	.	H	α-helix	trans	-58.5	-40.4	174.8	-69.2	-10.9	0	0	0	110.9	E105 V111 A112 A113 Y137	E105-D109 PolarHBondContact O-N 3.44Å; D109-V111 PolarHBondContact O-N 3.13Å; D109-A112 PolarHBondContact O-N 2.93Å; D109-A113 WeakPolarHBondContact O-CB 3.49Å; D109-A113 PolarHBondContact O-N 3.3Å; D109-Y137 PolarHBondContact OD1-OH 3.11Å; D109-Y137 VanDerWaalsContact OD1-OH 3.11Å
110	A	85.6	Confident	80.3	Confident	5 Å²	5	58.9 Å²	58.9	4%	0.041	30%	0.3	C	S	.	.	H	α-helix	trans	-65.5	-34.4	175.2	0	0	0	0	0	113.5	P63 V64 V67 E106 L107 H108 L114	P63-A110 HydrophobicContact CB-CB 4.21Å; V64-A110 HydrophobicContact CB-CB 4.49Å; V64-A110 HydrophobicContact CG2-CB 3.98Å; V67-A110 HydrophobicContact CB-CB 4.08Å; V67-A110 HydrophobicContact CG2-CB 3.57Å; E106-A110 WeakPolarHBondContact O-CB 3.49Å; E106-A110 PolarHBondContact O-N 3.41Å; E106-A110 VanDerWaalsContact O-N 3.15Å; L107-A110 PolarHBondContact O-N 3Å; H108-A110 PolarHBondContact O-N 3.42Å; A110-L114 PolarHBondContact O-N 3.26Å
111	V	87.5	Confident	81.2	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-70.2	-43.3	173.2	174	0	0	0	0	111	V67 L95 I102 L107 H108 D109 A113 L114 F115 V136	V67-V111 HydrophobicContact CG1-CG2 3.87Å; V67-V111 HydrophobicContact CG2-CG2 3.82Å; L95-V111 HydrophobicContact CD1-CG1 3.99Å; I102-V111 HydrophobicContact CD1-CG2 3.65Å; L107-V111 WeakPolarHBondContact O-CG2 3.4Å; L107-V111 PolarHBondContact O-N 2.86Å; H108-V111 PolarHBondContact O-N 3.44Å; D109-V111 PolarHBondContact O-N 3.13Å; V111-A113 VanDerWaalsContact C-N 3.29Å; V111-A113 PolarHBondContact O-N 3.05Å; V111-L114 WeakPolarHBondContact O-CB 3.46Å; V111-L114 PolarHBondContact O-N 2.96Å; V111-L114 VanDerWaalsContact O-N 3.12Å; V111-F115 HydrophobicContact CG1-CD2 4.25Å; V111-F115 HydrophobicContact CG1-CE1 4.38Å; V111-F115 HydrophobicContact CG1-CE2 3.59Å; V111-F115 HydrophobicContact CG1-CZ 3.66Å; V111-F115 PolarHBondContact O-N 3.4Å; V111-F115 VanDerWaalsContact O-N 3.11Å; V111-V136 HydrophobicContact CG1-CG2 3.83Å
112	A	87.6	Confident	81.9	Confident	4 Å²	4	49 Å²	49	3%	0.033	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-42.5	174.1	0	0	0	0	0	111.3	H108 D109 L114 F115 L116 I133 V136 Y137	H108-A112 PolarHBondContact O-N 3.06Å; D109-A112 PolarHBondContact O-N 2.93Å; A112-L114 VanDerWaalsContact C-N 3.32Å; A112-L114 PolarHBondContact O-N 3.43Å; A112-F115 PolarHBondContact O-N 3.19Å; A112-L116 PolarHBondContact O-N 3.36Å; A112-I133 HydrophobicContact CB-CG1 4.3Å; A112-I133 HydrophobicContact CB-CG2 4.35Å; A112-V136 HydrophobicContact CB-CG1 4.48Å; A112-Y137 HydrophobicContact CB-CE2 4.2Å
113	A	87.2	Confident	82.9	Confident	45 Å²	45	48.7 Å²	48.7	37%	0.372	26%	0.258	S	S	.	.	H	α-helix	trans	-62.5	-36.3	174.6	0	0	0	0	0	112.7	D109 V111 L116 A117	D109-A113 WeakPolarHBondContact O-CB 3.49Å; D109-A113 PolarHBondContact O-N 3.3Å; V111-A113 VanDerWaalsContact C-N 3.29Å; V111-A113 PolarHBondContact O-N 3.05Å; A113-L116 PolarHBondContact O-N 3.39Å; A113-A117 PolarHBondContact O-N 3.31Å
114	L	89.4	Confident	83.7	Confident	10 Å²	10	39.9 Å²	39.9	5%	0.052	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-46.1	172.8	177	69.7	0	0	0	111.2	V67 W71 F94 A110 V111 A112 L116 A117 L118	V67-L114 HydrophobicContact CG1-CB 4.16Å; V67-L114 HydrophobicContact CG1-CD2 3.97Å; W71-L114 HydrophobicContact CB-CD2 3.88Å; W71-L114 HydrophobicContact CD2-CD2 3.91Å; W71-L114 HydrophobicContact CE3-CD2 3.94Å; W71-L114 HydrophobicContact CG-CD1 4.23Å; W71-L114 HydrophobicContact CG-CD2 3.89Å; F94-L114 HydrophobicContact CD1-CD2 4.14Å; F94-L114 HydrophobicContact CE1-CD2 3.52Å; F94-L114 HydrophobicContact CZ-CD2 4.12Å; A110-L114 PolarHBondContact O-N 3.26Å; V111-L114 WeakPolarHBondContact O-CB 3.46Å; V111-L114 PolarHBondContact O-N 2.96Å; V111-L114 VanDerWaalsContact O-N 3.12Å; A112-L114 VanDerWaalsContact C-N 3.32Å; A112-L114 PolarHBondContact O-N 3.43Å; L114-L116 VanDerWaalsContact C-N 3.33Å; L114-L116 PolarHBondContact O-N 3.23Å; L114-A117 WeakPolarHBondContact O-CB 3.39Å; L114-A117 PolarHBondContact O-N 3.09Å; L114-A117 VanDerWaalsContact O-N 3.16Å; L114-L118 HydrophobicContact CG-CD1 4.41Å; L114-L118 WeakPolarHBondContact O-CG 3.41Å; L114-L118 PolarHBondContact O-N 3.41Å
115	F	89.9	Confident	84.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65	-36.4	179.1	-61	-31.2	0	0	0	112.7	C91 F94 L95 V111 A112 L118 H119 L124 T129 L132 I133 V136	C91-F115 HydrophobicContact CB-CD1 4.07Å; C91-F115 HydrophobicContact CB-CE1 3.54Å; C91-F115 HydrophobicContact CB-CZ 4.12Å; F94-F115 HydrophobicContact CD1-CE1 4.38Å; L95-F115 HydrophobicContact CB-CZ 4.3Å; V111-F115 HydrophobicContact CG1-CD2 4.25Å; V111-F115 HydrophobicContact CG1-CE1 4.38Å; V111-F115 HydrophobicContact CG1-CE2 3.59Å; V111-F115 HydrophobicContact CG1-CZ 3.66Å; V111-F115 PolarHBondContact O-N 3.4Å; V111-F115 VanDerWaalsContact O-N 3.11Å; A112-F115 PolarHBondContact O-N 3.19Å; F115-L118 HydrophobicContact CD1-CD1 4.28Å; F115-L118 PolarHBondContact O-N 3.39Å; F115-H119 PolarHBondContact O-N 2.95Å; F115-L124 HydrophobicContact CB-CD1 4.27Å; F115-T129 HydrophobicContact CB-CG2 4.49Å; F115-L132 HydrophobicContact CD1-CD1 4.41Å; F115-L132 HydrophobicContact CD2-CB 3.62Å; F115-L132 HydrophobicContact CE2-CB 3.84Å; F115-L132 HydrophobicContact CE2-CD2 4.34Å; F115-L132 HydrophobicContact CG-CB 4.14Å; F115-L132 HydrophobicContact CG-CD1 4.38Å; F115-L132 HydrophobicContact CZ-CD2 4.35Å; F115-I133 HydrophobicContact CB-CG1 4.41Å; F115-V136 HydrophobicContact CD2-CG2 4.11Å; F115-V136 HydrophobicContact CE2-CG2 3.63Å
116	L	86.3	Confident	85.1	Confident	79 Å²	79	41.5 Å²	41.5	41%	0.414	22%	0.221	S	C	.	.	H	α-helix	trans	-62	-44	170.8	-70.4	172.6	0	0	0	111.7	A112 A113 L114 L118 H119 E120 T129 I133	A112-L116 PolarHBondContact O-N 3.36Å; A113-L116 PolarHBondContact O-N 3.39Å; L114-L116 VanDerWaalsContact C-N 3.33Å; L114-L116 PolarHBondContact O-N 3.23Å; L116-L118 VanDerWaalsContact C-N 3.32Å; L116-L118 PolarHBondContact O-N 2.95Å; L116-H119 WeakPolarHBondContact O-CB 3.29Å; L116-H119 PolarHBondContact O-N 2.64Å; L116-E120 WeakPolarHBondContact O-CG 2.95Å; L116-E120 PolarHBondContact O-N 2.79Å; L116-T129 HydrophobicContact CD2-CG2 4.08Å; L116-I133 HydrophobicContact CD1-CD1 4.46Å; L116-I133 HydrophobicContact CD2-CD1 3.63Å; L116-I133 HydrophobicContact CG-CD1 3.78Å
117	A	86.6	Confident	85.6	Confident	33 Å²	33	38.5 Å²	38.5	27%	0.273	22%	0.22	S	C	.	.	H	α-helix	trans	-63.8	-37	177.3	0	0	0	0	0	112.5	A113 L114 H119 E120 A121	A113-A117 PolarHBondContact O-N 3.31Å; L114-A117 WeakPolarHBondContact O-CB 3.39Å; L114-A117 PolarHBondContact O-N 3.09Å; L114-A117 VanDerWaalsContact O-N 3.16Å; A117-H119 VanDerWaalsContact C-N 3.35Å; A117-E120 PolarHBondContact O-N 3.28Å; A117-A121 WeakPolarHBondContact O-CB 3.06Å; A117-A121 PolarHBondContact O-N 2.86Å
118	L	87.4	Confident	86	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.2	-37.5	174.2	-67.9	176.2	0	0	0	111.7	W71 M87 C91 L114 F115 L116 A121 G122 L123 L124	W71-L118 HydrophobicContact CH2-CD1 4.2Å; W71-L118 HydrophobicContact CZ2-CD1 4.06Å; W71-L118 HydrophobicContact CZ2-CD2 4.34Å; M87-L118 HydrophobicContact CE-CD1 3.82Å; M87-L118 HydrophobicContact CE-CD2 3.94Å; M87-L118 HydrophobicContact CE-CG 4.39Å; C91-L118 VanDerWaalsContact SG-CD1 3.57Å; L114-L118 HydrophobicContact CG-CD1 4.41Å; L114-L118 WeakPolarHBondContact O-CG 3.41Å; L114-L118 PolarHBondContact O-N 3.41Å; F115-L118 HydrophobicContact CD1-CD1 4.28Å; F115-L118 PolarHBondContact O-N 3.39Å; L116-L118 VanDerWaalsContact C-N 3.32Å; L116-L118 PolarHBondContact O-N 2.95Å; L118-A121 PolarHBondContact O-N 2.87Å; L118-G122 PolarHBondContact O-N 3.06Å; L118-L123 HydrophobicContact CB-CB 4.33Å; L118-L123 HydrophobicContact CD2-CB 4.49Å; L118-L123 HydrophobicContact CD2-CD1 3.57Å; L118-L123 WeakPolarHBondContact O-CA 3.43Å; L118-L123 VanDerWaalsContact O-CB 3.32Å; L118-L123 WeakPolarHBondContact O-CB 3.34Å; L118-L123 PolarHBondContact O-N 3.25Å; L118-L124 HydrophobicContact CB-CD1 3.72Å; L118-L124 HydrophobicContact CB-CG 4Å; L118-L124 HydrophobicContact CD1-CD1 4.2Å; L118-L124 PolarHBondContact O-N 2.85Å
119	H	87	Confident	86.4	Confident	39 Å²	39	39.1 Å²	39.1	18%	0.181	22%	0.224	C	C	.	.	H	α-helix	trans	-63.5	-46.9	172.2	170.9	-111.4	0	0	0	112.3	F115 L116 A117 A121 G122 L124 T129	F115-H119 PolarHBondContact O-N 2.95Å; L116-H119 WeakPolarHBondContact O-CB 3.29Å; L116-H119 PolarHBondContact O-N 2.64Å; A117-H119 VanDerWaalsContact C-N 3.35Å; H119-A121 PolarHBondContact O-N 2.98Å; H119-G122 PolarHBondContact O-N 3.15Å; H119-L124 HydrophobicContact CB-CB 4.36Å; H119-L124 PolarHBondContact CD2-O 3.5Å; H119-T129 HydrophobicContact CB-CG2 3.93Å; H119-T129 WeakPolarHBondContact CB-OG1 3.15Å
120	E	83.6	Confident	86.5	Confident	164 Å²	164	39.4 Å²	39.4	77%	0.766	23%	0.226	S	C	*	.	H	α-helix	trans	-61.6	-31.8	176.9	-71.6	179.8	172.4	0	0	112.6	L116 A117 G122	L116-E120 WeakPolarHBondContact O-CG 2.95Å; L116-E120 PolarHBondContact O-N 2.79Å; A117-E120 PolarHBondContact O-N 3.28Å; E120-G122 PolarHBondContact O-N 3.4Å
121	A	82.4	Confident	86.8	Confident	24 Å²	24	43 Å²	43	20%	0.198	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-1.5	173.6	0	0	0	0	0	114.2	V52 A117 L118 H119 L123	V52-A121 HydrophobicContact CG2-CB 3.54Å; A117-A121 WeakPolarHBondContact O-CB 3.06Å; A117-A121 PolarHBondContact O-N 2.86Å; L118-A121 PolarHBondContact O-N 2.87Å; H119-A121 PolarHBondContact O-N 2.98Å; A121-L123 VanDerWaalsContact C-N 3.32Å; A121-L123 HydrophobicContact CB-CD1 4.05Å; A121-L123 HydrophobicContact CB-CG 4.04Å
122	G	82.1	Confident	86.9	Confident	15 Å²	15	42.9 Å²	42.9	16%	0.155	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	18.3	-178.1	0	0	0	0	0	114.3	L118 H119 E120	L118-G122 PolarHBondContact O-N 3.06Å; H119-G122 PolarHBondContact O-N 3.15Å; E120-G122 PolarHBondContact O-N 3.4Å
123	L	84.2	Confident	86.9	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	25%	0.248	C	C	.	.	S	Bend	trans	-92.4	-20.8	-178.9	-57.3	174	0	0	0	112.9	F45 L49 V52 I84 M87 L118 A121	F45-L123 HydrophobicContact CD2-CD2 3.71Å; F45-L123 HydrophobicContact CE2-CD2 3.17Å; F45-L123 HydrophobicContact CZ-CD2 3.78Å; L49-L123 HydrophobicContact CD2-CD1 3.8Å; V52-L123 HydrophobicContact CG2-CD1 4.5Å; I84-L123 HydrophobicContact CG1-CD2 4.5Å; M87-L123 WeakPolarHBondContact CB-O 3.36Å; M87-L123 HydrophobicContact CE-CB 4.12Å; M87-L123 HydrophobicContact CE-CD1 4.47Å; M87-L123 HydrophobicContact CG-CB 4.26Å; M87-L123 WeakPolarHBondContact CG-O 3.38Å; L118-L123 HydrophobicContact CB-CB 4.33Å; L118-L123 HydrophobicContact CD2-CB 4.49Å; L118-L123 HydrophobicContact CD2-CD1 3.57Å; L118-L123 WeakPolarHBondContact O-CA 3.43Å; L118-L123 VanDerWaalsContact O-CB 3.32Å; L118-L123 WeakPolarHBondContact O-CB 3.34Å; L118-L123 PolarHBondContact O-N 3.25Å; A121-L123 VanDerWaalsContact C-N 3.32Å; A121-L123 HydrophobicContact CB-CD1 4.05Å; A121-L123 HydrophobicContact CB-CG 4.04Å
124	L	85.5	Confident	86.9	Confident	4 Å²	4	44 Å²	44	2%	0.021	25%	0.247	C	C	.	.	S	Bend	trans	-124.4	145.3	173.9	-69.9	173.5	0	0	0	109.9	M87 P88 F115 L118 H119 D128 T129 L132	M87-L124 HydrophobicContact CB-CD2 3.91Å; P88-L124 HydrophobicContact CB-CD2 4.38Å; P88-L124 HydrophobicContact CG-CD2 3.95Å; F115-L124 HydrophobicContact CB-CD1 4.27Å; L118-L124 HydrophobicContact CB-CD1 3.72Å; L118-L124 HydrophobicContact CB-CG 4Å; L118-L124 HydrophobicContact CD1-CD1 4.2Å; L118-L124 PolarHBondContact O-N 2.85Å; H119-L124 HydrophobicContact CB-CB 4.36Å; H119-L124 PolarHBondContact CD2-O 3.5Å; L124-D128 HydrophobicContact CD2-CB 4.47Å; L124-T129 WeakPolarHBondContact CB-OG1 3.47Å; L124-L132 HydrophobicContact CD1-CD1 3.78Å; L124-L132 HydrophobicContact CD2-CD1 4.04Å
125	F	87	Confident	86.7	Confident	109 Å²	109	47.4 Å²	47.4	48%	0.478	26%	0.262	S	S	.	.			trans	-81.3	150.9	167.6	-64.4	-74.6	0	0	0	110.4	G127 D128 T129	F125-G127 PolarHBondContact O-N 3.44Å; F125-G127 VanDerWaalsContact O-N 3.11Å; F125-D128 PolarHBondContact O-N 2.98Å; F125-T129 PolarHBondContact O-N 3.17Å; F125-T129 PolarHBondContact O-OG1 3.09Å; F125-T129 VanDerWaalsContact O-OG1 3.06Å
126	H	85.4	Confident	86.5	Confident	116 Å²	116	47.6 Å²	47.6	54%	0.537	26%	0.262	S	S	.	.	H	α-helix	trans	-51.1	-39.4	-178.9	-175.9	64.9	0	0	0	113.9	T129 N130	H126-T129 PolarHBondContact O-N 3.33Å; H126-N130 PolarHBondContact CE1-ND2 3.19Å; H126-N130 PolarHBondContact NE2-ND2 3.07Å; H126-N130 VanDerWaalsContact O-CG 3.31Å; H126-N130 PolarHBondContact O-N 3.47Å; H126-N130 PolarHBondContact O-ND2 3.39Å
127	G	87.6	Confident	86.2	Confident	51 Å²	51	47.9 Å²	47.9	53%	0.526	26%	0.259	S	S	.	.	H	α-helix	trans	-63.4	-46.1	177.2	0	0	0	0	0	112.9	F125 N130 M131	F125-G127 PolarHBondContact O-N 3.44Å; F125-G127 VanDerWaalsContact O-N 3.11Å; G127-N130 PolarHBondContact O-N 3.18Å; G127-M131 PolarHBondContact O-N 3.49Å
128	D	89.2	Confident	85.7	Confident	46 Å²	46	51.5 Å²	51.5	25%	0.246	27%	0.273	C	S	.	.	H	α-helix	trans	-65.5	-41.5	178	-59.7	-42	0	0	0	111.2	P88 L124 F125 M131 L132	P88-D128 HydrophobicContact CB-CB 4.07Å; P88-D128 HydrophobicContact CG-CB 3.94Å; P88-D128 WeakPolarHBondContact CG-OD2 3.25Å; L124-D128 HydrophobicContact CD2-CB 4.47Å; F125-D128 PolarHBondContact O-N 2.98Å; D128-M131 PolarHBondContact O-N 2.88Å; D128-L132 WeakPolarHBondContact O-CB 3.16Å; D128-L132 WeakPolarHBondContact O-CD1 3.44Å; D128-L132 VanDerWaalsContact O-CG 3.23Å; D128-L132 WeakPolarHBondContact O-CG 3.2Å; D128-L132 PolarHBondContact O-N 2.94Å
129	T	88.3	Confident	84.5	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-60.4	-47.5	177.2	-53	0	0	0	0	111.7	F115 L116 H119 L124 F125 H126 M131 L132 I133	F115-T129 HydrophobicContact CB-CG2 4.49Å; L116-T129 HydrophobicContact CD2-CG2 4.08Å; H119-T129 HydrophobicContact CB-CG2 3.93Å; H119-T129 WeakPolarHBondContact CB-OG1 3.15Å; L124-T129 WeakPolarHBondContact CB-OG1 3.47Å; F125-T129 PolarHBondContact O-N 3.17Å; F125-T129 PolarHBondContact O-OG1 3.09Å; F125-T129 VanDerWaalsContact O-OG1 3.06Å; H126-T129 PolarHBondContact O-N 3.33Å; T129-M131 VanDerWaalsContact C-N 3.34Å; T129-M131 PolarHBondContact O-N 3.5Å; T129-L132 PolarHBondContact O-N 3.24Å; T129-I133 HydrophobicContact CG2-CD1 3.81Å; T129-I133 HydrophobicContact CG2-CG1 4.49Å; T129-I133 WeakPolarHBondContact O-CB 3.41Å; T129-I133 VanDerWaalsContact O-CG1 3.25Å; T129-I133 WeakPolarHBondContact O-CG1 3.45Å; T129-I133 PolarHBondContact O-N 3.41Å
130	N	87.6	Confident	82.9	Confident	79 Å²	79	57.6 Å²	57.6	42%	0.422	30%	0.299	S	S	.	.	H	α-helix	trans	-63	-41.4	177.5	-70.5	-17.5	0	0	0	111.5	H126 G127 A134	H126-N130 PolarHBondContact CE1-ND2 3.19Å; H126-N130 PolarHBondContact NE2-ND2 3.07Å; H126-N130 VanDerWaalsContact O-CG 3.31Å; H126-N130 PolarHBondContact O-N 3.47Å; H126-N130 PolarHBondContact O-ND2 3.39Å; G127-N130 PolarHBondContact O-N 3.18Å; N130-A134 VanDerWaalsContact O-CB 3.27Å; N130-A134 WeakPolarHBondContact O-CB 3.47Å; N130-A134 PolarHBondContact O-N 3.44Å
131	M	90.4	Very high	81	Confident	79 Å²	79	56.6 Å²	56.6	39%	0.389	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-45.4	175.7	179.9	-166	65.1	0	0	111.8	L92 G127 D128 T129 A134 K135	L92-M131 HydrophobicContact CD1-CE 4.41Å; G127-M131 PolarHBondContact O-N 3.49Å; D128-M131 PolarHBondContact O-N 2.88Å; T129-M131 VanDerWaalsContact C-N 3.34Å; T129-M131 PolarHBondContact O-N 3.5Å; M131-A134 PolarHBondContact O-N 3.15Å; M131-K135 WeakPolarHBondContact O-CG 3.34Å; M131-K135 PolarHBondContact O-N 3.17Å
132	L	89.8	Confident	79.2	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.9	-45.6	179.4	-75	164.9	0	0	0	111.6	C91 L92 F115 L124 D128 T129 A134 K135 V136	C91-L132 HydrophobicContact CB-CD1 3.52Å; C91-L132 HydrophobicContact CB-CD2 3.71Å; C91-L132 HydrophobicContact CB-CG 4.28Å; L92-L132 HydrophobicContact CD2-CD2 3.7Å; L92-L132 HydrophobicContact CG-CD2 3.8Å; F115-L132 HydrophobicContact CD1-CD1 4.41Å; F115-L132 HydrophobicContact CD2-CB 3.62Å; F115-L132 HydrophobicContact CE2-CB 3.84Å; F115-L132 HydrophobicContact CE2-CD2 4.34Å; F115-L132 HydrophobicContact CG-CB 4.14Å; F115-L132 HydrophobicContact CG-CD1 4.38Å; F115-L132 HydrophobicContact CZ-CD2 4.35Å; L124-L132 HydrophobicContact CD1-CD1 3.78Å; L124-L132 HydrophobicContact CD2-CD1 4.04Å; D128-L132 WeakPolarHBondContact O-CB 3.16Å; D128-L132 WeakPolarHBondContact O-CD1 3.44Å; D128-L132 VanDerWaalsContact O-CG 3.23Å; D128-L132 WeakPolarHBondContact O-CG 3.2Å; D128-L132 PolarHBondContact O-N 2.94Å; T129-L132 PolarHBondContact O-N 3.24Å; L132-A134 VanDerWaalsContact C-N 3.35Å; L132-K135 WeakPolarHBondContact O-CB 3.32Å; L132-K135 PolarHBondContact O-N 3.31Å; L132-K135 VanDerWaalsContact O-N 3.17Å; L132-V136 WeakPolarHBondContact O-CG2 3.46Å; L132-V136 PolarHBondContact O-N 2.99Å
133	I	87.4	Confident	77.4	Confident	30 Å²	30	62.4 Å²	62.4	15%	0.154	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-43.1	176.1	-67.5	169.7	0	0	0	110.6	A112 F115 L116 T129 K135 V136 Y137	A112-I133 HydrophobicContact CB-CG1 4.3Å; A112-I133 HydrophobicContact CB-CG2 4.35Å; F115-I133 HydrophobicContact CB-CG1 4.41Å; L116-I133 HydrophobicContact CD1-CD1 4.46Å; L116-I133 HydrophobicContact CD2-CD1 3.63Å; L116-I133 HydrophobicContact CG-CD1 3.78Å; T129-I133 HydrophobicContact CG2-CD1 3.81Å; T129-I133 HydrophobicContact CG2-CG1 4.49Å; T129-I133 WeakPolarHBondContact O-CB 3.41Å; T129-I133 VanDerWaalsContact O-CG1 3.25Å; T129-I133 WeakPolarHBondContact O-CG1 3.45Å; T129-I133 PolarHBondContact O-N 3.41Å; I133-K135 VanDerWaalsContact C-N 3.26Å; I133-K135 PolarHBondContact O-N 2.74Å; I133-V136 WeakPolarHBondContact O-CB 3.32Å; I133-V136 PolarHBondContact O-N 3.47Å; I133-Y137 HydrophobicContact CG2-CD2 3.86Å; I133-Y137 HydrophobicContact CG2-CE2 3.61Å; I133-Y137 VanDerWaalsContact O-CD2 3.23Å; I133-Y137 WeakPolarHBondContact O-CD2 3.3Å; I133-Y137 PolarHBondContact O-N 3.31Å
134	A	87	Confident	75.7	Confident	44 Å²	44	66 Å²	66	36%	0.364	34%	0.343	S	S	.	.	H	α-helix	trans	-60.2	-37.8	175.2	0	0	0	0	0	111.6	N130 M131 L132 Y137 N138	N130-A134 VanDerWaalsContact O-CB 3.27Å; N130-A134 WeakPolarHBondContact O-CB 3.47Å; N130-A134 PolarHBondContact O-N 3.44Å; M131-A134 PolarHBondContact O-N 3.15Å; L132-A134 VanDerWaalsContact C-N 3.35Å; A134-Y137 PolarHBondContact O-N 2.96Å; A134-N138 WeakPolarHBondContact O-CB 3.46Å; A134-N138 PolarHBondContact O-N 3.1Å; A134-N138 PolarHBondContact O-ND2 2.99Å
135	K	86.3	Confident	74.2	Confident	81 Å²	81	71.7 Å²	71.7	35%	0.352	37%	0.371	S	S	.	.	H	α-helix	trans	-63.9	-46.9	173.9	-78.5	177.5	168.7	-71.5	0	112.1	L92 L95 M131 L132 I133 Y137 N138 H139	L92-K135 HydrophobicContact CD2-CD 3.39Å; L95-K135 HydrophobicContact CD2-CB 3.72Å; M131-K135 WeakPolarHBondContact O-CG 3.34Å; M131-K135 PolarHBondContact O-N 3.17Å; L132-K135 WeakPolarHBondContact O-CB 3.32Å; L132-K135 PolarHBondContact O-N 3.31Å; L132-K135 VanDerWaalsContact O-N 3.17Å; I133-K135 VanDerWaalsContact C-N 3.26Å; I133-K135 PolarHBondContact O-N 2.74Å; K135-Y137 PolarHBondContact O-N 2.88Å; K135-N138 PolarHBondContact O-N 3.14Å; K135-H139 PolarHBondContact O-CD2 3.45Å; K135-H139 VanDerWaalsContact O-CD2 3.24Å; K135-H139 PolarHBondContact O-N 3.36Å
136	V	85.1	Confident	72.6	Confident	3 Å²	3	71.7 Å²	71.7	2%	0.018	37%	0.372	C	S	.	.	H	α-helix	trans	-49.7	-44.8	176.6	172.9	0	0	0	0	111.5	L95 H108 V111 A112 F115 L132 I133	L95-V136 HydrophobicContact CD1-CG2 3.63Å; L95-V136 HydrophobicContact CD2-CG2 4.17Å; H108-V136 HydrophobicContact CB-CG1 3.77Å; H108-V136 WeakPolarHBondContact O-CG1 3.23Å; V111-V136 HydrophobicContact CG1-CG2 3.83Å; A112-V136 HydrophobicContact CB-CG1 4.48Å; F115-V136 HydrophobicContact CD2-CG2 4.11Å; F115-V136 HydrophobicContact CE2-CG2 3.63Å; L132-V136 WeakPolarHBondContact O-CG2 3.46Å; L132-V136 PolarHBondContact O-N 2.99Å; I133-V136 WeakPolarHBondContact O-CB 3.32Å; I133-V136 PolarHBondContact O-N 3.47Å
137	Y	80.4	Confident	71.4	Confident	85 Å²	85	70.8 Å²	70.8	33%	0.333	37%	0.371	S	S	.	.	H	α-helix	trans	-85.1	-33	-179.7	-63.2	-65.4	0	0	0	113.8	D109 A112 I133 A134 K135 H139 R140 F141	D109-Y137 PolarHBondContact OD1-OH 3.11Å; D109-Y137 VanDerWaalsContact OD1-OH 3.11Å; A112-Y137 HydrophobicContact CB-CE2 4.2Å; I133-Y137 HydrophobicContact CG2-CD2 3.86Å; I133-Y137 HydrophobicContact CG2-CE2 3.61Å; I133-Y137 VanDerWaalsContact O-CD2 3.23Å; I133-Y137 WeakPolarHBondContact O-CD2 3.3Å; I133-Y137 PolarHBondContact O-N 3.31Å; A134-Y137 PolarHBondContact O-N 2.96Å; K135-Y137 PolarHBondContact O-N 2.88Å; Y137-H139 PolarHBondContact O-N 3.17Å; Y137-R140 WeakPolarHBondContact O-CB 3.43Å; Y137-R140 PolarHBondContact O-N 3.34Å; Y137-F141 VanDerWaalsContact O-CD2 3.31Å; Y137-F141 WeakPolarHBondContact O-CD2 3.34Å; Y137-F141 PolarHBondContact O-N 2.92Å
138	N	76.2	Confident	69.9	Low	109 Å²	109	72.7 Å²	72.7	58%	0.583	37%	0.368	S	S	*	.	H	α-helix	trans	-65.1	-28.9	176.3	-79.4	-22.4	0	0	0	112.5	A134 K135 R140 F141	A134-N138 WeakPolarHBondContact O-CB 3.46Å; A134-N138 PolarHBondContact O-N 3.1Å; A134-N138 PolarHBondContact O-ND2 2.99Å; K135-N138 PolarHBondContact O-N 3.14Å; N138-R140 PolarHBondContact O-N 3.28Å; N138-F141 CarbonylContact O-C 3.57Å; N138-F141 PolarHBondContact O-N 3.46Å; N138-F141 VanDerWaalsContact O-N 3.15Å
139	H	62	Low	68.4	Low	100 Å²	100	74.5 Å²	74.5	46%	0.463	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.3	170.7	-87	-88.1	0	0	0	113.1	E99 K135 Y137	E99-H139 VanDerWaalsContact CD-ND1 3.31Å; E99-H139 IonicContact OE1-CD2 3.07Å; E99-H139 PolarHBondContact OE1-CD2 3.05Å; E99-H139 IonicContact OE1-CE1 3.01Å; E99-H139 PolarHBondContact OE1-CE1 3.29Å; E99-H139 IonicContact OE1-CG 3.12Å; E99-H139 IonicContact OE1-ND1 3.3Å; E99-H139 PolarHBondContact OE1-ND1 3.46Å; E99-H139 IonicContact OE1-NE2 3.39Å; E99-H139 PolarHBondContact OE1-NE2 2.86Å; E99-H139 VanDerWaalsContact OE1-NE2 3.07Å; E99-H139 IonicContact OE2-CE1 3.79Å; E99-H139 PolarHBondContact OE2-CE1 3.49Å; E99-H139 IonicContact OE2-ND1 3.16Å; E99-H139 PolarHBondContact OE2-ND1 2.92Å; E99-H139 IonicContact OE2-NE2 3.73Å; K135-H139 PolarHBondContact O-CD2 3.45Å; K135-H139 VanDerWaalsContact O-CD2 3.24Å; K135-H139 PolarHBondContact O-N 3.36Å; Y137-H139 PolarHBondContact O-N 3.17Å
140	R	53.8	Low	67.3	Low	67 Å²	67	80.9 Å²	80.9	25%	0.253	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-23.5	172.5	-69.6	-163.2	150.6	-139.4	-14.4	114.9	E103 E105 H108 Y137 N138	E103-R140 PolarHBondContact O-NH2 3.16Å; E105-R140 IonicContact OE1-NH1 2.94Å; E105-R140 IonicContact OE2-NH1 3.46Å; E105-R140 PolarHBondContact OE2-NH1 3.39Å; H108-R140 VanDerWaalsContact CE1-CG 3.48Å; H108-R140 WeakPolarHBondContact CE1-CG 3.47Å; H108-R140 PolarHBondContact CE1-NE 3.01Å; H108-R140 VanDerWaalsContact CE1-NE 3.26Å; H108-R140 WeakPolarHBondContact ND1-CD 3.48Å; H108-R140 VanDerWaalsContact ND1-CG 3.26Å; H108-R140 WeakPolarHBondContact ND1-CG 3.47Å; H108-R140 PolarHBondContact ND1-NE 3.24Å; Y137-R140 WeakPolarHBondContact O-CB 3.43Å; Y137-R140 PolarHBondContact O-N 3.34Å; N138-R140 PolarHBondContact O-N 3.28Å
141	F	44.2	Very low	66.4	Low	143 Å²	143	81.2 Å²	81.2	63%	0.627	41%	0.406	S	S	*	.			trans	-110.5	50.6	-173.8	-70.6	-77.8	0	0	0	111.2	Y137 N138 P143	Y137-F141 VanDerWaalsContact O-CD2 3.31Å; Y137-F141 WeakPolarHBondContact O-CD2 3.34Å; Y137-F141 PolarHBondContact O-N 2.92Å; N138-F141 CarbonylContact O-C 3.57Å; N138-F141 PolarHBondContact O-N 3.46Å; N138-F141 VanDerWaalsContact O-N 3.15Å; F141-P143 VanDerWaalsContact C-CD 3.44Å; F141-P143 WeakPolarHBondContact O-CD 3.46Å
142	N	43.2	Very low	65.2	Low	81 Å²	81	80.3 Å²	80.3	43%	0.433	41%	0.408	S	S	.	.			trans	-86.6	93.5	151.1	-161.4	-6.9	0	0	0	107.5	V144 M145	N142-V144 PolarHBondContact O-N 3.28Å; N142-V144 VanDerWaalsContact OD1-CB 3.24Å; N142-V144 WeakPolarHBondContact OD1-CB 3.03Å; N142-V144 VanDerWaalsContact OD1-CG2 3.29Å; N142-V144 WeakPolarHBondContact OD1-CG2 2.77Å; N142-V144 PolarHBondContact OD1-N 3.15Å; N142-M145 HydrophobicContact CB-CB 4.46Å; N142-M145 HydrophobicContact CB-CG 4.38Å; N142-M145 PolarHBondContact O-N 3.09Å
143	P	44.7	Very low	64.2	Low	81 Å²	81	87 Å²	87	53%	0.526	44%	0.437	S	S	.	.	H	α-helix	trans	-54.1	-24.7	177.3	21.8	-32.8	0	0	0	111.7	F141 M145 Q146 I147	F141-P143 VanDerWaalsContact C-CD 3.44Å; F141-P143 WeakPolarHBondContact O-CD 3.46Å; P143-M145 PolarHBondContact O-N 2.8Å; P143-Q146 PolarHBondContact O-N 3.36Å; P143-I147 WeakPolarHBondContact O-CB 3.25Å; P143-I147 WeakPolarHBondContact O-CD1 3.46Å; P143-I147 WeakPolarHBondContact O-CG1 3.32Å; P143-I147 PolarHBondContact O-N 3.4Å
144	V	49.5	Very low	63.4	Low	78 Å²	78	91.5 Å²	91.5	47%	0.473	46%	0.461	S	S	.	.	H	α-helix	trans	-60.7	-39.9	173.9	-174.2	0	0	0	0	112	N142 I147 L148	N142-V144 PolarHBondContact O-N 3.28Å; N142-V144 VanDerWaalsContact OD1-CB 3.24Å; N142-V144 WeakPolarHBondContact OD1-CB 3.03Å; N142-V144 VanDerWaalsContact OD1-CG2 3.29Å; N142-V144 WeakPolarHBondContact OD1-CG2 2.77Å; N142-V144 PolarHBondContact OD1-N 3.15Å; V144-I147 PolarHBondContact O-N 3.45Å; V144-L148 HydrophobicContact CG1-CD1 3.85Å; V144-L148 HydrophobicContact CG1-CG 4.26Å; V144-L148 WeakPolarHBondContact O-CB 3.31Å; V144-L148 WeakPolarHBondContact O-CG 3.48Å; V144-L148 PolarHBondContact O-N 3.16Å
145	M	53.5	Low	62.1	Low	123 Å²	123	94.3 Å²	94.3	61%	0.606	47%	0.47	S	S	*	.	H	α-helix	trans	-73.7	-34.9	179.9	-77.9	-65.8	-76.4	0	0	112.8	N142 P143 I147 L148 D149	N142-M145 HydrophobicContact CB-CB 4.46Å; N142-M145 HydrophobicContact CB-CG 4.38Å; N142-M145 PolarHBondContact O-N 3.09Å; P143-M145 PolarHBondContact O-N 2.8Å; M145-I147 VanDerWaalsContact C-N 3.33Å; M145-L148 PolarHBondContact O-N 3.06Å; M145-L148 HydrophobicContact SD-CD1 4.27Å; M145-D149 WeakPolarHBondContact O-CB 3.42Å; M145-D149 PolarHBondContact O-N 3.41Å
146	Q	52.4	Low	60.8	Low	108 Å²	108	97.1 Å²	97.1	51%	0.505	49%	0.489	S	S	.	.	H	α-helix	trans	-69.1	-34.2	172.5	-68.3	-173.5	31	0	0	111.9	P143 K150	P143-Q146 PolarHBondContact O-N 3.36Å; Q146-K150 WeakPolarHBondContact O-CB 3.31Å; Q146-K150 VanDerWaalsContact O-CG 3.31Å; Q146-K150 WeakPolarHBondContact O-CG 3.49Å; Q146-K150 PolarHBondContact O-N 2.92Å
147	I	60.2	Low	59.1	Low	98 Å²	98	100.1 Å²	100.1	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-68	-44.6	173	-69.3	165.6	0	0	0	109.9	P143 V144 M145 K150 I151	P143-I147 WeakPolarHBondContact O-CB 3.25Å; P143-I147 WeakPolarHBondContact O-CD1 3.46Å; P143-I147 WeakPolarHBondContact O-CG1 3.32Å; P143-I147 PolarHBondContact O-N 3.4Å; V144-I147 PolarHBondContact O-N 3.45Å; M145-I147 VanDerWaalsContact C-N 3.33Å; I147-K150 PolarHBondContact O-N 3.05Å; I147-I151 HydrophobicContact CG2-CD1 3.52Å; I147-I151 HydrophobicContact CG2-CG1 4.3Å; I147-I151 WeakPolarHBondContact O-CB 3.43Å; I147-I151 WeakPolarHBondContact O-CD1 3.34Å; I147-I151 WeakPolarHBondContact O-CG1 3.39Å; I147-I151 PolarHBondContact O-N 2.93Å
148	L	55.7	Low	57.4	Low	91 Å²	91	104.2 Å²	104.2	48%	0.476	54%	0.542	S	S	.	.	H	α-helix	trans	-66.6	-39.6	177.6	-72.3	171.2	0	0	0	112.6	V144 M145 I151 S152	V144-L148 HydrophobicContact CG1-CD1 3.85Å; V144-L148 HydrophobicContact CG1-CG 4.26Å; V144-L148 WeakPolarHBondContact O-CB 3.31Å; V144-L148 WeakPolarHBondContact O-CG 3.48Å; V144-L148 PolarHBondContact O-N 3.16Å; M145-L148 PolarHBondContact O-N 3.06Å; M145-L148 HydrophobicContact SD-CD1 4.27Å; L148-I151 PolarHBondContact O-N 3.24Å; L148-S152 WeakPolarHBondContact O-CB 3.39Å; L148-S152 PolarHBondContact O-N 3.27Å
149	D	58.1	Low	55.9	Low	83 Å²	83	112.5 Å²	112.5	44%	0.444	57%	0.574	S	S	.	*	H	α-helix	trans	-68.6	-35.8	176.4	-171.1	54.7	0	0	0	111.6	M145 K153	M145-D149 WeakPolarHBondContact O-CB 3.42Å; M145-D149 PolarHBondContact O-N 3.41Å; D149-K153 WeakPolarHBondContact O-CB 3.17Å; D149-K153 WeakPolarHBondContact O-CD 3.31Å; D149-K153 VanDerWaalsContact O-CG 3.26Å; D149-K153 WeakPolarHBondContact O-CG 3.23Å; D149-K153 PolarHBondContact O-N 3.39Å; D149-K153 WeakPolarHBondContact OD1-CE 3.45Å; D149-K153 IonicContact OD1-NZ 2.69Å; D149-K153 PolarHBondContact OD1-NZ 3.49Å; D149-K153 WeakPolarHBondContact OD2-CE 3.39Å; D149-K153 IonicContact OD2-NZ 3.37Å; D149-K153 PolarHBondContact OD2-NZ 3.33Å
150	K	64.9	Low	55.6	Low	136 Å²	136	113.2 Å²	113.2	59%	0.591	58%	0.579	S	S	*	*	H	α-helix	trans	-66.5	-46.1	169.4	-79.1	-179.8	176.4	-178	0	112.1	Q146 I147 S152 K153 D154	Q146-K150 WeakPolarHBondContact O-CB 3.31Å; Q146-K150 VanDerWaalsContact O-CG 3.31Å; Q146-K150 WeakPolarHBondContact O-CG 3.49Å; Q146-K150 PolarHBondContact O-N 2.92Å; I147-K150 PolarHBondContact O-N 3.05Å; K150-S152 VanDerWaalsContact C-N 3.3Å; K150-S152 PolarHBondContact O-N 3.37Å; K150-K153 PolarHBondContact O-N 3.16Å; K150-D154 WeakPolarHBondContact O-CB 3.39Å; K150-D154 PolarHBondContact O-N 2.85Å
151	I	70.4	Confident	55.7	Low	85 Å²	85	115.6 Å²	115.6	44%	0.436	60%	0.596	S	S	.	*	H	α-helix	trans	-63.4	-36	177.9	-69.6	167.2	0	0	0	111.4	I147 L148 N155	I147-I151 HydrophobicContact CG2-CD1 3.52Å; I147-I151 HydrophobicContact CG2-CG1 4.3Å; I147-I151 WeakPolarHBondContact O-CB 3.43Å; I147-I151 WeakPolarHBondContact O-CD1 3.34Å; I147-I151 WeakPolarHBondContact O-CG1 3.39Å; I147-I151 PolarHBondContact O-N 2.93Å; L148-I151 PolarHBondContact O-N 3.24Å; I151-N155 WeakPolarHBondContact CG2-ND2 3.36Å; I151-N155 WeakPolarHBondContact O-CB 3.31Å; I151-N155 PolarHBondContact O-N 3.11Å; I151-N155 PolarHBondContact O-ND2 3.06Å
152	S	63.5	Low	56.3	Low	61 Å²	61	114.1 Å²	114.1	43%	0.427	60%	0.595	S	S	.	*	H	α-helix	trans	-68	-46.6	175.7	-163.9	0	0	0	0	111	L148 K150 D154 N155 D156	L148-S152 WeakPolarHBondContact O-CB 3.39Å; L148-S152 PolarHBondContact O-N 3.27Å; K150-S152 VanDerWaalsContact C-N 3.3Å; K150-S152 PolarHBondContact O-N 3.37Å; S152-D154 VanDerWaalsContact C-N 3.31Å; S152-D154 PolarHBondContact O-N 3.36Å; S152-N155 PolarHBondContact O-N 2.8Å; S152-D156 PolarHBondContact O-N 3.23Å
153	K	68.6	Low	57.1	Low	139 Å²	139	116 Å²	116	60%	0.604	60%	0.604	S	S	*	*	H	α-helix	trans	-66.7	-30	179.1	-73.4	170	-179.3	165.6	0	113.6	D149 K150	D149-K153 WeakPolarHBondContact O-CB 3.17Å; D149-K153 WeakPolarHBondContact O-CD 3.31Å; D149-K153 VanDerWaalsContact O-CG 3.26Å; D149-K153 WeakPolarHBondContact O-CG 3.23Å; D149-K153 PolarHBondContact O-N 3.39Å; D149-K153 WeakPolarHBondContact OD1-CE 3.45Å; D149-K153 IonicContact OD1-NZ 2.69Å; D149-K153 PolarHBondContact OD1-NZ 3.49Å; D149-K153 WeakPolarHBondContact OD2-CE 3.39Å; D149-K153 IonicContact OD2-NZ 3.37Å; D149-K153 PolarHBondContact OD2-NZ 3.33Å; K150-K153 PolarHBondContact O-N 3.16Å
154	D	71	Confident	57.9	Low	126 Å²	126	118.2 Å²	118.2	67%	0.674	61%	0.609	S	S	*	*	H	α-helix	trans	-80.3	-22	177.4	-68.5	-22.8	0	0	0	112.7	K150 S152	K150-D154 WeakPolarHBondContact O-CB 3.39Å; K150-D154 PolarHBondContact O-N 2.85Å; S152-D154 VanDerWaalsContact C-N 3.31Å; S152-D154 PolarHBondContact O-N 3.36Å
155	N	60.4	Low	58.4	Low	103 Å²	103	120.9 Å²	120.9	55%	0.551	62%	0.618	S	S	*	*	H	α-helix	trans	-95.5	-20.3	-178.5	-78.1	-44.3	0	0	0	114.9	I151 S152 G157	I151-N155 WeakPolarHBondContact CG2-ND2 3.36Å; I151-N155 WeakPolarHBondContact O-CB 3.31Å; I151-N155 PolarHBondContact O-N 3.11Å; I151-N155 PolarHBondContact O-ND2 3.06Å; S152-N155 PolarHBondContact O-N 2.8Å; N155-G157 PolarHBondContact O-N 2.66Å
156	D	58.3	Low	58.8	Low	140 Å²	140	120.7 Å²	120.7	75%	0.749	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	7.8	178.8	-72.5	-41.4	0	0	0	113.9	S152	S152-D156 PolarHBondContact O-N 3.23Å
157	G	50.7	Low	59.3	Low	65 Å²	65	121.7 Å²	121.7	67%	0.67	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	5.7	179.8	0	0	0	0	0	116.1	N155	N155-G157 PolarHBondContact O-N 2.66Å
158	H	43.2	Very low	59.2	Low	172 Å²	172	123.7 Å²	123.7	80%	0.796	64%	0.638	S	S	*	*			trans	-140.4	77.1	-175.2	-115.8	-59.1	0	0	0	112.1
159	F	45.4	Very low	59.5	Low	283 Å²	283	126.6 Å²	126.6	100%	1.241	65%	0.653	S	S	*	*			trans	-132.6	0	154.4	-88.1	-78.9	0	0	0	109.4

Retrieved 159 of 159 residues in 259.3 ms (Link to these results)

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