A0A077Z671_TRITR Loading...

Ski protein like

AlphaFold DB , UniProt , Accession A0A077Z671, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 618 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	31.4	Very low	38.5	Very low	213 Å²	213	135.6 Å²	135.6	100%	1.049	68%	0.68	S	S	*	*				0	-45.2	0	-78.5	175.4	71.3	0	0	112.9	K3 N4	M1-K3 VanDerWaalsContact C-N 3.34Å; M1-K3 PolarHBondContact O-N 3.34Å; M1-N4 PolarHBondContact O-N 3.15Å; M1-N4 VanDerWaalsContact O-N 3.08Å
2	I	34	Very low	38.7	Very low	145 Å²	145	133.2 Å²	133.2	74%	0.744	67%	0.67	S	S	*	*	H	α-helix	trans	-62	-31.1	179.4	-60.7	170.2	0	0	0	114.2	N4 T6	I2-N4 VanDerWaalsContact C-N 3.26Å; I2-N4 PolarHBondContact O-N 3.44Å; I2-T6 PolarHBondContact O-N 3.47Å; I2-T6 PolarHBondContact O-OG1 3.36Å
3	K	35.3	Very low	38.8	Very low	195 Å²	195	130.4 Å²	130.4	85%	0.848	66%	0.657	S	S	*	*	H	α-helix	trans	-66.5	-20.6	174	-78.2	-174.2	176.3	-179.1	0	114.4	M1 T6	M1-K3 VanDerWaalsContact C-N 3.34Å; M1-K3 PolarHBondContact O-N 3.34Å; K3-T6 PolarHBondContact O-OG1 2.91Å
4	N	41.8	Very low	39.2	Very low	138 Å²	138	132.2 Å²	132.2	74%	0.738	66%	0.659	S	S	*	*	H	α-helix	trans	-91.1	-28.3	-176.1	-129.6	6.4	0	0	0	112.5	M1 I2	M1-N4 PolarHBondContact O-N 3.15Å; M1-N4 VanDerWaalsContact O-N 3.08Å; I2-N4 VanDerWaalsContact C-N 3.26Å; I2-N4 PolarHBondContact O-N 3.44Å
5	E	39.4	Very low	39.7	Very low	148 Å²	148	137.8 Å²	137.8	69%	0.692	67%	0.669	S	S	*	*	H	α-helix	trans	-79.7	-33.3	175.7	-73.6	-166.7	150	0	0	113.1	G7 R8 L9	E5-G7 VanDerWaalsContact C-N 3.31Å; E5-G7 PolarHBondContact O-N 3.42Å; E5-R8 PolarHBondContact O-N 3.13Å; E5-L9 PolarHBondContact O-N 2.65Å; E5-L9 VanDerWaalsContact O-N 3.11Å
6	T	38.4	Very low	39.5	Very low	82 Å²	82	140.1 Å²	140.1	50%	0.503	68%	0.675	S	S	.	*	H	α-helix	trans	-61.3	-37.7	174.2	29.7	0	0	0	0	112.2	I2 K3 L9 V10	I2-T6 PolarHBondContact O-N 3.47Å; I2-T6 PolarHBondContact O-OG1 3.36Å; K3-T6 PolarHBondContact O-OG1 2.91Å; T6-L9 PolarHBondContact O-N 2.81Å; T6-V10 WeakPolarHBondContact O-CG2 3.27Å; T6-V10 PolarHBondContact O-N 3.34Å; T6-V10 VanDerWaalsContact O-N 3.14Å
7	G	35.6	Very low	39.9	Very low	41 Å²	41	141.5 Å²	141.5	42%	0.423	68%	0.68	S	S	.	*	H	α-helix	trans	-63.6	-39.3	174.5	0	0	0	0	0	113.9	E5 Q11	E5-G7 VanDerWaalsContact C-N 3.31Å; E5-G7 PolarHBondContact O-N 3.42Å; G7-Q11 PolarHBondContact O-N 3.48Å; G7-Q11 VanDerWaalsContact O-N 3.15Å
8	R	39.5	Very low	39.7	Very low	191 Å²	191	137 Å²	137	72%	0.721	68%	0.678	S	S	*	*	H	α-helix	trans	-69	-37.5	177.1	-84.3	-176.1	167	176.5	-3.2	112.5	E5 Q11 L12	E5-R8 PolarHBondContact O-N 3.13Å; R8-Q11 PolarHBondContact O-N 3.4Å; R8-L12 PolarHBondContact O-N 3.47Å
9	L	41.1	Very low	39.2	Very low	115 Å²	115	133.5 Å²	133.5	60%	0.602	68%	0.68	S	S	*	*	H	α-helix	trans	-67.5	-40	177.7	-123.6	126.1	0	0	0	111.9	E5 T6 Q11 L12 L13	E5-L9 PolarHBondContact O-N 2.65Å; E5-L9 VanDerWaalsContact O-N 3.11Å; T6-L9 PolarHBondContact O-N 2.81Å; L9-Q11 PolarHBondContact O-N 2.89Å; L9-L12 PolarHBondContact O-N 3.22Å; L9-L13 HydrophobicContact CD2-CD1 4.28Å; L9-L13 PolarHBondContact O-N 2.88Å
10	V	42.5	Very low	38.8	Very low	83 Å²	83	136.6 Å²	136.6	50%	0.503	69%	0.692	S	S	.	*	H	α-helix	trans	-65.7	-36.7	174.5	173.7	0	0	0	0	111.9	T6 L13 K14	T6-V10 WeakPolarHBondContact O-CG2 3.27Å; T6-V10 PolarHBondContact O-N 3.34Å; T6-V10 VanDerWaalsContact O-N 3.14Å; V10-L13 PolarHBondContact O-N 3.23Å; V10-K14 PolarHBondContact O-N 2.86Å
11	Q	43.9	Very low	38.2	Very low	141 Å²	141	135 Å²	135	66%	0.659	70%	0.699	S	S	*	*	H	α-helix	trans	-67.1	-37	173.3	-101	-178.7	-10.6	0	0	113	G7 R8 L9 R15	G7-Q11 PolarHBondContact O-N 3.48Å; G7-Q11 VanDerWaalsContact O-N 3.15Å; R8-Q11 PolarHBondContact O-N 3.4Å; L9-Q11 PolarHBondContact O-N 2.89Å; Q11-R15 PolarHBondContact O-N 3.43Å
12	L	41.4	Very low	38.1	Very low	106 Å²	106	129.8 Å²	129.8	56%	0.555	69%	0.691	S	S	*	*	H	α-helix	trans	-67.2	-40.4	174.6	-104.3	151	0	0	0	111.9	R8 L9 R15 F16	R8-L12 PolarHBondContact O-N 3.47Å; L9-L12 PolarHBondContact O-N 3.22Å; L12-R15 PolarHBondContact O-N 3.23Å; L12-F16 PolarHBondContact O-N 2.85Å
13	L	40.1	Very low	37.7	Very low	97 Å²	97	127.5 Å²	127.5	51%	0.508	69%	0.687	S	S	.	*	H	α-helix	trans	-68	-38.2	176.6	-79.4	160	0	0	0	112.7	L9 V10 R15 F16 Q17	L9-L13 HydrophobicContact CD2-CD1 4.28Å; L9-L13 PolarHBondContact O-N 2.88Å; V10-L13 PolarHBondContact O-N 3.23Å; L13-R15 PolarHBondContact O-N 3.28Å; L13-F16 PolarHBondContact O-N 2.71Å; L13-F16 VanDerWaalsContact O-N 3.13Å; L13-Q17 PolarHBondContact O-N 3.39Å
14	K	44.5	Very low	37.5	Very low	156 Å²	156	126.8 Å²	126.8	68%	0.678	69%	0.692	S	S	*	*	H	α-helix	trans	-63.8	-26.7	173.2	-82.7	-175	176.1	-177.6	0	113.4	V10	V10-K14 PolarHBondContact O-N 2.86Å
15	R	46	Very low	36.8	Very low	216 Å²	216	127.2 Å²	127.2	82%	0.815	69%	0.694	S	S	*	*	H	α-helix	trans	-73	-31.8	172.7	-82.4	-174.6	-176.9	164.2	1.8	113	Q11 L12 L13	Q11-R15 PolarHBondContact O-N 3.43Å; L12-R15 PolarHBondContact O-N 3.23Å; L13-R15 PolarHBondContact O-N 3.28Å
16	F	37.8	Very low	36.6	Very low	174 Å²	174	125.6 Å²	125.6	76%	0.763	70%	0.696	S	S	*	*	H	α-helix	trans	-78.2	-27.8	179.4	-98	-84.8	0	0	0	113.6	L12 L13 G18	L12-F16 PolarHBondContact O-N 2.85Å; L13-F16 PolarHBondContact O-N 2.71Å; L13-F16 VanDerWaalsContact O-N 3.13Å; F16-G18 VanDerWaalsContact C-N 3.32Å; F16-G18 PolarHBondContact O-N 3.47Å
17	Q	45.2	Very low	36.3	Very low	164 Å²	164	128.3 Å²	128.3	77%	0.766	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-2.3	178.2	-74.5	-178.9	-22.5	0	0	114.6	L13	L13-Q17 PolarHBondContact O-N 3.39Å
18	G	36.8	Very low	35.9	Very low	61 Å²	61	132.7 Å²	132.7	63%	0.629	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	0.3	-177.1	0	0	0	0	0	116.5	F16 Q20	F16-G18 VanDerWaalsContact C-N 3.32Å; F16-G18 PolarHBondContact O-N 3.47Å; G18-Q20 PolarHBondContact O-N 3.23Å
19	G	29.4	Very low	35.6	Very low	71 Å²	71	128.8 Å²	128.8	73%	0.732	74%	0.74	S	S	*	*			trans	-87.3	99.7	-177	0	0	0	0	0	112.9
20	Q	31.7	Very low	35.1	Very low	194 Å²	194	128.1 Å²	128.1	91%	0.907	75%	0.751	S	S	*	*			trans	-65.7	148.6	176.1	-73.8	179.4	-8.9	0	0	113.5	G18	G18-Q20 PolarHBondContact O-N 3.23Å
21	A	25.6	Very low	34.7	Very low	103 Å²	103	128.4 Å²	128.4	85%	0.851	76%	0.762	S	S	*	*			trans	-64.4	148.7	175.6	0	0	0	0	0	114.2
22	A	29.9	Very low	34.2	Very low	105 Å²	105	127 Å²	127	87%	0.868	77%	0.767	S	S	*	*			trans	-144.5	123.5	153.7	0	0	0	0	0	109.6
23	S	25.4	Very low	34	Very low	96 Å²	96	127.4 Å²	127.4	67%	0.671	78%	0.78	S	S	*	*			trans	-72.8	158.9	177.8	116.4	0	0	0	0	111.3
24	L	30.9	Very low	33.8	Very low	180 Å²	180	126.6 Å²	126.6	94%	0.942	79%	0.787	S	S	*	*			trans	-162.7	126.3	147.7	-97.1	160.7	0	0	0	109.5
25	D	28.8	Very low	33.3	Very low	147 Å²	147	125.5 Å²	125.5	79%	0.786	79%	0.793	S	S	*	*			trans	-83.4	170.6	-167.3	-71	-52.3	0	0	0	116.4
26	P	35.3	Very low	32.9	Very low	114 Å²	114	120.6 Å²	120.6	74%	0.74	79%	0.787	S	S	*	*			trans	-108.1	152.3	-174.5	38.5	-28.4	0	0	0	115.4
27	V	31.3	Very low	32.8	Very low	140 Å²	140	118.9 Å²	118.9	85%	0.848	79%	0.786	S	S	*	*			trans	-149.2	127.1	163.4	-179.7	0	0	0	0	112.8
28	T	27.8	Very low	32.3	Very low	133 Å²	133	117.8 Å²	117.8	82%	0.816	79%	0.785	S	S	*	*			trans	-7.1	140.1	154.7	-1.1	0	0	0	0	122.5
29	A	32.9	Very low	32.3	Very low	108 Å²	108	119.8 Å²	119.8	89%	0.893	79%	0.79	S	S	*	*			trans	-156.6	135.8	143.9	0	0	0	0	0	112.2
30	A	29.6	Very low	32.6	Very low	102 Å²	102	124 Å²	124	84%	0.843	80%	0.795	S	S	*	*			trans	-107.3	172.2	-171.5	0	0	0	0	0	113.3
31	A	34.4	Very low	32.8	Very low	88 Å²	88	119.2 Å²	119.2	73%	0.727	78%	0.781	S	S	*	*			trans	136.6	106.5	146	0	0	0	0	0	112.3
32	S	34.4	Very low	33.3	Very low	111 Å²	111	121.8 Å²	121.8	78%	0.776	78%	0.781	S	S	*	*				86.3	122.9	97.2	-56.3	0	0	0	0	112.1
33	S	36.1	Very low	33.6	Very low	116 Å²	116	122.7 Å²	122.7	81%	0.811	78%	0.78	S	S	*	*				-179.1	130.3	74.1	-45.4	0	0	0	0	108.1
34	A	35.8	Very low	33.9	Very low	80 Å²	80	123.1 Å²	123.1	66%	0.661	78%	0.783	S	S	*	*				109.8	102.5	96	0	0	0	0	0	112.4
35	T	34.7	Very low	34.1	Very low	132 Å²	132	121.6 Å²	121.6	81%	0.81	78%	0.776	S	S	*	*				88.7	137.7	104.6	67.1	0	0	0	0	112.6
36	V	37.1	Very low	34.3	Very low	114 Å²	114	120.2 Å²	120.2	69%	0.691	77%	0.773	S	S	*	*			cis	-167.7	141.1	39.9	169.9	0	0	0	0	108.6
37	N	35.1	Very low	34.1	Very low	137 Å²	137	118.9 Å²	118.9	73%	0.733	77%	0.766	S	S	*	*			trans	38.5	154.8	146.1	-45.8	-6.8	0	0	0	121.7
38	D	35.5	Very low	34.2	Very low	141 Å²	141	121.2 Å²	121.2	75%	0.754	77%	0.767	S	S	*	*			cis	-162.9	170	27.6	-131.3	-35	0	0	0	111.9
39	S	36.1	Very low	34.3	Very low	103 Å²	103	119.2 Å²	119.2	72%	0.72	76%	0.764	S	S	*	*			trans	-84.6	148.1	-163.3	-35.7	0	0	0	0	114.8
40	N	35.2	Very low	34.4	Very low	159 Å²	159	122.4 Å²	122.4	85%	0.85	77%	0.765	S	S	*	*			trans	-169	127.7	137.8	-145.1	8.1	0	0	0	113.4
41	P	37.6	Very low	34.4	Very low	95 Å²	95	122.3 Å²	122.3	62%	0.617	76%	0.758	S	S	*	*			trans	-111.8	178.8	161.5	36.8	-23.9	0	0	0	113
42	D	34.4	Very low	34.4	Very low	157 Å²	157	125 Å²	125	84%	0.84	76%	0.76	S	S	*	*			trans	86.6	108.1	168.6	-58.7	-21.3	0	0	0	119.4
43	S	36.9	Very low	34.4	Very low	123 Å²	123	130.4 Å²	130.4	86%	0.86	76%	0.763	S	S	*	*				-171.3	116.6	123.5	59.9	0	0	0	0	112.1
44	S	31.1	Very low	34.3	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	77%	0.768	S	S	*	*			trans	-57.2	161.6	165.7	52.2	0	0	0	0	115.2
45	L	35.4	Very low	34.1	Very low	148 Å²	148	138.1 Å²	138.1	78%	0.775	77%	0.77	S	S	*	*				167.5	105.6	128.9	-85.8	159.5	0	0	0	109.5
46	T	33.4	Very low	33.9	Very low	118 Å²	118	138.2 Å²	138.2	72%	0.724	76%	0.761	S	S	*	*				57	144.7	102.8	61.3	0	0	0	0	115.4
47	S	31.3	Very low	33.4	Very low	87 Å²	87	142.1 Å²	142.1	61%	0.608	76%	0.764	S	S	*	*			cis	174.6	146.5	-12.7	49.9	0	0	0	0	104
48	H	33.8	Very low	33.2	Very low	188 Å²	188	144 Å²	144	87%	0.87	77%	0.773	S	S	*	*			trans	-173.9	112.1	141	-96.7	-57	0	0	0	110.6
49	A	29	Very low	32.9	Very low	91 Å²	91	142 Å²	142	75%	0.752	78%	0.775	S	S	*	*			trans	-98.2	149.4	162.6	0	0	0	0	0	109.2
50	I	34.7	Very low	32.7	Very low	176 Å²	176	143 Å²	143	90%	0.903	78%	0.782	S	S	*	*			trans	-130.5	126.4	160.1	-64.3	178.8	0	0	0	107.8
51	S	29.9	Very low	32.4	Very low	99 Å²	99	139.4 Å²	139.4	69%	0.692	78%	0.783	S	S	*	*			trans	-125.5	143.9	179.7	54.9	0	0	0	0	109.2
52	D	35.5	Very low	32	Very low	145 Å²	145	140.9 Å²	140.9	78%	0.775	79%	0.794	S	S	*	*			trans	-171.5	118.3	151.5	-104	-24	0	0	0	108.9
53	R	34.6	Very low	31.6	Very low	224 Å²	224	141 Å²	141	85%	0.845	79%	0.794	S	S	*	*				82.3	107.3	66.2	-81.3	-169.4	170.8	-178.1	-0.6	115.6
54	R	33	Very low	31.4	Very low	244 Å²	244	144 Å²	144	92%	0.921	80%	0.795	S	S	*	*			trans	172.8	115.8	131.3	-122.7	172.1	174.6	144.1	-0.8	108.6
55	V	31.8	Very low	31.2	Very low	114 Å²	114	148.7 Å²	148.7	69%	0.691	81%	0.805	S	S	*	*			cis	81	99.2	47.4	-178.8	0	0	0	0	114.2
56	E	29.7	Very low	30.9	Very low	135 Å²	135	150 Å²	150	63%	0.631	81%	0.807	S	S	*	*			trans	76.3	130.3	132.3	-75.2	-172	140.3	0	0	125.4
57	R	28	Very low	30.8	Very low	196 Å²	196	150.1 Å²	150.1	74%	0.74	81%	0.807	S	S	*	*			trans	74.5	118.9	137.3	-69.4	171.5	-154.8	178.8	10.7	119.2
58	L	30.8	Very low	30.7	Very low	177 Å²	177	151.4 Å²	151.4	93%	0.927	81%	0.814	S	S	*	*				-172.6	132.2	105	-92.1	161.2	0	0	0	110.3
59	A	28.2	Very low	30.4	Very low	98 Å²	98	152.9 Å²	152.9	81%	0.81	81%	0.812	S	S	*	*			trans	-97.4	137.3	176.5	0	0	0	0	0	110.3
60	S	33	Very low	30.6	Very low	124 Å²	124	154.7 Å²	154.7	87%	0.867	82%	0.816	S	S	*	*			trans	-174.1	126.6	146.3	57.8	0	0	0	0	109.1
61	G	27.7	Very low	30.3	Very low	83 Å²	83	152.6 Å²	152.6	86%	0.856	81%	0.805	S	S	*	*			trans	-82.2	175.9	-164.4	0	0	0	0	0	117.3
62	C	29	Very low	30.6	Very low	126 Å²	126	152.3 Å²	152.3	85%	0.851	81%	0.809	S	S	*	*			trans	-161.1	127.6	143.9	-157.8	0	0	0	0	107	Q64	C62-Q64 PolarHBondContact O-N 3.37Å
63	D	27.2	Very low	30.6	Very low	159 Å²	159	150.4 Å²	150.4	85%	0.85	80%	0.799	S	S	*	*			trans	-60.9	125	179.3	-64.4	-64.7	0	0	0	111.5
64	Q	33.1	Very low	30.9	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	79%	0.785	S	S	*	*			trans	-155.8	118.5	155.9	-111	166.5	23.3	0	0	109.6	C62 H66	C62-Q64 PolarHBondContact O-N 3.37Å; Q64-H66 PolarHBondContact O-N 3.38Å
65	E	25.4	Very low	31.2	Very low	202 Å²	202	136.1 Å²	136.1	94%	0.944	77%	0.767	S	S	*	*			trans	-50.6	121.7	176.6	-64.7	179.2	123.6	0	0	111.2
66	H	30.5	Very low	31.5	Very low	175 Å²	175	135.9 Å²	135.9	81%	0.81	76%	0.761	S	S	*	*			trans	-133.5	117.5	170.7	-145	57.2	0	0	0	111.2	Q64	Q64-H66 PolarHBondContact O-N 3.38Å
67	V	29.8	Very low	31.9	Very low	121 Å²	121	134.1 Å²	134.1	73%	0.733	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-58.5	138.5	179.1	178.5	0	0	0	0	110.9
68	P	30.7	Very low	32.3	Very low	115 Å²	115	130.8 Å²	130.8	75%	0.747	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-74.2	128.5	178.8	1	14	0	0	0	111.2
69	R	27.1	Very low	32.6	Very low	218 Å²	218	126.7 Å²	126.7	82%	0.823	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-68.9	129.6	168.2	-69	-180	178.3	-155.2	-0.9	110
70	P	32.2	Very low	33	Very low	130 Å²	130	127.1 Å²	127.1	84%	0.844	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-78.6	143.4	165.7	3.1	14.3	0	0	0	110.5
71	I	29.8	Very low	33	Very low	131 Å²	131	126.8 Å²	126.8	67%	0.672	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-91.8	155.5	-160.6	-68	158.2	0	0	0	109.8	D73	I71-D73 WeakPolarHBondContact CG2-OD2 3.41Å; I71-D73 PolarHBondContact O-N 3.31Å
72	A	35	Very low	33.6	Very low	94 Å²	94	128.6 Å²	128.6	78%	0.777	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	34.3	-174	0	0	0	0	0	116.3
73	D	36.4	Very low	34	Very low	105 Å²	105	126.8 Å²	126.8	56%	0.561	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-8.6	-173.5	-67.2	-30.6	0	0	0	114.3	I71	I71-D73 WeakPolarHBondContact CG2-OD2 3.41Å; I71-D73 PolarHBondContact O-N 3.31Å
74	D	40.8	Very low	34.3	Very low	102 Å²	102	126.4 Å²	126.4	55%	0.545	66%	0.656	S	S	.	*	H	α-helix	trans	-75.2	-25.9	-175.8	-89	-20.1	0	0	0	114.7	L77 M78	D74-L77 PolarHBondContact O-N 3.4Å; D74-M78 PolarHBondContact O-N 3.26Å
75	A	39.4	Very low	34.7	Very low	66 Å²	66	123.9 Å²	123.9	55%	0.545	64%	0.639	S	S	.	*	H	α-helix	trans	-68.2	-40.1	177.7	0	0	0	0	0	111.5	L77 M78 D79	A75-L77 VanDerWaalsContact C-N 3.32Å; A75-L77 PolarHBondContact O-N 3.13Å; A75-M78 PolarHBondContact O-N 3.32Å; A75-D79 PolarHBondContact O-N 3Å
76	L	38.5	Very low	35	Very low	108 Å²	108	118.3 Å²	118.3	57%	0.565	62%	0.618	S	S	*	*	H	α-helix	trans	-68.6	-31.4	178.4	-70.2	175.2	0	0	0	112.2	D79 L80	L76-D79 PolarHBondContact O-N 3.5Å; L76-L80 WeakPolarHBondContact O-CB 3.31Å; L76-L80 VanDerWaalsContact O-CG 3.24Å; L76-L80 WeakPolarHBondContact O-CG 3.25Å; L76-L80 PolarHBondContact O-N 3.12Å
77	L	37.1	Very low	34.9	Very low	98 Å²	98	116.5 Å²	116.5	51%	0.513	61%	0.608	S	S	.	*	H	α-helix	trans	-69.5	-39.6	177.3	-160.4	84.8	0	0	0	111.7	D74 A75 L80 Y81	D74-L77 PolarHBondContact O-N 3.4Å; A75-L77 VanDerWaalsContact C-N 3.32Å; A75-L77 PolarHBondContact O-N 3.13Å; L77-L80 PolarHBondContact O-N 3.01Å; L77-Y81 WeakPolarHBondContact O-CB 3.43Å; L77-Y81 PolarHBondContact O-N 3.38Å
78	M	37.2	Very low	35	Very low	126 Å²	126	116.7 Å²	116.7	62%	0.621	61%	0.612	S	S	*	*	H	α-helix	trans	-67.6	-38.5	173.2	-82	-67.3	-176.9	0	0	112	D74 A75 Y81 R82	D74-M78 PolarHBondContact O-N 3.26Å; A75-M78 PolarHBondContact O-N 3.32Å; M78-Y81 PolarHBondContact O-N 3.5Å; M78-R82 WeakPolarHBondContact O-CB 3.43Å; M78-R82 WeakPolarHBondContact O-CG 3.41Å; M78-R82 PolarHBondContact O-N 3.31Å
79	D	37	Very low	35.1	Very low	91 Å²	91	116.6 Å²	116.6	49%	0.487	61%	0.609	S	S	.	*	H	α-helix	trans	-63.6	-42.4	172.6	-72.8	-21.7	0	0	0	111.1	A75 L76 Y81 R82 V83	A75-D79 PolarHBondContact O-N 3Å; L76-D79 PolarHBondContact O-N 3.5Å; D79-Y81 PolarHBondContact O-N 3.15Å; D79-R82 PolarHBondContact O-N 3.48Å; D79-V83 WeakPolarHBondContact O-CB 3.46Å; D79-V83 WeakPolarHBondContact O-CG2 3.38Å; D79-V83 PolarHBondContact O-N 2.95Å
80	L	36	Very low	35.4	Very low	107 Å²	107	114.1 Å²	114.1	56%	0.56	60%	0.604	S	S	*	*	H	α-helix	trans	-64.2	-38.4	174.3	-77	167.5	0	0	0	112.5	L76 L77 V83 Q84	L76-L80 WeakPolarHBondContact O-CB 3.31Å; L76-L80 VanDerWaalsContact O-CG 3.24Å; L76-L80 WeakPolarHBondContact O-CG 3.25Å; L76-L80 PolarHBondContact O-N 3.12Å; L77-L80 PolarHBondContact O-N 3.01Å; L80-V83 PolarHBondContact O-N 3.27Å; L80-Q84 PolarHBondContact O-N 3.43Å
81	Y	34.2	Very low	35.5	Very low	118 Å²	118	113.1 Å²	113.1	46%	0.463	60%	0.598	S	S	.	*	H	α-helix	trans	-68.7	-35.9	176.7	-113.3	-85	0	0	0	112.6	L77 M78 D79	L77-Y81 WeakPolarHBondContact O-CB 3.43Å; L77-Y81 PolarHBondContact O-N 3.38Å; M78-Y81 PolarHBondContact O-N 3.5Å; D79-Y81 PolarHBondContact O-N 3.15Å
82	R	39	Very low	35.8	Very low	120 Å²	120	112 Å²	112	45%	0.453	60%	0.597	S	S	.	*	H	α-helix	trans	-68.8	-39	172.4	-74.7	177.7	177.2	-133.7	-5.8	111.3	M78 D79 Q84 R85	M78-R82 WeakPolarHBondContact O-CB 3.43Å; M78-R82 WeakPolarHBondContact O-CG 3.41Å; M78-R82 PolarHBondContact O-N 3.31Å; D79-R82 PolarHBondContact O-N 3.48Å; R82-Q84 VanDerWaalsContact C-N 3.34Å; R82-Q84 PolarHBondContact O-N 3.11Å; R82-R85 PolarHBondContact O-N 3.21Å
83	V	36.8	Very low	36	Very low	88 Å²	88	113.5 Å²	113.5	53%	0.533	60%	0.599	S	S	.	*	H	α-helix	trans	-66.2	-33.5	177.1	169.7	0	0	0	0	112.2	D79 L80 R85	D79-V83 WeakPolarHBondContact O-CB 3.46Å; D79-V83 WeakPolarHBondContact O-CG2 3.38Å; D79-V83 PolarHBondContact O-N 2.95Å; L80-V83 PolarHBondContact O-N 3.27Å; V83-R85 VanDerWaalsContact C-N 3.27Å; V83-R85 PolarHBondContact O-N 3.14Å
84	Q	34	Very low	36.2	Very low	152 Å²	152	113.3 Å²	113.3	71%	0.71	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-16.2	178.2	-83.7	-175.2	-16.5	0	0	114.8	L80 R82	L80-Q84 PolarHBondContact O-N 3.43Å; R82-Q84 VanDerWaalsContact C-N 3.34Å; R82-Q84 PolarHBondContact O-N 3.11Å
85	R	41.2	Very low	36.2	Very low	135 Å²	135	116.7 Å²	116.7	51%	0.509	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.7	0.3	-174.5	-66.4	-165.6	-177.9	-144.3	5.9	114.8	R82 V83 Q358	R82-R85 PolarHBondContact O-N 3.21Å; V83-R85 VanDerWaalsContact C-N 3.27Å; V83-R85 PolarHBondContact O-N 3.14Å; R85-Q358 VanDerWaalsContact NH1-CD 3.31Å
86	V	32.4	Very low	36.7	Very low	84 Å²	84	118.3 Å²	118.3	51%	0.509	62%	0.621	S	S	.	*	S	Bend	trans	-97.7	152	168.4	-173.2	0	0	0	0	107.3
87	F	29.6	Very low	37	Very low	138 Å²	138	118.1 Å²	118.1	61%	0.605	63%	0.627	S	S	*	*			trans	98.1	112.7	169.8	-46.6	-64.7	0	0	0	116.5	V89	F87-V89 HydrophobicContact CB-CB 4.37Å; F87-V89 HydrophobicContact CB-CG2 3.75Å; F87-V89 HydrophobicContact CG-CG2 4.46Å; F87-V89 PolarHBondContact O-N 3.4Å
88	P	30.3	Very low	37.7	Very low	125 Å²	125	124 Å²	124	81%	0.812	64%	0.642	S	S	*	*	S	Bend		-61.2	111.3	109.1	29.6	-26.1	0	0	0	106.3	K90	P88-K90 VanDerWaalsContact C-N 3.29Å; P88-K90 PolarHBondContact O-N 3.31Å
89	V	32.5	Very low	38.4	Very low	112 Å²	112	121.5 Å²	121.5	68%	0.679	63%	0.631	S	S	*	*			trans	-59.2	97.8	177.3	176.6	0	0	0	0	106.3	F87	F87-V89 HydrophobicContact CB-CB 4.37Å; F87-V89 HydrophobicContact CB-CG2 3.75Å; F87-V89 HydrophobicContact CG-CG2 4.46Å; F87-V89 PolarHBondContact O-N 3.4Å
90	K	34.8	Very low	38.9	Very low	167 Å²	167	121.9 Å²	121.9	73%	0.726	64%	0.641	S	S	*	*			trans	-61.1	132.5	154.2	-76.4	-175.9	178.8	176.6	0	104.7	P88 T92	P88-K90 VanDerWaalsContact C-N 3.29Å; P88-K90 PolarHBondContact O-N 3.31Å; K90-T92 PolarHBondContact O-N 3.08Å
91	P	33.4	Very low	39.5	Very low	109 Å²	109	120.6 Å²	120.6	71%	0.708	65%	0.654	S	S	*	*			trans	-48.1	135	-174.3	18.8	-30.5	0	0	0	108.7
92	T	37.4	Very low	40.6	Very low	108 Å²	108	119.7 Å²	119.7	66%	0.663	66%	0.656	S	S	*	*			trans	-25.3	138.4	166.7	39.2	0	0	0	0	110.2	K90 V94	K90-T92 PolarHBondContact O-N 3.08Å; T92-V94 PolarHBondContact O-N 3.3Å
93	P	37.7	Very low	41.8	Very low	125 Å²	125	118.8 Å²	118.8	81%	0.812	67%	0.666	S	S	*	*			trans	-59.2	96.2	178.1	27.3	-31.4	0	0	0	106.6	L95	P93-L95 PolarHBondContact O-N 3.32Å
94	V	41.2	Very low	43.6	Very low	100 Å²	100	118.2 Å²	118.2	61%	0.606	66%	0.659	S	S	*	*			trans	-50.5	130.1	155.8	177.1	0	0	0	0	101.3	T92 V96	T92-V94 PolarHBondContact O-N 3.3Å; V94-V96 HydrophobicContact CB-CG2 3.74Å; V94-V96 HydrophobicContact CG1-CG2 3.89Å; V94-V96 WeakPolarHBondContact O-CG2 3.34Å; V94-V96 PolarHBondContact O-N 2.98Å
95	L	40.2	Very low	45.8	Very low	174 Å²	174	118 Å²	118	91%	0.911	65%	0.652	S	S	*	*			trans	-63.3	70.5	164.8	-69	168.9	0	0	0	106	P93	P93-L95 PolarHBondContact O-N 3.32Å
96	V	50.4	Low	47.9	Very low	99 Å²	99	113.4 Å²	113.4	60%	0.6	64%	0.64	S	S	*	*			trans	-66.3	127.8	171.3	-170.5	0	0	0	0	102.4	V94 R98	V94-V96 HydrophobicContact CB-CG2 3.74Å; V94-V96 HydrophobicContact CG1-CG2 3.89Å; V94-V96 WeakPolarHBondContact O-CG2 3.34Å; V94-V96 PolarHBondContact O-N 2.98Å; V96-R98 PolarHBondContact O-N 3.27Å
97	P	44.3	Very low	50.5	Low	105 Å²	105	112.6 Å²	112.6	68%	0.682	63%	0.631	S	S	*	*			trans	-44.4	138.6	170.4	-25.4	32.7	0	0	0	108.4	D99	P97-D99 PolarHBondContact O-N 2.89Å
98	R	51.8	Low	53.2	Low	220 Å²	220	108.2 Å²	108.2	83%	0.83	61%	0.612	S	S	*	*			trans	-40.7	138.1	167.2	176.9	-179.2	-77.4	173	-3.9	107.1	V96 S100	V96-R98 PolarHBondContact O-N 3.27Å; R98-S100 WeakPolarHBondContact CB-OG 3.42Å; R98-S100 PolarHBondContact O-N 3.09Å; R98-S100 PolarHBondContact O-OG 3.09Å
99	D	53.3	Low	56.1	Low	75 Å²	75	102.5 Å²	102.5	40%	0.401	58%	0.575	S	S	.	*	S	Bend	trans	-60.5	26.5	179.3	-63.9	-42.4	0	0	0	113.9	P97 G101 L102 G122	P97-D99 PolarHBondContact O-N 2.89Å; D99-G101 PolarHBondContact O-N 2.75Å; D99-L102 HydrophobicContact CB-CD1 4.15Å; D99-L102 PolarHBondContact O-N 3.38Å; D99-G122 PolarHBondContact OD2-N 3.34Å
100	S	46	Very low	58.8	Low	99 Å²	99	100 Å²	100	69%	0.692	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.4	94.3	165.9	-0.8	0	0	0	0	109.6	R98	R98-S100 WeakPolarHBondContact CB-OG 3.42Å; R98-S100 PolarHBondContact O-N 3.09Å; R98-S100 PolarHBondContact O-OG 3.09Å
101	G	49.3	Very low	61.4	Low	80 Å²	80	92.3 Å²	92.3	83%	0.825	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	128.3	-15.6	173.7	0	0	0	0	0	115	D99	D99-G101 PolarHBondContact O-N 2.75Å
102	L	57.7	Low	63.9	Low	99 Å²	99	90.7 Å²	90.7	52%	0.518	51%	0.507	S	S	.	.	S	Bend	trans	-74.7	142.2	171.6	-78.5	163	0	0	0	109.9	D99 L104	D99-L102 HydrophobicContact CB-CD1 4.15Å; D99-L102 PolarHBondContact O-N 3.38Å; L102-L104 PolarHBondContact O-N 3.34Å
103	P	63.3	Low	66.1	Low	100 Å²	100	88.3 Å²	88.3	65%	0.649	50%	0.504	S	S	*	.			trans	-58.1	137.6	176.1	24	-32.5	0	0	0	109.5	R105	P103-R105 WeakPolarHBondContact O-CG 3.45Å; P103-R105 PolarHBondContact O-N 3.27Å
104	L	75.5	Confident	68.4	Low	76 Å²	76	84.8 Å²	84.8	40%	0.398	48%	0.477	S	S	.	.			trans	-55.2	106.8	180	-159.6	93	0	0	0	109.8	L102 C106 F119 E163 Q164 A167	L102-L104 PolarHBondContact O-N 3.34Å; L104-C106 PolarHBondContact O-N 3.33Å; L104-F119 HydrophobicContact CD2-CD1 3.74Å; L104-F119 HydrophobicContact CD2-CE1 3.3Å; L104-F119 HydrophobicContact CD2-CZ 4.08Å; L104-F119 HydrophobicContact CG-CD1 3.96Å; L104-F119 HydrophobicContact CG-CE1 4.05Å; L104-E163 HydrophobicContact CD1-CB 4.39Å; L104-Q164 HydrophobicContact CD1-CG 3.77Å; L104-Q164 HydrophobicContact CD2-CG 4.03Å; L104-Q164 HydrophobicContact CG-CG 4.41Å; L104-A167 HydrophobicContact CD2-CB 3.73Å
105	R	79.3	Confident	70.7	Confident	149 Å²	149	86.3 Å²	86.3	56%	0.562	47%	0.472	S	S	*	.			trans	-84.2	93.5	-179	-66.6	-168.6	-179.1	-169.3	1.2	110.3	P103 F119 V120	P103-R105 WeakPolarHBondContact O-CG 3.45Å; P103-R105 PolarHBondContact O-N 3.27Å; R105-F119 WeakPolarHBondContact O-CA 3.44Å; R105-V120 HydrophobicContact CB-CB 4.47Å; R105-V120 PolarHBondContact O-N 3.34Å
106	C	85.4	Confident	73.1	Confident	38 Å²	38	78 Å²	78	26%	0.257	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	122.6	170.5	-167.1	0	0	0	0	109.6	L104 T117 F119	L104-C106 PolarHBondContact O-N 3.33Å; C106-T117 VanDerWaalsContact SG-CG2 3.51Å; C106-F119 HydrophobicContact CB-CD1 4.14Å; C106-F119 HydrophobicContact CB-CE1 3.8Å
107	E	86.9	Confident	75	Confident	66 Å²	66	73.6 Å²	73.6	31%	0.308	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	169.9	179.7	-67.1	-178.6	-166.6	0	0	110	T117 C118 V120 K125	E107-T117 WeakPolarHBondContact O-CA 3.09Å; E107-C118 PolarHBondContact N-O 3.06Å; E107-C118 PolarHBondContact O-N 3.45Å; E107-C118 PolarHBondContact O-SG 3.46Å; E107-V120 HydrophobicContact CG-CG2 4.38Å; E107-K125 WeakPolarHBondContact OE2-CE 3.25Å; E107-K125 IonicContact OE2-NZ 3.58Å; E107-K125 PolarHBondContact OE2-NZ 3.28Å
108	Q	87.5	Confident	77.3	Confident	46 Å²	46	68.6 Å²	68.6	22%	0.215	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	146	165.7	-66.7	178.7	-11.9	0	0	110.1	W115 I116 L225	Q108-W115 HydrophobicContact CB-CE3 3.79Å; Q108-W115 HydrophobicContact CB-CZ3 4.36Å; Q108-I116 WeakPolarHBondContact CA-O 3.18Å; Q108-L225 HydrophobicContact CG-CD2 4.25Å
109	T	89.7	Confident	79.1	Confident	6 Å²	6	58.2 Å²	58.2	4%	0.037	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.5	171.2	-173.2	0	0	0	0	109.8	I116 C118 L127	T109-I116 PolarHBondContact N-O 2.99Å; T109-I116 PolarHBondContact O-N 2.77Å; T109-C118 HydrophobicContact CG2-CB 4.29Å; T109-L127 HydrophobicContact CG2-CD1 3.97Å; T109-L127 HydrophobicContact CG2-CD2 4.01Å; T109-L127 HydrophobicContact CG2-CG 3.8Å
110	L	90.1	Very high	80.8	Confident	60 Å²	60	56.7 Å²	56.7	31%	0.314	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	131.1	171.5	-160.6	72.8	0	0	0	109.5	E114 W115	L110-E114 WeakPolarHBondContact CA-O 3.44Å; L110-W115 HydrophobicContact CB-CZ3 4.47Å; L110-W115 HydrophobicContact CD1-CD2 4.07Å; L110-W115 HydrophobicContact CD1-CG 4.37Å; L110-W115 HydrophobicContact CD1-CZ2 4.37Å
111	F	89.9	Confident	82.8	Confident	4 Å²	4	54.5 Å²	54.5	2%	0.018	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	115.8	171.1	180	-89.7	0	0	0	108	G113 E114 I116 F132 A244 V245 Y248	F111-G113 PolarHBondContact O-N 2.85Å; F111-E114 PolarHBondContact N-O 2.75Å; F111-E114 PolarHBondContact O-N 3.48Å; F111-I116 HydrophobicContact CB-CD1 3.55Å; F111-I116 HydrophobicContact CB-CG1 4.13Å; F111-I116 HydrophobicContact CD1-CD1 3.96Å; F111-I116 HydrophobicContact CG-CD1 3.91Å; F111-F132 HydrophobicContact CD1-CD2 4.26Å; F111-F132 HydrophobicContact CD1-CE2 4.04Å; F111-F132 HydrophobicContact CD2-CE2 4.25Å; F111-F132 HydrophobicContact CE1-CD2 4.25Å; F111-F132 AromaticContact CE1-CE2 3.62Å; F111-F132 HydrophobicContact CE1-CE2 3.62Å; F111-F132 AromaticContact CE2-CE2 3.84Å; F111-F132 HydrophobicContact CE2-CE2 3.84Å; F111-F132 HydrophobicContact CG-CE2 4.36Å; F111-F132 HydrophobicContact CZ-CD2 4.49Å; F111-F132 AromaticContact CZ-CE2 3.53Å; F111-F132 HydrophobicContact CZ-CE2 3.53Å; F111-F132 HydrophobicContact CZ-CZ 4.3Å; F111-A244 HydrophobicContact CD2-CB 4.43Å; F111-A244 HydrophobicContact CE2-CB 4.11Å; F111-V245 HydrophobicContact CD2-CG2 4.26Å; F111-V245 HydrophobicContact CE2-CG2 3.87Å; F111-Y248 HydrophobicContact CE1-CG 4.42Å; F111-Y248 HydrophobicContact CZ-CD1 4.15Å; F111-Y248 HydrophobicContact CZ-CD2 4.45Å; F111-Y248 AromaticContact CZ-CG 3.86Å; F111-Y248 HydrophobicContact CZ-CG 3.86Å
112	E	85.3	Confident	84.3	Confident	75 Å²	75	53.5 Å²	53.5	35%	0.35	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	33.7	-178.7	-63.2	-60	112	0	0	114.9	S137 Y248	E112-S137 VanDerWaalsContact CB-OG 3.24Å; E112-S137 WeakPolarHBondContact CB-OG 3.36Å; E112-Y248 HydrophobicContact CG-CD1 3.97Å; E112-Y248 HydrophobicContact CG-CE1 3.56Å
113	G	83.9	Confident	85.4	Confident	58 Å²	58	52 Å²	52	60%	0.598	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.6	-1.8	-179.4	0	0	0	0	0	115.3	F111	F111-G113 PolarHBondContact O-N 2.85Å
114	E	86.4	Confident	86.5	Confident	51 Å²	51	48 Å²	48	24%	0.238	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	138.4	177.1	-167.6	177.3	154.7	0	0	111	L110 F111 I116 S135 R136	L110-E114 WeakPolarHBondContact CA-O 3.44Å; F111-E114 PolarHBondContact N-O 2.75Å; F111-E114 PolarHBondContact O-N 3.48Å; E114-I116 PolarHBondContact O-N 2.98Å; E114-S135 WeakPolarHBondContact OE2-CA 3.41Å; E114-S135 VanDerWaalsContact OE2-CB 3.26Å; E114-S135 WeakPolarHBondContact OE2-CB 3.48Å; E114-R136 PolarHBondContact OE2-N 3.31Å
115	W	88.4	Confident	87.3	Confident	132 Å²	132	47.6 Å²	47.6	50%	0.5	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	116.7	176.2	-70.7	104.1	0	0	0	110.3	Q108 L110 Q131	Q108-W115 HydrophobicContact CB-CE3 3.79Å; Q108-W115 HydrophobicContact CB-CZ3 4.36Å; L110-W115 HydrophobicContact CB-CZ3 4.47Å; L110-W115 HydrophobicContact CD1-CD2 4.07Å; L110-W115 HydrophobicContact CD1-CG 4.37Å; L110-W115 HydrophobicContact CD1-CZ2 4.37Å; W115-Q131 PolarHBondContact O-NE2 3.04Å
116	I	89.9	Confident	87.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.7	177.1	-55.1	-178.3	0	0	0	109.2	Q108 T109 F111 E114 L127 Q131 F132	Q108-I116 WeakPolarHBondContact CA-O 3.18Å; T109-I116 PolarHBondContact N-O 2.99Å; T109-I116 PolarHBondContact O-N 2.77Å; F111-I116 HydrophobicContact CB-CD1 3.55Å; F111-I116 HydrophobicContact CB-CG1 4.13Å; F111-I116 HydrophobicContact CD1-CD1 3.96Å; F111-I116 HydrophobicContact CG-CD1 3.91Å; E114-I116 PolarHBondContact O-N 2.98Å; I116-L127 HydrophobicContact CB-CD2 4.11Å; I116-L127 HydrophobicContact CB-CG 4.49Å; I116-L127 HydrophobicContact CD1-CD2 4.1Å; I116-L127 HydrophobicContact CG2-CB 3.91Å; I116-L127 HydrophobicContact CG2-CD2 3.94Å; I116-L127 HydrophobicContact CG2-CG 4.05Å; I116-Q131 HydrophobicContact CG2-CB 4.3Å; I116-Q131 HydrophobicContact CG2-CG 4.26Å; I116-F132 HydrophobicContact CD1-CB 4.16Å; I116-F132 HydrophobicContact CD1-CD2 3.77Å; I116-F132 HydrophobicContact CD1-CG 4.47Å; I116-F132 HydrophobicContact CG2-CB 4.48Å
117	T	91.2	Very high	88.3	Confident	6 Å²	6	41.3 Å²	41.3	4%	0.037	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	136.7	178.3	-52	0	0	0	0	109.9	C106 E107 C128 Q131 L168 V228	C106-T117 VanDerWaalsContact SG-CG2 3.51Å; E107-T117 WeakPolarHBondContact O-CA 3.09Å; T117-C128 PolarHBondContact O-N 3.42Å; T117-Q131 PolarHBondContact OG1-OE1 2.8Å; T117-L168 HydrophobicContact CG2-CD2 3.76Å; T117-V228 HydrophobicContact CG2-CG2 3.96Å; T117-V228 WeakPolarHBondContact OG1-CG2 3.14Å
118	C	91.6	Very high	88.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	158.6	-176	63.1	0	0	0	0	111.9	E107 T109 K125 R126 L127	E107-C118 PolarHBondContact N-O 3.06Å; E107-C118 PolarHBondContact O-N 3.45Å; E107-C118 PolarHBondContact O-SG 3.46Å; T109-C118 HydrophobicContact CG2-CB 4.29Å; C118-K125 HydrophobicContact CB-CB 4.44Å; C118-R126 CarbonylContact C-O 3.43Å; C118-R126 WeakPolarHBondContact CA-O 3.29Å; C118-R126 VanDerWaalsContact CB-O 3.27Å; C118-R126 WeakPolarHBondContact CB-O 3.41Å; C118-L127 HydrophobicContact CB-CD1 4.31Å; C118-L127 HydrophobicContact CB-CG 4.2Å
119	F	91.3	Very high	88.8	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.009	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	139.3	169.4	-60.9	-73.7	0	0	0	109.9	L104 R105 C106 I121 R126 Q164 A167 L168 L238	L104-F119 HydrophobicContact CD2-CD1 3.74Å; L104-F119 HydrophobicContact CD2-CE1 3.3Å; L104-F119 HydrophobicContact CD2-CZ 4.08Å; L104-F119 HydrophobicContact CG-CD1 3.96Å; L104-F119 HydrophobicContact CG-CE1 4.05Å; R105-F119 WeakPolarHBondContact O-CA 3.44Å; C106-F119 HydrophobicContact CB-CD1 4.14Å; C106-F119 HydrophobicContact CB-CE1 3.8Å; F119-I121 HydrophobicContact CB-CD1 3.94Å; F119-I121 HydrophobicContact CB-CG1 3.99Å; F119-R126 PolarHBondContact N-O 3.47Å; F119-R126 PolarHBondContact O-N 3.25Å; F119-Q164 HydrophobicContact CD1-CG 4.33Å; F119-Q164 HydrophobicContact CD2-CB 4.26Å; F119-Q164 HydrophobicContact CD2-CG 3.92Å; F119-Q164 HydrophobicContact CE1-CG 4.27Å; F119-Q164 HydrophobicContact CE2-CB 3.69Å; F119-Q164 HydrophobicContact CE2-CG 3.83Å; F119-Q164 HydrophobicContact CG-CG 4.16Å; F119-Q164 HydrophobicContact CZ-CB 3.85Å; F119-Q164 HydrophobicContact CZ-CG 4Å; F119-Q164 WeakPolarHBondContact CZ-O 3.41Å; F119-A167 HydrophobicContact CE1-CB 3.99Å; F119-A167 HydrophobicContact CZ-CB 4.03Å; F119-L168 HydrophobicContact CE2-CD1 3.96Å; F119-L168 HydrophobicContact CE2-CD2 4.09Å; F119-L168 HydrophobicContact CE2-CG 3.88Å; F119-L168 HydrophobicContact CZ-CD1 4.4Å; F119-L168 HydrophobicContact CZ-CD2 4.09Å; F119-L168 HydrophobicContact CZ-CG 3.83Å; F119-L238 HydrophobicContact CD2-CD1 4.16Å; F119-L238 HydrophobicContact CD2-CD2 3.84Å; F119-L238 HydrophobicContact CE2-CD2 4.22Å
120	V	89.1	Confident	88.7	Confident	44 Å²	44	37.3 Å²	37.3	27%	0.267	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	112.5	170.6	-176.3	0	0	0	0	108.4	R105 E107 E124 K125	R105-V120 HydrophobicContact CB-CB 4.47Å; R105-V120 PolarHBondContact O-N 3.34Å; E107-V120 HydrophobicContact CG-CG2 4.38Å; V120-E124 WeakPolarHBondContact CA-O 3.27Å; V120-K125 HydrophobicContact CG2-CG 4.36Å
121	I	87.3	Confident	88.7	Confident	52 Å²	52	36.3 Å²	36.3	27%	0.267	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	117.1	-176.1	-57.9	170.1	0	0	0	108	F119 G123 E124 R126 Q164 L238	F119-I121 HydrophobicContact CB-CD1 3.94Å; F119-I121 HydrophobicContact CB-CG1 3.99Å; I121-G123 VanDerWaalsContact C-N 3.26Å; I121-G123 PolarHBondContact O-N 3.47Å; I121-E124 PolarHBondContact N-O 2.84Å; I121-E124 PolarHBondContact O-N 2.82Å; I121-R126 HydrophobicContact CB-CG 4.29Å; I121-R126 HydrophobicContact CD1-CB 4.32Å; I121-R126 HydrophobicContact CD1-CG 4.25Å; I121-Q164 VanDerWaalsContact CD1-NE2 3.26Å; I121-L238 HydrophobicContact CD1-CD1 3.76Å
122	G	79.9	Confident	88.7	Confident	59 Å²	59	36.1 Å²	36.1	61%	0.608	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	34.3	-178.3	0	0	0	0	0	113.1	D99 E124	D99-G122 PolarHBondContact OD2-N 3.34Å; G122-E124 PolarHBondContact O-N 2.94Å
123	G	82.1	Confident	88.8	Confident	67 Å²	67	33.6 Å²	33.6	69%	0.691	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	77	1.5	-177.7	0	0	0	0	0	115.4	I121	I121-G123 VanDerWaalsContact C-N 3.26Å; I121-G123 PolarHBondContact O-N 3.47Å
124	E	86.3	Confident	88.9	Confident	17 Å²	17	35.3 Å²	35.3	8%	0.079	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	142.5	177.7	-65.6	-152.2	136.2	0	0	113.1	V120 I121 G122 R126 W340 G341	V120-E124 WeakPolarHBondContact CA-O 3.27Å; I121-E124 PolarHBondContact N-O 2.84Å; I121-E124 PolarHBondContact O-N 2.82Å; G122-E124 PolarHBondContact O-N 2.94Å; E124-R126 PolarHBondContact O-N 3.4Å; E124-W340 HydrophobicContact CG-CE3 3.77Å; E124-W340 HydrophobicContact CG-CZ3 3.98Å; E124-W340 VanDerWaalsContact OE1-CA 3.28Å; E124-W340 WeakPolarHBondContact OE1-CA 3.41Å; E124-W340 VanDerWaalsContact OE2-CE3 3.25Å; E124-W340 WeakPolarHBondContact OE2-CZ3 3.44Å; E124-G341 PolarHBondContact OE1-N 2.94Å
125	K	91.2	Very high	88.9	Confident	68 Å²	68	32.9 Å²	32.9	30%	0.296	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	121.2	172.6	-65.7	-169.2	174.4	-159.9	0	109.7	E107 C118 V120 K241	E107-K125 WeakPolarHBondContact OE2-CE 3.25Å; E107-K125 IonicContact OE2-NZ 3.58Å; E107-K125 PolarHBondContact OE2-NZ 3.28Å; C118-K125 HydrophobicContact CB-CB 4.44Å; V120-K125 HydrophobicContact CG2-CG 4.36Å; K125-K241 HydrophobicContact CB-CB 4.2Å; K125-K241 PolarHBondContact O-N 2.84Å
126	R	93.2	Very high	88.9	Confident	55 Å²	55	36.1 Å²	36.1	21%	0.208	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	107.9	175.5	-54.8	-152.9	-178.9	-169.6	-9	110.3	C118 F119 I121 E124 L238 I239	C118-R126 CarbonylContact C-O 3.43Å; C118-R126 WeakPolarHBondContact CA-O 3.29Å; C118-R126 VanDerWaalsContact CB-O 3.27Å; C118-R126 WeakPolarHBondContact CB-O 3.41Å; F119-R126 PolarHBondContact N-O 3.47Å; F119-R126 PolarHBondContact O-N 3.25Å; I121-R126 HydrophobicContact CB-CG 4.29Å; I121-R126 HydrophobicContact CD1-CB 4.32Å; I121-R126 HydrophobicContact CD1-CG 4.25Å; E124-R126 PolarHBondContact O-N 3.4Å; R126-L238 HydrophobicContact CB-CB 4Å; R126-L238 HydrophobicContact CB-CD1 4.14Å; R126-I239 CarbonylContact C-O 3.55Å; R126-I239 VanDerWaalsContact CA-O 3.32Å; R126-I239 WeakPolarHBondContact CA-O 3.46Å
127	L	93.8	Very high	88.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	146.2	-173	-70.5	67.7	0	0	0	110.5	T109 I116 C118 L129 L238 I239 K241 A244	T109-L127 HydrophobicContact CG2-CD1 3.97Å; T109-L127 HydrophobicContact CG2-CD2 4.01Å; T109-L127 HydrophobicContact CG2-CG 3.8Å; I116-L127 HydrophobicContact CB-CD2 4.11Å; I116-L127 HydrophobicContact CB-CG 4.49Å; I116-L127 HydrophobicContact CD1-CD2 4.1Å; I116-L127 HydrophobicContact CG2-CB 3.91Å; I116-L127 HydrophobicContact CG2-CD2 3.94Å; I116-L127 HydrophobicContact CG2-CG 4.05Å; C118-L127 HydrophobicContact CB-CD1 4.31Å; C118-L127 HydrophobicContact CB-CG 4.2Å; L127-L129 PolarHBondContact O-N 3.42Å; L127-L129 VanDerWaalsContact O-N 3.09Å; L127-L238 VanDerWaalsContact O-CA 3.25Å; L127-L238 WeakPolarHBondContact O-CA 3.18Å; L127-I239 HydrophobicContact CB-CG2 4.05Å; L127-I239 PolarHBondContact N-O 2.99Å; L127-I239 PolarHBondContact O-N 3.44Å; L127-K241 HydrophobicContact CD1-CB 3.66Å; L127-K241 HydrophobicContact CD1-CG 4.18Å; L127-A244 HydrophobicContact CD2-CB 4.29Å
128	C	92.3	Very high	88.6	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	110.1	168.8	177.3	0	0	0	0	109.5	T117 T130 Q131 F132 L168 V228	T117-C128 PolarHBondContact O-N 3.42Å; C128-T130 VanDerWaalsContact C-N 3.3Å; C128-T130 PolarHBondContact O-N 3.09Å; C128-Q131 HydrophobicContact CB-CB 4.01Å; C128-Q131 PolarHBondContact O-N 3.33Å; C128-Q131 VanDerWaalsContact O-N 3.17Å; C128-F132 WeakPolarHBondContact O-CB 3.47Å; C128-F132 PolarHBondContact O-N 3.08Å; C128-L168 HydrophobicContact CB-CD1 4.17Å; C128-L168 HydrophobicContact CB-CD2 4.09Å; C128-V228 HydrophobicContact CB-CG1 4.41Å
129	L	91.8	Very high	88.5	Confident	9 Å²	9	43.5 Å²	43.5	5%	0.047	23%	0.227	C	C	.	.	H	α-helix	trans	-59.1	-44.2	-176	-177.5	68.3	0	0	0	110.3	L127 Q131 F132 M133 C157 I204 A237 I239	L127-L129 PolarHBondContact O-N 3.42Å; L127-L129 VanDerWaalsContact O-N 3.09Å; L129-Q131 VanDerWaalsContact C-N 3.33Å; L129-Q131 PolarHBondContact O-N 3.05Å; L129-F132 HydrophobicContact CD1-CD1 4.09Å; L129-F132 PolarHBondContact O-N 3.18Å; L129-F132 VanDerWaalsContact O-N 3.17Å; L129-M133 HydrophobicContact CD1-CG 4.13Å; L129-M133 HydrophobicContact CD1-SD 4.28Å; L129-M133 HydrophobicContact CG-CG 4.06Å; L129-M133 WeakPolarHBondContact O-CB 3.49Å; L129-M133 WeakPolarHBondContact O-CG 3.46Å; L129-M133 PolarHBondContact O-N 3.35Å; L129-C157 HydrophobicContact CD2-CB 4.08Å; L129-I204 HydrophobicContact CD2-CG1 4.44Å; L129-A237 HydrophobicContact CB-CB 4.16Å; L129-A237 WeakPolarHBondContact CB-O 3.2Å; L129-A237 HydrophobicContact CD2-CB 3.79Å; L129-A237 PolarHBondContact N-O 2.9Å; L129-I239 HydrophobicContact CD1-CB 4.07Å; L129-I239 HydrophobicContact CD1-CD1 4.46Å; L129-I239 HydrophobicContact CD1-CG2 4Å
130	T	88.3	Confident	88.3	Confident	24 Å²	24	49.4 Å²	49.4	15%	0.147	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-41.9	178.9	-56.2	0	0	0	0	112.5	C128 H134 L229 F233 S236	C128-T130 VanDerWaalsContact C-N 3.3Å; C128-T130 PolarHBondContact O-N 3.09Å; T130-H134 PolarHBondContact O-N 2.98Å; T130-H134 PolarHBondContact O-ND1 2.85Å; T130-L229 HydrophobicContact CG2-CD2 3.62Å; T130-F233 HydrophobicContact CG2-CE1 3.72Å; T130-F233 HydrophobicContact CG2-CE2 4.29Å; T130-F233 HydrophobicContact CG2-CZ 3.48Å; T130-F233 VanDerWaalsContact CG2-CZ 3.48Å; T130-S236 PolarHBondContact OG1-OG 2.98Å; T130-S236 VanDerWaalsContact OG1-OG 3.04Å
131	Q	88.9	Confident	88.4	Confident	40 Å²	40	48.6 Å²	48.6	19%	0.187	24%	0.242	C	C	.	.	H	α-helix	trans	-67	-44.4	176.2	-172.2	-178.8	3.8	0	0	110.6	W115 I116 T117 C128 L129 M133 H134 S135 V228	W115-Q131 PolarHBondContact O-NE2 3.04Å; I116-Q131 HydrophobicContact CG2-CB 4.3Å; I116-Q131 HydrophobicContact CG2-CG 4.26Å; T117-Q131 PolarHBondContact OG1-OE1 2.8Å; C128-Q131 HydrophobicContact CB-CB 4.01Å; C128-Q131 PolarHBondContact O-N 3.33Å; C128-Q131 VanDerWaalsContact O-N 3.17Å; L129-Q131 VanDerWaalsContact C-N 3.33Å; L129-Q131 PolarHBondContact O-N 3.05Å; Q131-M133 PolarHBondContact O-N 3.44Å; Q131-H134 CarbonylContact O-C 3.59Å; Q131-H134 PolarHBondContact O-N 3.4Å; Q131-S135 PolarHBondContact O-N 3.1Å; Q131-S135 VanDerWaalsContact O-N 3.14Å; Q131-V228 HydrophobicContact CB-CG1 3.78Å; Q131-V228 HydrophobicContact CG-CG1 4.07Å; Q131-V228 VanDerWaalsContact OE1-CG1 3.24Å
132	F	90.4	Very high	88.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.4	-42.8	178.9	170.9	-108.8	0	0	0	113.2	F111 I116 C128 L129 H134 S135 L138 I239 A244 L247	F111-F132 HydrophobicContact CD1-CD2 4.26Å; F111-F132 HydrophobicContact CD1-CE2 4.04Å; F111-F132 HydrophobicContact CD2-CE2 4.25Å; F111-F132 HydrophobicContact CE1-CD2 4.25Å; F111-F132 AromaticContact CE1-CE2 3.62Å; F111-F132 HydrophobicContact CE1-CE2 3.62Å; F111-F132 AromaticContact CE2-CE2 3.84Å; F111-F132 HydrophobicContact CE2-CE2 3.84Å; F111-F132 HydrophobicContact CG-CE2 4.36Å; F111-F132 HydrophobicContact CZ-CD2 4.49Å; F111-F132 AromaticContact CZ-CE2 3.53Å; F111-F132 HydrophobicContact CZ-CE2 3.53Å; F111-F132 HydrophobicContact CZ-CZ 4.3Å; I116-F132 HydrophobicContact CD1-CB 4.16Å; I116-F132 HydrophobicContact CD1-CD2 3.77Å; I116-F132 HydrophobicContact CD1-CG 4.47Å; I116-F132 HydrophobicContact CG2-CB 4.48Å; C128-F132 WeakPolarHBondContact O-CB 3.47Å; C128-F132 PolarHBondContact O-N 3.08Å; L129-F132 HydrophobicContact CD1-CD1 4.09Å; L129-F132 PolarHBondContact O-N 3.18Å; L129-F132 VanDerWaalsContact O-N 3.17Å; F132-H134 PolarHBondContact O-N 3.33Å; F132-S135 WeakPolarHBondContact O-CB 3.41Å; F132-S135 PolarHBondContact O-N 2.95Å; F132-S135 PolarHBondContact O-OG 3.34Å; F132-L138 HydrophobicContact CD1-CD1 3.58Å; F132-L138 HydrophobicContact CD2-CD1 4.15Å; F132-L138 HydrophobicContact CE1-CD1 3.2Å; F132-L138 HydrophobicContact CE1-CG 4.42Å; F132-L138 HydrophobicContact CE2-CD1 3.79Å; F132-L138 HydrophobicContact CE2-CG 4.33Å; F132-L138 HydrophobicContact CG-CD1 4.07Å; F132-L138 HydrophobicContact CZ-CD1 3.33Å; F132-L138 HydrophobicContact CZ-CG 4.12Å; F132-L138 WeakPolarHBondContact O-CD1 3.5Å; F132-I239 HydrophobicContact CD1-CG2 4Å; F132-I239 HydrophobicContact CE1-CD1 4.01Å; F132-I239 HydrophobicContact CE1-CG2 4.39Å; F132-I239 HydrophobicContact CG-CG2 4.36Å; F132-A244 HydrophobicContact CD2-CB 4.32Å; F132-A244 HydrophobicContact CE1-CB 4.3Å; F132-A244 HydrophobicContact CE2-CB 3.71Å; F132-A244 HydrophobicContact CZ-CB 3.68Å; F132-L247 HydrophobicContact CE1-CD2 3.8Å; F132-L247 HydrophobicContact CZ-CD2 4.2Å
133	M	88.2	Confident	89	Confident	21 Å²	21	50.4 Å²	50.4	10%	0.103	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-31	177.1	-67.5	-65.8	-75.5	0	0	112.6	L129 Q131 L138 F143 I146	L129-M133 HydrophobicContact CD1-CG 4.13Å; L129-M133 HydrophobicContact CD1-SD 4.28Å; L129-M133 HydrophobicContact CG-CG 4.06Å; L129-M133 WeakPolarHBondContact O-CB 3.49Å; L129-M133 WeakPolarHBondContact O-CG 3.46Å; L129-M133 PolarHBondContact O-N 3.35Å; Q131-M133 PolarHBondContact O-N 3.44Å; M133-L138 HydrophobicContact SD-CD1 4.32Å; M133-F143 HydrophobicContact CE-CD2 3.37Å; M133-F143 HydrophobicContact CE-CE2 3.58Å; M133-F143 HydrophobicContact CE-CG 4.5Å; M133-I146 HydrophobicContact CE-CB 4.1Å; M133-I146 HydrophobicContact CE-CD1 3.78Å; M133-I146 HydrophobicContact CE-CG2 3.67Å; M133-I146 HydrophobicContact SD-CD1 4.23Å; M133-I146 HydrophobicContact SD-CG2 3.7Å
134	H	85.3	Confident	89.3	Confident	94 Å²	94	50.1 Å²	50.1	44%	0.435	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	3.1	176.9	-63.4	107.9	0	0	0	113.7	T130 Q131 F132 R139	T130-H134 PolarHBondContact O-N 2.98Å; T130-H134 PolarHBondContact O-ND1 2.85Å; Q131-H134 CarbonylContact O-C 3.59Å; Q131-H134 PolarHBondContact O-N 3.4Å; F132-H134 PolarHBondContact O-N 3.33Å; H134-R139 VanDerWaalsContact O-CD 3.31Å; H134-R139 WeakPolarHBondContact O-CD 3.42Å; H134-R139 WeakPolarHBondContact O-CG 3.3Å; H134-R139 PolarHBondContact O-NE 3.08Å; H134-R139 VanDerWaalsContact O-NE 3.13Å
135	S	87.5	Confident	89.6	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	-59.9	150.7	176.2	67.8	0	0	0	0	111.4	E114 Q131 F132 S137 L138 R139	E114-S135 WeakPolarHBondContact OE2-CA 3.41Å; E114-S135 VanDerWaalsContact OE2-CB 3.26Å; E114-S135 WeakPolarHBondContact OE2-CB 3.48Å; Q131-S135 PolarHBondContact O-N 3.1Å; Q131-S135 VanDerWaalsContact O-N 3.14Å; F132-S135 WeakPolarHBondContact O-CB 3.41Å; F132-S135 PolarHBondContact O-N 2.95Å; F132-S135 PolarHBondContact O-OG 3.34Å; S135-S137 PolarHBondContact O-N 3Å; S135-S137 VanDerWaalsContact O-N 3.14Å; S135-L138 PolarHBondContact O-N 3.38Å; S135-L138 VanDerWaalsContact O-N 3.14Å; S135-L138 PolarHBondContact OG-N 2.99Å; S135-R139 WeakPolarHBondContact O-CG 3.5Å; S135-R139 PolarHBondContact O-N 3.23Å
136	R	86.7	Confident	89.6	Confident	200 Å²	200	49.2 Å²	49.2	76%	0.755	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-35.7	178.1	-169.2	177.4	-169.8	163.9	4.3	112.3	E114	E114-R136 PolarHBondContact OE2-N 3.31Å
137	S	85.9	Confident	89.5	Confident	17 Å²	17	48.1 Å²	48.1	12%	0.119	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-32.1	-177.2	-58.7	0	0	0	0	113.1	E112 S135 R140 Y248	E112-S137 VanDerWaalsContact CB-OG 3.24Å; E112-S137 WeakPolarHBondContact CB-OG 3.36Å; S135-S137 PolarHBondContact O-N 3Å; S135-S137 VanDerWaalsContact O-N 3.14Å; S137-R140 WeakPolarHBondContact O-CG 3.28Å; S137-R140 PolarHBondContact O-NE 3.43Å; S137-R140 VanDerWaalsContact O-NE 3.15Å; S137-Y248 WeakPolarHBondContact O-CE2 3.04Å
138	L	90.3	Very high	89.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-25.8	179	-80.3	-170.1	0	0	0	115	F132 M133 S135 R140 F141 Y248 L251	F132-L138 HydrophobicContact CD1-CD1 3.58Å; F132-L138 HydrophobicContact CD2-CD1 4.15Å; F132-L138 HydrophobicContact CE1-CD1 3.2Å; F132-L138 HydrophobicContact CE1-CG 4.42Å; F132-L138 HydrophobicContact CE2-CD1 3.79Å; F132-L138 HydrophobicContact CE2-CG 4.33Å; F132-L138 HydrophobicContact CG-CD1 4.07Å; F132-L138 HydrophobicContact CZ-CD1 3.33Å; F132-L138 HydrophobicContact CZ-CG 4.12Å; F132-L138 WeakPolarHBondContact O-CD1 3.5Å; M133-L138 HydrophobicContact SD-CD1 4.32Å; S135-L138 PolarHBondContact O-N 3.38Å; S135-L138 VanDerWaalsContact O-N 3.14Å; S135-L138 PolarHBondContact OG-N 2.99Å; L138-R140 PolarHBondContact O-N 3.49Å; L138-F141 HydrophobicContact CD2-CD2 3.87Å; L138-F141 HydrophobicContact CD2-CE2 4.26Å; L138-F141 PolarHBondContact O-N 3.38Å; L138-Y248 HydrophobicContact CD2-CD2 4.12Å; L138-L251 HydrophobicContact CD2-CD1 3.64Å
139	R	88.1	Confident	89.4	Confident	144 Å²	144	54.5 Å²	54.5	54%	0.543	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-19.4	179.9	-82.7	-174.5	-70.4	-176	-3.3	115	H134 S135 F141	H134-R139 VanDerWaalsContact O-CD 3.31Å; H134-R139 WeakPolarHBondContact O-CD 3.42Å; H134-R139 WeakPolarHBondContact O-CG 3.3Å; H134-R139 PolarHBondContact O-NE 3.08Å; H134-R139 VanDerWaalsContact O-NE 3.13Å; S135-R139 WeakPolarHBondContact O-CG 3.5Å; S135-R139 PolarHBondContact O-N 3.23Å; R139-F141 VanDerWaalsContact C-N 3.33Å
140	R	88.3	Confident	89.4	Confident	127 Å²	127	54.3 Å²	54.3	48%	0.479	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-11	176.2	68.1	-175.1	169.6	111.9	-10.9	114.6	S137 L138 Y248 C252	S137-R140 WeakPolarHBondContact O-CG 3.28Å; S137-R140 PolarHBondContact O-NE 3.43Å; S137-R140 VanDerWaalsContact O-NE 3.15Å; L138-R140 PolarHBondContact O-N 3.49Å; R140-Y248 VanDerWaalsContact NH2-CE2 3.3Å; R140-Y248 PolarHBondContact NH2-OH 2.88Å; R140-Y248 VanDerWaalsContact NH2-OH 3.08Å; R140-C252 PolarHBondContact NH2-SG 2.96Å
141	F	91.2	Very high	89.5	Confident	26 Å²	26	57 Å²	57	11%	0.114	27%	0.274	C	S	.	.	S	Bend	trans	-103.6	147.3	177.5	-57.5	-74.8	0	0	0	110	L138 R139 I146 Y248 L251	L138-F141 HydrophobicContact CD2-CD2 3.87Å; L138-F141 HydrophobicContact CD2-CE2 4.26Å; L138-F141 PolarHBondContact O-N 3.38Å; R139-F141 VanDerWaalsContact C-N 3.33Å; F141-I146 HydrophobicContact CB-CD1 4.2Å; F141-I146 HydrophobicContact CB-CG1 3.98Å; F141-Y248 HydrophobicContact CE2-CD2 4.27Å; F141-Y248 HydrophobicContact CE2-CE2 4.16Å; F141-L251 HydrophobicContact CD1-CB 4.04Å; F141-L251 HydrophobicContact CD1-CD2 4.28Å; F141-L251 HydrophobicContact CD2-CB 4.17Å; F141-L251 HydrophobicContact CD2-CD1 4.06Å; F141-L251 HydrophobicContact CE1-CB 3.69Å; F141-L251 VanDerWaalsContact CE1-O 3.25Å; F141-L251 WeakPolarHBondContact CE1-O 3.08Å; F141-L251 HydrophobicContact CE2-CB 3.83Å; F141-L251 HydrophobicContact CE2-CD1 4.38Å; F141-L251 HydrophobicContact CG-CB 4.25Å; F141-L251 HydrophobicContact CG-CD1 4.26Å; F141-L251 HydrophobicContact CG-CD2 4.38Å; F141-L251 HydrophobicContact CZ-CB 3.55Å
142	T	90.4	Very high	89.6	Confident	75 Å²	75	60 Å²	60	46%	0.46	28%	0.284	S	S	.	.			trans	-72.4	148.1	174.3	79.5	0	0	0	0	109.7	S144 D145 I146	T142-S144 PolarHBondContact O-N 2.93Å; T142-D145 PolarHBondContact O-N 2.91Å; T142-D145 PolarHBondContact OG1-N 2.83Å; T142-D145 VanDerWaalsContact OG1-N 3.13Å; T142-D145 PolarHBondContact OG1-OD2 2.92Å; T142-I146 WeakPolarHBondContact O-CG1 3.32Å; T142-I146 PolarHBondContact O-N 3.41Å
143	F	88.2	Confident	89.5	Confident	75 Å²	75	60 Å²	60	33%	0.329	28%	0.284	S	S	.	.	H	α-helix	trans	-57.6	-35.2	174.8	-175.6	-100.2	0	0	0	112.7	M133 D145 I146 N147 I204	M133-F143 HydrophobicContact CE-CD2 3.37Å; M133-F143 HydrophobicContact CE-CE2 3.58Å; M133-F143 HydrophobicContact CE-CG 4.5Å; F143-D145 PolarHBondContact O-N 3.34Å; F143-I146 PolarHBondContact O-N 3.32Å; F143-N147 WeakPolarHBondContact CD1-ND2 3.38Å; F143-N147 WeakPolarHBondContact CE1-ND2 3.31Å; F143-N147 WeakPolarHBondContact O-CB 3.37Å; F143-N147 PolarHBondContact O-N 2.93Å; F143-N147 PolarHBondContact O-OD1 3.31Å; F143-I204 HydrophobicContact CE1-CB 4.26Å; F143-I204 HydrophobicContact CE1-CG2 4.42Å; F143-I204 WeakPolarHBondContact CE1-O 3.47Å; F143-I204 HydrophobicContact CE2-CB 3.96Å; F143-I204 HydrophobicContact CE2-CG2 3.32Å; F143-I204 HydrophobicContact CZ-CB 3.41Å; F143-I204 VanDerWaalsContact CZ-CB 3.41Å; F143-I204 HydrophobicContact CZ-CG2 3.2Å; F143-I204 WeakPolarHBondContact CZ-O 3.26Å
144	S	89.6	Confident	89.6	Confident	60 Å²	60	64.4 Å²	64.4	42%	0.42	31%	0.308	S	S	.	.	H	α-helix	trans	-61.3	-43.3	174.4	-171.4	0	0	0	0	111.9	T142 N147 K148	T142-S144 PolarHBondContact O-N 2.93Å; S144-N147 PolarHBondContact O-N 2.94Å; S144-K148 WeakPolarHBondContact O-CB 3.46Å; S144-K148 WeakPolarHBondContact O-CG 3.44Å; S144-K148 PolarHBondContact O-N 3.41Å; S144-K148 VanDerWaalsContact OG-CE 3.31Å; S144-K148 WeakPolarHBondContact OG-CE 3.28Å; S144-K148 PolarHBondContact OG-NZ 3.34Å
145	D	91.5	Very high	89.9	Confident	62 Å²	62	60.4 Å²	60.4	33%	0.332	29%	0.29	S	S	.	.	H	α-helix	trans	-69.2	-38.7	179.7	-58.7	-34.7	0	0	0	111.6	T142 F143 T149	T142-D145 PolarHBondContact O-N 2.91Å; T142-D145 PolarHBondContact OG1-N 2.83Å; T142-D145 VanDerWaalsContact OG1-N 3.13Å; T142-D145 PolarHBondContact OG1-OD2 2.92Å; F143-D145 PolarHBondContact O-N 3.34Å; D145-T149 VanDerWaalsContact O-CB 3.29Å; D145-T149 WeakPolarHBondContact O-CB 3.42Å; D145-T149 PolarHBondContact O-N 3.47Å; D145-T149 PolarHBondContact O-OG1 2.75Å
146	I	92.6	Very high	90	Very high	4 Å²	4	67 Å²	67	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-60.9	-49.6	174.3	-62.3	166.8	0	0	0	109.8	M133 F141 T142 F143 K148 T149 C150 L247 L251	M133-I146 HydrophobicContact CE-CB 4.1Å; M133-I146 HydrophobicContact CE-CD1 3.78Å; M133-I146 HydrophobicContact CE-CG2 3.67Å; M133-I146 HydrophobicContact SD-CD1 4.23Å; M133-I146 HydrophobicContact SD-CG2 3.7Å; F141-I146 HydrophobicContact CB-CD1 4.2Å; F141-I146 HydrophobicContact CB-CG1 3.98Å; T142-I146 WeakPolarHBondContact O-CG1 3.32Å; T142-I146 PolarHBondContact O-N 3.41Å; F143-I146 PolarHBondContact O-N 3.32Å; I146-K148 PolarHBondContact O-N 2.95Å; I146-T149 WeakPolarHBondContact O-CB 3.49Å; I146-T149 PolarHBondContact O-N 3.47Å; I146-T149 VanDerWaalsContact O-N 3.15Å; I146-C150 PolarHBondContact O-N 3.28Å; I146-C150 PolarHBondContact O-SG 3.43Å; I146-C150 VanDerWaalsContact O-SG 3.32Å; I146-L247 HydrophobicContact CG2-CD1 4.48Å; I146-L247 HydrophobicContact CG2-CD2 4.15Å; I146-L251 HydrophobicContact CG1-CD1 3.97Å
147	N	90.9	Very high	90.2	Very high	33 Å²	33	58.2 Å²	58.2	18%	0.176	29%	0.289	C	S	.	.	H	α-helix	trans	-64.9	-42.4	-178.3	-66.1	3.5	0	0	0	112.1	F143 S144 T149 C150 A151 L203 I204	F143-N147 WeakPolarHBondContact CD1-ND2 3.38Å; F143-N147 WeakPolarHBondContact CE1-ND2 3.31Å; F143-N147 WeakPolarHBondContact O-CB 3.37Å; F143-N147 PolarHBondContact O-N 2.93Å; F143-N147 PolarHBondContact O-OD1 3.31Å; S144-N147 PolarHBondContact O-N 2.94Å; N147-T149 VanDerWaalsContact C-N 3.27Å; N147-T149 PolarHBondContact O-N 3.46Å; N147-C150 PolarHBondContact O-N 3.38Å; N147-A151 PolarHBondContact O-N 2.97Å; N147-L203 PolarHBondContact ND2-O 3.47Å; N147-I204 WeakPolarHBondContact OD1-CD1 3.24Å
148	K	92.2	Very high	90.5	Very high	131 Å²	131	58.6 Å²	58.6	57%	0.57	29%	0.292	S	S	*	.	H	α-helix	trans	-59.2	-40.9	173.5	-74.9	169.2	-172.6	164.1	0	111.4	S144 I146 A151 Y152	S144-K148 WeakPolarHBondContact O-CB 3.46Å; S144-K148 WeakPolarHBondContact O-CG 3.44Å; S144-K148 PolarHBondContact O-N 3.41Å; S144-K148 VanDerWaalsContact OG-CE 3.31Å; S144-K148 WeakPolarHBondContact OG-CE 3.28Å; S144-K148 PolarHBondContact OG-NZ 3.34Å; I146-K148 PolarHBondContact O-N 2.95Å; K148-A151 PolarHBondContact O-N 3.48Å; K148-Y152 VanDerWaalsContact O-CB 3.3Å; K148-Y152 WeakPolarHBondContact O-CB 3.44Å; K148-Y152 PolarHBondContact O-N 2.99Å
149	T	91.3	Very high	90.5	Very high	3 Å²	3	63.6 Å²	63.6	2%	0.018	32%	0.324	C	S	.	.	H	α-helix	trans	-69	-43.5	178.6	-59.2	0	0	0	0	111.6	D145 I146 N147 A151 Y152 L153 L247 F250 L251	D145-T149 VanDerWaalsContact O-CB 3.29Å; D145-T149 WeakPolarHBondContact O-CB 3.42Å; D145-T149 PolarHBondContact O-N 3.47Å; D145-T149 PolarHBondContact O-OG1 2.75Å; I146-T149 WeakPolarHBondContact O-CB 3.49Å; I146-T149 PolarHBondContact O-N 3.47Å; I146-T149 VanDerWaalsContact O-N 3.15Å; N147-T149 VanDerWaalsContact C-N 3.27Å; N147-T149 PolarHBondContact O-N 3.46Å; T149-A151 VanDerWaalsContact C-N 3.3Å; T149-A151 PolarHBondContact O-N 2.89Å; T149-Y152 PolarHBondContact O-N 3.41Å; T149-L153 HydrophobicContact CG2-CD1 3.59Å; T149-L153 HydrophobicContact CG2-CG 4.03Å; T149-L153 WeakPolarHBondContact O-CB 3.45Å; T149-L153 WeakPolarHBondContact O-CG 3.45Å; T149-L153 PolarHBondContact O-N 3.16Å; T149-L247 HydrophobicContact CG2-CD1 3.37Å; T149-F250 HydrophobicContact CG2-CB 4.29Å; T149-F250 HydrophobicContact CG2-CD1 3.26Å; T149-F250 HydrophobicContact CG2-CE1 3.76Å; T149-F250 HydrophobicContact CG2-CG 4.06Å; T149-L251 HydrophobicContact CG2-CD2 4.35Å; T149-L251 HydrophobicContact CG2-CG 4.29Å; T149-L251 WeakPolarHBondContact OG1-CD2 3.49Å
150	C	92.3	Very high	90.5	Very high	4 Å²	4	57.6 Å²	57.6	3%	0.027	30%	0.304	C	S	.	.	H	α-helix	trans	-56.5	-45.3	173.8	-70.4	0	0	0	0	111.4	I146 N147 N154 I155	I146-C150 PolarHBondContact O-N 3.28Å; I146-C150 PolarHBondContact O-SG 3.43Å; I146-C150 VanDerWaalsContact O-SG 3.32Å; N147-C150 PolarHBondContact O-N 3.38Å; C150-N154 PolarHBondContact O-N 3.35Å; C150-N154 VanDerWaalsContact O-N 3.12Å; C150-I155 HydrophobicContact CB-CB 4.42Å; C150-I155 PolarHBondContact O-N 3.49Å
151	A	90.7	Very high	90.5	Very high	80 Å²	80	53.5 Å²	53.5	66%	0.661	30%	0.295	S	S	*	.	H	α-helix	trans	-64.2	-44.2	176	0	0	0	0	0	112.1	N147 K148 T149 N154	N147-A151 PolarHBondContact O-N 2.97Å; K148-A151 PolarHBondContact O-N 3.48Å; T149-A151 VanDerWaalsContact C-N 3.3Å; T149-A151 PolarHBondContact O-N 2.89Å; A151-N154 PolarHBondContact O-N 3.29Å
152	Y	89.5	Confident	90.3	Very high	103 Å²	103	61.2 Å²	61.2	40%	0.404	32%	0.323	S	S	.	.	H	α-helix	trans	-64.3	-40.7	179.6	176.8	-98	0	0	0	113.2	K148 T149 N154 F250 R335	K148-Y152 VanDerWaalsContact O-CB 3.3Å; K148-Y152 WeakPolarHBondContact O-CB 3.44Å; K148-Y152 PolarHBondContact O-N 2.99Å; T149-Y152 PolarHBondContact O-N 3.41Å; Y152-N154 VanDerWaalsContact C-N 3.27Å; Y152-F250 HydrophobicContact CD1-CE1 4.03Å; Y152-F250 AromaticContact CD1-CE2 3.96Å; Y152-F250 HydrophobicContact CD1-CE2 3.96Å; Y152-F250 AromaticContact CD1-CZ 3.47Å; Y152-F250 HydrophobicContact CD1-CZ 3.47Å; Y152-F250 VanDerWaalsContact CD1-CZ 3.47Å; Y152-F250 HydrophobicContact CE1-CE1 4.38Å; Y152-F250 AromaticContact CE1-CE2 3.56Å; Y152-F250 HydrophobicContact CE1-CE2 3.56Å; Y152-F250 AromaticContact CE1-CZ 3.39Å; Y152-F250 HydrophobicContact CE1-CZ 3.39Å; Y152-F250 HydrophobicContact CG-CZ 4.47Å; Y152-R335 WeakPolarHBondContact O-CD 3.44Å; Y152-R335 WeakPolarHBondContact O-CG 3.43Å
153	L	89.5	Confident	90	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-0.1	179.7	-64.4	179.1	0	0	0	113.4	T149 I155 R246 F250 F333	T149-L153 HydrophobicContact CG2-CD1 3.59Å; T149-L153 HydrophobicContact CG2-CG 4.03Å; T149-L153 WeakPolarHBondContact O-CB 3.45Å; T149-L153 WeakPolarHBondContact O-CG 3.45Å; T149-L153 PolarHBondContact O-N 3.16Å; L153-I155 VanDerWaalsContact C-N 3.3Å; L153-I155 HydrophobicContact CB-CD1 3.88Å; L153-I155 HydrophobicContact CB-CG1 3.85Å; L153-I155 HydrophobicContact CD1-CD1 3.95Å; L153-I155 PolarHBondContact O-N 2.94Å; L153-R246 HydrophobicContact CD1-CG 4.37Å; L153-F250 HydrophobicContact CD1-CB 3.9Å; L153-F250 HydrophobicContact CD1-CD1 4.46Å; L153-F250 HydrophobicContact CD1-CG 4.1Å; L153-F250 HydrophobicContact CD2-CD2 3.99Å; L153-F250 HydrophobicContact CD2-CE2 4.27Å; L153-F250 HydrophobicContact CD2-CG 4.3Å; L153-F333 HydrophobicContact CD2-CB 4.49Å
154	N	90.3	Very high	90	Very high	115 Å²	115	60.8 Å²	60.8	62%	0.615	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	42.7	-176.7	-163.9	32.6	0	0	0	113	C150 A151 Y152	C150-N154 PolarHBondContact O-N 3.35Å; C150-N154 VanDerWaalsContact O-N 3.12Å; A151-N154 PolarHBondContact O-N 3.29Å; Y152-N154 VanDerWaalsContact C-N 3.27Å
155	I	90.7	Very high	89.9	Confident	9 Å²	9	58.5 Å²	58.5	5%	0.046	30%	0.3	C	S	.	.			trans	-82.9	121.2	179.4	-65.8	172.3	0	0	0	109.4	C150 L153 I239 D243 L247	C150-I155 HydrophobicContact CB-CB 4.42Å; C150-I155 PolarHBondContact O-N 3.49Å; L153-I155 VanDerWaalsContact C-N 3.3Å; L153-I155 HydrophobicContact CB-CD1 3.88Å; L153-I155 HydrophobicContact CB-CG1 3.85Å; L153-I155 HydrophobicContact CD1-CD1 3.95Å; L153-I155 PolarHBondContact O-N 2.94Å; I155-I239 HydrophobicContact CG2-CD1 3.97Å; I155-I239 HydrophobicContact CG2-CG1 4.19Å; I155-D243 HydrophobicContact CD1-CB 4.19Å; I155-D243 HydrophobicContact CG1-CB 4.12Å; I155-D243 HydrophobicContact CG2-CB 3.77Å; I155-L247 HydrophobicContact CD1-CB 3.75Å; I155-L247 HydrophobicContact CD1-CD1 4.45Å
156	H	89.5	Confident	89.4	Confident	139 Å²	139	59.1 Å²	59.1	64%	0.644	30%	0.301	S	S	*	.			trans	-97.6	118.5	179.2	178.1	-91.4	0	0	0	111.6	P158	H156-P158 VanDerWaalsContact O-CD 3.26Å; H156-P158 WeakPolarHBondContact O-CD 3.46Å
157	C	91.8	Very high	89	Confident	15 Å²	15	60.7 Å²	60.7	10%	0.101	32%	0.315	C	S	.	.			trans	-107.7	92.6	179	-62.9	0	0	0	0	111.4	L129 A237 L238	L129-C157 HydrophobicContact CD2-CB 4.08Å; C157-A237 HydrophobicContact CB-CB 4.29Å; C157-L238 CarbonylContact C-O 3.57Å; C157-L238 WeakPolarHBondContact CA-O 3.4Å; C157-L238 WeakPolarHBondContact CB-O 3.33Å
158	P	90.6	Very high	88.6	Confident	25 Å²	25	59.2 Å²	59.2	16%	0.162	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-66.3	145.3	179.7	25.4	-33.4	0	0	0	111.9	H156 A237 L238	H156-P158 VanDerWaalsContact O-CD 3.26Å; H156-P158 WeakPolarHBondContact O-CD 3.46Å; P158-A237 CarbonylContact O-C 3.5Å; P158-A237 VanDerWaalsContact O-CA 3.27Å; P158-A237 WeakPolarHBondContact O-CA 3.39Å; P158-A237 WeakPolarHBondContact O-CB 3.49Å; P158-L238 VanDerWaalsContact CD-O 3.28Å; P158-L238 WeakPolarHBondContact CD-O 3.35Å; P158-L238 HydrophobicContact CG-CB 4.43Å; P158-L238 PolarHBondContact O-N 3.36Å
159	P	91.1	Very high	88	Confident	105 Å²	105	55.6 Å²	55.6	68%	0.682	29%	0.291	S	S	*	.	B	Isolated β-bridge	trans	-64.2	149.7	173.3	28.8	-34.6	0	0	0	111.1
160	C	88.5	Confident	86.6	Confident	18 Å²	18	56.7 Å²	56.7	12%	0.122	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-66.7	138	171.9	-68.2	0	0	0	0	110.7	Q164 M165 S236 L238	C160-Q164 HydrophobicContact CB-CB 4.06Å; C160-M165 HydrophobicContact CB-CG 3.64Å; C160-M165 HydrophobicContact CB-SD 3.64Å; C160-S236 WeakPolarHBondContact CB-O 3.37Å; C160-S236 PolarHBondContact N-O 3.42Å; C160-L238 VanDerWaalsContact SG-CD2 3.59Å
161	S	88.3	Confident	84.5	Confident	42 Å²	42	64.3 Å²	64.3	29%	0.294	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-64.5	166.1	165.3	58.8	0	0	0	0	111.4	E163 Q164 M165	S161-E163 VanDerWaalsContact C-N 3.33Å; S161-E163 PolarHBondContact O-N 3.42Å; S161-Q164 PolarHBondContact O-N 2.83Å; S161-Q164 WeakPolarHBondContact OG-CB 3.4Å; S161-Q164 WeakPolarHBondContact OG-CG 3.3Å; S161-Q164 PolarHBondContact OG-N 3.36Å; S161-Q164 PolarHBondContact OG-OE1 2.9Å; S161-M165 WeakPolarHBondContact O-CG 3.29Å; S161-M165 PolarHBondContact O-N 3.23Å
162	R	86	Confident	81.8	Confident	188 Å²	188	67.4 Å²	67.4	71%	0.709	33%	0.33	S	S	*	.	H	α-helix	trans	-59.3	-44.3	176.8	-178	178.4	171.7	172.1	-0.6	111.4	Q164 M165 E166	R162-Q164 VanDerWaalsContact C-N 3.33Å; R162-Q164 PolarHBondContact O-N 3.36Å; R162-M165 PolarHBondContact O-N 3.12Å; R162-E166 IonicContact CZ-OE1 3.38Å; R162-E166 IonicContact NE-OE1 3.35Å; R162-E166 PolarHBondContact NE-OE1 2.95Å; R162-E166 IonicContact NH2-OE1 3.29Å; R162-E166 WeakPolarHBondContact O-CG 3.32Å; R162-E166 PolarHBondContact O-N 3.23Å
163	E	85.8	Confident	79	Confident	120 Å²	120	68.8 Å²	68.8	56%	0.561	35%	0.345	S	S	*	.	H	α-helix	trans	-63.3	-39.7	178.5	-59.1	84.8	-175.3	0	0	111.6	L104 S161 E166 A167	L104-E163 HydrophobicContact CD1-CB 4.39Å; S161-E163 VanDerWaalsContact C-N 3.33Å; S161-E163 PolarHBondContact O-N 3.42Å; E163-E166 PolarHBondContact O-N 3.2Å; E163-A167 WeakPolarHBondContact O-CB 3.36Å; E163-A167 PolarHBondContact O-N 3.46Å
164	Q	87.9	Confident	76.2	Confident	20 Å²	20	77.9 Å²	77.9	9%	0.093	39%	0.387	C	S	.	.	H	α-helix	trans	-66.3	-42.3	176	-72.2	162.8	-16.4	0	0	112.3	L104 F119 I121 C160 S161 R162 E166 A167 L168	L104-Q164 HydrophobicContact CD1-CG 3.77Å; L104-Q164 HydrophobicContact CD2-CG 4.03Å; L104-Q164 HydrophobicContact CG-CG 4.41Å; F119-Q164 HydrophobicContact CD1-CG 4.33Å; F119-Q164 HydrophobicContact CD2-CB 4.26Å; F119-Q164 HydrophobicContact CD2-CG 3.92Å; F119-Q164 HydrophobicContact CE1-CG 4.27Å; F119-Q164 HydrophobicContact CE2-CB 3.69Å; F119-Q164 HydrophobicContact CE2-CG 3.83Å; F119-Q164 HydrophobicContact CG-CG 4.16Å; F119-Q164 HydrophobicContact CZ-CB 3.85Å; F119-Q164 HydrophobicContact CZ-CG 4Å; F119-Q164 WeakPolarHBondContact CZ-O 3.41Å; I121-Q164 VanDerWaalsContact CD1-NE2 3.26Å; C160-Q164 HydrophobicContact CB-CB 4.06Å; S161-Q164 PolarHBondContact O-N 2.83Å; S161-Q164 WeakPolarHBondContact OG-CB 3.4Å; S161-Q164 WeakPolarHBondContact OG-CG 3.3Å; S161-Q164 PolarHBondContact OG-N 3.36Å; S161-Q164 PolarHBondContact OG-OE1 2.9Å; R162-Q164 VanDerWaalsContact C-N 3.33Å; R162-Q164 PolarHBondContact O-N 3.36Å; Q164-E166 VanDerWaalsContact C-N 3.35Å; Q164-A167 PolarHBondContact O-N 3.15Å; Q164-L168 WeakPolarHBondContact O-CG 3.45Å; Q164-L168 PolarHBondContact O-N 2.92Å
165	M	85.8	Confident	73.2	Confident	13 Å²	13	77.5 Å²	77.5	6%	0.064	39%	0.394	C	S	.	.	H	α-helix	trans	-62	-44.1	175	-77.2	-59.5	-59.2	0	0	111.2	C160 S161 R162 A167 L168 K169 L229 T234 S236	C160-M165 HydrophobicContact CB-CG 3.64Å; C160-M165 HydrophobicContact CB-SD 3.64Å; S161-M165 WeakPolarHBondContact O-CG 3.29Å; S161-M165 PolarHBondContact O-N 3.23Å; R162-M165 PolarHBondContact O-N 3.12Å; M165-A167 VanDerWaalsContact C-N 3.31Å; M165-A167 PolarHBondContact O-N 3.03Å; M165-L168 PolarHBondContact O-N 3.5Å; M165-K169 WeakPolarHBondContact O-CG 3.45Å; M165-K169 PolarHBondContact O-N 2.94Å; M165-L229 HydrophobicContact CE-CD1 4.36Å; M165-T234 WeakPolarHBondContact CE-O 3.23Å; M165-S236 PolarHBondContact SD-N 3.42Å
166	E	82.2	Confident	70.3	Confident	75 Å²	75	82.9 Å²	82.9	35%	0.35	43%	0.427	S	S	.	.	H	α-helix	trans	-63.8	-35.1	176.6	-72.7	177.9	-168.4	0	0	112.4	R162 E163 Q164	R162-E166 IonicContact CZ-OE1 3.38Å; R162-E166 IonicContact NE-OE1 3.35Å; R162-E166 PolarHBondContact NE-OE1 2.95Å; R162-E166 IonicContact NH2-OE1 3.29Å; R162-E166 WeakPolarHBondContact O-CG 3.32Å; R162-E166 PolarHBondContact O-N 3.23Å; E163-E166 PolarHBondContact O-N 3.2Å; Q164-E166 VanDerWaalsContact C-N 3.35Å
167	A	83.5	Confident	67.3	Low	37 Å²	37	82.4 Å²	82.4	31%	0.306	43%	0.433	S	S	.	.	H	α-helix	trans	-72	-29.6	175.5	0	0	0	0	0	113.9	L104 F119 E163 Q164 M165	L104-A167 HydrophobicContact CD2-CB 3.73Å; F119-A167 HydrophobicContact CE1-CB 3.99Å; F119-A167 HydrophobicContact CZ-CB 4.03Å; E163-A167 WeakPolarHBondContact O-CB 3.36Å; E163-A167 PolarHBondContact O-N 3.46Å; Q164-A167 PolarHBondContact O-N 3.15Å; M165-A167 VanDerWaalsContact C-N 3.31Å; M165-A167 PolarHBondContact O-N 3.03Å
168	L	82.3	Confident	64.2	Low	2 Å²	2	88 Å²	88	1%	0.01	46%	0.462	C	S	.	.	H	α-helix	trans	-82	-26	176.8	-70.8	172.8	0	0	0	113.3	T117 F119 C128 Q164 M165 V228 L229	T117-L168 HydrophobicContact CG2-CD2 3.76Å; F119-L168 HydrophobicContact CE2-CD1 3.96Å; F119-L168 HydrophobicContact CE2-CD2 4.09Å; F119-L168 HydrophobicContact CE2-CG 3.88Å; F119-L168 HydrophobicContact CZ-CD1 4.4Å; F119-L168 HydrophobicContact CZ-CD2 4.09Å; F119-L168 HydrophobicContact CZ-CG 3.83Å; C128-L168 HydrophobicContact CB-CD1 4.17Å; C128-L168 HydrophobicContact CB-CD2 4.09Å; Q164-L168 WeakPolarHBondContact O-CG 3.45Å; Q164-L168 PolarHBondContact O-N 2.92Å; M165-L168 PolarHBondContact O-N 3.5Å; L168-V228 HydrophobicContact CD2-CB 4.15Å; L168-V228 HydrophobicContact CD2-CG1 4.25Å; L168-V228 HydrophobicContact CD2-CG2 4.17Å; L168-V228 PolarHBondContact O-N 2.86Å; L168-L229 HydrophobicContact CB-CD1 3.9Å; L168-L229 HydrophobicContact CB-CG 4.22Å; L168-L229 HydrophobicContact CD1-CD1 3.93Å; L168-L229 PolarHBondContact O-N 3.34Å; L168-L229 VanDerWaalsContact O-N 3.07Å
169	K	80.7	Confident	61.1	Low	54 Å²	54	92.2 Å²	92.2	24%	0.235	49%	0.489	C	S	.	.	B	Isolated β-bridge	trans	-70	137.6	-179.8	-77.6	172.7	-171.8	-151.9	0	110.8	M165 R171 L229 V231 F233	M165-K169 WeakPolarHBondContact O-CG 3.45Å; M165-K169 PolarHBondContact O-N 2.94Å; K169-R171 PolarHBondContact O-N 3.45Å; K169-L229 WeakPolarHBondContact CA-O 3.42Å; K169-V231 PolarHBondContact NZ-O 3.35Å; K169-F233 WeakPolarHBondContact CE-O 3.36Å; K169-F233 PolarHBondContact NZ-O 3.05Å
170	V	61.7	Low	58.4	Low	26 Å²	26	92.2 Å²	92.2	16%	0.158	49%	0.491	C	S	.	.			trans	-57.1	107.4	169.2	178.1	0	0	0	0	108.8	L172 N227 L229 V231	V170-L172 HydrophobicContact CG1-CD2 3.75Å; V170-L172 HydrophobicContact CG1-CG 3.73Å; V170-L172 PolarHBondContact O-N 3.31Å; V170-N227 WeakPolarHBondContact CG1-OD1 3.33Å; V170-N227 HydrophobicContact CG2-CB 4.14Å; V170-L229 PolarHBondContact N-O 3.47Å; V170-L229 VanDerWaalsContact N-O 3.16Å; V170-V231 HydrophobicContact CB-CG1 4.47Å; V170-V231 WeakPolarHBondContact O-CG1 3.43Å
171	R	47	Very low	55.7	Low	165 Å²	165	98.1 Å²	98.1	62%	0.623	52%	0.521	S	S	*	.			trans	-79.1	100.7	152.7	-75	-174.7	-175.9	152.9	3.3	105.3	K169 N173 L226	K169-R171 PolarHBondContact O-N 3.45Å; R171-N173 PolarHBondContact O-N 3.32Å; R171-L226 HydrophobicContact CB-CD2 4.24Å
172	L	35.2	Very low	53.1	Low	145 Å²	145	105.4 Å²	105.4	76%	0.759	55%	0.55	S	S	*	*			trans	-62	88.4	162.5	-71.9	172.5	0	0	0	105.3	V170 E174	V170-L172 HydrophobicContact CG1-CD2 3.75Å; V170-L172 HydrophobicContact CG1-CG 3.73Å; V170-L172 PolarHBondContact O-N 3.31Å; L172-E174 PolarHBondContact O-N 2.99Å; L172-E174 VanDerWaalsContact O-N 3.15Å
173	N	30.8	Very low	50.4	Low	132 Å²	132	105.3 Å²	105.3	71%	0.706	56%	0.555	S	S	*	*			trans	-63	119.1	167	-86.2	4.3	0	0	0	106	R171 S175	R171-N173 PolarHBondContact O-N 3.32Å; N173-S175 PolarHBondContact O-N 3.2Å
174	E	29.9	Very low	47.9	Very low	191 Å²	191	107.8 Å²	107.8	89%	0.893	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	39.5	-178.6	-64.3	175.5	136.1	0	0	113.8	L172	L172-E174 PolarHBondContact O-N 2.99Å; L172-E174 VanDerWaalsContact O-N 3.15Å
175	S	27.4	Very low	45.4	Very low	107 Å²	107	112.2 Å²	112.2	75%	0.748	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136	18.4	-171.3	-59.5	0	0	0	0	115.8	N173	N173-S175 PolarHBondContact O-N 3.2Å
176	V	29.4	Very low	42.9	Very low	122 Å²	122	121.5 Å²	121.5	74%	0.739	63%	0.63	S	S	*	*			trans	-129.1	76.5	163	-170.7	0	0	0	0	109.5	L178	V176-L178 HydrophobicContact CG1-CG 3.94Å; V176-L178 PolarHBondContact O-N 3.26Å; V176-L178 VanDerWaalsContact O-N 3.14Å
177	V	26.7	Very low	40.5	Very low	129 Å²	129	122.6 Å²	122.6	78%	0.782	64%	0.644	S	S	*	*			trans	-70.6	96.8	158.3	178.4	0	0	0	0	106.3	P179	V177-P179 VanDerWaalsContact O-CD 3.23Å; V177-P179 WeakPolarHBondContact O-CD 3.33Å
178	L	26.9	Very low	38.3	Very low	133 Å²	133	127 Å²	127	70%	0.696	67%	0.669	S	S	*	*			trans	-78.1	111.2	163.3	-82.2	171.6	0	0	0	108	V176 S180	V176-L178 HydrophobicContact CG1-CG 3.94Å; V176-L178 PolarHBondContact O-N 3.26Å; V176-L178 VanDerWaalsContact O-N 3.14Å; L178-S180 PolarHBondContact O-N 2.94Å
179	P	26.4	Very low	36.4	Very low	113 Å²	113	131.3 Å²	131.3	73%	0.734	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	32.3	-173.9	-11.5	29.8	0	0	0	114.5	V177	V177-P179 VanDerWaalsContact O-CD 3.23Å; V177-P179 WeakPolarHBondContact O-CD 3.33Å
180	S	33.9	Very low	34.1	Very low	105 Å²	105	134.7 Å²	134.7	73%	0.734	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.9	11	-165.6	-54.8	0	0	0	0	117.7	L178	L178-S180 PolarHBondContact O-N 2.94Å
181	L	31.4	Very low	32.9	Very low	141 Å²	141	139.3 Å²	139.3	74%	0.738	76%	0.761	S	S	*	*			trans	-107.7	38.6	173.1	-77.6	172.6	0	0	0	113.8	K183 F184	L181-K183 VanDerWaalsContact C-N 3.26Å; L181-K183 PolarHBondContact O-N 3.48Å; L181-F184 HydrophobicContact CD2-CD2 4.4Å
182	Q	33.5	Very low	32	Very low	195 Å²	195	143.4 Å²	143.4	91%	0.911	78%	0.776	S	S	*	*			trans	-87.4	19.5	175.6	-147.1	175	2.3	0	0	113.8
183	K	31.1	Very low	31.7	Very low	186 Å²	186	139.6 Å²	139.6	81%	0.809	77%	0.772	S	S	*	*			trans	-142.4	71.3	179.8	-72.6	-175.2	179.4	177.5	0	112.5	L181	L181-K183 VanDerWaalsContact C-N 3.26Å; L181-K183 PolarHBondContact O-N 3.48Å
184	F	32.6	Very low	31.6	Very low	173 Å²	173	141.4 Å²	141.4	76%	0.759	78%	0.78	S	S	*	*			trans	-143.9	122.6	152.9	-85.9	-74.4	0	0	0	110	L181	L181-F184 HydrophobicContact CD2-CD2 4.4Å
185	P	34.5	Very low	31.4	Very low	112 Å²	112	140.9 Å²	140.9	73%	0.727	78%	0.783	S	S	*	*			trans	-95.9	100.7	-177.7	34.7	-26.1	0	0	0	109.9
186	Y	33.3	Very low	31.6	Very low	208 Å²	208	140.2 Å²	140.2	82%	0.816	78%	0.779	S	S	*	*			trans	-140.1	129	158.3	-71.8	-74.1	0	0	0	110.2
187	P	32.1	Very low	31.5	Very low	99 Å²	99	140.7 Å²	140.7	64%	0.643	78%	0.782	S	S	*	*			trans	-75.3	151.5	-171.6	29.7	-33.8	0	0	0	112.7	S189	P187-S189 PolarHBondContact O-N 2.98Å
188	P	37.1	Very low	31.6	Very low	129 Å²	129	139 Å²	139	84%	0.838	77%	0.772	S	S	*	*	S	Bend	trans	-79.7	38.5	-172.2	34.8	-38.3	0	0	0	114.4
189	S	41.9	Very low	31.8	Very low	92 Å²	92	137 Å²	137	64%	0.643	77%	0.774	S	S	*	*			trans	-98.6	-3.9	-170.9	50.9	0	0	0	0	116.2	P187	P187-S189 PolarHBondContact O-N 2.98Å
190	C	34.4	Very low	32	Very low	126 Å²	126	138.1 Å²	138.1	85%	0.851	78%	0.782	S	S	*	*	S	Bend	trans	-90.5	-0.1	-178.4	-86.4	0	0	0	0	116
191	C	35.3	Very low	31.9	Very low	123 Å²	123	136.6 Å²	136.6	83%	0.831	78%	0.782	S	S	*	*			trans	-96.8	9.6	-171.1	-57	0	0	0	0	115.4
192	R	28.3	Very low	32	Very low	251 Å²	251	136.9 Å²	136.9	95%	0.947	79%	0.785	S	S	*	*			trans	-104.3	90	175.3	-85.8	-176.2	173.9	-164.4	-1.3	110.4
193	G	28.2	Very low	32.2	Very low	64 Å²	64	132.9 Å²	132.9	66%	0.66	77%	0.769	S	S	*	*			trans	-163	102.7	175.4	0	0	0	0	0	113.7
194	L	29.1	Very low	32.8	Very low	170 Å²	170	126.1 Å²	126.1	89%	0.89	74%	0.741	S	S	*	*			trans	71.8	79.4	153	-69.3	143.8	0	0	0	118.5
195	L	26.8	Very low	32.8	Very low	180 Å²	180	122.4 Å²	122.4	94%	0.942	73%	0.729	S	S	*	*			trans	-78.9	106.5	145.2	-79.1	152.2	0	0	0	107.7
196	S	30.3	Very low	32.9	Very low	94 Å²	94	121.5 Å²	121.5	66%	0.657	72%	0.721	S	S	*	*			trans	-113.6	111.8	166.7	171.6	0	0	0	0	108.3
197	T	27.4	Very low	32.7	Very low	132 Å²	132	117.1 Å²	117.1	81%	0.81	72%	0.716	S	S	*	*			trans	-83.9	117.7	173.8	51.3	0	0	0	0	109.5
198	T	30	Very low	32.8	Very low	93 Å²	93	115.7 Å²	115.7	57%	0.571	71%	0.706	S	S	*	*			trans	-136.3	119.7	168.3	39.6	0	0	0	0	111.6
199	A	31.2	Very low	32.4	Very low	91 Å²	91	116.7 Å²	116.7	75%	0.752	70%	0.703	S	S	*	*			trans	41.9	127	162.1	0	0	0	0	0	121.1	G201	A199-G201 PolarHBondContact O-N 2.87Å
200	P	29.9	Very low	32	Very low	137 Å²	137	115 Å²	115	89%	0.89	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	123.3	171	33.2	-28.8	0	0	0	109.3
201	G	32.6	Very low	31.7	Very low	72 Å²	72	115.5 Å²	115.5	74%	0.742	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	161	-16.1	172.5	0	0	0	0	0	116.8	A199	A199-G201 PolarHBondContact O-N 2.87Å
202	N	32.5	Very low	31.6	Very low	148 Å²	148	114.9 Å²	114.9	79%	0.791	67%	0.674	S	S	*	*	S	Bend	trans	-111.9	131.8	-179.9	-69.7	-34	0	0	0	110.9	I204	N202-I204 PolarHBondContact O-N 2.77Å; N202-I204 VanDerWaalsContact O-N 3.16Å
203	L	37.3	Very low	31.6	Very low	110 Å²	110	107.9 Å²	107.9	58%	0.576	66%	0.662	S	S	*	*	S	Bend	trans	-55.3	121.9	172.6	-118	87	0	0	0	108.3	N147	N147-L203 PolarHBondContact ND2-O 3.47Å
204	I	45.2	Very low	31.8	Very low	44 Å²	44	112.3 Å²	112.3	23%	0.226	67%	0.666	C	S	.	*			trans	73.3	88.3	169.6	-28.7	149.1	0	0	0	110.8	L129 F143 N147 N202	L129-I204 HydrophobicContact CD2-CG1 4.44Å; F143-I204 HydrophobicContact CE1-CB 4.26Å; F143-I204 HydrophobicContact CE1-CG2 4.42Å; F143-I204 WeakPolarHBondContact CE1-O 3.47Å; F143-I204 HydrophobicContact CE2-CB 3.96Å; F143-I204 HydrophobicContact CE2-CG2 3.32Å; F143-I204 HydrophobicContact CZ-CB 3.41Å; F143-I204 VanDerWaalsContact CZ-CB 3.41Å; F143-I204 HydrophobicContact CZ-CG2 3.2Å; F143-I204 WeakPolarHBondContact CZ-O 3.26Å; N147-I204 WeakPolarHBondContact OD1-CD1 3.24Å; N202-I204 PolarHBondContact O-N 2.77Å; N202-I204 VanDerWaalsContact O-N 3.16Å
205	D	30.7	Very low	31.9	Very low	96 Å²	96	108 Å²	108	51%	0.513	65%	0.648	S	S	.	*			trans	-142.5	75.1	162.4	-161.5	8.7	0	0	0	109.2
206	V	36.5	Very low	32.2	Very low	92 Å²	92	105.5 Å²	105.5	56%	0.558	64%	0.643	S	S	*	*			trans	-142.7	78.3	166.2	-173.4	0	0	0	0	107	V208	V206-V208 HydrophobicContact CG1-CG2 3.9Å; V206-V208 PolarHBondContact O-N 3.16Å; V206-V208 VanDerWaalsContact O-N 3.13Å
207	T	30.5	Very low	32.4	Very low	116 Å²	116	108.7 Å²	108.7	71%	0.712	65%	0.645	S	S	*	*			trans	-76.2	92.8	169	-57.8	0	0	0	0	108
208	V	33.7	Very low	32.6	Very low	70 Å²	70	107.1 Å²	107.1	42%	0.424	64%	0.637	S	S	.	*			trans	-105.6	109.6	162.5	175.3	0	0	0	0	106.9	V206 V210 F233	V206-V208 HydrophobicContact CG1-CG2 3.9Å; V206-V208 PolarHBondContact O-N 3.16Å; V206-V208 VanDerWaalsContact O-N 3.13Å; V208-V210 HydrophobicContact CG1-CG2 4.37Å; V208-V210 PolarHBondContact O-N 3.26Å; V208-F233 HydrophobicContact CB-CE2 4.17Å
209	L	29.1	Very low	32.5	Very low	150 Å²	150	112.5 Å²	112.5	79%	0.785	66%	0.655	S	S	*	*			trans	-64.1	94.3	176.3	-168.6	81.8	0	0	0	109.4	I211	L209-I211 PolarHBondContact O-N 2.99Å
210	V	32.4	Very low	32.6	Very low	56 Å²	56	111.8 Å²	111.8	34%	0.339	66%	0.657	S	S	.	*			trans	-87.5	104.5	169.5	-176.6	0	0	0	0	107.6	V208 V212 P230 F233	V208-V210 HydrophobicContact CG1-CG2 4.37Å; V208-V210 PolarHBondContact O-N 3.26Å; V210-V212 VanDerWaalsContact C-N 3.3Å; V210-V212 HydrophobicContact CG1-CG2 3.92Å; V210-V212 PolarHBondContact O-N 3.45Å; V210-P230 HydrophobicContact CG1-CG 4.15Å; V210-P230 HydrophobicContact CG2-CG 3.88Å; V210-F233 HydrophobicContact CG2-CE2 4.44Å
211	I	28.6	Very low	32.6	Very low	137 Å²	137	114.8 Å²	114.8	70%	0.703	65%	0.652	S	S	*	*			trans	-68.3	93.1	166.5	-58.2	173.7	0	0	0	106.6	L209 C213	L209-I211 PolarHBondContact O-N 2.99Å; I211-C213 PolarHBondContact O-N 2.85Å
212	V	33.9	Very low	32.7	Very low	109 Å²	109	115.8 Å²	115.8	66%	0.661	65%	0.653	S	S	*	*			trans	-77.6	96.7	165.4	-175.6	0	0	0	0	106.3	V210 E214	V210-V212 VanDerWaalsContact C-N 3.3Å; V210-V212 HydrophobicContact CG1-CG2 3.92Å; V210-V212 PolarHBondContact O-N 3.45Å; V212-E214 PolarHBondContact O-N 3.49Å; V212-E214 VanDerWaalsContact O-N 3.11Å
213	C	27.7	Very low	33.2	Very low	104 Å²	104	111.9 Å²	111.9	70%	0.703	64%	0.636	S	S	*	*			trans	-61.2	108.5	158.6	-73	0	0	0	0	107	I211 P215	I211-C213 PolarHBondContact O-N 2.85Å; C213-P215 WeakPolarHBondContact O-CD 3.31Å
214	E	31.7	Very low	33.1	Very low	158 Å²	158	109.7 Å²	109.7	74%	0.738	64%	0.64	S	S	*	*			trans	-64.9	115.8	167.7	-74.5	-178.7	176.1	0	0	108.4	V212	V212-E214 PolarHBondContact O-N 3.49Å; V212-E214 VanDerWaalsContact O-N 3.11Å
215	P	32.9	Very low	33.1	Very low	78 Å²	78	112.2 Å²	112.2	51%	0.506	65%	0.653	S	S	.	*			trans	-72.5	144.2	158.5	31.8	-32.3	0	0	0	108.4	C213 F217	C213-P215 WeakPolarHBondContact O-CD 3.31Å; P215-F217 HydrophobicContact CB-CE2 4.33Å; P215-F217 HydrophobicContact CG-CD2 3.81Å; P215-F217 HydrophobicContact CG-CE2 3.49Å; P215-F217 VanDerWaalsContact CG-CE2 3.49Å; P215-F217 HydrophobicContact CG-CZ 4.46Å; P215-F217 PolarHBondContact O-N 3.33Å
216	P	32.5	Very low	33.9	Very low	129 Å²	129	112.3 Å²	112.3	84%	0.838	65%	0.654	S	S	*	*			trans	-73.3	97.1	176.2	30.8	-30.6	0	0	0	108.1	P218	P216-P218 WeakPolarHBondContact O-CD 3.39Å
217	F	33.6	Very low	34.8	Very low	161 Å²	161	113.4 Å²	113.4	71%	0.706	66%	0.656	S	S	*	*			trans	-82.3	122.2	168.5	-84.1	-76.3	0	0	0	109.5	P215	P215-F217 HydrophobicContact CB-CE2 4.33Å; P215-F217 HydrophobicContact CG-CD2 3.81Å; P215-F217 HydrophobicContact CG-CE2 3.49Å; P215-F217 VanDerWaalsContact CG-CE2 3.49Å; P215-F217 HydrophobicContact CG-CZ 4.46Å; P215-F217 PolarHBondContact O-N 3.33Å
218	P	31.6	Very low	36.5	Very low	98 Å²	98	109.6 Å²	109.6	64%	0.636	63%	0.632	S	S	*	*			trans	-63.4	138.9	171.1	24.4	-29.1	0	0	0	109.8	P216 G220	P216-P218 WeakPolarHBondContact O-CD 3.39Å; P218-G220 PolarHBondContact O-N 2.8Å
219	Q	29.3	Very low	38.4	Very low	206 Å²	206	106.5 Å²	106.5	96%	0.963	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	110.1	178.6	-66.8	171	-0.1	0	0	110
220	G	31.7	Very low	40.5	Very low	76 Å²	76	101.1 Å²	101.1	78%	0.784	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	149.7	-14.6	172.9	0	0	0	0	0	117.4	P218	P218-G220 PolarHBondContact O-N 2.8Å
221	Y	31.2	Very low	42.4	Very low	200 Å²	200	102.7 Å²	102.7	78%	0.784	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-101.8	120.7	177	-88.3	-95.9	0	0	0	111.5
222	A	34.4	Very low	44.5	Very low	93 Å²	93	101.5 Å²	101.5	77%	0.769	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-58.8	121.1	166.4	0	0	0	0	0	108.6	G224	A222-G224 PolarHBondContact O-N 3.16Å
223	P	42	Very low	46.3	Very low	67 Å²	67	97 Å²	97	44%	0.435	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-70.9	119	179.7	27.3	-29.2	0	0	0	108	L225	P223-L225 PolarHBondContact O-N 3.29Å
224	G	36.1	Very low	48.6	Very low	64 Å²	64	96.7 Å²	96.7	66%	0.66	56%	0.563	S	S	*	*			trans	-45.3	134.4	173.5	0	0	0	0	0	111.1	A222 L226	A222-G224 PolarHBondContact O-N 3.16Å; G224-L226 PolarHBondContact O-N 2.95Å
225	L	44.2	Very low	50.9	Low	96 Å²	96	94.4 Å²	94.4	50%	0.503	56%	0.556	S	S	.	*	S	Bend	trans	-62.2	55.9	-176	-95.8	148	0	0	0	114	Q108 P223	Q108-L225 HydrophobicContact CG-CD2 4.25Å; P223-L225 PolarHBondContact O-N 3.29Å
226	L	48.9	Very low	53.5	Low	99 Å²	99	91.2 Å²	91.2	52%	0.518	54%	0.535	S	S	.	.			trans	-166.2	118.6	171.9	-92.3	118.6	0	0	0	106.8	R171 G224	R171-L226 HydrophobicContact CB-CD2 4.24Å; G224-L226 PolarHBondContact O-N 2.95Å
227	N	54.1	Low	56.4	Low	115 Å²	115	85.9 Å²	85.9	62%	0.615	50%	0.502	S	S	*	.			trans	151.9	47.2	159.3	-71.9	-20.5	0	0	0	112.9	V170	V170-N227 WeakPolarHBondContact CG1-OD1 3.33Å; V170-N227 HydrophobicContact CG2-CB 4.14Å
228	V	66.6	Low	59.2	Low	35 Å²	35	78.3 Å²	78.3	21%	0.212	47%	0.469	C	S	.	.	S	Bend	trans	-92	-45.4	-172.4	-173.2	0	0	0	0	112.5	T117 C128 Q131 L168	T117-V228 HydrophobicContact CG2-CG2 3.96Å; T117-V228 WeakPolarHBondContact OG1-CG2 3.14Å; C128-V228 HydrophobicContact CB-CG1 4.41Å; Q131-V228 HydrophobicContact CB-CG1 3.78Å; Q131-V228 HydrophobicContact CG-CG1 4.07Å; Q131-V228 VanDerWaalsContact OE1-CG1 3.24Å; L168-V228 HydrophobicContact CD2-CB 4.15Å; L168-V228 HydrophobicContact CD2-CG1 4.25Å; L168-V228 HydrophobicContact CD2-CG2 4.17Å; L168-V228 PolarHBondContact O-N 2.86Å
229	L	73.4	Confident	62.1	Low	5 Å²	5	73.7 Å²	73.7	3%	0.026	44%	0.439	C	S	.	.	B	Isolated β-bridge	trans	-123.8	140.4	-176.4	-60.3	178.4	0	0	0	111	T130 M165 L168 K169 V170 F233	T130-L229 HydrophobicContact CG2-CD2 3.62Å; M165-L229 HydrophobicContact CE-CD1 4.36Å; L168-L229 HydrophobicContact CB-CD1 3.9Å; L168-L229 HydrophobicContact CB-CG 4.22Å; L168-L229 HydrophobicContact CD1-CD1 3.93Å; L168-L229 PolarHBondContact O-N 3.34Å; L168-L229 VanDerWaalsContact O-N 3.07Å; K169-L229 WeakPolarHBondContact CA-O 3.42Å; V170-L229 PolarHBondContact N-O 3.47Å; V170-L229 VanDerWaalsContact N-O 3.16Å; L229-F233 HydrophobicContact CB-CB 4.06Å; L229-F233 HydrophobicContact CB-CG 4.31Å; L229-F233 HydrophobicContact CD1-CD1 4Å; L229-F233 HydrophobicContact CD2-CD1 4.22Å; L229-F233 HydrophobicContact CD2-CE1 4.36Å; L229-F233 HydrophobicContact CD2-CG 4.45Å
230	P	73.1	Confident	65.2	Low	38 Å²	38	64.5 Å²	64.5	25%	0.247	40%	0.397	C	S	.	.			trans	-54.1	149.4	170.9	-24.9	33.8	0	0	0	112	V210 T232 F233	V210-P230 HydrophobicContact CG1-CG 4.15Å; V210-P230 HydrophobicContact CG2-CG 3.88Å; P230-T232 PolarHBondContact O-N 3.3Å; P230-T232 VanDerWaalsContact O-N 3.12Å; P230-F233 WeakPolarHBondContact O-CB 3.49Å; P230-F233 PolarHBondContact O-N 3Å
231	V	72	Confident	68.1	Low	89 Å²	89	62.3 Å²	62.3	54%	0.539	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-29	176.2	-70.2	0	0	0	0	113.2	K169 V170 F233	K169-V231 PolarHBondContact NZ-O 3.35Å; V170-V231 HydrophobicContact CB-CG1 4.47Å; V170-V231 WeakPolarHBondContact O-CG1 3.43Å; V231-F233 PolarHBondContact O-N 3.35Å
232	T	73.5	Confident	71.1	Confident	111 Å²	111	53 Å²	53	68%	0.681	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.6	177.2	54.1	0	0	0	0	113.5	P230 T234	P230-T232 PolarHBondContact O-N 3.3Å; P230-T232 VanDerWaalsContact O-N 3.12Å; T232-T234 PolarHBondContact O-N 3.44Å
233	F	72.3	Confident	73.9	Confident	15 Å²	15	49.7 Å²	49.7	7%	0.066	30%	0.3	C	S	.	.			trans	-68.2	117.9	-179.6	-133.6	-100.1	0	0	0	109.6	T130 K169 V208 V210 L229 P230 V231 N235	T130-F233 HydrophobicContact CG2-CE1 3.72Å; T130-F233 HydrophobicContact CG2-CE2 4.29Å; T130-F233 HydrophobicContact CG2-CZ 3.48Å; T130-F233 VanDerWaalsContact CG2-CZ 3.48Å; K169-F233 WeakPolarHBondContact CE-O 3.36Å; K169-F233 PolarHBondContact NZ-O 3.05Å; V208-F233 HydrophobicContact CB-CE2 4.17Å; V210-F233 HydrophobicContact CG2-CE2 4.44Å; L229-F233 HydrophobicContact CB-CB 4.06Å; L229-F233 HydrophobicContact CB-CG 4.31Å; L229-F233 HydrophobicContact CD1-CD1 4Å; L229-F233 HydrophobicContact CD2-CD1 4.22Å; L229-F233 HydrophobicContact CD2-CE1 4.36Å; L229-F233 HydrophobicContact CD2-CG 4.45Å; P230-F233 WeakPolarHBondContact O-CB 3.49Å; P230-F233 PolarHBondContact O-N 3Å; V231-F233 PolarHBondContact O-N 3.35Å; F233-N235 WeakPolarHBondContact CD1-O 3.31Å; F233-N235 WeakPolarHBondContact CE1-O 3.35Å
234	T	74.8	Confident	76.4	Confident	98 Å²	98	46.5 Å²	46.5	60%	0.601	28%	0.279	S	S	*	.			trans	-86.4	-37	-175.4	49.9	0	0	0	0	111.8	M165 T232	M165-T234 WeakPolarHBondContact CE-O 3.23Å; T232-T234 PolarHBondContact O-N 3.44Å
235	N	81.7	Confident	79.1	Confident	110 Å²	110	43.7 Å²	43.7	59%	0.588	25%	0.249	S	C	*	.			trans	-140.6	140.8	-170.9	-60.8	-28.1	0	0	0	111.3	F233	F233-N235 WeakPolarHBondContact CD1-O 3.31Å; F233-N235 WeakPolarHBondContact CE1-O 3.35Å
236	S	87.1	Confident	81.4	Confident	10 Å²	10	39.7 Å²	39.7	7%	0.07	23%	0.227	C	C	.	.			trans	-140.6	167.8	166.2	-177.7	0	0	0	0	107.8	T130 C160 M165	T130-S236 PolarHBondContact OG1-OG 2.98Å; T130-S236 VanDerWaalsContact OG1-OG 3.04Å; C160-S236 WeakPolarHBondContact CB-O 3.37Å; C160-S236 PolarHBondContact N-O 3.42Å; M165-S236 PolarHBondContact SD-N 3.42Å
237	A	92.3	Very high	83.5	Confident	18 Å²	18	35 Å²	35	15%	0.149	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-123.5	172.9	173.6	0	0	0	0	0	109.9	L129 C157 P158	L129-A237 HydrophobicContact CB-CB 4.16Å; L129-A237 WeakPolarHBondContact CB-O 3.2Å; L129-A237 HydrophobicContact CD2-CB 3.79Å; L129-A237 PolarHBondContact N-O 2.9Å; C157-A237 HydrophobicContact CB-CB 4.29Å; P158-A237 CarbonylContact O-C 3.5Å; P158-A237 VanDerWaalsContact O-CA 3.27Å; P158-A237 WeakPolarHBondContact O-CA 3.39Å; P158-A237 WeakPolarHBondContact O-CB 3.49Å
238	L	92.6	Very high	85.4	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	148.1	177.4	-58.2	176.3	0	0	0	110.7	F119 I121 R126 L127 C157 P158 C160	F119-L238 HydrophobicContact CD2-CD1 4.16Å; F119-L238 HydrophobicContact CD2-CD2 3.84Å; F119-L238 HydrophobicContact CE2-CD2 4.22Å; I121-L238 HydrophobicContact CD1-CD1 3.76Å; R126-L238 HydrophobicContact CB-CB 4Å; R126-L238 HydrophobicContact CB-CD1 4.14Å; L127-L238 VanDerWaalsContact O-CA 3.25Å; L127-L238 WeakPolarHBondContact O-CA 3.18Å; C157-L238 CarbonylContact C-O 3.57Å; C157-L238 WeakPolarHBondContact CA-O 3.4Å; C157-L238 WeakPolarHBondContact CB-O 3.33Å; P158-L238 VanDerWaalsContact CD-O 3.28Å; P158-L238 WeakPolarHBondContact CD-O 3.35Å; P158-L238 HydrophobicContact CG-CB 4.43Å; P158-L238 PolarHBondContact O-N 3.36Å; C160-L238 VanDerWaalsContact SG-CD2 3.59Å
239	I	93.7	Very high	86.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	138.8	171.3	-174.5	170	0	0	0	109.1	R126 L127 L129 F132 I155 D243 A244 L247	R126-I239 CarbonylContact C-O 3.55Å; R126-I239 VanDerWaalsContact CA-O 3.32Å; R126-I239 WeakPolarHBondContact CA-O 3.46Å; L127-I239 HydrophobicContact CB-CG2 4.05Å; L127-I239 PolarHBondContact N-O 2.99Å; L127-I239 PolarHBondContact O-N 3.44Å; L129-I239 HydrophobicContact CD1-CB 4.07Å; L129-I239 HydrophobicContact CD1-CD1 4.46Å; L129-I239 HydrophobicContact CD1-CG2 4Å; F132-I239 HydrophobicContact CD1-CG2 4Å; F132-I239 HydrophobicContact CE1-CD1 4.01Å; F132-I239 HydrophobicContact CE1-CG2 4.39Å; F132-I239 HydrophobicContact CG-CG2 4.36Å; I155-I239 HydrophobicContact CG2-CD1 3.97Å; I155-I239 HydrophobicContact CG2-CG1 4.19Å; I239-D243 HydrophobicContact CD1-CB 4.2Å; I239-D243 HydrophobicContact CG1-CB 3.87Å; I239-A244 HydrophobicContact CD1-CB 4.28Å; I239-A244 HydrophobicContact CG1-CB 4.42Å; I239-A244 HydrophobicContact CG2-CB 4.3Å; I239-L247 HydrophobicContact CD1-CD2 4.05Å
240	T	93.7	Very high	87.5	Confident	14 Å²	14	29.7 Å²	29.7	9%	0.086	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	149.2	177.1	71.9	0	0	0	0	110.1	T242 D243 A244	T240-T242 PolarHBondContact O-N 2.89Å; T240-D243 PolarHBondContact O-N 3.32Å; T240-D243 VanDerWaalsContact OG1-CB 3.23Å; T240-D243 WeakPolarHBondContact OG1-CB 3.25Å; T240-D243 PolarHBondContact OG1-N 3.34Å; T240-D243 PolarHBondContact OG1-OD2 3.21Å; T240-A244 WeakPolarHBondContact O-CB 3.32Å; T240-A244 PolarHBondContact O-N 2.87Å
241	K	92.9	Very high	88.4	Confident	30 Å²	30	28 Å²	28	13%	0.13	16%	0.16	C	C	.	.	H	α-helix	trans	-57.2	-38.9	175.9	-169.9	-175.8	179.3	-171.2	0	111.1	K125 L127 A244 V245 N343 D345	K125-K241 HydrophobicContact CB-CB 4.2Å; K125-K241 PolarHBondContact O-N 2.84Å; L127-K241 HydrophobicContact CD1-CB 3.66Å; L127-K241 HydrophobicContact CD1-CG 4.18Å; K241-A244 PolarHBondContact O-N 3.4Å; K241-V245 WeakPolarHBondContact O-CG2 3.47Å; K241-V245 PolarHBondContact O-N 3.4Å; K241-V245 VanDerWaalsContact O-N 3.16Å; K241-N343 PolarHBondContact NZ-OD1 2.84Å; K241-D345 IonicContact NZ-OD2 3.91Å
242	T	93	Very high	89.3	Confident	4 Å²	4	24.8 Å²	24.8	3%	0.025	14%	0.142	C	C	.	.	H	α-helix	trans	-59.2	-52.6	175.9	-58	0	0	0	0	111.4	T240 A244 V245 R246 F291 H339 F342	T240-T242 PolarHBondContact O-N 2.89Å; T242-A244 VanDerWaalsContact C-N 3.32Å; T242-A244 PolarHBondContact O-N 3.43Å; T242-V245 PolarHBondContact O-N 3.42Å; T242-R246 WeakPolarHBondContact O-CB 3.21Å; T242-R246 PolarHBondContact O-N 2.91Å; T242-F291 HydrophobicContact CG2-CE1 3.81Å; T242-F291 HydrophobicContact CG2-CZ 4.05Å; T242-H339 HydrophobicContact CG2-CB 3.47Å; T242-H339 VanDerWaalsContact CG2-CB 3.47Å; T242-H339 WeakPolarHBondContact CG2-O 3.45Å; T242-F342 HydrophobicContact CG2-CB 3.7Å; T242-F342 PolarHBondContact OG1-N 3.45Å
243	D	93.6	Very high	90	Very high	24 Å²	24	20.5 Å²	20.5	13%	0.128	11%	0.114	C	C	.	.	H	α-helix	trans	-67.1	-34.1	-179.1	-69	-39	0	0	0	112.2	I155 I239 T240 V245 R246 L247	I155-D243 HydrophobicContact CD1-CB 4.19Å; I155-D243 HydrophobicContact CG1-CB 4.12Å; I155-D243 HydrophobicContact CG2-CB 3.77Å; I239-D243 HydrophobicContact CD1-CB 4.2Å; I239-D243 HydrophobicContact CG1-CB 3.87Å; T240-D243 PolarHBondContact O-N 3.32Å; T240-D243 VanDerWaalsContact OG1-CB 3.23Å; T240-D243 WeakPolarHBondContact OG1-CB 3.25Å; T240-D243 PolarHBondContact OG1-N 3.34Å; T240-D243 PolarHBondContact OG1-OD2 3.21Å; D243-V245 PolarHBondContact O-N 2.95Å; D243-R246 PolarHBondContact O-N 3.21Å; D243-L247 WeakPolarHBondContact O-CB 3.06Å; D243-L247 PolarHBondContact O-N 2.71Å
244	A	94.1	Very high	90.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60	-44.9	174.8	0	0	0	0	0	111.7	F111 L127 F132 I239 T240 K241 T242 Y248	F111-A244 HydrophobicContact CD2-CB 4.43Å; F111-A244 HydrophobicContact CE2-CB 4.11Å; L127-A244 HydrophobicContact CD2-CB 4.29Å; F132-A244 HydrophobicContact CD2-CB 4.32Å; F132-A244 HydrophobicContact CE1-CB 4.3Å; F132-A244 HydrophobicContact CE2-CB 3.71Å; F132-A244 HydrophobicContact CZ-CB 3.68Å; I239-A244 HydrophobicContact CD1-CB 4.28Å; I239-A244 HydrophobicContact CG1-CB 4.42Å; I239-A244 HydrophobicContact CG2-CB 4.3Å; T240-A244 WeakPolarHBondContact O-CB 3.32Å; T240-A244 PolarHBondContact O-N 2.87Å; K241-A244 PolarHBondContact O-N 3.4Å; T242-A244 VanDerWaalsContact C-N 3.32Å; T242-A244 PolarHBondContact O-N 3.43Å; A244-Y248 WeakPolarHBondContact O-CB 3.21Å; A244-Y248 PolarHBondContact O-N 2.95Å; A244-Y248 VanDerWaalsContact O-N 3.09Å
245	V	93.2	Very high	91.1	Very high	5 Å²	5	22.2 Å²	22.2	3%	0.03	12%	0.122	C	C	.	.	H	α-helix	trans	-70.1	-41	177	-179.5	0	0	0	0	111.1	F111 K241 T242 D243 Y248 G249 F342	F111-V245 HydrophobicContact CD2-CG2 4.26Å; F111-V245 HydrophobicContact CE2-CG2 3.87Å; K241-V245 WeakPolarHBondContact O-CG2 3.47Å; K241-V245 PolarHBondContact O-N 3.4Å; K241-V245 VanDerWaalsContact O-N 3.16Å; T242-V245 PolarHBondContact O-N 3.42Å; D243-V245 PolarHBondContact O-N 2.95Å; V245-Y248 PolarHBondContact O-N 3.44Å; V245-G249 PolarHBondContact O-N 2.93Å; V245-F342 HydrophobicContact CB-CD1 4.39Å; V245-F342 HydrophobicContact CB-CE1 4.02Å; V245-F342 HydrophobicContact CG1-CD1 4.44Å; V245-F342 HydrophobicContact CG1-CE1 3.61Å; V245-F342 HydrophobicContact CG1-CZ 4.41Å; V245-F342 HydrophobicContact CG2-CE1 4.48Å
246	R	92.7	Very high	90.9	Very high	11 Å²	11	20.4 Å²	20.4	4%	0.042	11%	0.109	C	C	.	.	H	α-helix	trans	-59.5	-48.5	177.1	-171.8	-174.1	-178	-179.9	8	112.3	L153 T242 D243 G249 F250 F291 E334 H339	L153-R246 HydrophobicContact CD1-CG 4.37Å; T242-R246 WeakPolarHBondContact O-CB 3.21Å; T242-R246 PolarHBondContact O-N 2.91Å; D243-R246 PolarHBondContact O-N 3.21Å; R246-G249 PolarHBondContact O-N 3.29Å; R246-F250 PolarHBondContact O-N 2.82Å; R246-F250 VanDerWaalsContact O-N 3.1Å; R246-F291 HydrophobicContact CB-CD1 4.05Å; R246-F291 HydrophobicContact CB-CE1 3.76Å; R246-F291 HydrophobicContact CB-CE2 4.38Å; R246-F291 HydrophobicContact CB-CG 4.49Å; R246-F291 HydrophobicContact CB-CZ 3.93Å; R246-F291 HydrophobicContact CG-CD1 3.65Å; R246-F291 HydrophobicContact CG-CE1 3.89Å; R246-F291 HydrophobicContact CG-CG 4.01Å; R246-F291 HydrophobicContact CG-CZ 4.42Å; R246-E334 PolarHBondContact NH2-O 2.74Å; R246-H339 PolarHBondContact NH1-CD2 3.1Å
247	L	93.3	Very high	90.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-57.2	-50	175.5	172.9	58.1	0	0	0	110.9	F132 I146 T149 I155 I239 D243 F250 L251	F132-L247 HydrophobicContact CE1-CD2 3.8Å; F132-L247 HydrophobicContact CZ-CD2 4.2Å; I146-L247 HydrophobicContact CG2-CD1 4.48Å; I146-L247 HydrophobicContact CG2-CD2 4.15Å; T149-L247 HydrophobicContact CG2-CD1 3.37Å; I155-L247 HydrophobicContact CD1-CB 3.75Å; I155-L247 HydrophobicContact CD1-CD1 4.45Å; I239-L247 HydrophobicContact CD1-CD2 4.05Å; D243-L247 WeakPolarHBondContact O-CB 3.06Å; D243-L247 PolarHBondContact O-N 2.71Å; L247-F250 PolarHBondContact O-N 3.4Å; L247-L251 HydrophobicContact CD1-CD1 3.78Å; L247-L251 HydrophobicContact CD1-CG 4.13Å; L247-L251 HydrophobicContact CG-CD1 3.94Å; L247-L251 WeakPolarHBondContact O-CB 3.26Å; L247-L251 VanDerWaalsContact O-CG 3.3Å; L247-L251 WeakPolarHBondContact O-CG 2.92Å; L247-L251 PolarHBondContact O-N 3.22Å
248	Y	93.4	Very high	88.6	Confident	28 Å²	28	25.4 Å²	25.4	11%	0.11	14%	0.143	C	C	.	.	H	α-helix	trans	-63.7	-44.9	-179.2	178.9	-110.7	0	0	0	112.7	F111 E112 S137 L138 R140 F141 A244 V245 F250 L251 C252	F111-Y248 HydrophobicContact CE1-CG 4.42Å; F111-Y248 HydrophobicContact CZ-CD1 4.15Å; F111-Y248 HydrophobicContact CZ-CD2 4.45Å; F111-Y248 AromaticContact CZ-CG 3.86Å; F111-Y248 HydrophobicContact CZ-CG 3.86Å; E112-Y248 HydrophobicContact CG-CD1 3.97Å; E112-Y248 HydrophobicContact CG-CE1 3.56Å; S137-Y248 WeakPolarHBondContact O-CE2 3.04Å; L138-Y248 HydrophobicContact CD2-CD2 4.12Å; R140-Y248 VanDerWaalsContact NH2-CE2 3.3Å; R140-Y248 PolarHBondContact NH2-OH 2.88Å; R140-Y248 VanDerWaalsContact NH2-OH 3.08Å; F141-Y248 HydrophobicContact CE2-CD2 4.27Å; F141-Y248 HydrophobicContact CE2-CE2 4.16Å; A244-Y248 WeakPolarHBondContact O-CB 3.21Å; A244-Y248 PolarHBondContact O-N 2.95Å; A244-Y248 VanDerWaalsContact O-N 3.09Å; V245-Y248 PolarHBondContact O-N 3.44Å; Y248-F250 VanDerWaalsContact C-N 3.32Å; Y248-F250 PolarHBondContact O-N 2.92Å; Y248-L251 PolarHBondContact O-N 3Å; Y248-C252 VanDerWaalsContact CZ-SG 3.53Å; Y248-C252 PolarHBondContact O-N 2.95Å; Y248-C252 PolarHBondContact O-SG 3.36Å
249	G	91.8	Very high	87	Confident	5 Å²	5	30.8 Å²	30.8	5%	0.052	17%	0.172	C	C	.	.	H	α-helix	trans	-58.2	-43.5	177.1	0	0	0	0	0	112.4	V245 R246 C252 L253	V245-G249 PolarHBondContact O-N 2.93Å; R246-G249 PolarHBondContact O-N 3.29Å; G249-C252 WeakPolarHBondContact O-CB 3.03Å; G249-C252 PolarHBondContact O-N 3.46Å; G249-L253 PolarHBondContact O-N 3.49Å; G249-L253 VanDerWaalsContact O-N 3.15Å
250	F	91.7	Very high	85.2	Confident	12 Å²	12	32.6 Å²	32.6	5%	0.053	18%	0.181	C	C	.	.	H	α-helix	trans	-65.7	-46	176.3	-172.3	-91.7	0	0	0	112.7	T149 Y152 L153 R246 L247 Y248 C252 L253 Q254 F333	T149-F250 HydrophobicContact CG2-CB 4.29Å; T149-F250 HydrophobicContact CG2-CD1 3.26Å; T149-F250 HydrophobicContact CG2-CE1 3.76Å; T149-F250 HydrophobicContact CG2-CG 4.06Å; Y152-F250 HydrophobicContact CD1-CE1 4.03Å; Y152-F250 AromaticContact CD1-CE2 3.96Å; Y152-F250 HydrophobicContact CD1-CE2 3.96Å; Y152-F250 AromaticContact CD1-CZ 3.47Å; Y152-F250 HydrophobicContact CD1-CZ 3.47Å; Y152-F250 VanDerWaalsContact CD1-CZ 3.47Å; Y152-F250 HydrophobicContact CE1-CE1 4.38Å; Y152-F250 AromaticContact CE1-CE2 3.56Å; Y152-F250 HydrophobicContact CE1-CE2 3.56Å; Y152-F250 AromaticContact CE1-CZ 3.39Å; Y152-F250 HydrophobicContact CE1-CZ 3.39Å; Y152-F250 HydrophobicContact CG-CZ 4.47Å; L153-F250 HydrophobicContact CD1-CB 3.9Å; L153-F250 HydrophobicContact CD1-CD1 4.46Å; L153-F250 HydrophobicContact CD1-CG 4.1Å; L153-F250 HydrophobicContact CD2-CD2 3.99Å; L153-F250 HydrophobicContact CD2-CE2 4.27Å; L153-F250 HydrophobicContact CD2-CG 4.3Å; R246-F250 PolarHBondContact O-N 2.82Å; R246-F250 VanDerWaalsContact O-N 3.1Å; L247-F250 PolarHBondContact O-N 3.4Å; Y248-F250 VanDerWaalsContact C-N 3.32Å; Y248-F250 PolarHBondContact O-N 2.92Å; F250-C252 VanDerWaalsContact C-N 3.3Å; F250-C252 PolarHBondContact O-N 3.29Å; F250-L253 WeakPolarHBondContact O-CB 3.47Å; F250-L253 PolarHBondContact O-N 3.3Å; F250-L253 VanDerWaalsContact O-N 3.16Å; F250-Q254 HydrophobicContact CD1-CG 3.93Å; F250-Q254 HydrophobicContact CE1-CG 3.73Å; F250-Q254 HydrophobicContact CZ-CG 4.21Å; F250-Q254 VanDerWaalsContact CZ-NE2 3.31Å; F250-Q254 WeakPolarHBondContact O-CG 3.19Å; F250-Q254 PolarHBondContact O-N 3.35Å; F250-F333 AromaticContact CD2-CD1 3.95Å; F250-F333 HydrophobicContact CD2-CD1 3.95Å; F250-F333 HydrophobicContact CD2-CD2 4.09Å; F250-F333 AromaticContact CD2-CE1 3.57Å; F250-F333 HydrophobicContact CD2-CE1 3.57Å; F250-F333 AromaticContact CD2-CE2 3.72Å; F250-F333 HydrophobicContact CD2-CE2 3.72Å; F250-F333 HydrophobicContact CD2-CG 4.16Å; F250-F333 AromaticContact CD2-CZ 3.38Å; F250-F333 HydrophobicContact CD2-CZ 3.38Å; F250-F333 HydrophobicContact CE2-CD1 4.44Å; F250-F333 AromaticContact CE2-CD2 3.81Å; F250-F333 HydrophobicContact CE2-CD2 3.81Å; F250-F333 HydrophobicContact CE2-CE1 4.28Å; F250-F333 AromaticContact CE2-CE2 3.62Å; F250-F333 HydrophobicContact CE2-CE2 3.62Å; F250-F333 HydrophobicContact CE2-CG 4.19Å; F250-F333 AromaticContact CE2-CZ 3.82Å; F250-F333 HydrophobicContact CE2-CZ 3.82Å; F250-F333 HydrophobicContact CG-CZ 4.5Å
251	L	92.3	Very high	83.1	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-40.7	176.9	-74.2	169.7	0	0	0	111.6	L138 F141 I146 T149 L247 Y248 L253 Q254 S255	L138-L251 HydrophobicContact CD2-CD1 3.64Å; F141-L251 HydrophobicContact CD1-CB 4.04Å; F141-L251 HydrophobicContact CD1-CD2 4.28Å; F141-L251 HydrophobicContact CD2-CB 4.17Å; F141-L251 HydrophobicContact CD2-CD1 4.06Å; F141-L251 HydrophobicContact CE1-CB 3.69Å; F141-L251 VanDerWaalsContact CE1-O 3.25Å; F141-L251 WeakPolarHBondContact CE1-O 3.08Å; F141-L251 HydrophobicContact CE2-CB 3.83Å; F141-L251 HydrophobicContact CE2-CD1 4.38Å; F141-L251 HydrophobicContact CG-CB 4.25Å; F141-L251 HydrophobicContact CG-CD1 4.26Å; F141-L251 HydrophobicContact CG-CD2 4.38Å; F141-L251 HydrophobicContact CZ-CB 3.55Å; I146-L251 HydrophobicContact CG1-CD1 3.97Å; T149-L251 HydrophobicContact CG2-CD2 4.35Å; T149-L251 HydrophobicContact CG2-CG 4.29Å; T149-L251 WeakPolarHBondContact OG1-CD2 3.49Å; L247-L251 HydrophobicContact CD1-CD1 3.78Å; L247-L251 HydrophobicContact CD1-CG 4.13Å; L247-L251 HydrophobicContact CG-CD1 3.94Å; L247-L251 WeakPolarHBondContact O-CB 3.26Å; L247-L251 VanDerWaalsContact O-CG 3.3Å; L247-L251 WeakPolarHBondContact O-CG 2.92Å; L247-L251 PolarHBondContact O-N 3.22Å; Y248-L251 PolarHBondContact O-N 3Å; L251-L253 VanDerWaalsContact C-N 3.34Å; L251-L253 PolarHBondContact O-N 2.76Å; L251-Q254 PolarHBondContact O-N 3.38Å; L251-S255 PolarHBondContact O-N 2.85Å; L251-S255 PolarHBondContact O-OG 3.25Å
252	C	90.7	Very high	81.1	Confident	22 Å²	22	43.4 Å²	43.4	15%	0.149	23%	0.233	C	C	.	.	H	α-helix	trans	-57.5	-47.6	174.3	-68	0	0	0	0	111.6	R140 Y248 G249 F250 S255	R140-C252 PolarHBondContact NH2-SG 2.96Å; Y248-C252 VanDerWaalsContact CZ-SG 3.53Å; Y248-C252 PolarHBondContact O-N 2.95Å; Y248-C252 PolarHBondContact O-SG 3.36Å; G249-C252 WeakPolarHBondContact O-CB 3.03Å; G249-C252 PolarHBondContact O-N 3.46Å; F250-C252 VanDerWaalsContact C-N 3.3Å; F250-C252 PolarHBondContact O-N 3.29Å; C252-S255 PolarHBondContact O-N 3.06Å; C252-S255 PolarHBondContact O-OG 3.41Å
253	L	88.3	Confident	79.1	Confident	20 Å²	20	51.8 Å²	51.8	11%	0.105	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-47	179.5	178.6	67.3	0	0	0	111.8	G249 F250 L251 S255 K256 A257 A329 H330 F333	G249-L253 PolarHBondContact O-N 3.49Å; G249-L253 VanDerWaalsContact O-N 3.15Å; F250-L253 WeakPolarHBondContact O-CB 3.47Å; F250-L253 PolarHBondContact O-N 3.3Å; F250-L253 VanDerWaalsContact O-N 3.16Å; L251-L253 VanDerWaalsContact C-N 3.34Å; L251-L253 PolarHBondContact O-N 2.76Å; L253-S255 VanDerWaalsContact C-N 3.31Å; L253-S255 PolarHBondContact O-N 3.13Å; L253-K256 PolarHBondContact O-N 3.18Å; L253-K256 VanDerWaalsContact O-N 3.07Å; L253-A257 PolarHBondContact O-N 3.48Å; L253-A257 VanDerWaalsContact O-N 3.09Å; L253-A329 WeakPolarHBondContact CD2-O 3.17Å; L253-H330 WeakPolarHBondContact CD1-CE1 3.26Å; L253-F333 HydrophobicContact CD2-CE2 4.3Å; L253-F333 HydrophobicContact CD2-CZ 3.94Å
254	Q	85.5	Confident	76.9	Confident	94 Å²	94	58.5 Å²	58.5	44%	0.439	29%	0.292	S	S	.	.	H	α-helix	trans	-60.2	-40.4	-179.7	-73.2	-163.1	-31	0	0	112.5	F250 L251 K256 A257	F250-Q254 HydrophobicContact CD1-CG 3.93Å; F250-Q254 HydrophobicContact CE1-CG 3.73Å; F250-Q254 HydrophobicContact CZ-CG 4.21Å; F250-Q254 VanDerWaalsContact CZ-NE2 3.31Å; F250-Q254 WeakPolarHBondContact O-CG 3.19Å; F250-Q254 PolarHBondContact O-N 3.35Å; L251-Q254 PolarHBondContact O-N 3.38Å; Q254-K256 PolarHBondContact O-N 3.45Å; Q254-A257 PolarHBondContact O-N 3.22Å
255	S	84.9	Confident	74.6	Confident	55 Å²	55	62.7 Å²	62.7	39%	0.385	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-21.4	177.9	65.3	0	0	0	0	114	L251 C252 L253	L251-S255 PolarHBondContact O-N 2.85Å; L251-S255 PolarHBondContact O-OG 3.25Å; C252-S255 PolarHBondContact O-N 3.06Å; C252-S255 PolarHBondContact O-OG 3.41Å; L253-S255 VanDerWaalsContact C-N 3.31Å; L253-S255 PolarHBondContact O-N 3.13Å
256	K	79	Confident	72.4	Confident	72 Å²	72	68.6 Å²	68.6	31%	0.313	35%	0.352	S	S	.	.	H	α-helix	trans	-102.5	-16.6	-177	-66.2	-179.3	-176.2	-174	0	113.7	L253 Q254 P258 L259 L260 E318	L253-K256 PolarHBondContact O-N 3.18Å; L253-K256 VanDerWaalsContact O-N 3.07Å; Q254-K256 PolarHBondContact O-N 3.45Å; K256-P258 VanDerWaalsContact C-N 3.31Å; K256-L259 WeakPolarHBondContact O-CB 3.5Å; K256-L259 PolarHBondContact O-N 3.41Å; K256-L260 PolarHBondContact O-N 3.15Å; K256-E318 WeakPolarHBondContact CD-OE2 3.27Å; K256-E318 VanDerWaalsContact NZ-CD 3.28Å; K256-E318 IonicContact NZ-OE1 2.91Å; K256-E318 PolarHBondContact NZ-OE1 2.85Å; K256-E318 IonicContact NZ-OE2 3.7Å
257	A	70.2	Confident	70	Confident	47 Å²	47	72 Å²	72	39%	0.388	38%	0.378	S	S	.	.	H	α-helix	trans	-48.9	-43.6	178.4	0	0	0	0	0	113.8	L253 Q254 L259 L260	L253-A257 PolarHBondContact O-N 3.48Å; L253-A257 VanDerWaalsContact O-N 3.09Å; Q254-A257 PolarHBondContact O-N 3.22Å; A257-L259 PolarHBondContact O-N 3.05Å; A257-L260 PolarHBondContact O-N 3.31Å
258	P	59.7	Low	67.3	Low	86 Å²	86	77.7 Å²	77.7	56%	0.558	42%	0.418	S	S	*	.	H	α-helix	trans	-65.5	-21.6	179.5	-19.6	32.3	0	0	0	114.7	K256	K256-P258 VanDerWaalsContact C-N 3.31Å
259	L	59	Low	64.5	Low	116 Å²	116	81.9 Å²	81.9	61%	0.607	45%	0.447	S	S	*	.	H	α-helix	trans	-85.2	-23	-178.6	-61.7	179	0	0	0	112.5	K256 A257	K256-L259 WeakPolarHBondContact O-CB 3.5Å; K256-L259 PolarHBondContact O-N 3.41Å; A257-L259 PolarHBondContact O-N 3.05Å
260	L	55.2	Low	61.6	Low	37 Å²	37	87.5 Å²	87.5	19%	0.194	48%	0.48	C	S	.	.	H	α-helix	trans	-82.1	-32.8	-176.5	-64.2	171.8	0	0	0	112.1	K256 A257 K262 R263 K264 C316	K256-L260 PolarHBondContact O-N 3.15Å; A257-L260 PolarHBondContact O-N 3.31Å; L260-K262 VanDerWaalsContact C-N 3.29Å; L260-K262 PolarHBondContact O-N 2.81Å; L260-R263 PolarHBondContact O-N 3.39Å; L260-K264 PolarHBondContact O-N 3.04Å; L260-C316 HydrophobicContact CD1-CB 3.32Å; L260-C316 HydrophobicContact CD2-CB 4.13Å; L260-C316 WeakPolarHBondContact CD2-O 3.39Å; L260-C316 HydrophobicContact CG-CB 4.36Å
261	D	51.6	Low	59	Low	116 Å²	116	95.9 Å²	95.9	62%	0.62	53%	0.525	S	S	*	.	H	α-helix	trans	-66.3	-32.1	175.6	-75.6	-22.4	0	0	0	112.3
262	K	50	Low	55.9	Low	156 Å²	156	98.8 Å²	98.8	68%	0.678	56%	0.555	S	S	*	*	H	α-helix	trans	-70.5	-28.2	173.7	-74.8	-174	176	-177	0	113.8	L260 S265	L260-K262 VanDerWaalsContact C-N 3.29Å; L260-K262 PolarHBondContact O-N 2.81Å; K262-S265 PolarHBondContact O-OG 3.18Å; K262-S265 VanDerWaalsContact O-OG 3.13Å
263	R	50	Low	52.9	Low	179 Å²	179	101.2 Å²	101.2	68%	0.675	58%	0.583	S	S	*	*	H	α-helix	trans	-78.3	-27	178.6	-76.1	-175.3	175.5	-176.1	-0.7	112.5	L260 S265 S267	L260-R263 PolarHBondContact O-N 3.39Å; R263-S265 VanDerWaalsContact C-N 3.31Å; R263-S265 PolarHBondContact O-N 3.49Å; R263-S267 WeakPolarHBondContact O-CB 3.48Å; R263-S267 PolarHBondContact O-N 3.03Å; R263-S267 PolarHBondContact O-OG 3.42Å
264	K	48.9	Very low	50.4	Low	165 Å²	165	112.2 Å²	112.2	72%	0.717	62%	0.623	S	S	*	*	H	α-helix	trans	-70.9	-21.9	177.7	-76	179.9	178.4	174	0	113.5	L260	L260-K264 PolarHBondContact O-N 3.04Å
265	S	45.5	Very low	47.7	Very low	88 Å²	88	114.2 Å²	114.2	62%	0.615	65%	0.648	S	S	*	*	H	α-helix	trans	-84.4	-26	176.4	63.5	0	0	0	0	114.1	K262 R263	K262-S265 PolarHBondContact O-OG 3.18Å; K262-S265 VanDerWaalsContact O-OG 3.13Å; R263-S265 VanDerWaalsContact C-N 3.31Å; R263-S265 PolarHBondContact O-N 3.49Å
266	D	46.8	Very low	45.2	Very low	129 Å²	129	114.1 Å²	114.1	69%	0.69	66%	0.655	S	S	*	*	H	α-helix	trans	-116.9	5.1	-164.8	-64	3.1	0	0	0	114.3
267	S	42	Very low	43.2	Very low	82 Å²	82	121 Å²	121	57%	0.573	69%	0.685	S	S	*	*			trans	-116.1	67.9	-173.1	60.6	0	0	0	0	115	R263	R263-S267 WeakPolarHBondContact O-CB 3.48Å; R263-S267 PolarHBondContact O-N 3.03Å; R263-S267 PolarHBondContact O-OG 3.42Å
268	S	35.7	Very low	41.7	Very low	121 Å²	121	127 Å²	127	85%	0.846	70%	0.703	S	S	*	*			trans	-84.4	37.2	141.6	67.3	0	0	0	0	110.8	T270	S268-T270 PolarHBondContact O-N 3.46Å
269	T	34.8	Very low	40.9	Very low	116 Å²	116	126.2 Å²	126.2	71%	0.712	71%	0.71	S	S	*	*			trans	-97.9	91.1	168.9	-41.5	0	0	0	0	107.5	L271	T269-L271 PolarHBondContact O-N 2.76Å; T269-L271 VanDerWaalsContact O-N 3.11Å
270	T	32	Very low	40.3	Very low	123 Å²	123	125.5 Å²	125.5	76%	0.755	72%	0.721	S	S	*	*			trans	-44.5	116.5	159.1	43.3	0	0	0	0	108.3	S268 G272	S268-T270 PolarHBondContact O-N 3.46Å; T270-G272 PolarHBondContact O-N 3.28Å
271	L	36.3	Very low	40.7	Very low	188 Å²	188	126.6 Å²	126.6	98%	0.984	73%	0.726	S	S	*	*			trans	-69.4	64.4	150.8	-104.4	125.1	0	0	0	107	T269	T269-L271 PolarHBondContact O-N 2.76Å; T269-L271 VanDerWaalsContact O-N 3.11Å
272	G	28	Very low	42.1	Very low	63 Å²	63	124.7 Å²	124.7	65%	0.649	72%	0.722	S	S	*	*			trans	-75.8	139.9	161	0	0	0	0	0	107.9	T270	T270-G272 PolarHBondContact O-N 3.28Å
273	G	28.2	Very low	44.1	Very low	72 Å²	72	119.7 Å²	119.7	74%	0.742	70%	0.701	S	S	*	*			trans	105	46.6	155.1	0	0	0	0	0	117.6
274	R	34.2	Very low	46.2	Very low	251 Å²	251	111.2 Å²	111.2	95%	0.947	67%	0.669	S	S	*	*			trans	-133.3	67.4	134.8	-67.9	-170.7	93.6	176.8	5.6	109.4	G276	R274-G276 PolarHBondContact O-N 3.44Å
275	S	30.4	Very low	48.4	Very low	136 Å²	136	104.1 Å²	104.1	95%	0.951	64%	0.64	S	S	*	*			trans	-68.8	83.3	160.8	-167.9	0	0	0	0	107.7
276	G	32.7	Very low	50.8	Low	53 Å²	53	100 Å²	100	55%	0.546	61%	0.611	S	S	.	*			trans	-119.7	104.8	169.9	0	0	0	0	0	107	R274 K278	R274-G276 PolarHBondContact O-N 3.44Å; G276-K278 PolarHBondContact O-N 3.1Å
277	K	36.7	Very low	53.1	Low	217 Å²	217	95.2 Å²	95.2	94%	0.943	58%	0.584	S	S	*	*			trans	-23.6	89.9	172.6	-67.1	172.6	175.8	177	0	112.9
278	K	38.5	Very low	55.6	Low	174 Å²	174	91.3 Å²	91.3	76%	0.757	56%	0.557	S	S	*	*			trans	-141.9	101.7	174.3	-82	-169	175.7	-172.8	0	109.5	G276	G276-K278 PolarHBondContact O-N 3.1Å
279	G	42	Very low	58.3	Low	69 Å²	69	88.2 Å²	88.2	71%	0.711	53%	0.531	S	S	*	.			trans	59	130.4	150	0	0	0	0	0	117.9	L281	G279-L281 PolarHBondContact O-N 3.14Å
280	A	46.1	Very low	60.9	Low	100 Å²	100	83.7 Å²	83.7	83%	0.826	50%	0.504	S	S	*	.	S	Bend	trans	-61.1	15.7	-177.9	0	0	0	0	0	117.2
281	L	65.1	Low	63.7	Low	60 Å²	60	78 Å²	78	31%	0.314	47%	0.468	S	S	.	.			trans	-153.4	90.6	174	-63.6	173.3	0	0	0	110.2	G279 F283 L362 Y363 A366	G279-L281 PolarHBondContact O-N 3.14Å; L281-F283 VanDerWaalsContact C-N 3.28Å; L281-F283 PolarHBondContact O-N 3.46Å; L281-L362 HydrophobicContact CD1-CB 4.2Å; L281-L362 HydrophobicContact CD2-CB 4.38Å; L281-Y363 HydrophobicContact CD2-CD1 3.85Å; L281-Y363 HydrophobicContact CD2-CE1 3.43Å; L281-Y363 VanDerWaalsContact CD2-CE1 3.43Å; L281-A366 HydrophobicContact CD1-CB 4.22Å
282	S	80	Confident	66.1	Low	76 Å²	76	69.6 Å²	69.6	53%	0.531	43%	0.427	S	S	.	.	S	Bend	trans	-73.5	-20.5	177	57.5	0	0	0	0	113.4	Y299	S282-Y299 WeakPolarHBondContact O-CD1 3.46Å
283	F	92.1	Very high	69.1	Low	52 Å²	52	67.1 Å²	67.1	23%	0.228	40%	0.402	C	S	.	.			trans	-153.2	162.6	175.7	63.8	-90.6	0	0	0	110.9	L281 R297 F298 Y299 Y363	L281-F283 VanDerWaalsContact C-N 3.28Å; L281-F283 PolarHBondContact O-N 3.46Å; F283-R297 HydrophobicContact CB-CB 4.1Å; F283-R297 HydrophobicContact CD2-CB 3.66Å; F283-R297 HydrophobicContact CD2-CG 3.59Å; F283-R297 HydrophobicContact CE2-CB 4.31Å; F283-R297 HydrophobicContact CE2-CG 3.72Å; F283-R297 HydrophobicContact CG-CB 3.93Å; F283-R297 HydrophobicContact CG-CG 4.19Å; F283-R297 HydrophobicContact CZ-CG 4.39Å; F283-F298 CarbonylContact C-O 3.57Å; F283-F298 WeakPolarHBondContact CA-O 3.19Å; F283-F298 WeakPolarHBondContact CB-O 3.44Å; F283-Y299 HydrophobicContact CB-CD1 3.93Å; F283-Y299 HydrophobicContact CB-CE1 3.88Å; F283-Y299 HydrophobicContact CB-CG 4.36Å; F283-Y299 HydrophobicContact CD1-CE1 4.35Å; F283-Y299 HydrophobicContact CG-CE1 4.48Å; F283-Y363 WeakPolarHBondContact O-CE1 3.21Å
284	I	94.1	Very high	72.2	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	125.1	168.5	-51	169.9	0	0	0	107.6	V286 F298 R300 L353 Y363 A366 M367	I284-V286 HydrophobicContact CG2-CG1 4.31Å; I284-V286 PolarHBondContact O-N 3.29Å; I284-F298 HydrophobicContact CB-CB 4.29Å; I284-F298 PolarHBondContact N-O 3.45Å; I284-F298 PolarHBondContact O-N 2.86Å; I284-R300 HydrophobicContact CD1-CG 3.92Å; I284-R300 HydrophobicContact CG1-CG 4.3Å; I284-L353 HydrophobicContact CG2-CD2 3.58Å; I284-Y363 HydrophobicContact CG2-CD1 4.3Å; I284-A366 HydrophobicContact CD1-CB 3.63Å; I284-A366 HydrophobicContact CG1-CB 3.8Å; I284-M367 HydrophobicContact CG2-SD 4.41Å
285	P	95.6	Very high	75.1	Confident	16 Å²	16	55.8 Å²	55.8	10%	0.104	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	130.1	171.2	28.2	-31.9	0	0	0	109.2	L353 P354 E357 Y363	P285-L353 WeakPolarHBondContact O-CD2 3.44Å; P285-P354 HydrophobicContact CB-CG 4.2Å; P285-P354 WeakPolarHBondContact O-CD 3.13Å; P285-E357 HydrophobicContact CB-CG 4.38Å; P285-E357 HydrophobicContact CG-CB 4.14Å; P285-E357 HydrophobicContact CG-CG 3.78Å; P285-Y363 VanDerWaalsContact CD-CZ 3.49Å; P285-Y363 HydrophobicContact CG-CD1 4.18Å; P285-Y363 HydrophobicContact CG-CD2 3.77Å; P285-Y363 HydrophobicContact CG-CE1 4.09Å; P285-Y363 HydrophobicContact CG-CE2 3.72Å; P285-Y363 HydrophobicContact CG-CG 4.04Å
286	V	96	Very high	78.2	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	147.1	-175.1	-70.1	0	0	0	0	111.4	I284 R295 G296 F298 V311 F325 I351 H352 M367	I284-V286 HydrophobicContact CG2-CG1 4.31Å; I284-V286 PolarHBondContact O-N 3.29Å; V286-R295 CarbonylContact O-C 3.57Å; V286-R295 WeakPolarHBondContact O-CA 3.48Å; V286-G296 WeakPolarHBondContact CG2-O 3.45Å; V286-G296 PolarHBondContact N-O 2.84Å; V286-G296 PolarHBondContact O-N 3.3Å; V286-F298 HydrophobicContact CG1-CB 3.77Å; V286-F298 HydrophobicContact CG2-CB 4.09Å; V286-V311 HydrophobicContact CG2-CG1 3.82Å; V286-F325 HydrophobicContact CB-CE1 4.48Å; V286-F325 HydrophobicContact CG2-CE1 3.9Å; V286-F325 HydrophobicContact CG2-CZ 4.11Å; V286-I351 HydrophobicContact CB-CG2 3.56Å; V286-I351 HydrophobicContact CG1-CG2 3.61Å; V286-I351 HydrophobicContact CG2-CG2 4.4Å; V286-H352 CarbonylContact C-O 3.55Å; V286-H352 WeakPolarHBondContact CA-O 3.5Å; V286-M367 HydrophobicContact CG1-SD 4.27Å
287	E	95.3	Very high	81.2	Confident	29 Å²	29	51 Å²	51	14%	0.136	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	150.4	174.6	-173.2	162.9	-142.2	0	0	108.7	C294 R295 I351 H352 P354	E287-C294 WeakPolarHBondContact CA-O 3.47Å; E287-R295 HydrophobicContact CB-CG 4.25Å; E287-R295 HydrophobicContact CG-CG 3.93Å; E287-R295 WeakPolarHBondContact OE1-CG 3.26Å; E287-R295 IonicContact OE1-CZ 3.39Å; E287-R295 IonicContact OE1-NE 2.53Å; E287-R295 PolarHBondContact OE1-NE 3.29Å; E287-R295 IonicContact OE1-NH2 3.46Å; E287-R295 PolarHBondContact OE1-NH2 3.48Å; E287-R295 IonicContact OE2-CZ 3.7Å; E287-R295 IonicContact OE2-NE 3.8Å; E287-R295 IonicContact OE2-NH2 3.72Å; E287-R295 PolarHBondContact OE2-NH2 2.85Å; E287-I351 WeakPolarHBondContact O-CA 3.35Å; E287-H352 PolarHBondContact N-O 3.46Å; E287-H352 PolarHBondContact O-CD2 3.07Å; E287-H352 PolarHBondContact O-N 3.16Å; E287-P354 HydrophobicContact CB-CG 4.18Å; E287-P354 WeakPolarHBondContact OE2-CA 3.21Å
288	H	94.5	Very high	84	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152	163.1	73.2	84.6	0	0	0	108.5	C290 G293 C294 F325 V326 H328 Y350	H288-C290 PolarHBondContact CE1-O 3.47Å; H288-C290 VanDerWaalsContact CE1-O 3.26Å; H288-C290 PolarHBondContact ND1-N 2.92Å; H288-C290 PolarHBondContact ND1-O 3.25Å; H288-G293 CarbonylContact O-C 3.48Å; H288-G293 WeakPolarHBondContact O-CA 3.49Å; H288-C294 PolarHBondContact N-O 3.49Å; H288-C294 VanDerWaalsContact NE2-CB 3.28Å; H288-C294 WeakPolarHBondContact NE2-CB 3.45Å; H288-C294 PolarHBondContact NE2-N 3.36Å; H288-C294 PolarHBondContact O-N 2.87Å; H288-F325 AromaticContact CD2-CD1 3.81Å; H288-F325 AromaticContact CD2-CE1 3.56Å; H288-F325 AromaticContact CD2-CZ 3.83Å; H288-F325 PolarHBondContact CD2-O 2.97Å; H288-F325 PolarHBondContact NE2-O 3.38Å; H288-V326 HydrophobicContact CB-CG1 4.46Å; H288-H328 PolarHBondContact NE2-O 3.13Å; H288-H328 VanDerWaalsContact NE2-O 3.13Å; H288-Y350 WeakPolarHBondContact CA-O 3.48Å; H288-Y350 WeakPolarHBondContact CB-O 3.17Å
289	D	91.1	Very high	86.7	Confident	56 Å²	56	35.2 Å²	35.2	30%	0.299	21%	0.212	S	C	.	.			trans	-100.9	-1.7	178.3	-66.8	-35.9	0	0	0	113.2	F291 H352	D289-F291 PolarHBondContact O-N 3.47Å; D289-H352 IonicContact OD2-CE1 3.23Å; D289-H352 IonicContact OD2-NE2 3.18Å; D289-H352 PolarHBondContact OD2-NE2 3.25Å
290	C	91.1	Very high	89	Confident	21 Å²	21	36.5 Å²	36.5	14%	0.142	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-59.6	133	179.6	-54.7	0	0	0	0	112.5	H288 G292 G293 V326 F342 Y350	H288-C290 PolarHBondContact CE1-O 3.47Å; H288-C290 VanDerWaalsContact CE1-O 3.26Å; H288-C290 PolarHBondContact ND1-N 2.92Å; H288-C290 PolarHBondContact ND1-O 3.25Å; C290-G292 VanDerWaalsContact C-N 3.27Å; C290-G292 PolarHBondContact O-N 3.08Å; C290-G293 PolarHBondContact O-N 3.35Å; C290-V326 WeakPolarHBondContact CB-O 3.16Å; C290-F342 HydrophobicContact CB-CD2 4.26Å; C290-F342 HydrophobicContact CB-CE2 3.82Å; C290-Y350 VanDerWaalsContact SG-CB 3.58Å
291	F	90.6	Very high	91	Very high	3 Å²	3	38.2 Å²	38.2	1%	0.013	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	56.8	29.9	173.5	-48.1	-57.2	0	0	0	115.7	T242 R246 D289 A329 H339 F342	T242-F291 HydrophobicContact CG2-CE1 3.81Å; T242-F291 HydrophobicContact CG2-CZ 4.05Å; R246-F291 HydrophobicContact CB-CD1 4.05Å; R246-F291 HydrophobicContact CB-CE1 3.76Å; R246-F291 HydrophobicContact CB-CE2 4.38Å; R246-F291 HydrophobicContact CB-CG 4.49Å; R246-F291 HydrophobicContact CB-CZ 3.93Å; R246-F291 HydrophobicContact CG-CD1 3.65Å; R246-F291 HydrophobicContact CG-CE1 3.89Å; R246-F291 HydrophobicContact CG-CG 4.01Å; R246-F291 HydrophobicContact CG-CZ 4.42Å; D289-F291 PolarHBondContact O-N 3.47Å; F291-A329 WeakPolarHBondContact O-CB 3.43Å; F291-H339 AromaticContact CD1-CD2 3.69Å; F291-H339 AromaticContact CD1-CE1 3.8Å; F291-H339 AromaticContact CD1-CG 3.84Å; F291-H339 AromaticContact CD1-ND1 3.92Å; F291-H339 AromaticContact CD1-NE2 3.63Å; F291-H339 HydrophobicContact CE1-CB 4.04Å; F291-H339 AromaticContact CE1-CD2 3.98Å; F291-H339 AromaticContact CE1-CG 3.86Å; F291-F342 AromaticContact CE2-CD1 3.92Å; F291-F342 HydrophobicContact CE2-CD1 3.92Å; F291-F342 HydrophobicContact CE2-CD2 4Å; F291-F342 AromaticContact CE2-CE1 3.68Å; F291-F342 HydrophobicContact CE2-CE1 3.68Å; F291-F342 AromaticContact CE2-CE2 3.75Å; F291-F342 HydrophobicContact CE2-CE2 3.75Å; F291-F342 HydrophobicContact CE2-CG 4.08Å; F291-F342 AromaticContact CE2-CZ 3.58Å; F291-F342 HydrophobicContact CE2-CZ 3.58Å; F291-F342 HydrophobicContact CZ-CB 4.21Å; F291-F342 AromaticContact CZ-CD1 3.58Å; F291-F342 HydrophobicContact CZ-CD1 3.58Å; F291-F342 AromaticContact CZ-CD2 3.9Å; F291-F342 HydrophobicContact CZ-CD2 3.9Å; F291-F342 AromaticContact CZ-CE1 3.84Å; F291-F342 HydrophobicContact CZ-CE1 3.84Å; F291-F342 HydrophobicContact CZ-CE2 4.13Å; F291-F342 AromaticContact CZ-CG 3.61Å; F291-F342 HydrophobicContact CZ-CG 3.61Å; F291-F342 HydrophobicContact CZ-CZ 4.1Å
292	G	85.5	Confident	92.3	Very high	12 Å²	12	39.1 Å²	39.1	12%	0.124	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	103.9	-12.9	-175.7	0	0	0	0	0	113.8	C290 N332	C290-G292 VanDerWaalsContact C-N 3.27Å; C290-G292 PolarHBondContact O-N 3.08Å; G292-N332 WeakPolarHBondContact CA-O 3.29Å
293	G	90.7	Very high	92.7	Very high	11 Å²	11	37.8 Å²	37.8	11%	0.113	18%	0.179	C	C	.	.			trans	82.7	166.7	170	0	0	0	0	0	115.9	H288 C290 A329	H288-G293 CarbonylContact O-C 3.48Å; H288-G293 WeakPolarHBondContact O-CA 3.49Å; C290-G293 PolarHBondContact O-N 3.35Å; G293-A329 WeakPolarHBondContact O-CB 3.22Å
294	C	93.7	Very high	92.5	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.02	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	152.8	173	-167.5	0	0	0	0	111.5	E287 H288 C313 F325 H328	E287-C294 WeakPolarHBondContact CA-O 3.47Å; H288-C294 PolarHBondContact N-O 3.49Å; H288-C294 VanDerWaalsContact NE2-CB 3.28Å; H288-C294 WeakPolarHBondContact NE2-CB 3.45Å; H288-C294 PolarHBondContact NE2-N 3.36Å; H288-C294 PolarHBondContact O-N 2.87Å; C294-C313 PolarHBondContact SG-SG 2.86Å; C294-F325 HydrophobicContact CB-CE2 4.29Å; C294-H328 WeakPolarHBondContact CB-O 3.17Å
295	R	94.9	Very high	92.2	Very high	81 Å²	81	46.4 Å²	46.4	31%	0.306	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	148.7	173	-66.2	-177.4	174.7	-146	-5.2	111.3	V286 E287 D314 E356	V286-R295 CarbonylContact O-C 3.57Å; V286-R295 WeakPolarHBondContact O-CA 3.48Å; E287-R295 HydrophobicContact CB-CG 4.25Å; E287-R295 HydrophobicContact CG-CG 3.93Å; E287-R295 WeakPolarHBondContact OE1-CG 3.26Å; E287-R295 IonicContact OE1-CZ 3.39Å; E287-R295 IonicContact OE1-NE 2.53Å; E287-R295 PolarHBondContact OE1-NE 3.29Å; E287-R295 IonicContact OE1-NH2 3.46Å; E287-R295 PolarHBondContact OE1-NH2 3.48Å; E287-R295 IonicContact OE2-CZ 3.7Å; E287-R295 IonicContact OE2-NE 3.8Å; E287-R295 IonicContact OE2-NH2 3.72Å; E287-R295 PolarHBondContact OE2-NH2 2.85Å; R295-D314 PolarHBondContact O-N 3.46Å; R295-E356 IonicContact CZ-OE2 3.91Å; R295-E356 IonicContact NH1-OE1 2.67Å; R295-E356 IonicContact NH1-OE2 2.71Å; R295-E356 PolarHBondContact NH1-OE2 2.85Å; R295-E356 IonicContact NH2-OE1 3.22Å; R295-E356 PolarHBondContact NH2-OE1 2.9Å; R295-E356 IonicContact NH2-OE2 3.72Å; R295-E356 PolarHBondContact NH2-OE2 3.22Å
296	G	95.6	Very high	91.7	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164	-177.3	177.2	0	0	0	0	0	113.6	V286 K312	V286-G296 WeakPolarHBondContact CG2-O 3.45Å; V286-G296 PolarHBondContact N-O 2.84Å; V286-G296 PolarHBondContact O-N 3.3Å; G296-K312 CarbonylContact C-O 3.51Å; G296-K312 WeakPolarHBondContact CA-O 3.4Å
297	R	96.7	Very high	91.3	Very high	89 Å²	89	54.9 Å²	54.9	34%	0.336	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	118	178.9	-62	-179.1	-175.2	98.8	-8.3	109.9	F283 Y299 V311 K312 D314	F283-R297 HydrophobicContact CB-CB 4.1Å; F283-R297 HydrophobicContact CD2-CB 3.66Å; F283-R297 HydrophobicContact CD2-CG 3.59Å; F283-R297 HydrophobicContact CE2-CB 4.31Å; F283-R297 HydrophobicContact CE2-CG 3.72Å; F283-R297 HydrophobicContact CG-CB 3.93Å; F283-R297 HydrophobicContact CG-CG 4.19Å; F283-R297 HydrophobicContact CZ-CG 4.39Å; R297-Y299 HydrophobicContact CB-CE2 3.94Å; R297-Y299 WeakPolarHBondContact O-CD2 3.48Å; R297-V311 WeakPolarHBondContact O-CA 3.38Å; R297-K312 PolarHBondContact N-O 3.27Å; R297-K312 PolarHBondContact O-N 3.24Å; R297-D314 IonicContact CZ-OD1 2.83Å; R297-D314 VanDerWaalsContact CZ-OD1 3.23Å; R297-D314 IonicContact NE-OD1 3.73Å; R297-D314 IonicContact NH1-OD1 2.99Å; R297-D314 PolarHBondContact NH1-OD1 3.22Å; R297-D314 IonicContact NH2-OD1 3.27Å
298	F	96	Very high	91.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	115.3	177.5	-167.9	-69.9	0	0	0	110.3	F283 I284 V286 R300 Y303 C310 V311 A322 W347 L370	F283-F298 CarbonylContact C-O 3.57Å; F283-F298 WeakPolarHBondContact CA-O 3.19Å; F283-F298 WeakPolarHBondContact CB-O 3.44Å; I284-F298 HydrophobicContact CB-CB 4.29Å; I284-F298 PolarHBondContact N-O 3.45Å; I284-F298 PolarHBondContact O-N 2.86Å; V286-F298 HydrophobicContact CG1-CB 3.77Å; V286-F298 HydrophobicContact CG2-CB 4.09Å; F298-R300 HydrophobicContact CD1-CG 4.34Å; F298-Y303 HydrophobicContact CE1-CG 4.36Å; F298-Y303 HydrophobicContact CZ-CD1 4.44Å; F298-Y303 HydrophobicContact CZ-CD2 4.01Å; F298-Y303 AromaticContact CZ-CG 3.88Å; F298-Y303 HydrophobicContact CZ-CG 3.88Å; F298-C310 CarbonylContact C-O 3.48Å; F298-C310 WeakPolarHBondContact CA-O 3.29Å; F298-C310 HydrophobicContact CE1-CB 4.49Å; F298-C310 HydrophobicContact CZ-CB 4.25Å; F298-V311 HydrophobicContact CD2-CG2 3.43Å; F298-V311 VanDerWaalsContact CD2-CG2 3.43Å; F298-V311 HydrophobicContact CE2-CG2 3.85Å; F298-V311 HydrophobicContact CG-CG2 4.23Å; F298-A322 HydrophobicContact CE2-CB 4.13Å; F298-W347 HydrophobicContact CE2-CH2 4.31Å; F298-W347 HydrophobicContact CE2-CZ3 4.34Å; F298-L370 HydrophobicContact CD1-CD1 4.41Å; F298-L370 HydrophobicContact CD1-CD2 3.92Å; F298-L370 HydrophobicContact CD2-CD2 3.78Å; F298-L370 HydrophobicContact CE1-CD1 3.53Å; F298-L370 HydrophobicContact CE1-CD2 3.77Å; F298-L370 HydrophobicContact CE1-CG 4.3Å; F298-L370 HydrophobicContact CE2-CD1 4.2Å; F298-L370 HydrophobicContact CE2-CD2 3.63Å; F298-L370 HydrophobicContact CG-CD2 3.96Å; F298-L370 HydrophobicContact CZ-CD1 3.42Å; F298-L370 VanDerWaalsContact CZ-CD1 3.42Å; F298-L370 HydrophobicContact CZ-CD2 3.66Å; F298-L370 HydrophobicContact CZ-CG 4.16Å
299	Y	94.6	Very high	91.2	Very high	58 Å²	58	59.2 Å²	59.2	23%	0.227	30%	0.297	C	S	.	.			trans	-94.1	102.4	177.5	-65.6	-88.1	0	0	0	110	S282 F283 R297 D301 L302 C310 K312	S282-Y299 WeakPolarHBondContact O-CD1 3.46Å; F283-Y299 HydrophobicContact CB-CD1 3.93Å; F283-Y299 HydrophobicContact CB-CE1 3.88Å; F283-Y299 HydrophobicContact CB-CG 4.36Å; F283-Y299 HydrophobicContact CD1-CE1 4.35Å; F283-Y299 HydrophobicContact CG-CE1 4.48Å; R297-Y299 HydrophobicContact CB-CE2 3.94Å; R297-Y299 WeakPolarHBondContact O-CD2 3.48Å; Y299-D301 PolarHBondContact O-N 2.74Å; Y299-L302 HydrophobicContact CD2-CD1 4.43Å; Y299-L302 HydrophobicContact CG-CD1 4.17Å; Y299-L302 PolarHBondContact O-N 3.06Å; Y299-C310 PolarHBondContact N-O 3.35Å; Y299-K312 HydrophobicContact CD2-CB 4.48Å; Y299-K312 HydrophobicContact CE2-CB 3.75Å; Y299-K312 HydrophobicContact CE2-CD 4.47Å
300	R	89.4	Confident	91.4	Very high	96 Å²	96	56.5 Å²	56.5	36%	0.362	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-56	-40.7	179.9	-66	179	71.3	168.9	-0.4	112.3	I284 F298 L302 Y303	I284-R300 HydrophobicContact CD1-CG 3.92Å; I284-R300 HydrophobicContact CG1-CG 4.3Å; F298-R300 HydrophobicContact CD1-CG 4.34Å; R300-L302 PolarHBondContact O-N 3.13Å; R300-L302 VanDerWaalsContact O-N 3.15Å; R300-Y303 PolarHBondContact O-N 2.89Å
301	D	88.5	Confident	91.7	Very high	136 Å²	136	55.5 Å²	55.5	73%	0.727	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-63.4	-19.6	-179	-68.9	-10.5	0	0	0	113.6	Y299	Y299-D301 PolarHBondContact O-N 2.74Å
302	L	91.7	Very high	92	Very high	80 Å²	80	59.2 Å²	59.2	42%	0.419	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-93.1	-10.7	177.7	-60.3	-177.4	0	0	0	112.9	Y299 R300 D304 A308 C310 L319	Y299-L302 HydrophobicContact CD2-CD1 4.43Å; Y299-L302 HydrophobicContact CG-CD1 4.17Å; Y299-L302 PolarHBondContact O-N 3.06Å; R300-L302 PolarHBondContact O-N 3.13Å; R300-L302 VanDerWaalsContact O-N 3.15Å; L302-D304 PolarHBondContact O-N 3.17Å; L302-A308 VanDerWaalsContact O-CB 3.26Å; L302-A308 WeakPolarHBondContact O-CB 3.33Å; L302-C310 HydrophobicContact CB-CB 4.17Å; L302-L319 HydrophobicContact CD1-CD1 4.27Å; L302-L319 HydrophobicContact CD1-CD2 4.21Å
303	Y	90	Very high	92.5	Very high	47 Å²	47	58.6 Å²	58.6	18%	0.184	29%	0.286	C	S	.	.			trans	-88.4	81	-176.9	-170.9	-111.3	0	0	0	111.2	F298 R300 C310 W347 L370	F298-Y303 HydrophobicContact CE1-CG 4.36Å; F298-Y303 HydrophobicContact CZ-CD1 4.44Å; F298-Y303 HydrophobicContact CZ-CD2 4.01Å; F298-Y303 AromaticContact CZ-CG 3.88Å; F298-Y303 HydrophobicContact CZ-CG 3.88Å; R300-Y303 PolarHBondContact O-N 2.89Å; Y303-C310 HydrophobicContact CD2-CB 4.28Å; Y303-C310 VanDerWaalsContact CD2-SG 3.59Å; Y303-W347 HydrophobicContact CE2-CZ2 4.44Å; Y303-L370 HydrophobicContact CD1-CD1 4.21Å; Y303-L370 HydrophobicContact CE1-CD1 4.46Å
304	D	86.7	Confident	92.6	Very high	125 Å²	125	61.5 Å²	61.5	67%	0.668	30%	0.299	S	S	*	.	S	Bend	trans	-96.6	-31.7	178	66.7	-25.4	0	0	0	113.2	L302 A308	L302-D304 PolarHBondContact O-N 3.17Å; D304-A308 WeakPolarHBondContact OD1-CB 3.28Å
305	K	87.5	Confident	92.4	Very high	110 Å²	110	65.9 Å²	65.9	48%	0.478	32%	0.319	S	S	.	.	S	Bend	trans	-141.9	160.7	-179.2	67.2	-163.5	172.4	-169.6	0	111.1	T307 A308	K305-T307 WeakPolarHBondContact CG-OG1 3.44Å; K305-T307 PolarHBondContact O-N 2.93Å; K305-A308 HydrophobicContact CG-CB 4.06Å; K305-A308 WeakPolarHBondContact O-CB 3.41Å; K305-A308 PolarHBondContact O-N 2.89Å
306	P	85	Confident	92.3	Very high	95 Å²	95	62.9 Å²	62.9	62%	0.617	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.3	179.6	-26.1	35.3	0	0	0	114.7
307	T	87.9	Confident	92.1	Very high	99 Å²	99	64.4 Å²	64.4	61%	0.607	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	7.5	177.3	58	0	0	0	0	113.5	K305 T321	K305-T307 WeakPolarHBondContact CG-OG1 3.44Å; K305-T307 PolarHBondContact O-N 2.93Å; T307-T321 WeakPolarHBondContact O-CG2 3.49Å
308	A	92.7	Very high	91.9	Very high	5 Å²	5	62 Å²	62	4%	0.041	32%	0.318	C	S	.	.			trans	-72.1	132.9	179.1	0	0	0	0	0	111.8	L302 D304 K305 C310 T321	L302-A308 VanDerWaalsContact O-CB 3.26Å; L302-A308 WeakPolarHBondContact O-CB 3.33Å; D304-A308 WeakPolarHBondContact OD1-CB 3.28Å; K305-A308 HydrophobicContact CG-CB 4.06Å; K305-A308 WeakPolarHBondContact O-CB 3.41Å; K305-A308 PolarHBondContact O-N 2.89Å; A308-C310 PolarHBondContact O-N 2.77Å; A308-C310 PolarHBondContact O-SG 3.39Å; A308-C310 VanDerWaalsContact O-SG 3.37Å; A308-T321 WeakPolarHBondContact O-CA 3.29Å
309	E	95.6	Very high	91.8	Very high	115 Å²	115	64.8 Å²	64.8	54%	0.537	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	101.7	171.5	-60.5	-177.3	151.1	0	0	108.7	L319 L320 T321	E309-L319 HydrophobicContact CB-CB 4.35Å; E309-L319 HydrophobicContact CB-CD2 3.86Å; E309-L319 HydrophobicContact CB-CG 3.75Å; E309-L319 WeakPolarHBondContact O-CD2 3.47Å; E309-L320 CarbonylContact C-O 3.6Å; E309-L320 WeakPolarHBondContact CA-O 3.38Å; E309-T321 HydrophobicContact CG-CG2 4.21Å
310	C	95.1	Very high	91.9	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	-9.2	-169	52.9	0	0	0	0	113.2	F298 Y299 L302 Y303 A308 L320	F298-C310 CarbonylContact C-O 3.48Å; F298-C310 WeakPolarHBondContact CA-O 3.29Å; F298-C310 HydrophobicContact CE1-CB 4.49Å; F298-C310 HydrophobicContact CZ-CB 4.25Å; Y299-C310 PolarHBondContact N-O 3.35Å; L302-C310 HydrophobicContact CB-CB 4.17Å; Y303-C310 HydrophobicContact CD2-CB 4.28Å; Y303-C310 VanDerWaalsContact CD2-SG 3.59Å; A308-C310 PolarHBondContact O-N 2.77Å; A308-C310 PolarHBondContact O-SG 3.39Å; A308-C310 VanDerWaalsContact O-SG 3.37Å; C310-L320 PolarHBondContact N-O 3.41Å
311	V	96.7	Very high	92.1	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	116.9	-179.6	-169.5	0	0	0	0	109.8	V286 R297 F298 L320 A322 F325	V286-V311 HydrophobicContact CG2-CG1 3.82Å; R297-V311 WeakPolarHBondContact O-CA 3.38Å; F298-V311 HydrophobicContact CD2-CG2 3.43Å; F298-V311 VanDerWaalsContact CD2-CG2 3.43Å; F298-V311 HydrophobicContact CE2-CG2 3.85Å; F298-V311 HydrophobicContact CG-CG2 4.23Å; V311-L320 PolarHBondContact N-O 3.45Å; V311-L320 PolarHBondContact O-N 2.99Å; V311-A322 HydrophobicContact CG2-CB 4.34Å; V311-F325 HydrophobicContact CB-CB 4.11Å; V311-F325 HydrophobicContact CB-CD2 4.32Å; V311-F325 HydrophobicContact CB-CG 4.09Å; V311-F325 HydrophobicContact CG1-CB 4.15Å; V311-F325 HydrophobicContact CG1-CD1 3.82Å; V311-F325 HydrophobicContact CG1-CD2 3.55Å; V311-F325 HydrophobicContact CG1-CE1 4.03Å; V311-F325 HydrophobicContact CG1-CE2 3.81Å; V311-F325 HydrophobicContact CG1-CG 3.56Å; V311-F325 HydrophobicContact CG1-CZ 4.03Å; V311-F325 HydrophobicContact CG2-CB 4.41Å
312	K	96.8	Very high	92.4	Very high	80 Å²	80	53 Å²	53	35%	0.348	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	119.7	174.6	-172.1	178.6	178.9	-179.9	0	109.9	G296 R297 Y299 G317 E318 L319	G296-K312 CarbonylContact C-O 3.51Å; G296-K312 WeakPolarHBondContact CA-O 3.4Å; R297-K312 PolarHBondContact N-O 3.27Å; R297-K312 PolarHBondContact O-N 3.24Å; Y299-K312 HydrophobicContact CD2-CB 4.48Å; Y299-K312 HydrophobicContact CE2-CB 3.75Å; Y299-K312 HydrophobicContact CE2-CD 4.47Å; K312-G317 WeakPolarHBondContact CE-O 3.33Å; K312-E318 CarbonylContact C-O 3.46Å; K312-E318 WeakPolarHBondContact CA-O 3.35Å; K312-L319 HydrophobicContact CB-CD1 4.05Å
313	C	96.1	Very high	92.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	135	174.3	172.9	0	0	0	0	110.8	C294 H315 C316 G317 E318 L320 H328 H330	C294-C313 PolarHBondContact SG-SG 2.86Å; C313-H315 VanDerWaalsContact C-N 3.33Å; C313-H315 PolarHBondContact O-N 3.18Å; C313-H315 PolarHBondContact SG-N 2.95Å; C313-H315 VanDerWaalsContact SG-N 3.35Å; C313-C316 WeakPolarHBondContact CB-SG 3.38Å; C313-C316 PolarHBondContact SG-SG 3.47Å; C313-G317 WeakPolarHBondContact O-CA 3.36Å; C313-G317 PolarHBondContact O-N 3.5Å; C313-E318 PolarHBondContact N-O 3.44Å; C313-L320 HydrophobicContact CB-CD1 4.32Å; C313-H328 PolarHBondContact SG-NE2 3Å; C313-H330 PolarHBondContact SG-NE2 3.15Å; C313-H330 VanDerWaalsContact SG-NE2 3.41Å
314	D	93.8	Very high	92.7	Very high	71 Å²	71	50.3 Å²	50.3	38%	0.38	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-22.5	-179.5	-74.7	-24.2	0	0	0	113.3	R295 R297	R295-D314 PolarHBondContact O-N 3.46Å; R297-D314 IonicContact CZ-OD1 2.83Å; R297-D314 VanDerWaalsContact CZ-OD1 3.23Å; R297-D314 IonicContact NE-OD1 3.73Å; R297-D314 IonicContact NH1-OD1 2.99Å; R297-D314 PolarHBondContact NH1-OD1 3.22Å; R297-D314 IonicContact NH2-OD1 3.27Å
315	H	90.3	Very high	93.1	Very high	96 Å²	96	44.4 Å²	44.4	44%	0.444	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-49.7	-177.7	-63.9	88.7	0	0	0	112.7	C313 H330	C313-H315 VanDerWaalsContact C-N 3.33Å; C313-H315 PolarHBondContact O-N 3.18Å; C313-H315 PolarHBondContact SG-N 2.95Å; C313-H315 VanDerWaalsContact SG-N 3.35Å; H315-H330 HydrophobicContact CB-CB 4.32Å; H315-H330 VanDerWaalsContact CB-CD2 3.45Å; H315-H330 WeakPolarHBondContact CB-CD2 3.15Å; H315-H330 AromaticContact CG-CD2 3.99Å
316	C	91.2	Very high	93.4	Very high	17 Å²	17	39.1 Å²	39.1	12%	0.115	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	-14.7	179	57.6	0	0	0	0	114.7	L260 C313 E318 H328 H330	L260-C316 HydrophobicContact CD1-CB 3.32Å; L260-C316 HydrophobicContact CD2-CB 4.13Å; L260-C316 WeakPolarHBondContact CD2-O 3.39Å; L260-C316 HydrophobicContact CG-CB 4.36Å; C313-C316 WeakPolarHBondContact CB-SG 3.38Å; C313-C316 PolarHBondContact SG-SG 3.47Å; C316-E318 HydrophobicContact CB-CB 4.48Å; C316-E318 PolarHBondContact O-N 2.88Å; C316-E318 WeakPolarHBondContact SG-CB 3.47Å; C316-H328 VanDerWaalsContact SG-CE1 3.58Å; C316-H328 PolarHBondContact SG-NE2 3.46Å; C316-H330 PolarHBondContact SG-NE2 2.9Å
317	G	92.5	Very high	93.8	Very high	34 Å²	34	35.3 Å²	35.3	35%	0.351	19%	0.194	S	C	.	.			trans	70.6	7.8	-174.1	0	0	0	0	0	114.3	K312 C313	K312-G317 WeakPolarHBondContact CE-O 3.33Å; C313-G317 WeakPolarHBondContact O-CA 3.36Å; C313-G317 PolarHBondContact O-N 3.5Å
318	E	92	Very high	94	Very high	37 Å²	37	31 Å²	31	17%	0.173	17%	0.168	C	C	.	.			trans	-68.9	135.6	177.6	-170.1	176.7	159.7	0	0	110.8	K256 K312 C313 C316 L320	K256-E318 WeakPolarHBondContact CD-OE2 3.27Å; K256-E318 VanDerWaalsContact NZ-CD 3.28Å; K256-E318 IonicContact NZ-OE1 2.91Å; K256-E318 PolarHBondContact NZ-OE1 2.85Å; K256-E318 IonicContact NZ-OE2 3.7Å; K312-E318 CarbonylContact C-O 3.46Å; K312-E318 WeakPolarHBondContact CA-O 3.35Å; C313-E318 PolarHBondContact N-O 3.44Å; C316-E318 HydrophobicContact CB-CB 4.48Å; C316-E318 PolarHBondContact O-N 2.88Å; C316-E318 WeakPolarHBondContact SG-CB 3.47Å; E318-L320 HydrophobicContact CB-CG 4.44Å; E318-L320 HydrophobicContact CG-CD2 3.95Å; E318-L320 HydrophobicContact CG-CG 4.13Å; E318-L320 WeakPolarHBondContact OE1-CD2 3.39Å
319	L	94.9	Very high	93.9	Very high	59 Å²	59	31 Å²	31	31%	0.309	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	119	172.8	-163.3	70.5	0	0	0	108.3	L302 E309 K312	L302-L319 HydrophobicContact CD1-CD1 4.27Å; L302-L319 HydrophobicContact CD1-CD2 4.21Å; E309-L319 HydrophobicContact CB-CB 4.35Å; E309-L319 HydrophobicContact CB-CD2 3.86Å; E309-L319 HydrophobicContact CB-CG 3.75Å; E309-L319 WeakPolarHBondContact O-CD2 3.47Å; K312-L319 HydrophobicContact CB-CD1 4.05Å
320	L	94.9	Very high	93.5	Very high	11 Å²	11	27.7 Å²	27.7	6%	0.058	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	153.6	-170.8	-65.8	165.3	0	0	0	110.1	E309 C310 V311 C313 E318 A324 F325 H328	E309-L320 CarbonylContact C-O 3.6Å; E309-L320 WeakPolarHBondContact CA-O 3.38Å; C310-L320 PolarHBondContact N-O 3.41Å; V311-L320 PolarHBondContact N-O 3.45Å; V311-L320 PolarHBondContact O-N 2.99Å; C313-L320 HydrophobicContact CB-CD1 4.32Å; E318-L320 HydrophobicContact CB-CG 4.44Å; E318-L320 HydrophobicContact CG-CD2 3.95Å; E318-L320 HydrophobicContact CG-CG 4.13Å; E318-L320 WeakPolarHBondContact OE1-CD2 3.39Å; L320-A324 HydrophobicContact CB-CB 4.34Å; L320-A324 HydrophobicContact CD2-CB 4.22Å; L320-F325 HydrophobicContact CB-CB 4.35Å; L320-F325 HydrophobicContact CD1-CB 4.48Å; L320-F325 HydrophobicContact CD1-CD2 4.23Å; L320-H328 HydrophobicContact CD1-CB 3.87Å
321	T	94.7	Very high	92.3	Very high	31 Å²	31	31 Å²	31	19%	0.19	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	152.9	163.2	70.3	0	0	0	0	109.7	T307 A308 E309 K323 A324 F325	T307-T321 WeakPolarHBondContact O-CG2 3.49Å; A308-T321 WeakPolarHBondContact O-CA 3.29Å; E309-T321 HydrophobicContact CG-CG2 4.21Å; T321-K323 PolarHBondContact O-N 3.27Å; T321-A324 PolarHBondContact O-N 3.3Å; T321-A324 VanDerWaalsContact OG1-CB 3.32Å; T321-A324 WeakPolarHBondContact OG1-CB 3.45Å; T321-A324 PolarHBondContact OG1-N 3.3Å; T321-F325 PolarHBondContact O-N 3.13Å
322	A	94.4	Very high	90.9	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-56.6	-36.3	177.2	0	0	0	0	0	112.2	F298 V311 F325 V326 W347 I351	F298-A322 HydrophobicContact CE2-CB 4.13Å; V311-A322 HydrophobicContact CG2-CB 4.34Å; A322-F325 PolarHBondContact O-N 3.15Å; A322-V326 PolarHBondContact O-N 3.2Å; A322-W347 HydrophobicContact CB-CD2 3.49Å; A322-W347 VanDerWaalsContact CB-CD2 3.49Å; A322-W347 HydrophobicContact CB-CE3 3.69Å; A322-W347 HydrophobicContact CB-CG 4Å; A322-W347 HydrophobicContact CB-CH2 4.15Å; A322-W347 HydrophobicContact CB-CZ2 3.99Å; A322-W347 HydrophobicContact CB-CZ3 4.01Å; A322-I351 HydrophobicContact CB-CD1 4.36Å
323	K	93.5	Very high	89.9	Confident	42 Å²	42	34.3 Å²	34.3	18%	0.183	19%	0.194	C	C	.	.	H	α-helix	trans	-64.2	-41.6	173.4	177.2	173.1	176.7	173.2	0	113.1	T321 V326 S344 D345	T321-K323 PolarHBondContact O-N 3.27Å; K323-V326 WeakPolarHBondContact O-CG2 3.32Å; K323-S344 VanDerWaalsContact CE-OG 3.23Å; K323-S344 WeakPolarHBondContact CE-OG 3.46Å; K323-D345 VanDerWaalsContact CE-OD1 3.3Å; K323-D345 WeakPolarHBondContact CE-OD1 3.39Å; K323-D345 IonicContact NZ-OD1 3.57Å; K323-D345 PolarHBondContact NZ-OD1 3.08Å
324	A	93.7	Very high	88.9	Confident	29 Å²	29	36.6 Å²	36.6	24%	0.24	21%	0.205	C	C	.	.	H	α-helix	trans	-71.6	-38.5	177.9	0	0	0	0	0	111.5	L320 T321 V326 S327 H328	L320-A324 HydrophobicContact CB-CB 4.34Å; L320-A324 HydrophobicContact CD2-CB 4.22Å; T321-A324 PolarHBondContact O-N 3.3Å; T321-A324 VanDerWaalsContact OG1-CB 3.32Å; T321-A324 WeakPolarHBondContact OG1-CB 3.45Å; T321-A324 PolarHBondContact OG1-N 3.3Å; A324-V326 PolarHBondContact O-N 3.07Å; A324-S327 PolarHBondContact O-N 3.45Å; A324-S327 PolarHBondContact O-OG 3.37Å; A324-H328 PolarHBondContact O-N 2.96Å
325	F	95.6	Very high	88.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-56.1	-44.9	-179.8	179.1	-110.7	0	0	0	112.4	V286 H288 C294 V311 L320 T321 A322 S327 H328 I351	V286-F325 HydrophobicContact CB-CE1 4.48Å; V286-F325 HydrophobicContact CG2-CE1 3.9Å; V286-F325 HydrophobicContact CG2-CZ 4.11Å; H288-F325 AromaticContact CD2-CD1 3.81Å; H288-F325 AromaticContact CD2-CE1 3.56Å; H288-F325 AromaticContact CD2-CZ 3.83Å; H288-F325 PolarHBondContact CD2-O 2.97Å; H288-F325 PolarHBondContact NE2-O 3.38Å; C294-F325 HydrophobicContact CB-CE2 4.29Å; V311-F325 HydrophobicContact CB-CB 4.11Å; V311-F325 HydrophobicContact CB-CD2 4.32Å; V311-F325 HydrophobicContact CB-CG 4.09Å; V311-F325 HydrophobicContact CG1-CB 4.15Å; V311-F325 HydrophobicContact CG1-CD1 3.82Å; V311-F325 HydrophobicContact CG1-CD2 3.55Å; V311-F325 HydrophobicContact CG1-CE1 4.03Å; V311-F325 HydrophobicContact CG1-CE2 3.81Å; V311-F325 HydrophobicContact CG1-CG 3.56Å; V311-F325 HydrophobicContact CG1-CZ 4.03Å; V311-F325 HydrophobicContact CG2-CB 4.41Å; L320-F325 HydrophobicContact CB-CB 4.35Å; L320-F325 HydrophobicContact CD1-CB 4.48Å; L320-F325 HydrophobicContact CD1-CD2 4.23Å; T321-F325 PolarHBondContact O-N 3.13Å; A322-F325 PolarHBondContact O-N 3.15Å; F325-S327 PolarHBondContact O-N 2.96Å; F325-H328 WeakPolarHBondContact O-CB 3.31Å; F325-H328 PolarHBondContact O-N 2.95Å; F325-I351 HydrophobicContact CD1-CD1 3.78Å; F325-I351 HydrophobicContact CD1-CG1 4.25Å; F325-I351 HydrophobicContact CE1-CD1 4.37Å
326	V	94.5	Very high	87.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-7.2	179.7	-63.5	0	0	0	0	115.1	H288 C290 A322 K323 A324 F342 W347 Y350 I351	H288-V326 HydrophobicContact CB-CG1 4.46Å; C290-V326 WeakPolarHBondContact CB-O 3.16Å; A322-V326 PolarHBondContact O-N 3.2Å; K323-V326 WeakPolarHBondContact O-CG2 3.32Å; A324-V326 PolarHBondContact O-N 3.07Å; V326-F342 HydrophobicContact CG2-CE2 4.47Å; V326-F342 HydrophobicContact CG2-CZ 4.07Å; V326-W347 HydrophobicContact CG1-CB 3.78Å; V326-W347 HydrophobicContact CG2-CB 3.92Å; V326-Y350 HydrophobicContact CB-CD2 4.13Å; V326-Y350 HydrophobicContact CG1-CD2 4.19Å; V326-Y350 HydrophobicContact CG2-CD2 4.24Å; V326-I351 HydrophobicContact CG1-CD1 3.98Å; V326-I351 HydrophobicContact CG1-CG1 3.49Å; V326-I351 VanDerWaalsContact CG1-CG1 3.49Å
327	S	92.3	Very high	87	Confident	14 Å²	14	44.5 Å²	44.5	10%	0.098	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	2	173	63.1	0	0	0	0	113.4	A324 F325	A324-S327 PolarHBondContact O-N 3.45Å; A324-S327 PolarHBondContact O-OG 3.37Å; F325-S327 PolarHBondContact O-N 2.96Å
328	H	93.2	Very high	86.4	Confident	10 Å²	10	47.6 Å²	47.6	5%	0.046	25%	0.253	C	S	.	.			trans	-101.8	99	-175.2	179.5	84.5	0	0	0	109.7	H288 C294 C313 C316 L320 A324 F325 H330	H288-H328 PolarHBondContact NE2-O 3.13Å; H288-H328 VanDerWaalsContact NE2-O 3.13Å; C294-H328 WeakPolarHBondContact CB-O 3.17Å; C313-H328 PolarHBondContact SG-NE2 3Å; C316-H328 VanDerWaalsContact SG-CE1 3.58Å; C316-H328 PolarHBondContact SG-NE2 3.46Å; L320-H328 HydrophobicContact CD1-CB 3.87Å; A324-H328 PolarHBondContact O-N 2.96Å; F325-H328 WeakPolarHBondContact O-CB 3.31Å; F325-H328 PolarHBondContact O-N 2.95Å; H328-H330 AromaticContact CD2-NE2 3.98Å; H328-H330 AromaticContact CE1-NE2 3.54Å; H328-H330 AromaticContact NE2-CD2 3.44Å; H328-H330 PolarHBondContact NE2-CD2 3.35Å; H328-H330 AromaticContact NE2-NE2 2.98Å; H328-H330 PolarHBondContact NE2-NE2 3.23Å
329	A	90.3	Very high	85.9	Confident	3 Å²	3	47.4 Å²	47.4	3%	0.025	25%	0.252	C	S	.	.			trans	-115.7	150.7	174.8	0	0	0	0	0	109.8	L253 F291 G293 F333	L253-A329 WeakPolarHBondContact CD2-O 3.17Å; F291-A329 WeakPolarHBondContact O-CB 3.43Å; G293-A329 WeakPolarHBondContact O-CB 3.22Å; A329-F333 HydrophobicContact CB-CD1 4.18Å; A329-F333 HydrophobicContact CB-CE1 3.73Å; A329-F333 HydrophobicContact CB-CZ 4.23Å; A329-F333 WeakPolarHBondContact O-CE1 3.34Å; A329-F333 WeakPolarHBondContact O-CZ 3.18Å
330	H	86.5	Confident	85.3	Confident	46 Å²	46	52.5 Å²	52.5	21%	0.213	27%	0.267	C	S	.	.			trans	-113.5	-34.5	179.2	-84.4	-87.2	0	0	0	113.4	L253 C313 H315 C316 H328	L253-H330 WeakPolarHBondContact CD1-CE1 3.26Å; C313-H330 PolarHBondContact SG-NE2 3.15Å; C313-H330 VanDerWaalsContact SG-NE2 3.41Å; H315-H330 HydrophobicContact CB-CB 4.32Å; H315-H330 VanDerWaalsContact CB-CD2 3.45Å; H315-H330 WeakPolarHBondContact CB-CD2 3.15Å; H315-H330 AromaticContact CG-CD2 3.99Å; C316-H330 PolarHBondContact SG-NE2 2.9Å; H328-H330 AromaticContact CD2-NE2 3.98Å; H328-H330 AromaticContact CE1-NE2 3.54Å; H328-H330 AromaticContact NE2-CD2 3.44Å; H328-H330 PolarHBondContact NE2-CD2 3.35Å; H328-H330 AromaticContact NE2-NE2 2.98Å; H328-H330 PolarHBondContact NE2-NE2 3.23Å
331	C	71.3	Confident	84.8	Confident	71 Å²	71	54.2 Å²	54.2	48%	0.48	29%	0.288	S	S	.	.	S	Bend	trans	-124.6	160.4	-173.6	-62.7	0	0	0	0	108.6	F333	C331-F333 PolarHBondContact O-N 3.3Å; C331-F333 VanDerWaalsContact O-N 3.16Å
332	N	67.3	Low	84.6	Confident	121 Å²	121	53.6 Å²	53.6	65%	0.647	28%	0.282	S	S	*	.			trans	54.6	36.4	172	-58.4	-19.3	0	0	0	114.4	G292 E334	G292-N332 WeakPolarHBondContact CA-O 3.29Å; N332-E334 WeakPolarHBondContact O-CG 3.48Å; N332-E334 PolarHBondContact O-N 3.41Å
333	F	74.7	Confident	84.3	Confident	27 Å²	27	56 Å²	56	12%	0.118	30%	0.295	C	S	.	.			trans	-53	113.4	171.2	-72.6	-75.8	0	0	0	109.1	L153 F250 L253 A329 C331 R335	L153-F333 HydrophobicContact CD2-CB 4.49Å; F250-F333 AromaticContact CD2-CD1 3.95Å; F250-F333 HydrophobicContact CD2-CD1 3.95Å; F250-F333 HydrophobicContact CD2-CD2 4.09Å; F250-F333 AromaticContact CD2-CE1 3.57Å; F250-F333 HydrophobicContact CD2-CE1 3.57Å; F250-F333 AromaticContact CD2-CE2 3.72Å; F250-F333 HydrophobicContact CD2-CE2 3.72Å; F250-F333 HydrophobicContact CD2-CG 4.16Å; F250-F333 AromaticContact CD2-CZ 3.38Å; F250-F333 HydrophobicContact CD2-CZ 3.38Å; F250-F333 HydrophobicContact CE2-CD1 4.44Å; F250-F333 AromaticContact CE2-CD2 3.81Å; F250-F333 HydrophobicContact CE2-CD2 3.81Å; F250-F333 HydrophobicContact CE2-CE1 4.28Å; F250-F333 AromaticContact CE2-CE2 3.62Å; F250-F333 HydrophobicContact CE2-CE2 3.62Å; F250-F333 HydrophobicContact CE2-CG 4.19Å; F250-F333 AromaticContact CE2-CZ 3.82Å; F250-F333 HydrophobicContact CE2-CZ 3.82Å; F250-F333 HydrophobicContact CG-CZ 4.5Å; L253-F333 HydrophobicContact CD2-CE2 4.3Å; L253-F333 HydrophobicContact CD2-CZ 3.94Å; A329-F333 HydrophobicContact CB-CD1 4.18Å; A329-F333 HydrophobicContact CB-CE1 3.73Å; A329-F333 HydrophobicContact CB-CZ 4.23Å; A329-F333 WeakPolarHBondContact O-CE1 3.34Å; A329-F333 WeakPolarHBondContact O-CZ 3.18Å; C331-F333 PolarHBondContact O-N 3.3Å; C331-F333 VanDerWaalsContact O-N 3.16Å; F333-R335 VanDerWaalsContact C-N 3.26Å; F333-R335 WeakPolarHBondContact O-CG 3.24Å; F333-R335 PolarHBondContact O-N 3.2Å
334	E	76.1	Confident	84.2	Confident	48 Å²	48	54.2 Å²	54.2	22%	0.224	29%	0.288	C	S	.	.			trans	-75.7	72.7	-166.1	-62	-179.9	177.1	0	0	111.5	R246 N332 H336 V337 H339	R246-E334 PolarHBondContact NH2-O 2.74Å; N332-E334 WeakPolarHBondContact O-CG 3.48Å; N332-E334 PolarHBondContact O-N 3.41Å; E334-H336 PolarHBondContact O-N 3.38Å; E334-H336 VanDerWaalsContact O-N 3.16Å; E334-V337 HydrophobicContact CB-CB 3.77Å; E334-V337 HydrophobicContact CB-CG2 3.78Å; E334-V337 HydrophobicContact CG-CG2 4.39Å; E334-V337 PolarHBondContact O-N 3.45Å; E334-H339 IonicContact OE2-CE1 3.69Å; E334-H339 PolarHBondContact OE2-CE1 3.38Å; E334-H339 IonicContact OE2-ND1 3.53Å; E334-H339 IonicContact OE2-NE2 2.87Å
335	R	77.7	Confident	83.9	Confident	111 Å²	111	55.9 Å²	55.9	42%	0.419	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.8	-171.1	-69.9	171.9	-70	166	2.1	114.5	Y152 F333	Y152-R335 WeakPolarHBondContact O-CD 3.44Å; Y152-R335 WeakPolarHBondContact O-CG 3.43Å; F333-R335 VanDerWaalsContact C-N 3.26Å; F333-R335 WeakPolarHBondContact O-CG 3.24Å; F333-R335 PolarHBondContact O-N 3.2Å
336	H	77.4	Confident	83.7	Confident	168 Å²	168	59.1 Å²	59.1	78%	0.778	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	12.2	-177.6	-56.5	-62.8	0	0	0	112.6	E334	E334-H336 PolarHBondContact O-N 3.38Å; E334-H336 VanDerWaalsContact O-N 3.16Å
337	V	80	Confident	83.6	Confident	72 Å²	72	59.6 Å²	59.6	44%	0.436	31%	0.312	S	S	.	.			trans	-111	131.3	176.6	-177.4	0	0	0	0	109	E334	E334-V337 HydrophobicContact CB-CB 3.77Å; E334-V337 HydrophobicContact CB-CG2 3.78Å; E334-V337 HydrophobicContact CG-CG2 4.39Å; E334-V337 PolarHBondContact O-N 3.45Å
338	C	78.7	Confident	83.6	Confident	99 Å²	99	59.4 Å²	59.4	67%	0.669	31%	0.31	S	S	*	.			trans	-85.2	120.9	171.6	-61.6	0	0	0	0	109.4	W340	C338-W340 VanDerWaalsContact CB-NE1 3.33Å
339	H	82.7	Confident	83.5	Confident	32 Å²	32	62.5 Å²	62.5	15%	0.148	33%	0.333	C	S	.	.			trans	-95.9	124.6	176.3	-58	-84.4	0	0	0	110	T242 R246 F291 E334	T242-H339 HydrophobicContact CG2-CB 3.47Å; T242-H339 VanDerWaalsContact CG2-CB 3.47Å; T242-H339 WeakPolarHBondContact CG2-O 3.45Å; R246-H339 PolarHBondContact NH1-CD2 3.1Å; F291-H339 AromaticContact CD1-CD2 3.69Å; F291-H339 AromaticContact CD1-CE1 3.8Å; F291-H339 AromaticContact CD1-CG 3.84Å; F291-H339 AromaticContact CD1-ND1 3.92Å; F291-H339 AromaticContact CD1-NE2 3.63Å; F291-H339 HydrophobicContact CE1-CB 4.04Å; F291-H339 AromaticContact CE1-CD2 3.98Å; F291-H339 AromaticContact CE1-CG 3.86Å; E334-H339 IonicContact OE2-CE1 3.69Å; E334-H339 PolarHBondContact OE2-CE1 3.38Å; E334-H339 IonicContact OE2-ND1 3.53Å; E334-H339 IonicContact OE2-NE2 2.87Å
340	W	82.7	Confident	83.6	Confident	167 Å²	167	64.6 Å²	64.6	63%	0.633	34%	0.341	S	S	*	.			trans	-118.6	139	-178.2	-64.5	86.7	0	0	0	111	E124 C338 F342	E124-W340 HydrophobicContact CG-CE3 3.77Å; E124-W340 HydrophobicContact CG-CZ3 3.98Å; E124-W340 VanDerWaalsContact OE1-CA 3.28Å; E124-W340 WeakPolarHBondContact OE1-CA 3.41Å; E124-W340 VanDerWaalsContact OE2-CE3 3.25Å; E124-W340 WeakPolarHBondContact OE2-CZ3 3.44Å; C338-W340 VanDerWaalsContact CB-NE1 3.33Å; W340-F342 VanDerWaalsContact C-N 3.29Å; W340-F342 PolarHBondContact O-N 3.44Å
341	G	83.5	Confident	84	Confident	47 Å²	47	62.5 Å²	62.5	49%	0.485	33%	0.331	S	S	.	.	S	Bend	trans	67.8	14.2	171.9	0	0	0	0	0	117.3	E124 N343	E124-G341 PolarHBondContact OE1-N 2.94Å; G341-N343 PolarHBondContact O-N 3.38Å
342	F	89.9	Confident	85.1	Confident	18 Å²	18	61.5 Å²	61.5	8%	0.079	32%	0.319	C	S	.	.			trans	-63.7	134.6	174.8	174.8	-89.8	0	0	0	111	T242 V245 C290 F291 V326 W340 Y350	T242-F342 HydrophobicContact CG2-CB 3.7Å; T242-F342 PolarHBondContact OG1-N 3.45Å; V245-F342 HydrophobicContact CB-CD1 4.39Å; V245-F342 HydrophobicContact CB-CE1 4.02Å; V245-F342 HydrophobicContact CG1-CD1 4.44Å; V245-F342 HydrophobicContact CG1-CE1 3.61Å; V245-F342 HydrophobicContact CG1-CZ 4.41Å; V245-F342 HydrophobicContact CG2-CE1 4.48Å; C290-F342 HydrophobicContact CB-CD2 4.26Å; C290-F342 HydrophobicContact CB-CE2 3.82Å; F291-F342 AromaticContact CE2-CD1 3.92Å; F291-F342 HydrophobicContact CE2-CD1 3.92Å; F291-F342 HydrophobicContact CE2-CD2 4Å; F291-F342 AromaticContact CE2-CE1 3.68Å; F291-F342 HydrophobicContact CE2-CE1 3.68Å; F291-F342 AromaticContact CE2-CE2 3.75Å; F291-F342 HydrophobicContact CE2-CE2 3.75Å; F291-F342 HydrophobicContact CE2-CG 4.08Å; F291-F342 AromaticContact CE2-CZ 3.58Å; F291-F342 HydrophobicContact CE2-CZ 3.58Å; F291-F342 HydrophobicContact CZ-CB 4.21Å; F291-F342 AromaticContact CZ-CD1 3.58Å; F291-F342 HydrophobicContact CZ-CD1 3.58Å; F291-F342 AromaticContact CZ-CD2 3.9Å; F291-F342 HydrophobicContact CZ-CD2 3.9Å; F291-F342 AromaticContact CZ-CE1 3.84Å; F291-F342 HydrophobicContact CZ-CE1 3.84Å; F291-F342 HydrophobicContact CZ-CE2 4.13Å; F291-F342 AromaticContact CZ-CG 3.61Å; F291-F342 HydrophobicContact CZ-CG 3.61Å; F291-F342 HydrophobicContact CZ-CZ 4.1Å; V326-F342 HydrophobicContact CG2-CE2 4.47Å; V326-F342 HydrophobicContact CG2-CZ 4.07Å; W340-F342 VanDerWaalsContact C-N 3.29Å; W340-F342 PolarHBondContact O-N 3.44Å; F342-Y350 HydrophobicContact CD2-CE2 4.14Å; F342-Y350 HydrophobicContact CE2-CD2 4.04Å; F342-Y350 AromaticContact CE2-CE2 3.96Å; F342-Y350 HydrophobicContact CE2-CE2 3.96Å
343	N	89.3	Confident	86.3	Confident	51 Å²	51	56.3 Å²	56.3	27%	0.273	29%	0.291	S	S	.	.			trans	-144.5	104.1	176.2	-176.4	22.2	0	0	0	110.9	K241 G341 D345 N346 Y350	K241-N343 PolarHBondContact NZ-OD1 2.84Å; G341-N343 PolarHBondContact O-N 3.38Å; N343-D345 PolarHBondContact O-N 2.81Å; N343-D345 PolarHBondContact OD1-OD2 3.39Å; N343-N346 WeakPolarHBondContact O-CB 3.42Å; N343-N346 PolarHBondContact O-N 2.95Å; N343-Y350 PolarHBondContact N-OH 3.14Å; N343-Y350 WeakPolarHBondContact O-CE2 3.37Å; N343-Y350 PolarHBondContact O-OH 3.45Å; N343-Y350 VanDerWaalsContact O-OH 3.12Å
344	S	91.3	Very high	87.2	Confident	5 Å²	5	55.4 Å²	55.4	4%	0.035	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-60.5	-19.1	-175.5	56.2	0	0	0	0	114.6	K323 N346 W347	K323-S344 VanDerWaalsContact CE-OG 3.23Å; K323-S344 WeakPolarHBondContact CE-OG 3.46Å; S344-N346 PolarHBondContact O-N 3.21Å; S344-W347 WeakPolarHBondContact O-CB 3.35Å; S344-W347 PolarHBondContact O-N 3.01Å
345	D	87.7	Confident	87.7	Confident	64 Å²	64	57.6 Å²	57.6	34%	0.342	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-62.7	-28.3	170.9	-62.4	-47.3	0	0	0	112.4	K241 K323 N343 W347	K241-D345 IonicContact NZ-OD2 3.91Å; K323-D345 VanDerWaalsContact CE-OD1 3.3Å; K323-D345 WeakPolarHBondContact CE-OD1 3.39Å; K323-D345 IonicContact NZ-OD1 3.57Å; K323-D345 PolarHBondContact NZ-OD1 3.08Å; N343-D345 PolarHBondContact O-N 2.81Å; N343-D345 PolarHBondContact OD1-OD2 3.39Å; D345-W347 VanDerWaalsContact C-N 3.27Å; D345-W347 PolarHBondContact O-N 2.76Å
346	N	89.7	Confident	88	Confident	67 Å²	67	57 Å²	57	36%	0.358	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-92.8	36.2	175.4	-170.7	25.7	0	0	0	112	N343 S344 P348 S349 Y350	N343-N346 WeakPolarHBondContact O-CB 3.42Å; N343-N346 PolarHBondContact O-N 2.95Å; S344-N346 PolarHBondContact O-N 3.21Å; N346-P348 VanDerWaalsContact C-N 3.26Å; N346-P348 WeakPolarHBondContact O-CD 3.39Å; N346-S349 VanDerWaalsContact ND2-CB 3.34Å; N346-S349 WeakPolarHBondContact ND2-CB 3.18Å; N346-S349 PolarHBondContact ND2-OG 2.98Å; N346-S349 WeakPolarHBondContact O-CB 3.34Å; N346-S349 PolarHBondContact O-N 3.3Å; N346-S349 VanDerWaalsContact O-N 3.11Å; N346-S349 PolarHBondContact OD1-OG 2.92Å; N346-Y350 HydrophobicContact CB-CE2 4.4Å; N346-Y350 WeakPolarHBondContact O-CD2 3.48Å; N346-Y350 WeakPolarHBondContact O-CE2 3.4Å
347	W	92.9	Very high	88.5	Confident	10 Å²	10	52 Å²	52	4%	0.038	28%	0.28	C	S	.	.	H	α-helix	trans	-50.9	-33.4	178.1	68.6	-92.5	0	0	0	115	F298 Y303 A322 V326 S344 D345 S349 Y350 I351 L370 F374	F298-W347 HydrophobicContact CE2-CH2 4.31Å; F298-W347 HydrophobicContact CE2-CZ3 4.34Å; Y303-W347 HydrophobicContact CE2-CZ2 4.44Å; A322-W347 HydrophobicContact CB-CD2 3.49Å; A322-W347 VanDerWaalsContact CB-CD2 3.49Å; A322-W347 HydrophobicContact CB-CE3 3.69Å; A322-W347 HydrophobicContact CB-CG 4Å; A322-W347 HydrophobicContact CB-CH2 4.15Å; A322-W347 HydrophobicContact CB-CZ2 3.99Å; A322-W347 HydrophobicContact CB-CZ3 4.01Å; V326-W347 HydrophobicContact CG1-CB 3.78Å; V326-W347 HydrophobicContact CG2-CB 3.92Å; S344-W347 WeakPolarHBondContact O-CB 3.35Å; S344-W347 PolarHBondContact O-N 3.01Å; D345-W347 VanDerWaalsContact C-N 3.27Å; D345-W347 PolarHBondContact O-N 2.76Å; W347-S349 PolarHBondContact O-N 3.06Å; W347-S349 VanDerWaalsContact O-N 3.16Å; W347-Y350 PolarHBondContact O-N 3.48Å; W347-I351 HydrophobicContact CD2-CD1 4.46Å; W347-I351 HydrophobicContact CE3-CB 4.48Å; W347-I351 HydrophobicContact CE3-CD1 3.5Å; W347-I351 HydrophobicContact CE3-CG1 4.04Å; W347-I351 HydrophobicContact CZ3-CD1 4.03Å; W347-I351 PolarHBondContact O-N 3.2Å; W347-L370 HydrophobicContact CH2-CD1 4.33Å; W347-L370 HydrophobicContact CH2-CD2 4.25Å; W347-L370 HydrophobicContact CH2-CG 4.14Å; W347-L370 HydrophobicContact CZ3-CD2 4.27Å; W347-F374 AromaticContact CE2-CD2 3.89Å; W347-F374 AromaticContact CE2-CE2 3.98Å; W347-F374 HydrophobicContact CZ2-CB 4.41Å; W347-F374 AromaticContact CZ2-CD2 3.62Å; W347-F374 HydrophobicContact CZ2-CD2 3.62Å; W347-F374 HydrophobicContact CZ2-CE2 4.19Å; W347-F374 HydrophobicContact CZ2-CG 4.19Å; W347-F374 AromaticContact NE1-CD2 3.73Å; W347-F374 AromaticContact NE1-CE2 3.35Å
348	P	92.4	Very high	88.5	Confident	10 Å²	10	51.8 Å²	51.8	7%	0.065	27%	0.274	C	S	.	.	H	α-helix	trans	-64.9	-22.2	-179	-18.5	31.2	0	0	0	113.5	N346 Y350 K371 F374	N346-P348 VanDerWaalsContact C-N 3.26Å; N346-P348 WeakPolarHBondContact O-CD 3.39Å; P348-Y350 VanDerWaalsContact C-N 3.34Å; P348-K371 HydrophobicContact CB-CG 4.28Å; P348-K371 WeakPolarHBondContact O-CE 3.34Å; P348-K371 PolarHBondContact O-NZ 2.81Å; P348-F374 HydrophobicContact CB-CD1 4.44Å; P348-F374 HydrophobicContact CG-CB 4.23Å; P348-F374 HydrophobicContact CG-CD1 3.42Å; P348-F374 VanDerWaalsContact CG-CD1 3.42Å; P348-F374 HydrophobicContact CG-CD2 4.03Å; P348-F374 HydrophobicContact CG-CE1 3.64Å; P348-F374 HydrophobicContact CG-CE2 4.23Å; P348-F374 HydrophobicContact CG-CG 3.6Å; P348-F374 HydrophobicContact CG-CZ 4.03Å
349	S	90.5	Very high	88.3	Confident	76 Å²	76	50.5 Å²	50.5	53%	0.531	28%	0.277	S	S	.	.	H	α-helix	trans	-77.1	-21.5	174.9	-63.5	0	0	0	0	112.8	N346 W347	N346-S349 VanDerWaalsContact ND2-CB 3.34Å; N346-S349 WeakPolarHBondContact ND2-CB 3.18Å; N346-S349 PolarHBondContact ND2-OG 2.98Å; N346-S349 WeakPolarHBondContact O-CB 3.34Å; N346-S349 PolarHBondContact O-N 3.3Å; N346-S349 VanDerWaalsContact O-N 3.11Å; N346-S349 PolarHBondContact OD1-OG 2.92Å; W347-S349 PolarHBondContact O-N 3.06Å; W347-S349 VanDerWaalsContact O-N 3.16Å
350	Y	93.7	Very high	88.4	Confident	47 Å²	47	51.4 Å²	51.4	18%	0.184	28%	0.283	C	S	.	.	H	α-helix	trans	-102.9	-22.1	-177.9	-45.6	-51.1	0	0	0	113.8	H288 C290 V326 F342 N343 N346 W347 P348 H352	H288-Y350 WeakPolarHBondContact CA-O 3.48Å; H288-Y350 WeakPolarHBondContact CB-O 3.17Å; C290-Y350 VanDerWaalsContact SG-CB 3.58Å; V326-Y350 HydrophobicContact CB-CD2 4.13Å; V326-Y350 HydrophobicContact CG1-CD2 4.19Å; V326-Y350 HydrophobicContact CG2-CD2 4.24Å; F342-Y350 HydrophobicContact CD2-CE2 4.14Å; F342-Y350 HydrophobicContact CE2-CD2 4.04Å; F342-Y350 AromaticContact CE2-CE2 3.96Å; F342-Y350 HydrophobicContact CE2-CE2 3.96Å; N343-Y350 PolarHBondContact N-OH 3.14Å; N343-Y350 WeakPolarHBondContact O-CE2 3.37Å; N343-Y350 PolarHBondContact O-OH 3.45Å; N343-Y350 VanDerWaalsContact O-OH 3.12Å; N346-Y350 HydrophobicContact CB-CE2 4.4Å; N346-Y350 WeakPolarHBondContact O-CD2 3.48Å; N346-Y350 WeakPolarHBondContact O-CE2 3.4Å; W347-Y350 PolarHBondContact O-N 3.48Å; P348-Y350 VanDerWaalsContact C-N 3.34Å; Y350-H352 PolarHBondContact O-CD2 2.97Å; Y350-H352 VanDerWaalsContact O-CD2 3.32Å
351	I	94.7	Very high	88.3	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	28%	0.277	C	S	.	.			trans	-85.4	130.6	176	-56.2	-171.7	0	0	0	109.7	V286 E287 A322 F325 V326 W347 M367 K371	V286-I351 HydrophobicContact CB-CG2 3.56Å; V286-I351 HydrophobicContact CG1-CG2 3.61Å; V286-I351 HydrophobicContact CG2-CG2 4.4Å; E287-I351 WeakPolarHBondContact O-CA 3.35Å; A322-I351 HydrophobicContact CB-CD1 4.36Å; F325-I351 HydrophobicContact CD1-CD1 3.78Å; F325-I351 HydrophobicContact CD1-CG1 4.25Å; F325-I351 HydrophobicContact CE1-CD1 4.37Å; V326-I351 HydrophobicContact CG1-CD1 3.98Å; V326-I351 HydrophobicContact CG1-CG1 3.49Å; V326-I351 VanDerWaalsContact CG1-CG1 3.49Å; W347-I351 HydrophobicContact CD2-CD1 4.46Å; W347-I351 HydrophobicContact CE3-CB 4.48Å; W347-I351 HydrophobicContact CE3-CD1 3.5Å; W347-I351 HydrophobicContact CE3-CG1 4.04Å; W347-I351 HydrophobicContact CZ3-CD1 4.03Å; W347-I351 PolarHBondContact O-N 3.2Å; I351-M367 HydrophobicContact CB-CE 3.89Å; I351-M367 HydrophobicContact CG2-CE 3.54Å; I351-M367 WeakPolarHBondContact O-CE 3.47Å; I351-K371 PolarHBondContact O-NZ 2.81Å
352	H	93.4	Very high	88.4	Confident	50 Å²	50	49.6 Å²	49.6	23%	0.231	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-140.6	172	176.7	52.6	84.5	0	0	0	111.2	V286 E287 D289 Y350	V286-H352 CarbonylContact C-O 3.55Å; V286-H352 WeakPolarHBondContact CA-O 3.5Å; E287-H352 PolarHBondContact N-O 3.46Å; E287-H352 PolarHBondContact O-CD2 3.07Å; E287-H352 PolarHBondContact O-N 3.16Å; D289-H352 IonicContact OD2-CE1 3.23Å; D289-H352 IonicContact OD2-NE2 3.18Å; D289-H352 PolarHBondContact OD2-NE2 3.25Å; Y350-H352 PolarHBondContact O-CD2 2.97Å; Y350-H352 VanDerWaalsContact O-CD2 3.32Å
353	L	93.6	Very high	88.3	Confident	13 Å²	13	50.4 Å²	50.4	7%	0.068	28%	0.281	C	S	.	.			trans	-73.7	143.4	170.5	-63.3	177.2	0	0	0	110	I284 P285 Q358 A364 M367	I284-L353 HydrophobicContact CG2-CD2 3.58Å; P285-L353 WeakPolarHBondContact O-CD2 3.44Å; L353-Q358 HydrophobicContact CB-CG 4.07Å; L353-Q358 PolarHBondContact O-NE2 3.48Å; L353-A364 HydrophobicContact CD1-CB 4.29Å; L353-M367 HydrophobicContact CD2-CB 4.32Å; L353-M367 HydrophobicContact CG-CB 4.39Å; L353-M367 HydrophobicContact CG-CG 4.49Å
354	P	92.5	Very high	88.1	Confident	7 Å²	7	49.6 Å²	49.6	5%	0.045	28%	0.281	C	S	.	.			trans	-54	148.4	166.8	-22.8	32.2	0	0	0	111.1	P285 E287 E356 E357 Q358	P285-P354 HydrophobicContact CB-CG 4.2Å; P285-P354 WeakPolarHBondContact O-CD 3.13Å; E287-P354 HydrophobicContact CB-CG 4.18Å; E287-P354 WeakPolarHBondContact OE2-CA 3.21Å; P354-E356 WeakPolarHBondContact CB-OE2 3.17Å; P354-E356 PolarHBondContact O-N 3.24Å; P354-E357 PolarHBondContact O-N 3.38Å; P354-Q358 PolarHBondContact O-N 3.24Å
355	L	87.3	Confident	87.9	Confident	94 Å²	94	50.8 Å²	50.8	49%	0.492	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-33.9	-178.4	-77.2	162.2	0	0	0	113	E357	L355-E357 VanDerWaalsContact C-N 3.28Å; L355-E357 PolarHBondContact O-N 3.07Å
356	E	84.9	Confident	87.9	Confident	99 Å²	99	47.8 Å²	47.8	46%	0.463	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-26.6	179.9	-55.2	82.7	-157	0	0	113.1	R295 P354	R295-E356 IonicContact CZ-OE2 3.91Å; R295-E356 IonicContact NH1-OE1 2.67Å; R295-E356 IonicContact NH1-OE2 2.71Å; R295-E356 PolarHBondContact NH1-OE2 2.85Å; R295-E356 IonicContact NH2-OE1 3.22Å; R295-E356 PolarHBondContact NH2-OE1 2.9Å; R295-E356 IonicContact NH2-OE2 3.72Å; R295-E356 PolarHBondContact NH2-OE2 3.22Å; P354-E356 WeakPolarHBondContact CB-OE2 3.17Å; P354-E356 PolarHBondContact O-N 3.24Å
357	E	87.4	Confident	87.8	Confident	62 Å²	62	45 Å²	45	29%	0.29	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-3.3	-173.6	-63.2	-66.9	173.6	0	0	112.9	P285 P354 L355 G359 N360 Y363	P285-E357 HydrophobicContact CB-CG 4.38Å; P285-E357 HydrophobicContact CG-CB 4.14Å; P285-E357 HydrophobicContact CG-CG 3.78Å; P354-E357 PolarHBondContact O-N 3.38Å; L355-E357 VanDerWaalsContact C-N 3.28Å; L355-E357 PolarHBondContact O-N 3.07Å; E357-G359 PolarHBondContact O-N 3.03Å; E357-N360 WeakPolarHBondContact O-CB 3.26Å; E357-N360 PolarHBondContact O-N 3.17Å; E357-N360 PolarHBondContact OE2-ND2 2.85Å; E357-Y363 HydrophobicContact CB-CD2 4.11Å; E357-Y363 HydrophobicContact CG-CD2 4.31Å; E357-Y363 HydrophobicContact CG-CE2 4.42Å; E357-Y363 VanDerWaalsContact OE2-CD2 3.26Å; E357-Y363 WeakPolarHBondContact OE2-CD2 3.43Å; E357-Y363 VanDerWaalsContact OE2-CE2 3.24Å; E357-Y363 WeakPolarHBondContact OE2-CE2 3.37Å
358	Q	79	Confident	87.5	Confident	68 Å²	68	45.9 Å²	45.9	32%	0.318	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-26.4	179.5	-77.2	171.6	22.2	0	0	113.1	R85 L353 P354 N360	R85-Q358 VanDerWaalsContact NH1-CD 3.31Å; L353-Q358 HydrophobicContact CB-CG 4.07Å; L353-Q358 PolarHBondContact O-NE2 3.48Å; P354-Q358 PolarHBondContact O-N 3.24Å; Q358-N360 VanDerWaalsContact C-N 3.28Å
359	G	75.4	Confident	87.2	Confident	72 Å²	72	47.3 Å²	47.3	74%	0.742	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-8.1	173.3	0	0	0	0	0	114.4	E357 T361	E357-G359 PolarHBondContact O-N 3.03Å; G359-T361 PolarHBondContact O-N 2.81Å
360	N	83.9	Confident	87	Confident	51 Å²	51	44 Å²	44	27%	0.273	24%	0.24	S	C	.	.			trans	-85.3	104.3	-177.5	-169.9	-31.6	0	0	0	110.4	E357 Q358 L362 Y363 A364	E357-N360 WeakPolarHBondContact O-CB 3.26Å; E357-N360 PolarHBondContact O-N 3.17Å; E357-N360 PolarHBondContact OE2-ND2 2.85Å; Q358-N360 VanDerWaalsContact C-N 3.28Å; N360-L362 PolarHBondContact O-N 3.2Å; N360-L362 WeakPolarHBondContact OD1-CB 3.47Å; N360-L362 PolarHBondContact OD1-N 2.72Å; N360-Y363 HydrophobicContact CB-CD2 3.76Å; N360-Y363 HydrophobicContact CB-CG 4.41Å; N360-Y363 VanDerWaalsContact CG-CD2 3.43Å; N360-Y363 WeakPolarHBondContact ND2-CD2 3.36Å; N360-Y363 VanDerWaalsContact ND2-CE2 3.29Å; N360-Y363 WeakPolarHBondContact ND2-CE2 3.45Å; N360-Y363 PolarHBondContact O-N 3.47Å; N360-Y363 VanDerWaalsContact O-N 3.15Å; N360-Y363 PolarHBondContact OD1-N 3.09Å; N360-A364 PolarHBondContact O-N 3.43Å
361	T	82.4	Confident	86.7	Confident	83 Å²	83	44.8 Å²	44.8	51%	0.509	25%	0.245	S	C	.	.	H	α-helix	trans	-59.2	-32.7	-176.8	55.6	0	0	0	0	112.9	G359 Y365	G359-T361 PolarHBondContact O-N 2.81Å; T361-Y365 WeakPolarHBondContact O-CB 3.32Å; T361-Y365 PolarHBondContact O-N 3.15Å
362	L	83.6	Confident	86.3	Confident	93 Å²	93	45.7 Å²	45.7	49%	0.487	25%	0.251	S	S	.	.	H	α-helix	trans	-68.2	-43.3	177.8	-70	177	0	0	0	111.9	L281 N360 A366	L281-L362 HydrophobicContact CD1-CB 4.2Å; L281-L362 HydrophobicContact CD2-CB 4.38Å; N360-L362 PolarHBondContact O-N 3.2Å; N360-L362 WeakPolarHBondContact OD1-CB 3.47Å; N360-L362 PolarHBondContact OD1-N 2.72Å; L362-A366 WeakPolarHBondContact O-CB 3.5Å; L362-A366 PolarHBondContact O-N 2.87Å
363	Y	89.2	Confident	85.8	Confident	36 Å²	36	45.7 Å²	45.7	14%	0.141	26%	0.256	C	S	.	.	H	α-helix	trans	-71.1	-40.2	176.3	-71.3	-43.5	0	0	0	112.1	L281 F283 I284 P285 E357 N360 Y365 A366 M367	L281-Y363 HydrophobicContact CD2-CD1 3.85Å; L281-Y363 HydrophobicContact CD2-CE1 3.43Å; L281-Y363 VanDerWaalsContact CD2-CE1 3.43Å; F283-Y363 WeakPolarHBondContact O-CE1 3.21Å; I284-Y363 HydrophobicContact CG2-CD1 4.3Å; P285-Y363 VanDerWaalsContact CD-CZ 3.49Å; P285-Y363 HydrophobicContact CG-CD1 4.18Å; P285-Y363 HydrophobicContact CG-CD2 3.77Å; P285-Y363 HydrophobicContact CG-CE1 4.09Å; P285-Y363 HydrophobicContact CG-CE2 3.72Å; P285-Y363 HydrophobicContact CG-CG 4.04Å; E357-Y363 HydrophobicContact CB-CD2 4.11Å; E357-Y363 HydrophobicContact CG-CD2 4.31Å; E357-Y363 HydrophobicContact CG-CE2 4.42Å; E357-Y363 VanDerWaalsContact OE2-CD2 3.26Å; E357-Y363 WeakPolarHBondContact OE2-CD2 3.43Å; E357-Y363 VanDerWaalsContact OE2-CE2 3.24Å; E357-Y363 WeakPolarHBondContact OE2-CE2 3.37Å; N360-Y363 HydrophobicContact CB-CD2 3.76Å; N360-Y363 HydrophobicContact CB-CG 4.41Å; N360-Y363 VanDerWaalsContact CG-CD2 3.43Å; N360-Y363 WeakPolarHBondContact ND2-CD2 3.36Å; N360-Y363 VanDerWaalsContact ND2-CE2 3.29Å; N360-Y363 WeakPolarHBondContact ND2-CE2 3.45Å; N360-Y363 PolarHBondContact O-N 3.47Å; N360-Y363 VanDerWaalsContact O-N 3.15Å; N360-Y363 PolarHBondContact OD1-N 3.09Å; Y363-Y365 VanDerWaalsContact C-N 3.32Å; Y363-Y365 PolarHBondContact O-N 3.07Å; Y363-A366 PolarHBondContact O-N 3.2Å; Y363-M367 WeakPolarHBondContact O-CB 3.16Å; Y363-M367 PolarHBondContact O-N 3.09Å
364	A	85.3	Confident	85.3	Confident	34 Å²	34	46.6 Å²	46.6	28%	0.281	26%	0.259	S	S	.	.	H	α-helix	trans	-57.6	-48.3	175.6	0	0	0	0	0	110.8	L353 N360 A366 M367 E368	L353-A364 HydrophobicContact CD1-CB 4.29Å; N360-A364 PolarHBondContact O-N 3.43Å; A364-A366 PolarHBondContact O-N 2.92Å; A364-M367 PolarHBondContact O-N 3.28Å; A364-E368 PolarHBondContact O-N 3.05Å
365	Y	85.6	Confident	84.9	Confident	29 Å²	29	50.5 Å²	50.5	11%	0.114	28%	0.277	C	S	.	.	H	α-helix	trans	-62.5	-41.3	175.8	174.4	-121.3	0	0	0	113.3	T361 Y363 M367 Q369 A433 L436	T361-Y365 WeakPolarHBondContact O-CB 3.32Å; T361-Y365 PolarHBondContact O-N 3.15Å; Y363-Y365 VanDerWaalsContact C-N 3.32Å; Y363-Y365 PolarHBondContact O-N 3.07Å; Y365-M367 VanDerWaalsContact C-N 3.32Å; Y365-Q369 HydrophobicContact CD2-CG 4.39Å; Y365-Q369 HydrophobicContact CE2-CG 3.69Å; Y365-Q369 WeakPolarHBondContact O-CG 3.34Å; Y365-Q369 PolarHBondContact O-N 2.93Å; Y365-Q369 VanDerWaalsContact O-N 3.15Å; Y365-Q369 PolarHBondContact O-NE2 3.02Å; Y365-Q369 PolarHBondContact OH-NE2 3.06Å; Y365-Q369 PolarHBondContact OH-OE1 3.38Å; Y365-A433 HydrophobicContact CD2-CB 4.29Å; Y365-A433 VanDerWaalsContact CE2-CA 3.45Å; Y365-A433 HydrophobicContact CE2-CB 3.13Å; Y365-A433 VanDerWaalsContact CZ-CB 3.46Å; Y365-A433 WeakPolarHBondContact OH-CA 3.38Å; Y365-A433 WeakPolarHBondContact OH-CB 3.36Å; Y365-A433 PolarHBondContact OH-O 3.02Å; Y365-L436 HydrophobicContact CE1-CD1 4.48Å
366	A	87.9	Confident	84.6	Confident	1 Å²	1	51 Å²	51	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-65.7	-36.8	176.6	0	0	0	0	0	112.1	L281 I284 L362 Y363 A364 L370	L281-A366 HydrophobicContact CD1-CB 4.22Å; I284-A366 HydrophobicContact CD1-CB 3.63Å; I284-A366 HydrophobicContact CG1-CB 3.8Å; L362-A366 WeakPolarHBondContact O-CB 3.5Å; L362-A366 PolarHBondContact O-N 2.87Å; Y363-A366 PolarHBondContact O-N 3.2Å; A364-A366 PolarHBondContact O-N 2.92Å; A366-L370 PolarHBondContact O-N 3.18Å; A366-L370 VanDerWaalsContact O-N 3.13Å
367	M	87.8	Confident	84.3	Confident	10 Å²	10	48.8 Å²	48.8	5%	0.049	28%	0.275	C	S	.	.	H	α-helix	trans	-69.3	-40.6	178.4	-167.2	63.5	-170.8	0	0	111.9	I284 V286 I351 L353 Y363 A364 Y365 L370 K371	I284-M367 HydrophobicContact CG2-SD 4.41Å; V286-M367 HydrophobicContact CG1-SD 4.27Å; I351-M367 HydrophobicContact CB-CE 3.89Å; I351-M367 HydrophobicContact CG2-CE 3.54Å; I351-M367 WeakPolarHBondContact O-CE 3.47Å; L353-M367 HydrophobicContact CD2-CB 4.32Å; L353-M367 HydrophobicContact CG-CB 4.39Å; L353-M367 HydrophobicContact CG-CG 4.49Å; Y363-M367 WeakPolarHBondContact O-CB 3.16Å; Y363-M367 PolarHBondContact O-N 3.09Å; A364-M367 PolarHBondContact O-N 3.28Å; Y365-M367 VanDerWaalsContact C-N 3.32Å; M367-L370 WeakPolarHBondContact O-CB 3.46Å; M367-L370 PolarHBondContact O-N 3.47Å; M367-L370 HydrophobicContact SD-CD2 4.21Å; M367-K371 WeakPolarHBondContact O-CG 3.15Å; M367-K371 PolarHBondContact O-N 3.43Å
368	E	87	Confident	84	Confident	27 Å²	27	51 Å²	51	13%	0.126	29%	0.286	C	S	.	.	H	α-helix	trans	-66.6	-40.8	176.3	-170.8	-173.1	166.2	0	0	112.5	A364 L370 K371 T372 N426 L429	A364-E368 PolarHBondContact O-N 3.05Å; E368-L370 VanDerWaalsContact C-N 3.28Å; E368-L370 PolarHBondContact O-N 3.04Å; E368-K371 PolarHBondContact O-N 3.18Å; E368-T372 WeakPolarHBondContact O-CB 3.43Å; E368-T372 PolarHBondContact O-N 3.11Å; E368-T372 PolarHBondContact O-OG1 2.81Å; E368-N426 WeakPolarHBondContact OE1-CA 3.37Å; E368-N426 PolarHBondContact OE1-OD1 3.03Å; E368-L429 WeakPolarHBondContact OE2-CB 3.46Å; E368-L429 WeakPolarHBondContact OE2-CD2 3.47Å; E368-L429 WeakPolarHBondContact OE2-CG 3.22Å
369	Q	86.2	Confident	84.1	Confident	41 Å²	41	54.5 Å²	54.5	19%	0.192	30%	0.3	C	S	.	.	H	α-helix	trans	-58.8	-42.3	172.8	-78.3	176.7	80.2	0	0	111.7	Y365 T372 S373	Y365-Q369 HydrophobicContact CD2-CG 4.39Å; Y365-Q369 HydrophobicContact CE2-CG 3.69Å; Y365-Q369 WeakPolarHBondContact O-CG 3.34Å; Y365-Q369 PolarHBondContact O-N 2.93Å; Y365-Q369 VanDerWaalsContact O-N 3.15Å; Y365-Q369 PolarHBondContact O-NE2 3.02Å; Y365-Q369 PolarHBondContact OH-NE2 3.06Å; Y365-Q369 PolarHBondContact OH-OE1 3.38Å; Q369-T372 PolarHBondContact O-N 3.16Å; Q369-S373 WeakPolarHBondContact O-CB 3.04Å; Q369-S373 PolarHBondContact O-N 3.45Å; Q369-S373 PolarHBondContact O-OG 3.07Å
370	L	86.6	Confident	84.3	Confident	5 Å²	5	56.8 Å²	56.8	3%	0.026	29%	0.291	C	S	.	.	H	α-helix	trans	-60.7	-48.5	177	179	65.6	0	0	0	110.8	F298 Y303 W347 A366 M367 E368 T372 S373 F374	F298-L370 HydrophobicContact CD1-CD1 4.41Å; F298-L370 HydrophobicContact CD1-CD2 3.92Å; F298-L370 HydrophobicContact CD2-CD2 3.78Å; F298-L370 HydrophobicContact CE1-CD1 3.53Å; F298-L370 HydrophobicContact CE1-CD2 3.77Å; F298-L370 HydrophobicContact CE1-CG 4.3Å; F298-L370 HydrophobicContact CE2-CD1 4.2Å; F298-L370 HydrophobicContact CE2-CD2 3.63Å; F298-L370 HydrophobicContact CG-CD2 3.96Å; F298-L370 HydrophobicContact CZ-CD1 3.42Å; F298-L370 VanDerWaalsContact CZ-CD1 3.42Å; F298-L370 HydrophobicContact CZ-CD2 3.66Å; F298-L370 HydrophobicContact CZ-CG 4.16Å; Y303-L370 HydrophobicContact CD1-CD1 4.21Å; Y303-L370 HydrophobicContact CE1-CD1 4.46Å; W347-L370 HydrophobicContact CH2-CD1 4.33Å; W347-L370 HydrophobicContact CH2-CD2 4.25Å; W347-L370 HydrophobicContact CH2-CG 4.14Å; W347-L370 HydrophobicContact CZ3-CD2 4.27Å; A366-L370 PolarHBondContact O-N 3.18Å; A366-L370 VanDerWaalsContact O-N 3.13Å; M367-L370 WeakPolarHBondContact O-CB 3.46Å; M367-L370 PolarHBondContact O-N 3.47Å; M367-L370 HydrophobicContact SD-CD2 4.21Å; E368-L370 VanDerWaalsContact C-N 3.28Å; E368-L370 PolarHBondContact O-N 3.04Å; L370-T372 PolarHBondContact O-N 2.98Å; L370-S373 PolarHBondContact O-N 2.86Å; L370-S373 PolarHBondContact O-OG 2.8Å; L370-F374 PolarHBondContact O-N 2.8Å
371	K	87.8	Confident	84	Confident	65 Å²	65	56.1 Å²	56.1	28%	0.283	29%	0.292	S	S	.	.	H	α-helix	trans	-62.1	-43.7	178	-67.7	-173.8	-176.5	-156.4	0	112.1	P348 I351 M367 E368 S373 F374 E375	P348-K371 HydrophobicContact CB-CG 4.28Å; P348-K371 WeakPolarHBondContact O-CE 3.34Å; P348-K371 PolarHBondContact O-NZ 2.81Å; I351-K371 PolarHBondContact O-NZ 2.81Å; M367-K371 WeakPolarHBondContact O-CG 3.15Å; M367-K371 PolarHBondContact O-N 3.43Å; E368-K371 PolarHBondContact O-N 3.18Å; K371-S373 PolarHBondContact O-N 2.91Å; K371-F374 WeakPolarHBondContact O-CB 3.47Å; K371-F374 PolarHBondContact O-N 3.07Å; K371-E375 PolarHBondContact O-N 2.95Å; K371-E375 VanDerWaalsContact O-N 3.07Å
372	T	86.2	Confident	83.7	Confident	20 Å²	20	54.8 Å²	54.8	12%	0.123	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-43	177.4	-56	0	0	0	0	111.7	E368 Q369 L370 F374 E375 E376 K430	E368-T372 WeakPolarHBondContact O-CB 3.43Å; E368-T372 PolarHBondContact O-N 3.11Å; E368-T372 PolarHBondContact O-OG1 2.81Å; Q369-T372 PolarHBondContact O-N 3.16Å; L370-T372 PolarHBondContact O-N 2.98Å; T372-F374 PolarHBondContact O-N 3.18Å; T372-E375 PolarHBondContact O-N 2.89Å; T372-E376 HydrophobicContact CG2-CG 4.44Å; T372-E376 WeakPolarHBondContact O-CG 3.32Å; T372-E376 PolarHBondContact O-N 3.37Å; T372-K430 VanDerWaalsContact OG1-CE 3.26Å; T372-K430 WeakPolarHBondContact OG1-CE 3.45Å
373	S	82.2	Confident	83.4	Confident	49 Å²	49	55.8 Å²	55.8	34%	0.343	30%	0.295	S	S	.	.	H	α-helix	trans	-61.9	-33.2	178.1	72.7	0	0	0	0	112.8	Q369 L370 K371 A377	Q369-S373 WeakPolarHBondContact O-CB 3.04Å; Q369-S373 PolarHBondContact O-N 3.45Å; Q369-S373 PolarHBondContact O-OG 3.07Å; L370-S373 PolarHBondContact O-N 2.86Å; L370-S373 PolarHBondContact O-OG 2.8Å; K371-S373 PolarHBondContact O-N 2.91Å; S373-A377 WeakPolarHBondContact O-CB 3.3Å; S373-A377 PolarHBondContact O-N 3.18Å; S373-A377 VanDerWaalsContact O-N 3.07Å
374	F	83.3	Confident	82.7	Confident	32 Å²	32	61.6 Å²	61.6	14%	0.14	32%	0.321	C	S	.	.	H	α-helix	trans	-70.5	-47.7	175	177.5	-88.1	0	0	0	111.6	W347 P348 L370 K371 T372 E376 A377 E378	W347-F374 AromaticContact CE2-CD2 3.89Å; W347-F374 AromaticContact CE2-CE2 3.98Å; W347-F374 HydrophobicContact CZ2-CB 4.41Å; W347-F374 AromaticContact CZ2-CD2 3.62Å; W347-F374 HydrophobicContact CZ2-CD2 3.62Å; W347-F374 HydrophobicContact CZ2-CE2 4.19Å; W347-F374 HydrophobicContact CZ2-CG 4.19Å; W347-F374 AromaticContact NE1-CD2 3.73Å; W347-F374 AromaticContact NE1-CE2 3.35Å; P348-F374 HydrophobicContact CB-CD1 4.44Å; P348-F374 HydrophobicContact CG-CB 4.23Å; P348-F374 HydrophobicContact CG-CD1 3.42Å; P348-F374 VanDerWaalsContact CG-CD1 3.42Å; P348-F374 HydrophobicContact CG-CD2 4.03Å; P348-F374 HydrophobicContact CG-CE1 3.64Å; P348-F374 HydrophobicContact CG-CE2 4.23Å; P348-F374 HydrophobicContact CG-CG 3.6Å; P348-F374 HydrophobicContact CG-CZ 4.03Å; L370-F374 PolarHBondContact O-N 2.8Å; K371-F374 WeakPolarHBondContact O-CB 3.47Å; K371-F374 PolarHBondContact O-N 3.07Å; T372-F374 PolarHBondContact O-N 3.18Å; F374-E376 VanDerWaalsContact C-N 3.28Å; F374-E376 PolarHBondContact O-N 2.9Å; F374-A377 PolarHBondContact O-N 3.12Å; F374-E378 WeakPolarHBondContact O-CB 3.39Å; F374-E378 PolarHBondContact O-N 3.32Å
375	E	83.4	Confident	81.7	Confident	90 Å²	90	68.3 Å²	68.3	42%	0.421	34%	0.339	S	S	.	.	H	α-helix	trans	-58.8	-40.3	177.2	-71.1	177.2	-172.9	0	0	112	K371 T372 E378 K379	K371-E375 PolarHBondContact O-N 2.95Å; K371-E375 VanDerWaalsContact O-N 3.07Å; T372-E375 PolarHBondContact O-N 2.89Å; E375-E378 PolarHBondContact O-N 2.83Å; E375-K379 WeakPolarHBondContact O-CB 3.32Å; E375-K379 VanDerWaalsContact O-CG 3.28Å; E375-K379 WeakPolarHBondContact O-CG 3.37Å; E375-K379 PolarHBondContact O-N 3.47Å
376	E	80.9	Confident	79.7	Confident	105 Å²	105	69.6 Å²	69.6	49%	0.491	36%	0.361	S	S	.	.	H	α-helix	trans	-65.2	-45.4	175.6	-72.8	174.3	-178.9	0	0	111.8	T372 F374 E378 K379 Q380	T372-E376 HydrophobicContact CG2-CG 4.44Å; T372-E376 WeakPolarHBondContact O-CG 3.32Å; T372-E376 PolarHBondContact O-N 3.37Å; F374-E376 VanDerWaalsContact C-N 3.28Å; F374-E376 PolarHBondContact O-N 2.9Å; E376-E378 VanDerWaalsContact C-N 3.31Å; E376-E378 PolarHBondContact O-N 3.04Å; E376-K379 PolarHBondContact O-N 3.48Å; E376-Q380 VanDerWaalsContact O-CG 3.29Å; E376-Q380 WeakPolarHBondContact O-CG 3.41Å; E376-Q380 PolarHBondContact O-N 3.07Å
377	A	80.2	Confident	77.6	Confident	51 Å²	51	78.5 Å²	78.5	42%	0.421	40%	0.396	S	S	.	.	H	α-helix	trans	-62.5	-38.5	176.1	0	0	0	0	0	112.1	S373 F374 Q380 A381	S373-A377 WeakPolarHBondContact O-CB 3.3Å; S373-A377 PolarHBondContact O-N 3.18Å; S373-A377 VanDerWaalsContact O-N 3.07Å; F374-A377 PolarHBondContact O-N 3.12Å; A377-Q380 PolarHBondContact O-N 2.87Å; A377-A381 WeakPolarHBondContact O-CB 3.37Å; A377-A381 PolarHBondContact O-N 3.35Å
378	E	79.8	Confident	75.2	Confident	110 Å²	110	83.7 Å²	83.7	51%	0.514	43%	0.429	S	S	.	.	H	α-helix	trans	-67.5	-44.7	176.9	-171	176.3	-166	0	0	111.8	F374 E375 E376 Q380 A381 A382	F374-E378 WeakPolarHBondContact O-CB 3.39Å; F374-E378 PolarHBondContact O-N 3.32Å; E375-E378 PolarHBondContact O-N 2.83Å; E376-E378 VanDerWaalsContact C-N 3.31Å; E376-E378 PolarHBondContact O-N 3.04Å; E378-Q380 VanDerWaalsContact C-N 3.32Å; E378-Q380 PolarHBondContact O-N 2.59Å; E378-A381 PolarHBondContact O-N 3.25Å; E378-A381 VanDerWaalsContact O-N 3.17Å; E378-A382 WeakPolarHBondContact O-CB 3.24Å; E378-A382 PolarHBondContact O-N 2.99Å
379	K	82.1	Confident	72.6	Confident	141 Å²	141	90.3 Å²	90.3	61%	0.613	46%	0.459	S	S	*	.	H	α-helix	trans	-59.2	-43.1	173.8	-75.1	171.3	-175.5	171.2	0	111.6	E375 E376 A382 L383	E375-K379 WeakPolarHBondContact O-CB 3.32Å; E375-K379 VanDerWaalsContact O-CG 3.28Å; E375-K379 WeakPolarHBondContact O-CG 3.37Å; E375-K379 PolarHBondContact O-N 3.47Å; E376-K379 PolarHBondContact O-N 3.48Å; K379-A382 PolarHBondContact O-N 3.33Å; K379-L383 WeakPolarHBondContact O-CB 3.33Å; K379-L383 PolarHBondContact O-N 2.77Å
380	Q	78.8	Confident	69.7	Low	120 Å²	120	95.9 Å²	95.9	56%	0.561	49%	0.49	S	S	*	.	H	α-helix	trans	-63.9	-40.1	175.6	-71.9	177.4	22.9	0	0	112	E376 A377 E378 K384	E376-Q380 VanDerWaalsContact O-CG 3.29Å; E376-Q380 WeakPolarHBondContact O-CG 3.41Å; E376-Q380 PolarHBondContact O-N 3.07Å; A377-Q380 PolarHBondContact O-N 2.87Å; E378-Q380 VanDerWaalsContact C-N 3.32Å; E378-Q380 PolarHBondContact O-N 2.59Å; Q380-K384 WeakPolarHBondContact O-CG 3.4Å; Q380-K384 PolarHBondContact O-N 3.22Å; Q380-K384 VanDerWaalsContact O-N 3.1Å
381	A	77.6	Confident	66.8	Low	36 Å²	36	101 Å²	101	30%	0.298	52%	0.523	S	S	.	.	H	α-helix	trans	-67.3	-39.8	175.9	0	0	0	0	0	112.3	A377 E378 K384 R385	A377-A381 WeakPolarHBondContact O-CB 3.37Å; A377-A381 PolarHBondContact O-N 3.35Å; E378-A381 PolarHBondContact O-N 3.25Å; E378-A381 VanDerWaalsContact O-N 3.17Å; A381-K384 PolarHBondContact O-N 2.87Å; A381-R385 WeakPolarHBondContact O-CG 3.12Å; A381-R385 PolarHBondContact O-N 3.38Å; A381-R385 VanDerWaalsContact O-N 3.09Å
382	A	76.1	Confident	64	Low	55 Å²	55	107 Å²	107	46%	0.455	55%	0.552	S	S	.	*	H	α-helix	trans	-63.8	-43.6	175.7	0	0	0	0	0	111.6	E378 K379 K384 R385 G386	E378-A382 WeakPolarHBondContact O-CB 3.24Å; E378-A382 PolarHBondContact O-N 2.99Å; K379-A382 PolarHBondContact O-N 3.33Å; A382-K384 VanDerWaalsContact C-N 3.34Å; A382-K384 PolarHBondContact O-N 3.29Å; A382-R385 PolarHBondContact O-N 3.35Å; A382-G386 PolarHBondContact O-N 3.02Å; A382-G386 VanDerWaalsContact O-N 3.09Å
383	L	76.9	Confident	61.1	Low	114 Å²	114	115.1 Å²	115.1	60%	0.597	59%	0.589	S	S	*	*	H	α-helix	trans	-60.6	-44	175.8	-167.6	70.3	0	0	0	111.2	K379 R385 G386 Y387	K379-L383 WeakPolarHBondContact O-CB 3.33Å; K379-L383 PolarHBondContact O-N 2.77Å; L383-R385 VanDerWaalsContact C-N 3.31Å; L383-R385 PolarHBondContact O-N 3.33Å; L383-G386 PolarHBondContact O-N 3.35Å; L383-Y387 HydrophobicContact CD1-CE2 4.08Å; L383-Y387 HydrophobicContact CG-CD2 4.44Å; L383-Y387 HydrophobicContact CG-CE2 4.19Å; L383-Y387 WeakPolarHBondContact O-CD2 3.45Å; L383-Y387 PolarHBondContact O-N 3.39Å
384	K	75.6	Confident	58.6	Low	158 Å²	158	117.7 Å²	117.7	69%	0.687	61%	0.607	S	S	*	*	H	α-helix	trans	-61.1	-37	176.3	-73.8	176.3	-178.4	179.4	0	112.9	Q380 A381 A382	Q380-K384 WeakPolarHBondContact O-CG 3.4Å; Q380-K384 PolarHBondContact O-N 3.22Å; Q380-K384 VanDerWaalsContact O-N 3.1Å; A381-K384 PolarHBondContact O-N 2.87Å; A382-K384 VanDerWaalsContact C-N 3.34Å; A382-K384 PolarHBondContact O-N 3.29Å
385	R	64.2	Low	56.1	Low	176 Å²	176	121.2 Å²	121.2	66%	0.664	64%	0.635	S	S	*	*	H	α-helix	trans	-67.8	-36.1	175.8	-71.9	179.4	-173.3	126.8	-0.1	112.6	A381 A382 L383 Y387 T388	A381-R385 WeakPolarHBondContact O-CG 3.12Å; A381-R385 PolarHBondContact O-N 3.38Å; A381-R385 VanDerWaalsContact O-N 3.09Å; A382-R385 PolarHBondContact O-N 3.35Å; L383-R385 VanDerWaalsContact C-N 3.31Å; L383-R385 PolarHBondContact O-N 3.33Å; R385-Y387 VanDerWaalsContact C-N 3.3Å; R385-Y387 PolarHBondContact O-N 3.12Å; R385-T388 PolarHBondContact O-N 2.97Å; R385-T388 PolarHBondContact O-OG1 3.32Å
386	G	42.9	Very low	53.6	Low	56 Å²	56	126 Å²	126	58%	0.577	66%	0.655	S	S	*	*	H	α-helix	trans	-68	-22.8	179.9	0	0	0	0	0	115	A382 L383	A382-G386 PolarHBondContact O-N 3.02Å; A382-G386 VanDerWaalsContact O-N 3.09Å; L383-G386 PolarHBondContact O-N 3.35Å
387	Y	43.3	Very low	51.2	Low	187 Å²	187	129.6 Å²	129.6	73%	0.733	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-10.9	178.1	-84.7	-87	0	0	0	114.2	L383 R385	L383-Y387 HydrophobicContact CD1-CE2 4.08Å; L383-Y387 HydrophobicContact CG-CD2 4.44Å; L383-Y387 HydrophobicContact CG-CE2 4.19Å; L383-Y387 WeakPolarHBondContact O-CD2 3.45Å; L383-Y387 PolarHBondContact O-N 3.39Å; R385-Y387 VanDerWaalsContact C-N 3.3Å; R385-Y387 PolarHBondContact O-N 3.12Å
388	T	39	Very low	48.6	Very low	120 Å²	120	137.6 Å²	137.6	74%	0.736	69%	0.688	S	S	*	*	S	Bend	trans	-89.6	-6.3	179.2	30.6	0	0	0	0	114.6	R385	R385-T388 PolarHBondContact O-N 2.97Å; R385-T388 PolarHBondContact O-OG1 3.32Å
389	E	30.6	Very low	45.9	Very low	165 Å²	165	141.5 Å²	141.5	77%	0.771	70%	0.704	S	S	*	*			trans	-110.9	81.2	168.5	-69.6	-175.6	176	0	0	109.2	P391	E389-P391 WeakPolarHBondContact O-CD 3.38Å
390	L	25.6	Very low	43.1	Very low	158 Å²	158	140.2 Å²	140.2	83%	0.827	71%	0.711	S	S	*	*			trans	-68.7	119.4	159.4	-84.2	168.4	0	0	0	107.1	Q392	L390-Q392 PolarHBondContact O-N 3.46Å
391	P	26.9	Very low	40.6	Very low	113 Å²	113	141.8 Å²	141.8	73%	0.734	72%	0.722	S	S	*	*			trans	-63.2	115.8	176.5	-15.8	29	0	0	0	108.4	E389 E393	E389-P391 WeakPolarHBondContact O-CD 3.38Å; P391-E393 PolarHBondContact O-N 3.05Å
392	Q	28	Very low	38	Very low	192 Å²	192	146.7 Å²	146.7	90%	0.897	74%	0.744	S	S	*	*			trans	-67.3	83.6	158.8	-87.2	-172.2	-40.6	0	0	107.7	L390 S394	L390-Q392 PolarHBondContact O-N 3.46Å; Q392-S394 PolarHBondContact O-N 3.06Å; Q392-S394 VanDerWaalsContact O-N 3.07Å
393	E	25	Very low	35.6	Very low	190 Å²	190	149.5 Å²	149.5	89%	0.888	76%	0.755	S	S	*	*			trans	-60.6	104.6	161.7	-91	-169.5	139.2	0	0	108.8	P391	P391-E393 PolarHBondContact O-N 3.05Å
394	S	29.6	Very low	33.2	Very low	102 Å²	102	148.8 Å²	148.8	71%	0.713	76%	0.76	S	S	*	*			trans	-151.3	126.7	148	63.1	0	0	0	0	110.8	Q392	Q392-S394 PolarHBondContact O-N 3.06Å; Q392-S394 VanDerWaalsContact O-N 3.07Å
395	S	32.9	Very low	30.9	Very low	106 Å²	106	147.8 Å²	147.8	74%	0.741	76%	0.762	S	S	*	*			trans	93.4	76.6	161.4	-51	0	0	0	0	118.8
396	K	30.5	Very low	29.2	Very low	192 Å²	192	147.1 Å²	147.1	84%	0.835	77%	0.769	S	S	*	*				57.8	106	109.5	-74.6	175.6	177.8	169.5	0	118.7
397	K	29.6	Very low	28.7	Very low	180 Å²	180	149.7 Å²	149.7	78%	0.783	77%	0.769	S	S	*	*				142.2	98.7	117	-84.1	169.9	-180	-179.4	0	109.9
398	R	26	Very low	28.2	Very low	219 Å²	219	144.9 Å²	144.9	83%	0.826	76%	0.763	S	S	*	*				80.2	85.9	89.1	-161.5	-172.2	-66.1	178.7	-3.1	111.8
399	F	23.4	Very low	27.9	Very low	192 Å²	192	145.3 Å²	145.3	84%	0.842	76%	0.757	S	S	*	*			trans	-140.4	97.6	140.3	-143.1	-95.4	0	0	0	106.8	L401	F399-L401 HydrophobicContact CD1-CD1 4.33Å; F399-L401 HydrophobicContact CE1-CD1 3.78Å
400	C	23	Very low	28.1	Very low	113 Å²	113	142 Å²	142	76%	0.764	75%	0.747	S	S	*	*			trans	-96.5	125.9	168.6	-65.8	0	0	0	0	106.5
401	L	26	Very low	28.2	Very low	153 Å²	153	141.8 Å²	141.8	80%	0.801	74%	0.744	S	S	*	*			trans	-116.1	113.5	154.3	-101.8	148.9	0	0	0	105.6	F399	F399-L401 HydrophobicContact CD1-CD1 4.33Å; F399-L401 HydrophobicContact CE1-CD1 3.78Å
402	D	22.4	Very low	28.4	Very low	140 Å²	140	144.3 Å²	144.3	75%	0.749	74%	0.739	S	S	*	*			trans	-57.1	130.6	174.7	-78	-50.5	0	0	0	111.3
403	T	25.9	Very low	28.7	Very low	113 Å²	113	139.6 Å²	139.6	69%	0.693	73%	0.727	S	S	*	*			trans	-146	83.1	137.5	58	0	0	0	0	108.1
404	S	26.3	Very low	28.9	Very low	100 Å²	100	137 Å²	137	70%	0.699	72%	0.719	S	S	*	*			trans	-58.2	148.5	132.6	43.9	0	0	0	0	107.2
405	D	27.6	Very low	29.1	Very low	136 Å²	136	138.1 Å²	138.1	73%	0.727	72%	0.717	S	S	*	*			trans	78.6	79.4	-160.9	-55.3	-26.4	0	0	0	114.4
406	M	30	Very low	29.1	Very low	163 Å²	163	136.3 Å²	136.3	80%	0.803	70%	0.701	S	S	*	*			trans	-143.5	118.4	145.6	-84.9	-60.5	105.5	0	0	109
407	N	31.4	Very low	29.1	Very low	109 Å²	109	131.6 Å²	131.6	58%	0.583	70%	0.698	S	S	*	*			trans	-59.7	155.4	-159.1	-77.9	-23.7	0	0	0	116.6	E409 V410	N407-E409 HydrophobicContact CB-CB 3.97Å; N407-E409 PolarHBondContact O-N 2.88Å; N407-V410 PolarHBondContact O-N 3.34Å
408	S	32.9	Very low	29.2	Very low	87 Å²	87	127.8 Å²	127.8	61%	0.608	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	9.6	163.6	78.5	0	0	0	0	115.9	R412	S408-R412 PolarHBondContact O-NH1 3.36Å; S408-R412 PolarHBondContact OG-NH1 2.85Å
409	E	31.9	Very low	29.2	Very low	129 Å²	129	119.2 Å²	119.2	60%	0.603	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-32.3	-178.6	-124	157.8	-179.9	0	0	111.6	N407 R412 S413	N407-E409 HydrophobicContact CB-CB 3.97Å; N407-E409 PolarHBondContact O-N 2.88Å; E409-R412 WeakPolarHBondContact O-CB 3.35Å; E409-R412 PolarHBondContact O-N 3.26Å; E409-S413 PolarHBondContact O-N 2.87Å; E409-S413 VanDerWaalsContact O-N 3.13Å
410	V	36.3	Very low	29.5	Very low	95 Å²	95	112.4 Å²	112.4	58%	0.576	64%	0.636	S	S	*	*	H	α-helix	trans	-75.8	-29.2	179	-177.4	0	0	0	0	112	N407 R412 S413	N407-V410 PolarHBondContact O-N 3.34Å; V410-R412 VanDerWaalsContact C-N 3.33Å; V410-S413 PolarHBondContact O-N 2.85Å
411	M	27.1	Very low	29.9	Very low	154 Å²	154	110.5 Å²	110.5	76%	0.759	62%	0.624	S	S	*	*	H	α-helix	trans	-67.7	-32.6	167.6	-94.6	-154.3	-163.6	0	0	112.4
412	R	31	Very low	30.3	Very low	166 Å²	166	106.5 Å²	106.5	63%	0.626	61%	0.605	S	S	*	*	H	α-helix	trans	-70.2	-34.6	176.7	-80.3	-177	171.9	91.1	-5.2	111.9	S408 E409 V410 N414 L415 V416	S408-R412 PolarHBondContact O-NH1 3.36Å; S408-R412 PolarHBondContact OG-NH1 2.85Å; E409-R412 WeakPolarHBondContact O-CB 3.35Å; E409-R412 PolarHBondContact O-N 3.26Å; V410-R412 VanDerWaalsContact C-N 3.33Å; R412-N414 VanDerWaalsContact C-N 3.34Å; R412-N414 PolarHBondContact O-N 3.06Å; R412-L415 PolarHBondContact O-N 3.22Å; R412-V416 WeakPolarHBondContact O-CG2 3.48Å
413	S	33.2	Very low	30.7	Very low	93 Å²	93	107.1 Å²	107.1	65%	0.65	60%	0.598	S	S	*	*	H	α-helix	trans	-68.2	-26	177.6	-91	0	0	0	0	114.9	E409 V410	E409-S413 PolarHBondContact O-N 2.87Å; E409-S413 VanDerWaalsContact O-N 3.13Å; V410-S413 PolarHBondContact O-N 2.85Å
414	N	31.1	Very low	31	Very low	136 Å²	136	107.8 Å²	107.8	73%	0.727	59%	0.589	S	S	*	*	H	α-helix	trans	-88.7	-14.6	179.2	-72.7	-28.8	0	0	0	114	R412	R412-N414 VanDerWaalsContact C-N 3.34Å; R412-N414 PolarHBondContact O-N 3.06Å
415	L	32.2	Very low	31.5	Very low	125 Å²	125	107 Å²	107	65%	0.654	58%	0.577	S	S	*	*	S	Bend	trans	-85.1	-8.7	175.5	-99.2	137.6	0	0	0	113.5	R412	R412-L415 PolarHBondContact O-N 3.22Å
416	V	34	Very low	31.8	Very low	67 Å²	67	103.4 Å²	103.4	41%	0.406	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.7	2.2	-170.7	171.9	0	0	0	0	113.8	R412 A610	R412-V416 WeakPolarHBondContact O-CG2 3.48Å; V416-A610 HydrophobicContact CG1-CB 3.81Å
417	A	30.5	Very low	32.2	Very low	93 Å²	93	99.4 Å²	99.4	77%	0.769	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	3.1	178.6	0	0	0	0	0	115.1
418	I	30.4	Very low	32.5	Very low	101 Å²	101	100.6 Å²	100.6	52%	0.518	54%	0.543	S	S	.	.	S	Bend	trans	-92.4	107.6	172.4	-56.3	176.4	0	0	0	107.3	V422	I418-V422 HydrophobicContact CG2-CB 4.1Å; I418-V422 HydrophobicContact CG2-CG1 4.33Å
419	A	27.2	Very low	33	Very low	39 Å²	39	99 Å²	99	32%	0.322	53%	0.527	S	S	.	.			trans	-49.5	130.2	173.9	0	0	0	0	0	109.7	S421 V422	A419-S421 PolarHBondContact O-N 3.5Å; A419-V422 HydrophobicContact CB-CG2 4.19Å; A419-V422 WeakPolarHBondContact O-CB 3.28Å; A419-V422 PolarHBondContact O-N 2.78Å
420	P	29.5	Very low	33.3	Very low	49 Å²	49	96.5 Å²	96.5	32%	0.318	51%	0.514	S	S	.	.	H	α-helix	trans	-54.2	-28.5	-179.3	-28.7	34.7	0	0	0	113.9	V422 Y423 Y424 F613	P420-V422 VanDerWaalsContact C-N 3.25Å; P420-V422 PolarHBondContact O-N 2.71Å; P420-Y423 PolarHBondContact O-N 2.67Å; P420-Y424 HydrophobicContact CB-CE2 4.43Å; P420-Y424 WeakPolarHBondContact O-CD2 3.22Å; P420-Y424 PolarHBondContact O-N 3.21Å; P420-Y424 VanDerWaalsContact O-N 3.15Å; P420-F613 HydrophobicContact CG-CD1 4.35Å
421	S	31.6	Very low	33.4	Very low	72 Å²	72	94.7 Å²	94.7	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-56.9	-38.7	173.4	55.5	0	0	0	0	112.6	A419 Y423 D425	A419-S421 PolarHBondContact O-N 3.5Å; S421-Y423 VanDerWaalsContact C-N 3.3Å; S421-Y423 PolarHBondContact O-N 2.89Å; S421-D425 VanDerWaalsContact O-CG 3.3Å; S421-D425 PolarHBondContact O-N 3.01Å
422	V	33.4	Very low	34.1	Very low	69 Å²	69	92.7 Å²	92.7	42%	0.418	49%	0.494	S	S	.	.	H	α-helix	trans	-72.5	-25.1	178.8	-173	0	0	0	0	111.6	I418 A419 P420 N426	I418-V422 HydrophobicContact CG2-CB 4.1Å; I418-V422 HydrophobicContact CG2-CG1 4.33Å; A419-V422 HydrophobicContact CB-CG2 4.19Å; A419-V422 WeakPolarHBondContact O-CB 3.28Å; A419-V422 PolarHBondContact O-N 2.78Å; P420-V422 VanDerWaalsContact C-N 3.25Å; P420-V422 PolarHBondContact O-N 2.71Å; V422-N426 WeakPolarHBondContact CG1-ND2 3.23Å; V422-N426 PolarHBondContact O-N 2.92Å; V422-N426 PolarHBondContact O-ND2 2.79Å
423	Y	30.5	Very low	34.6	Very low	154 Å²	154	85.2 Å²	85.2	60%	0.604	47%	0.468	S	S	*	.	H	α-helix	trans	-80.3	-37.8	179	-159.6	-92.3	0	0	0	112.4	P420 S421 V427	P420-Y423 PolarHBondContact O-N 2.67Å; S421-Y423 VanDerWaalsContact C-N 3.3Å; S421-Y423 PolarHBondContact O-N 2.89Å; Y423-V427 HydrophobicContact CD1-CG2 4.4Å; Y423-V427 HydrophobicContact CE1-CG2 4.21Å; Y423-V427 WeakPolarHBondContact O-CG2 3.45Å; Y423-V427 PolarHBondContact O-N 2.94Å
424	Y	32.8	Very low	34.9	Very low	126 Å²	126	84.5 Å²	84.5	49%	0.494	46%	0.462	S	S	.	.	H	α-helix	trans	-72.6	-40.8	177.5	-73.7	-75	0	0	0	112.2	P420 F428	P420-Y424 HydrophobicContact CB-CE2 4.43Å; P420-Y424 WeakPolarHBondContact O-CD2 3.22Å; P420-Y424 PolarHBondContact O-N 3.21Å; P420-Y424 VanDerWaalsContact O-N 3.15Å; Y424-F428 WeakPolarHBondContact O-CB 3.32Å; Y424-F428 PolarHBondContact O-N 2.82Å; Y424-F428 VanDerWaalsContact O-N 3.16Å
425	D	37	Very low	35.3	Very low	85 Å²	85	80.6 Å²	80.6	46%	0.455	45%	0.449	S	S	.	.	H	α-helix	trans	-62	-50.2	179.2	-70.7	-18.6	0	0	0	111.4	S421 V427 L429	S421-D425 VanDerWaalsContact O-CG 3.3Å; S421-D425 PolarHBondContact O-N 3.01Å; D425-V427 PolarHBondContact O-N 2.88Å; D425-L429 VanDerWaalsContact O-CB 3.32Å; D425-L429 WeakPolarHBondContact O-CB 2.91Å; D425-L429 VanDerWaalsContact O-CD1 3.25Å; D425-L429 WeakPolarHBondContact O-CD1 3.44Å; D425-L429 PolarHBondContact O-N 3.19Å
426	N	34.1	Very low	35.8	Very low	60 Å²	60	77.5 Å²	77.5	32%	0.321	43%	0.433	S	S	.	.	H	α-helix	trans	-72.4	-27.4	-174.3	-75.6	-72	0	0	0	114.3	E368 V422 K430	E368-N426 WeakPolarHBondContact OE1-CA 3.37Å; E368-N426 PolarHBondContact OE1-OD1 3.03Å; V422-N426 WeakPolarHBondContact CG1-ND2 3.23Å; V422-N426 PolarHBondContact O-N 2.92Å; V422-N426 PolarHBondContact O-ND2 2.79Å; N426-K430 WeakPolarHBondContact O-CB 3.28Å; N426-K430 WeakPolarHBondContact O-CD 3.46Å; N426-K430 WeakPolarHBondContact O-CG 2.98Å; N426-K430 PolarHBondContact O-N 3.11Å
427	V	38	Very low	36.2	Very low	79 Å²	79	77.8 Å²	77.8	48%	0.479	43%	0.431	S	S	.	.	H	α-helix	trans	-85.5	-41.9	-179.2	178.8	0	0	0	0	111	Y423 D425 A431	Y423-V427 HydrophobicContact CD1-CG2 4.4Å; Y423-V427 HydrophobicContact CE1-CG2 4.21Å; Y423-V427 WeakPolarHBondContact O-CG2 3.45Å; Y423-V427 PolarHBondContact O-N 2.94Å; D425-V427 PolarHBondContact O-N 2.88Å; V427-A431 WeakPolarHBondContact O-CB 3.14Å; V427-A431 PolarHBondContact O-N 3.22Å
428	F	36.9	Very low	36.8	Very low	133 Å²	133	76.1 Å²	76.1	58%	0.583	42%	0.418	S	S	*	.	H	α-helix	trans	-73.1	-42.7	179.3	-112.9	-89.3	0	0	0	112.2	Y424 K430 A431 Y432	Y424-F428 WeakPolarHBondContact O-CB 3.32Å; Y424-F428 PolarHBondContact O-N 2.82Å; Y424-F428 VanDerWaalsContact O-N 3.16Å; F428-K430 PolarHBondContact O-N 3.44Å; F428-A431 PolarHBondContact O-N 3.39Å; F428-Y432 VanDerWaalsContact O-CB 3.29Å; F428-Y432 WeakPolarHBondContact O-CB 3.11Å; F428-Y432 PolarHBondContact O-N 3.45Å
429	L	44.4	Very low	37.3	Very low	53 Å²	53	75.8 Å²	75.8	28%	0.277	42%	0.417	S	S	.	.	H	α-helix	trans	-63.8	-41	175.1	-89.4	91	0	0	0	111	E368 D425 A431 Y432 A433	E368-L429 WeakPolarHBondContact OE2-CB 3.46Å; E368-L429 WeakPolarHBondContact OE2-CD2 3.47Å; E368-L429 WeakPolarHBondContact OE2-CG 3.22Å; D425-L429 VanDerWaalsContact O-CB 3.32Å; D425-L429 WeakPolarHBondContact O-CB 2.91Å; D425-L429 VanDerWaalsContact O-CD1 3.25Å; D425-L429 WeakPolarHBondContact O-CD1 3.44Å; D425-L429 PolarHBondContact O-N 3.19Å; L429-A431 PolarHBondContact O-N 2.89Å; L429-Y432 PolarHBondContact O-N 3.34Å; L429-A433 WeakPolarHBondContact O-CB 3.47Å; L429-A433 PolarHBondContact O-N 3.46Å
430	K	38.8	Very low	38.1	Very low	78 Å²	78	79.4 Å²	79.4	34%	0.339	43%	0.427	S	S	.	.	H	α-helix	trans	-64	-35.1	174	-73.9	178.7	-170.9	-174.4	0	113.7	T372 N426 F428 A433 S434	T372-K430 VanDerWaalsContact OG1-CE 3.26Å; T372-K430 WeakPolarHBondContact OG1-CE 3.45Å; N426-K430 WeakPolarHBondContact O-CB 3.28Å; N426-K430 WeakPolarHBondContact O-CD 3.46Å; N426-K430 WeakPolarHBondContact O-CG 2.98Å; N426-K430 PolarHBondContact O-N 3.11Å; F428-K430 PolarHBondContact O-N 3.44Å; K430-A433 VanDerWaalsContact O-CB 3.3Å; K430-A433 WeakPolarHBondContact O-CB 3.45Å; K430-S434 WeakPolarHBondContact O-CB 3.4Å; K430-S434 PolarHBondContact O-N 2.6Å; K430-S434 VanDerWaalsContact O-N 3.16Å; K430-S434 PolarHBondContact O-OG 3.38Å
431	A	38.2	Very low	38.6	Very low	57 Å²	57	81.5 Å²	81.5	47%	0.471	44%	0.436	S	S	.	.	H	α-helix	trans	-69.5	-44.3	174.9	0	0	0	0	0	111.3	V427 F428 L429 A433 S434 A435	V427-A431 WeakPolarHBondContact O-CB 3.14Å; V427-A431 PolarHBondContact O-N 3.22Å; F428-A431 PolarHBondContact O-N 3.39Å; L429-A431 PolarHBondContact O-N 2.89Å; A431-A433 VanDerWaalsContact C-N 3.34Å; A431-S434 PolarHBondContact O-N 3.32Å; A431-A435 WeakPolarHBondContact O-CB 3.23Å; A431-A435 PolarHBondContact O-N 3.33Å
432	Y	40.5	Very low	39	Very low	112 Å²	112	84.2 Å²	84.2	44%	0.439	44%	0.439	S	S	.	.	H	α-helix	trans	-62.6	-41.3	175.7	-177.1	-108.2	0	0	0	111.8	F428 L429 S434 A435 L436	F428-Y432 VanDerWaalsContact O-CB 3.29Å; F428-Y432 WeakPolarHBondContact O-CB 3.11Å; F428-Y432 PolarHBondContact O-N 3.45Å; L429-Y432 PolarHBondContact O-N 3.34Å; Y432-S434 VanDerWaalsContact C-N 3.34Å; Y432-S434 PolarHBondContact O-N 3.39Å; Y432-A435 PolarHBondContact O-N 3.23Å; Y432-L436 HydrophobicContact CD1-CD1 3.91Å; Y432-L436 HydrophobicContact CE1-CD1 3.37Å; Y432-L436 HydrophobicContact CE1-CG 4.2Å; Y432-L436 HydrophobicContact CE2-CD1 4.46Å; Y432-L436 HydrophobicContact CE2-CG 4.5Å; Y432-L436 PolarHBondContact O-N 2.99Å
433	A	41.8	Very low	39.2	Very low	9 Å²	9	86.8 Å²	86.8	7%	0.074	45%	0.448	C	S	.	.	H	α-helix	trans	-51.3	-54.9	173.3	0	0	0	0	0	112.1	Y365 L429 K430 A431 A435 L436 I437	Y365-A433 HydrophobicContact CD2-CB 4.29Å; Y365-A433 VanDerWaalsContact CE2-CA 3.45Å; Y365-A433 HydrophobicContact CE2-CB 3.13Å; Y365-A433 VanDerWaalsContact CZ-CB 3.46Å; Y365-A433 WeakPolarHBondContact OH-CA 3.38Å; Y365-A433 WeakPolarHBondContact OH-CB 3.36Å; Y365-A433 PolarHBondContact OH-O 3.02Å; L429-A433 WeakPolarHBondContact O-CB 3.47Å; L429-A433 PolarHBondContact O-N 3.46Å; K430-A433 VanDerWaalsContact O-CB 3.3Å; K430-A433 WeakPolarHBondContact O-CB 3.45Å; A431-A433 VanDerWaalsContact C-N 3.34Å; A433-A435 VanDerWaalsContact C-N 3.31Å; A433-A435 PolarHBondContact O-N 3.4Å; A433-L436 PolarHBondContact O-N 3.36Å; A433-I437 WeakPolarHBondContact O-CG1 3.44Å; A433-I437 PolarHBondContact O-N 2.92Å
434	S	40.4	Very low	39.6	Very low	77 Å²	77	88 Å²	88	54%	0.538	45%	0.451	S	S	.	.	H	α-helix	trans	-66.4	-37.9	-175.1	-60.8	0	0	0	0	110.3	K430 A431 Y432 A438	K430-S434 WeakPolarHBondContact O-CB 3.4Å; K430-S434 PolarHBondContact O-N 2.6Å; K430-S434 VanDerWaalsContact O-N 3.16Å; K430-S434 PolarHBondContact O-OG 3.38Å; A431-S434 PolarHBondContact O-N 3.32Å; Y432-S434 VanDerWaalsContact C-N 3.34Å; Y432-S434 PolarHBondContact O-N 3.39Å; S434-A438 VanDerWaalsContact O-CB 3.26Å; S434-A438 WeakPolarHBondContact O-CB 3.43Å; S434-A438 PolarHBondContact O-N 2.98Å
435	A	39.5	Very low	40	Very low	54 Å²	54	85.1 Å²	85.1	45%	0.446	45%	0.45	S	S	.	.	H	α-helix	trans	-66	-43	175	0	0	0	0	0	112.5	A431 Y432 A433 A438 N439	A431-A435 WeakPolarHBondContact O-CB 3.23Å; A431-A435 PolarHBondContact O-N 3.33Å; Y432-A435 PolarHBondContact O-N 3.23Å; A433-A435 VanDerWaalsContact C-N 3.31Å; A433-A435 PolarHBondContact O-N 3.4Å; A435-A438 PolarHBondContact O-N 2.83Å; A435-N439 PolarHBondContact O-N 3.19Å
436	L	42	Very low	40.2	Very low	61 Å²	61	87.5 Å²	87.5	32%	0.319	46%	0.457	S	S	.	.	H	α-helix	trans	-64.6	-41.9	175.9	-78.8	176.4	0	0	0	112.1	Y365 Y432 A433 N439 Q440	Y365-L436 HydrophobicContact CE1-CD1 4.48Å; Y432-L436 HydrophobicContact CD1-CD1 3.91Å; Y432-L436 HydrophobicContact CE1-CD1 3.37Å; Y432-L436 HydrophobicContact CE1-CG 4.2Å; Y432-L436 HydrophobicContact CE2-CD1 4.46Å; Y432-L436 HydrophobicContact CE2-CG 4.5Å; Y432-L436 PolarHBondContact O-N 2.99Å; A433-L436 PolarHBondContact O-N 3.36Å; L436-N439 PolarHBondContact O-N 2.99Å; L436-Q440 WeakPolarHBondContact O-CB 3.13Å; L436-Q440 WeakPolarHBondContact O-CG 3.43Å; L436-Q440 PolarHBondContact O-N 3.37Å
437	I	43.6	Very low	40.4	Very low	72 Å²	72	91.3 Å²	91.3	37%	0.369	48%	0.478	S	S	.	.	H	α-helix	trans	-65.8	-42.8	176.7	-67.4	166.9	0	0	0	110.5	A433 N439 Q440 N441	A433-I437 WeakPolarHBondContact O-CG1 3.44Å; A433-I437 PolarHBondContact O-N 2.92Å; I437-N439 PolarHBondContact O-N 3.45Å; I437-Q440 PolarHBondContact O-N 3.5Å; I437-N441 WeakPolarHBondContact O-CB 3.45Å; I437-N441 VanDerWaalsContact O-CG 3.28Å; I437-N441 PolarHBondContact O-N 3.26Å; I437-N441 PolarHBondContact O-ND2 3.32Å
438	A	41.5	Very low	40.3	Very low	58 Å²	58	92 Å²	92	48%	0.479	49%	0.486	S	S	.	.	H	α-helix	trans	-60.3	-44	175.8	0	0	0	0	0	111.7	S434 A435 N441 F442	S434-A438 VanDerWaalsContact O-CB 3.26Å; S434-A438 WeakPolarHBondContact O-CB 3.43Å; S434-A438 PolarHBondContact O-N 2.98Å; A435-A438 PolarHBondContact O-N 2.83Å; A438-N441 PolarHBondContact O-N 3.24Å; A438-F442 VanDerWaalsContact O-CB 3.32Å; A438-F442 WeakPolarHBondContact O-CB 3.43Å; A438-F442 PolarHBondContact O-N 3.25Å
439	N	41.5	Very low	40.4	Very low	94 Å²	94	94.6 Å²	94.6	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-42.4	175.3	-89	-4.6	0	0	0	112.6	A435 L436 I437 N441 F442 M443	A435-N439 PolarHBondContact O-N 3.19Å; L436-N439 PolarHBondContact O-N 2.99Å; I437-N439 PolarHBondContact O-N 3.45Å; N439-N441 VanDerWaalsContact C-N 3.34Å; N439-N441 PolarHBondContact O-N 3.27Å; N439-F442 PolarHBondContact O-N 2.99Å; N439-M443 VanDerWaalsContact O-CG 3.28Å; N439-M443 WeakPolarHBondContact O-CG 3.27Å; N439-M443 PolarHBondContact O-N 3.07Å
440	Q	43.1	Very low	39.7	Very low	116 Å²	116	101 Å²	101	54%	0.542	53%	0.528	S	S	.	.	H	α-helix	trans	-63.3	-40.1	176.4	-78.7	-174.9	-4.7	0	0	112.2	L436 I437 R444	L436-Q440 WeakPolarHBondContact O-CB 3.13Å; L436-Q440 WeakPolarHBondContact O-CG 3.43Å; L436-Q440 PolarHBondContact O-N 3.37Å; I437-Q440 PolarHBondContact O-N 3.5Å; Q440-R444 WeakPolarHBondContact O-CB 3.32Å; Q440-R444 WeakPolarHBondContact O-CG 3.41Å; Q440-R444 PolarHBondContact O-N 3.41Å
441	N	40.6	Very low	39.3	Very low	93 Å²	93	101 Å²	101	50%	0.497	55%	0.551	S	S	.	*	H	α-helix	trans	-69.3	-38	176	-71.7	-22.1	0	0	0	111.8	I437 A438 N439 R444 S445	I437-N441 WeakPolarHBondContact O-CB 3.45Å; I437-N441 VanDerWaalsContact O-CG 3.28Å; I437-N441 PolarHBondContact O-N 3.26Å; I437-N441 PolarHBondContact O-ND2 3.32Å; A438-N441 PolarHBondContact O-N 3.24Å; N439-N441 VanDerWaalsContact C-N 3.34Å; N439-N441 PolarHBondContact O-N 3.27Å; N441-R444 PolarHBondContact O-N 3.44Å; N441-S445 WeakPolarHBondContact O-CB 3.4Å; N441-S445 PolarHBondContact O-N 2.93Å; N441-S445 PolarHBondContact O-OG 3.39Å
442	F	39.5	Very low	38.7	Very low	129 Å²	129	104.6 Å²	104.6	57%	0.566	57%	0.567	S	S	*	*	H	α-helix	trans	-60.9	-48.5	173.8	-174.9	-99.7	0	0	0	111.3	A438 N439 S445 H446	A438-F442 VanDerWaalsContact O-CB 3.32Å; A438-F442 WeakPolarHBondContact O-CB 3.43Å; A438-F442 PolarHBondContact O-N 3.25Å; N439-F442 PolarHBondContact O-N 2.99Å; F442-S445 PolarHBondContact O-N 2.91Å; F442-S445 PolarHBondContact O-OG 3.13Å; F442-H446 PolarHBondContact O-N 3.46Å
443	M	37.6	Very low	38.3	Very low	122 Å²	122	108.6 Å²	108.6	60%	0.601	59%	0.587	S	S	*	*	H	α-helix	trans	-62	-45.6	177	-66.4	-65.4	-73.4	0	0	112.1	N439 S445 H446 D447	N439-M443 VanDerWaalsContact O-CG 3.28Å; N439-M443 WeakPolarHBondContact O-CG 3.27Å; N439-M443 PolarHBondContact O-N 3.07Å; M443-S445 VanDerWaalsContact C-N 3.29Å; M443-S445 PolarHBondContact O-N 3.35Å; M443-H446 PolarHBondContact O-N 3.49Å; M443-H446 VanDerWaalsContact O-N 3.16Å; M443-D447 PolarHBondContact O-N 3.03Å
444	R	40.5	Very low	38	Very low	180 Å²	180	114 Å²	114	68%	0.679	62%	0.619	S	S	*	*	H	α-helix	trans	-65.2	-29.8	177.7	-75.1	-178.8	179.7	-172.1	3.1	113.6	Q440 N441 H446	Q440-R444 WeakPolarHBondContact O-CB 3.32Å; Q440-R444 WeakPolarHBondContact O-CG 3.41Å; Q440-R444 PolarHBondContact O-N 3.41Å; N441-R444 PolarHBondContact O-N 3.44Å; R444-H446 VanDerWaalsContact C-N 3.28Å; R444-H446 PolarHBondContact O-N 3.3Å
445	S	39.7	Very low	37.4	Very low	66 Å²	66	118.4 Å²	118.4	46%	0.462	64%	0.637	S	S	.	*	H	α-helix	trans	-72.6	-21.4	176.9	74.4	0	0	0	0	113.1	N441 F442 M443 S448	N441-S445 WeakPolarHBondContact O-CB 3.4Å; N441-S445 PolarHBondContact O-N 2.93Å; N441-S445 PolarHBondContact O-OG 3.39Å; F442-S445 PolarHBondContact O-N 2.91Å; F442-S445 PolarHBondContact O-OG 3.13Å; M443-S445 VanDerWaalsContact C-N 3.29Å; M443-S445 PolarHBondContact O-N 3.35Å; S445-S448 PolarHBondContact O-OG 3.46Å
446	H	41.1	Very low	36.9	Very low	134 Å²	134	119.5 Å²	119.5	62%	0.62	65%	0.653	S	S	*	*	H	α-helix	trans	-88	-28	-179.8	-124	-87.3	0	0	0	113.5	F442 M443 R444 S448	F442-H446 PolarHBondContact O-N 3.46Å; M443-H446 PolarHBondContact O-N 3.49Å; M443-H446 VanDerWaalsContact O-N 3.16Å; R444-H446 VanDerWaalsContact C-N 3.28Å; R444-H446 PolarHBondContact O-N 3.3Å; H446-S448 VanDerWaalsContact C-N 3.27Å; H446-S448 PolarHBondContact O-N 2.87Å
447	D	39.4	Very low	36.2	Very low	140 Å²	140	125.4 Å²	125.4	75%	0.749	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-11.2	177.4	-78.8	-25.3	0	0	0	114.3	M443	M443-D447 PolarHBondContact O-N 3.03Å
448	S	36.7	Very low	35.6	Very low	94 Å²	94	131.4 Å²	131.4	66%	0.657	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	5.7	-177.9	61.5	0	0	0	0	114.9	S445 H446	S445-S448 PolarHBondContact O-OG 3.46Å; H446-S448 VanDerWaalsContact C-N 3.27Å; H446-S448 PolarHBondContact O-N 2.87Å
449	K	37.1	Very low	34.9	Very low	188 Å²	188	134 Å²	134	82%	0.817	72%	0.72	S	S	*	*	S	Bend	trans	-126.7	10.5	-174.4	-86.6	-176.4	177.4	177.1	0	116.7
450	M	31.1	Very low	34.3	Very low	187 Å²	187	133.8 Å²	133.8	92%	0.921	73%	0.731	S	S	*	*	S	Bend	trans	-128	121.6	171.2	-92.5	-157.6	-178.2	0	0	112.3
451	G	29	Very low	33.5	Very low	79 Å²	79	135.4 Å²	135.4	81%	0.814	74%	0.742	S	S	*	*			trans	109.8	53.9	143.1	0	0	0	0	0	118.7	F453	G451-F453 PolarHBondContact O-N 2.83Å
452	T	26.9	Very low	33.1	Very low	132 Å²	132	139.8 Å²	139.8	81%	0.81	76%	0.759	S	S	*	*			trans	-71.5	106.7	144	41.9	0	0	0	0	108.3
453	F	31.7	Very low	32.5	Very low	195 Å²	195	139.6 Å²	139.6	86%	0.855	77%	0.768	S	S	*	*			trans	-167.1	103.5	150.6	-96.9	-69.7	0	0	0	111.2	G451	G451-F453 PolarHBondContact O-N 2.83Å
454	T	35.3	Very low	31.9	Very low	122 Å²	122	137.3 Å²	137.3	75%	0.748	78%	0.777	S	S	*	*			trans	49.3	114	140.5	59.7	0	0	0	0	122.8
455	N	28.2	Very low	31.3	Very low	171 Å²	171	135 Å²	135	91%	0.914	79%	0.785	S	S	*	*			trans	-1.8	135.9	143.4	-58.1	-14.1	0	0	0	120.2
456	G	29.3	Very low	30.7	Very low	77 Å²	77	137.3 Å²	137.3	79%	0.794	80%	0.801	S	S	*	*			trans	-171.1	106.7	158.2	0	0	0	0	0	110.3
457	E	26	Very low	30	Very low	184 Å²	184	135.1 Å²	135.1	86%	0.86	81%	0.806	S	S	*	*			trans	-61.3	142.8	177.4	-62	168	133.6	0	0	111.7
458	H	32.7	Very low	29.4	Very low	199 Å²	199	138.9 Å²	138.9	92%	0.921	82%	0.816	S	S	*	*			trans	-163.1	115.7	143.1	-99.6	-73.5	0	0	0	110.4
459	S	26	Very low	28.8	Very low	113 Å²	113	141 Å²	141	79%	0.79	83%	0.825	S	S	*	*			trans	-82	140.1	171.1	51.6	0	0	0	0	112.4
460	A	29.8	Very low	28.3	Very low	88 Å²	88	135.2 Å²	135.2	73%	0.727	82%	0.818	S	S	*	*			trans	161.5	108.9	142.2	0	0	0	0	0	108.9
461	I	26.4	Very low	28.2	Very low	151 Å²	151	134.1 Å²	134.1	77%	0.774	82%	0.816	S	S	*	*				54.4	103.1	101.5	-55.3	169.4	0	0	0	112.9
462	H	30.4	Very low	27.9	Very low	184 Å²	184	136.3 Å²	136.3	85%	0.852	82%	0.818	S	S	*	*			trans	-158.7	142.6	130.6	-114.5	-74.9	0	0	0	112.4
463	T	27.8	Very low	28	Very low	125 Å²	125	138.6 Å²	138.6	77%	0.767	82%	0.824	S	S	*	*			trans	-84.3	156.9	-168.7	41.1	0	0	0	0	113.7
464	G	25.4	Very low	27.6	Very low	75 Å²	75	133.6 Å²	133.6	77%	0.773	82%	0.819	S	S	*	*			trans	161.1	108.3	163.3	0	0	0	0	0	114.5
465	P	27.9	Very low	27.3	Very low	131 Å²	131	134.5 Å²	134.5	85%	0.851	82%	0.824	S	S	*	*			trans	-102.1	147.8	-176.9	36.5	-28.2	0	0	0	113.5
466	S	27.5	Very low	27.1	Very low	114 Å²	114	137 Å²	137	80%	0.797	82%	0.821	S	S	*	*			trans	-153	105.8	159.1	73.5	0	0	0	0	109.5
467	A	25.9	Very low	26.8	Very low	88 Å²	88	141 Å²	141	73%	0.727	82%	0.824	S	S	*	*				84.2	93.5	83.9	0	0	0	0	0	113.1
468	F	26.6	Very low	26.8	Very low	219 Å²	219	136 Å²	136	96%	0.961	82%	0.821	S	S	*	*			trans	-159.7	96.4	132.5	-119.1	-84.7	0	0	0	108.3
469	T	25.1	Very low	26.4	Very low	140 Å²	140	133 Å²	133	86%	0.859	82%	0.817	S	S	*	*			trans	-108.7	144.7	170.6	42.1	0	0	0	0	109.1
470	G	25.9	Very low	26.4	Very low	65 Å²	65	135.4 Å²	135.4	67%	0.67	82%	0.819	S	S	*	*			trans	151.3	122.7	161.6	0	0	0	0	0	110.3
471	D	28.2	Very low	26.2	Very low	164 Å²	164	136.1 Å²	136.1	88%	0.877	82%	0.817	S	S	*	*			cis	-157.3	140.6	-2.2	-93.4	-40.4	0	0	0	107.6
472	C	22.3	Very low	26.1	Very low	125 Å²	125	135.4 Å²	135.4	85%	0.845	82%	0.824	S	S	*	*			trans	-86.7	134.7	163.6	-72.7	0	0	0	0	109
473	L	29.9	Very low	25.9	Very low	181 Å²	181	137.9 Å²	137.9	95%	0.948	83%	0.826	S	S	*	*			trans	-136.4	121.5	150	-91.5	173.1	0	0	0	110.7
474	A	24.2	Very low	25.9	Very low	89 Å²	89	137 Å²	137	74%	0.736	82%	0.822	S	S	*	*			trans	-96.1	141.4	178	0	0	0	0	0	110.8
475	V	28.1	Very low	26.2	Very low	142 Å²	142	137.6 Å²	137.6	86%	0.861	82%	0.819	S	S	*	*			trans	-157	102.7	148.5	-175.3	0	0	0	0	106.9
476	R	24.4	Very low	26.3	Very low	224 Å²	224	137.4 Å²	137.4	85%	0.845	81%	0.812	S	S	*	*				72.9	109	86.7	-143.8	176.5	-174.7	160.4	0.5	114.2
477	N	23.5	Very low	26.6	Very low	161 Å²	161	136.7 Å²	136.7	86%	0.861	81%	0.813	S	S	*	*			trans	34.1	114.7	152	-60.8	-10.7	0	0	0	119.5
478	G	24.9	Very low	26.9	Very low	77 Å²	77	142 Å²	142	79%	0.794	82%	0.815	S	S	*	*			trans	177.3	109	162.8	0	0	0	0	0	112.9
479	V	23.8	Very low	27.2	Very low	138 Å²	138	133.7 Å²	133.7	84%	0.836	79%	0.787	S	S	*	*			trans	-51.2	128.9	165.7	175.7	0	0	0	0	110.2
480	L	26.1	Very low	27.5	Very low	162 Å²	162	133.7 Å²	133.7	85%	0.848	78%	0.781	S	S	*	*			trans	155.8	161	150.9	-87.8	147.4	0	0	0	112.4
481	P	26.5	Very low	27.7	Very low	103 Å²	103	140.8 Å²	140.8	67%	0.669	79%	0.788	S	S	*	*				-95.7	167.2	-123.7	39.4	-37.4	0	0	0	115.1	R483	P481-R483 PolarHBondContact O-N 2.83Å
482	C	24.6	Very low	27.8	Very low	137 Å²	137	140.1 Å²	140.1	93%	0.926	77%	0.773	S	S	*	*			trans	-39.7	113.9	174.4	-56.7	0	0	0	0	112.8
483	R	26.2	Very low	28.2	Very low	236 Å²	236	138.6 Å²	138.6	89%	0.891	76%	0.757	S	S	*	*			trans	-91.2	151.7	167.3	-80.6	-172.3	173.3	-178.8	-1.5	110.9	P481	P481-R483 PolarHBondContact O-N 2.83Å
484	P	27.4	Very low	28.2	Very low	105 Å²	105	133.1 Å²	133.1	68%	0.682	73%	0.733	S	S	*	*			trans	-80.6	166.9	-164.3	-3.6	23.4	0	0	0	113.6	D486	P484-D486 VanDerWaalsContact C-N 3.27Å; P484-D486 PolarHBondContact O-N 3.05Å; P484-D486 VanDerWaalsContact O-N 3.08Å
485	A	31.7	Very low	28.5	Very low	88 Å²	88	133.1 Å²	133.1	73%	0.727	72%	0.724	S	S	*	*	S	Bend	trans	-75.1	18.4	-165	0	0	0	0	0	116.9
486	D	30	Very low	28.6	Very low	128 Å²	128	131.6 Å²	131.6	68%	0.684	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-9.5	-157.5	-52.9	-24.2	0	0	0	114.9	P484	P484-D486 VanDerWaalsContact C-N 3.27Å; P484-D486 PolarHBondContact O-N 3.05Å; P484-D486 VanDerWaalsContact O-N 3.08Å
487	A	33.6	Very low	28.9	Very low	99 Å²	99	123.9 Å²	123.9	82%	0.818	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-7.2	-175.8	0	0	0	0	0	115.3
488	Y	31.8	Very low	29.3	Very low	200 Å²	200	121 Å²	121	78%	0.784	68%	0.678	S	S	*	*	S	Bend	trans	-106	-12.3	-178.9	-120.1	-91.1	0	0	0	113.8
489	A	32.3	Very low	29.7	Very low	44 Å²	44	121.3 Å²	121.3	36%	0.364	66%	0.664	S	S	.	*	H	α-helix	trans	-76.4	-37.6	-176.9	0	0	0	0	0	113.1	R491 R492 N493	A489-R491 VanDerWaalsContact C-N 3.35Å; A489-R491 PolarHBondContact O-N 2.9Å; A489-R492 PolarHBondContact O-N 2.9Å; A489-R492 VanDerWaalsContact O-N 3.12Å; A489-N493 PolarHBondContact O-N 3.37Å
490	D	32	Very low	30.1	Very low	139 Å²	139	121.6 Å²	121.6	74%	0.743	65%	0.651	S	S	*	*	H	α-helix	trans	-66.1	-33.3	-173	-115.4	-1.9	0	0	0	113.6
491	R	29.8	Very low	30.5	Very low	215 Å²	215	115.3 Å²	115.3	81%	0.811	62%	0.621	S	S	*	*	H	α-helix	trans	-77.9	-24.7	177.2	-135.1	-179.8	-117	-153.4	-0.6	112.7	A489 V495	A489-R491 VanDerWaalsContact C-N 3.35Å; A489-R491 PolarHBondContact O-N 2.9Å; R491-V495 WeakPolarHBondContact O-CG2 3.45Å
492	R	31.1	Very low	31.1	Very low	149 Å²	149	120.4 Å²	120.4	56%	0.562	63%	0.627	S	S	*	*	H	α-helix	trans	-84.2	-35.8	-174.5	-149.9	172.6	-177.1	143.6	-1.5	111.9	A489 M496	A489-R492 PolarHBondContact O-N 2.9Å; A489-R492 VanDerWaalsContact O-N 3.12Å; R492-M496 PolarHBondContact O-N 2.83Å
493	N	30.9	Very low	32.2	Very low	94 Å²	94	121.2 Å²	121.2	50%	0.503	62%	0.617	S	S	.	*	H	α-helix	trans	-70.5	-35.8	175.4	-71.4	-14.8	0	0	0	112.1	A489 A497	A489-N493 PolarHBondContact O-N 3.37Å; N493-A497 WeakPolarHBondContact O-CB 3.19Å; N493-A497 PolarHBondContact O-N 2.85Å
494	S	30.6	Very low	32.8	Very low	65 Å²	65	112.3 Å²	112.3	46%	0.455	59%	0.588	S	S	.	*	H	α-helix	trans	-67	-38.5	175.8	-175.3	0	0	0	0	113.1	N498	S494-N498 VanDerWaalsContact O-CB 3.31Å; S494-N498 WeakPolarHBondContact O-CB 2.82Å; S494-N498 VanDerWaalsContact O-CG 3.28Å; S494-N498 PolarHBondContact O-N 3.01Å; S494-N498 PolarHBondContact O-ND2 3.46Å
495	V	30.2	Very low	33.4	Very low	90 Å²	90	109.1 Å²	109.1	55%	0.545	57%	0.567	S	S	.	*	H	α-helix	trans	-75.5	-41	-179.5	176.9	0	0	0	0	111.7	R491 V499	R491-V495 WeakPolarHBondContact O-CG2 3.45Å; V495-V499 HydrophobicContact CG1-CG2 4.37Å; V495-V499 WeakPolarHBondContact O-CB 3.45Å; V495-V499 WeakPolarHBondContact O-CG2 3.17Å; V495-V499 PolarHBondContact O-N 2.96Å
496	M	29.1	Very low	34	Very low	109 Å²	109	109 Å²	109	54%	0.537	55%	0.554	S	S	.	*	H	α-helix	trans	-69.2	-40.6	176.3	-76.5	-82.4	-101.1	0	0	112.4	R492 N498 V499 Y500	R492-M496 PolarHBondContact O-N 2.83Å; M496-N498 VanDerWaalsContact C-N 3.34Å; M496-N498 PolarHBondContact O-N 3.19Å; M496-V499 PolarHBondContact O-N 2.79Å; M496-Y500 HydrophobicContact CE-CE2 4.5Å; M496-Y500 WeakPolarHBondContact O-CD2 3.49Å; M496-Y500 PolarHBondContact O-N 3.08Å; M496-Y500 VanDerWaalsContact O-N 3.16Å; M496-Y500 HydrophobicContact SD-CD2 4.16Å; M496-Y500 HydrophobicContact SD-CE2 3.65Å
497	A	30.9	Very low	35.4	Very low	62 Å²	62	107.7 Å²	107.7	51%	0.512	54%	0.544	S	S	.	.	H	α-helix	trans	-65.6	-35.6	177.4	0	0	0	0	0	112.7	N493 S501	N493-A497 WeakPolarHBondContact O-CB 3.19Å; N493-A497 PolarHBondContact O-N 2.85Å; A497-S501 WeakPolarHBondContact O-CB 3.4Å; A497-S501 PolarHBondContact O-N 2.75Å; A497-S501 VanDerWaalsContact O-N 3.14Å
498	N	32	Very low	35.9	Very low	102 Å²	102	109.1 Å²	109.1	55%	0.545	53%	0.534	S	S	.	.	H	α-helix	trans	-77.8	-31.5	178.3	-76	-29	0	0	0	113.6	S494 M496 T504	S494-N498 VanDerWaalsContact O-CB 3.31Å; S494-N498 WeakPolarHBondContact O-CB 2.82Å; S494-N498 VanDerWaalsContact O-CG 3.28Å; S494-N498 PolarHBondContact O-N 3.01Å; S494-N498 PolarHBondContact O-ND2 3.46Å; M496-N498 VanDerWaalsContact C-N 3.34Å; M496-N498 PolarHBondContact O-N 3.19Å; N498-T504 WeakPolarHBondContact O-CB 3.22Å; N498-T504 PolarHBondContact O-OG1 2.94Å
499	V	33.6	Very low	36.5	Very low	82 Å²	82	101.2 Å²	101.2	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-74.4	-32.9	177.5	172	0	0	0	0	111.8	V495 M496	V495-V499 HydrophobicContact CG1-CG2 4.37Å; V495-V499 WeakPolarHBondContact O-CB 3.45Å; V495-V499 WeakPolarHBondContact O-CG2 3.17Å; V495-V499 PolarHBondContact O-N 2.96Å; M496-V499 PolarHBondContact O-N 2.79Å
500	Y	31.1	Very low	37.8	Very low	144 Å²	144	104.3 Å²	104.3	57%	0.565	51%	0.511	S	S	*	.	S	Bend	trans	-105.4	10.6	-178	-65.9	-71.6	0	0	0	114.7	M496 R502	M496-Y500 HydrophobicContact CE-CE2 4.5Å; M496-Y500 WeakPolarHBondContact O-CD2 3.49Å; M496-Y500 PolarHBondContact O-N 3.08Å; M496-Y500 VanDerWaalsContact O-N 3.16Å; M496-Y500 HydrophobicContact SD-CD2 4.16Å; M496-Y500 HydrophobicContact SD-CE2 3.65Å; Y500-R502 PolarHBondContact O-N 2.62Å
501	S	36.1	Very low	39.1	Very low	30 Å²	30	102 Å²	102	21%	0.21	50%	0.499	C	S	.	.			trans	-63.5	140.1	173	97.7	0	0	0	0	109.7	A497 E503 T504 V505	A497-S501 WeakPolarHBondContact O-CB 3.4Å; A497-S501 PolarHBondContact O-N 2.75Å; A497-S501 VanDerWaalsContact O-N 3.14Å; S501-E503 PolarHBondContact O-N 3.29Å; S501-E503 VanDerWaalsContact O-N 3.08Å; S501-E503 PolarHBondContact OG-N 3.23Å; S501-T504 PolarHBondContact O-N 3.47Å; S501-T504 PolarHBondContact OG-N 3.39Å; S501-T504 PolarHBondContact OG-OG1 2.9Å; S501-V505 PolarHBondContact O-N 3.46Å; S501-V505 VanDerWaalsContact O-N 3.13Å
502	R	37.6	Very low	39.8	Very low	211 Å²	211	94.7 Å²	94.7	80%	0.796	48%	0.475	S	S	*	.	H	α-helix	trans	-56	-27.2	178.3	-171.2	174.2	174.8	154.3	-0	111.9	Y500 N506	Y500-R502 PolarHBondContact O-N 2.62Å; R502-N506 WeakPolarHBondContact O-CB 3.14Å; R502-N506 VanDerWaalsContact O-CG 3.28Å; R502-N506 PolarHBondContact O-N 3.3Å; R502-N506 VanDerWaalsContact O-N 3.13Å; R502-N506 PolarHBondContact O-ND2 2.99Å
503	E	47.5	Very low	40.7	Very low	153 Å²	153	94 Å²	94	72%	0.715	48%	0.476	S	S	*	.	H	α-helix	trans	-71.9	-46.5	176.7	-68.9	155.4	-177.4	0	0	111.6	S501 V505 N506 E507	S501-E503 PolarHBondContact O-N 3.29Å; S501-E503 VanDerWaalsContact O-N 3.08Å; S501-E503 PolarHBondContact OG-N 3.23Å; E503-V505 PolarHBondContact O-N 2.9Å; E503-N506 PolarHBondContact O-N 3.33Å; E503-E507 PolarHBondContact O-N 2.99Å
504	T	40.2	Very low	42.1	Very low	49 Å²	49	97.7 Å²	97.7	30%	0.301	48%	0.483	S	S	.	.	H	α-helix	trans	-64.2	-40.7	178.4	-43	0	0	0	0	111.4	N498 S501 E507 Q508	N498-T504 WeakPolarHBondContact O-CB 3.22Å; N498-T504 PolarHBondContact O-OG1 2.94Å; S501-T504 PolarHBondContact O-N 3.47Å; S501-T504 PolarHBondContact OG-N 3.39Å; S501-T504 PolarHBondContact OG-OG1 2.9Å; T504-E507 PolarHBondContact O-N 3.16Å; T504-Q508 WeakPolarHBondContact O-CB 3.03Å; T504-Q508 WeakPolarHBondContact O-CG 3.24Å; T504-Q508 PolarHBondContact O-N 3.17Å
505	V	39.1	Very low	43	Very low	38 Å²	38	101 Å²	101	23%	0.23	49%	0.49	C	S	.	.	H	α-helix	trans	-64.6	-41.5	175.6	176.7	0	0	0	0	111.4	S501 E503 T509 M583	S501-V505 PolarHBondContact O-N 3.46Å; S501-V505 VanDerWaalsContact O-N 3.13Å; E503-V505 PolarHBondContact O-N 2.9Å; V505-T509 VanDerWaalsContact O-CB 3.31Å; V505-T509 WeakPolarHBondContact O-CB 3.45Å; V505-T509 PolarHBondContact O-N 2.74Å; V505-T509 PolarHBondContact O-OG1 2.8Å; V505-M583 HydrophobicContact CG1-CE 3.73Å; V505-M583 HydrophobicContact CG1-SD 4.49Å
506	N	45.4	Very low	43.6	Very low	86 Å²	86	102.2 Å²	102.2	46%	0.46	49%	0.492	S	S	.	.	H	α-helix	trans	-66.4	-41.5	176.9	-84.6	-20.1	0	0	0	112.6	R502 E503 T509 K510	R502-N506 WeakPolarHBondContact O-CB 3.14Å; R502-N506 VanDerWaalsContact O-CG 3.28Å; R502-N506 PolarHBondContact O-N 3.3Å; R502-N506 VanDerWaalsContact O-N 3.13Å; R502-N506 PolarHBondContact O-ND2 2.99Å; E503-N506 PolarHBondContact O-N 3.33Å; N506-T509 PolarHBondContact O-N 3.23Å; N506-K510 WeakPolarHBondContact O-CG 3.23Å; N506-K510 PolarHBondContact O-N 2.85Å
507	E	59.4	Low	44.2	Very low	101 Å²	101	100.6 Å²	100.6	47%	0.472	49%	0.492	S	S	.	.	H	α-helix	trans	-66.2	-44.6	176.5	-83.5	-61.5	125.4	0	0	111.9	E503 T504 T509 K510 L511	E503-E507 PolarHBondContact O-N 2.99Å; T504-E507 PolarHBondContact O-N 3.16Å; E507-T509 VanDerWaalsContact C-N 3.31Å; E507-T509 PolarHBondContact O-N 2.85Å; E507-K510 PolarHBondContact O-N 2.91Å; E507-K510 IonicContact OE1-NZ 2.95Å; E507-K510 PolarHBondContact OE1-NZ 3.23Å; E507-L511 WeakPolarHBondContact O-CB 3.49Å; E507-L511 PolarHBondContact O-N 3.29Å
508	Q	43	Very low	44.9	Very low	129 Å²	129	100.1 Å²	100.1	60%	0.603	49%	0.485	S	S	*	.	H	α-helix	trans	-62.5	-38.8	174.6	-72.8	-163	-7.4	0	0	112.1	T504 L511 L512	T504-Q508 WeakPolarHBondContact O-CB 3.03Å; T504-Q508 WeakPolarHBondContact O-CG 3.24Å; T504-Q508 PolarHBondContact O-N 3.17Å; Q508-L511 PolarHBondContact O-N 3.27Å; Q508-L512 PolarHBondContact O-N 3.48Å
509	T	44.6	Very low	45.1	Very low	33 Å²	33	101.6 Å²	101.6	20%	0.202	48%	0.484	C	S	.	.	H	α-helix	trans	-63.8	-41.7	175.1	-58.1	0	0	0	0	111.9	V505 N506 E507 K513	V505-T509 VanDerWaalsContact O-CB 3.31Å; V505-T509 WeakPolarHBondContact O-CB 3.45Å; V505-T509 PolarHBondContact O-N 2.74Å; V505-T509 PolarHBondContact O-OG1 2.8Å; N506-T509 PolarHBondContact O-N 3.23Å; E507-T509 VanDerWaalsContact C-N 3.31Å; E507-T509 PolarHBondContact O-N 2.85Å; T509-K513 WeakPolarHBondContact O-CB 3.45Å; T509-K513 WeakPolarHBondContact O-CG 3.2Å; T509-K513 PolarHBondContact O-N 3.43Å
510	K	59.9	Low	45.3	Very low	109 Å²	109	101.5 Å²	101.5	47%	0.474	49%	0.486	S	S	.	.	H	α-helix	trans	-65.1	-43.4	174.8	-75	176.4	-168.9	167	0	111.8	N506 E507 K513 R514	N506-K510 WeakPolarHBondContact O-CG 3.23Å; N506-K510 PolarHBondContact O-N 2.85Å; E507-K510 PolarHBondContact O-N 2.91Å; E507-K510 IonicContact OE1-NZ 2.95Å; E507-K510 PolarHBondContact OE1-NZ 3.23Å; K510-K513 PolarHBondContact O-N 2.95Å; K510-R514 WeakPolarHBondContact O-CG 3.41Å; K510-R514 PolarHBondContact O-N 3.46Å
511	L	59.5	Low	45.8	Very low	92 Å²	92	100.9 Å²	100.9	48%	0.482	49%	0.489	S	S	.	.	H	α-helix	trans	-64.6	-41.2	-179.7	-155.1	103.8	0	0	0	111.2	E507 Q508 R514 K515	E507-L511 WeakPolarHBondContact O-CB 3.49Å; E507-L511 PolarHBondContact O-N 3.29Å; Q508-L511 PolarHBondContact O-N 3.27Å; L511-R514 PolarHBondContact O-N 3.34Å; L511-K515 PolarHBondContact O-N 3.16Å; L511-K515 VanDerWaalsContact O-N 3.08Å
512	L	44.1	Very low	46	Very low	61 Å²	61	105.2 Å²	105.2	32%	0.319	51%	0.505	S	S	.	.	H	α-helix	trans	-68.3	-40.6	174.3	-103.8	100.2	0	0	0	112.6	Q508 R514 K515 L516	Q508-L512 PolarHBondContact O-N 3.48Å; L512-R514 VanDerWaalsContact C-N 3.25Å; L512-R514 PolarHBondContact O-N 3.33Å; L512-K515 PolarHBondContact O-N 3.32Å; L512-K515 VanDerWaalsContact O-N 3.1Å; L512-L516 HydrophobicContact CD2-CD1 4.46Å; L512-L516 PolarHBondContact O-N 3.32Å
513	K	49.4	Very low	46.1	Very low	133 Å²	133	102 Å²	102	58%	0.578	50%	0.5	S	S	*	.	H	α-helix	trans	-58.4	-37.9	173.8	-81.2	-176.8	176.9	-177.1	0	112.1	T509 K510 S517	T509-K513 WeakPolarHBondContact O-CB 3.45Å; T509-K513 WeakPolarHBondContact O-CG 3.2Å; T509-K513 PolarHBondContact O-N 3.43Å; K510-K513 PolarHBondContact O-N 2.95Å; K513-S517 WeakPolarHBondContact O-CB 3.25Å; K513-S517 PolarHBondContact O-N 2.98Å; K513-S517 PolarHBondContact O-OG 3.26Å
514	R	61	Low	45.6	Very low	173 Å²	173	98.9 Å²	98.9	65%	0.653	49%	0.494	S	S	*	.	H	α-helix	trans	-64.5	-45.1	172.6	-72.2	178.6	-175.8	157.2	1.5	111.9	K510 L511 L512 S517 S518	K510-R514 WeakPolarHBondContact O-CG 3.41Å; K510-R514 PolarHBondContact O-N 3.46Å; L511-R514 PolarHBondContact O-N 3.34Å; L512-R514 VanDerWaalsContact C-N 3.25Å; L512-R514 PolarHBondContact O-N 3.33Å; R514-S517 PolarHBondContact O-N 3.47Å; R514-S518 PolarHBondContact O-N 2.77Å; R514-S518 VanDerWaalsContact O-N 3.09Å; R514-S518 PolarHBondContact O-OG 2.87Å
515	K	49.9	Very low	45.5	Very low	135 Å²	135	103.8 Å²	103.8	59%	0.587	51%	0.514	S	S	*	.	H	α-helix	trans	-65.2	-35.6	177.1	-74.9	-172.5	176.1	-174.3	0	113.8	L511 L512 S518 Y519	L511-K515 PolarHBondContact O-N 3.16Å; L511-K515 VanDerWaalsContact O-N 3.08Å; L512-K515 PolarHBondContact O-N 3.32Å; L512-K515 VanDerWaalsContact O-N 3.1Å; K515-S518 PolarHBondContact O-OG 3.44Å; K515-Y519 PolarHBondContact O-N 3.18Å
516	L	41	Very low	45.5	Very low	115 Å²	115	108.9 Å²	108.9	60%	0.602	54%	0.54	S	S	*	.	H	α-helix	trans	-72	-34.3	175.2	-96.4	122.4	0	0	0	112.6	L512 Y519 S520	L512-L516 HydrophobicContact CD2-CD1 4.46Å; L512-L516 PolarHBondContact O-N 3.32Å; L516-Y519 PolarHBondContact O-N 2.93Å; L516-S520 PolarHBondContact O-N 3.48Å
517	S	43.6	Very low	45	Very low	75 Å²	75	110.2 Å²	110.2	52%	0.524	55%	0.551	S	S	.	*	H	α-helix	trans	-70.1	-42.3	177.6	-55.1	0	0	0	0	111.3	K513 R514 Y519 S520 E521	K513-S517 WeakPolarHBondContact O-CB 3.25Å; K513-S517 PolarHBondContact O-N 2.98Å; K513-S517 PolarHBondContact O-OG 3.26Å; R514-S517 PolarHBondContact O-N 3.47Å; S517-Y519 VanDerWaalsContact C-N 3.28Å; S517-Y519 PolarHBondContact O-N 2.79Å; S517-S520 PolarHBondContact O-N 2.85Å; S517-E521 PolarHBondContact O-N 3.26Å
518	S	45.5	Very low	43.6	Very low	52 Å²	52	112.5 Å²	112.5	36%	0.364	57%	0.567	S	S	.	*	H	α-helix	trans	-64.1	-33.1	175.1	62.8	0	0	0	0	112.6	R514 K515 S520 E521 E522	R514-S518 PolarHBondContact O-N 2.77Å; R514-S518 VanDerWaalsContact O-N 3.09Å; R514-S518 PolarHBondContact O-OG 2.87Å; K515-S518 PolarHBondContact O-OG 3.44Å; S518-S520 PolarHBondContact O-N 2.87Å; S518-E521 PolarHBondContact O-N 3.08Å; S518-E522 PolarHBondContact O-N 2.53Å; S518-E522 VanDerWaalsContact O-N 3.12Å
519	Y	35.4	Very low	43	Very low	133 Å²	133	110.8 Å²	110.8	52%	0.522	57%	0.574	S	S	.	*	H	α-helix	trans	-68.7	-31.7	177.5	-121.1	-91.3	0	0	0	113.6	K515 L516 S517 Q523	K515-Y519 PolarHBondContact O-N 3.18Å; L516-Y519 PolarHBondContact O-N 2.93Å; S517-Y519 VanDerWaalsContact C-N 3.28Å; S517-Y519 PolarHBondContact O-N 2.79Å; Y519-Q523 PolarHBondContact O-N 2.64Å
520	S	38.2	Very low	42.4	Very low	79 Å²	79	114.1 Å²	114.1	55%	0.552	60%	0.599	S	S	*	*	H	α-helix	trans	-74.9	-30.5	175.6	-70.5	0	0	0	0	112.3	L516 S517 S518 S524	L516-S520 PolarHBondContact O-N 3.48Å; S517-S520 PolarHBondContact O-N 2.85Å; S518-S520 PolarHBondContact O-N 2.87Å; S520-S524 WeakPolarHBondContact O-CB 3.14Å; S520-S524 PolarHBondContact O-N 3.45Å; S520-S524 PolarHBondContact O-OG 3.14Å
521	E	40.7	Very low	41	Very low	132 Å²	132	116.3 Å²	116.3	62%	0.617	61%	0.611	S	S	*	*	H	α-helix	trans	-73.9	-39.2	175.5	-71.8	180	165.4	0	0	111.9	S517 S518 Q523 S524 Q525	S517-E521 PolarHBondContact O-N 3.26Å; S518-E521 PolarHBondContact O-N 3.08Å; E521-Q523 PolarHBondContact O-N 2.98Å; E521-S524 PolarHBondContact O-N 2.76Å; E521-Q525 PolarHBondContact O-N 3.32Å; E521-Q525 VanDerWaalsContact O-N 3.13Å
522	E	41.2	Very low	39.5	Very low	120 Å²	120	119.5 Å²	119.5	56%	0.561	62%	0.624	S	S	*	*	H	α-helix	trans	-69.5	-30.7	178.9	-75.5	-177.8	174.1	0	0	114	S518 N526	S518-E522 PolarHBondContact O-N 2.53Å; S518-E522 VanDerWaalsContact O-N 3.12Å; E522-N526 PolarHBondContact O-ND2 3.18Å
523	Q	39.1	Very low	38.6	Very low	144 Å²	144	123 Å²	123	67%	0.673	65%	0.651	S	S	*	*	H	α-helix	trans	-79.5	-21.5	172.8	-81.1	-171.8	-5.7	0	0	113.4	Y519 E521	Y519-Q523 PolarHBondContact O-N 2.64Å; E521-Q523 PolarHBondContact O-N 2.98Å
524	S	37.4	Very low	37.5	Very low	87 Å²	87	122 Å²	122	61%	0.608	66%	0.661	S	S	*	*	H	α-helix	trans	-83	-26.3	177.8	-55.7	0	0	0	0	112.6	S520 E521	S520-S524 WeakPolarHBondContact O-CB 3.14Å; S520-S524 PolarHBondContact O-N 3.45Å; S520-S524 PolarHBondContact O-OG 3.14Å; E521-S524 PolarHBondContact O-N 2.76Å
525	Q	37.6	Very low	35.9	Very low	153 Å²	153	123.6 Å²	123.6	72%	0.715	67%	0.673	S	S	*	*	H	α-helix	trans	-90.6	-17.6	-178.3	-72.1	-179.2	-10.8	0	0	114.3	E521	E521-Q525 PolarHBondContact O-N 3.32Å; E521-Q525 VanDerWaalsContact O-N 3.13Å
526	N	39	Very low	35	Very low	145 Å²	145	122 Å²	122	78%	0.775	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	10	-177	-92	-43.8	0	0	0	115.9	E522	E522-N526 PolarHBondContact O-ND2 3.18Å
527	V	34.8	Very low	34.3	Very low	113 Å²	113	122.6 Å²	122.6	69%	0.685	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	-2.1	-176.5	-172.5	0	0	0	0	113.6
528	N	30.1	Very low	33.6	Very low	150 Å²	150	121.8 Å²	121.8	80%	0.802	70%	0.696	S	S	*	*	S	Bend	trans	-130.9	34	-172.1	-80.4	-25.3	0	0	0	116.1
529	A	31.9	Very low	32.9	Very low	93 Å²	93	126.2 Å²	126.2	77%	0.769	72%	0.721	S	S	*	*			trans	-124.8	92.1	170.1	0	0	0	0	0	111.5
530	S	30.3	Very low	32.9	Very low	103 Å²	103	126.7 Å²	126.7	72%	0.72	73%	0.731	S	S	*	*			trans	-47.8	142.4	145.6	54.1	0	0	0	0	109.2
531	E	31.1	Very low	32.8	Very low	155 Å²	155	130.5 Å²	130.5	72%	0.724	75%	0.745	S	S	*	*				-175.9	143.4	75.3	-88.1	-167.2	127.5	0	0	111
532	Q	27.5	Very low	32.5	Very low	159 Å²	159	126.2 Å²	126.2	74%	0.743	74%	0.737	S	S	*	*			trans	69	98.8	142.7	-63.5	172.6	34	0	0	119.4
533	C	26.5	Very low	32.5	Very low	134 Å²	134	129.6 Å²	129.6	91%	0.905	75%	0.75	S	S	*	*				-160.6	124.2	113.5	-115.1	0	0	0	0	111
534	S	25	Very low	32.5	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	75%	0.754	S	S	*	*			trans	-68.1	134	-172.9	42.5	0	0	0	0	114.5
535	F	27	Very low	33	Very low	208 Å²	208	129.8 Å²	129.8	91%	0.912	75%	0.749	S	S	*	*			trans	-141.1	138.6	141.1	-122.7	-90.9	0	0	0	109.9
536	S	31.6	Very low	33.3	Very low	102 Å²	102	128.3 Å²	128.3	71%	0.713	75%	0.745	S	S	*	*			trans	-66.3	147	-157.8	46.6	0	0	0	0	116.7	G538	S536-G538 PolarHBondContact O-N 3.22Å
537	S	27.5	Very low	33.5	Very low	127 Å²	127	129.3 Å²	129.3	89%	0.888	74%	0.742	S	S	*	*			trans	-36.4	115.3	162.3	176.4	0	0	0	0	114.4
538	G	28.9	Very low	34.3	Very low	57 Å²	57	126.2 Å²	126.2	59%	0.588	73%	0.729	S	S	*	*			trans	-149.2	110.3	159.8	0	0	0	0	0	107.6	S536 I540	S536-G538 PolarHBondContact O-N 3.22Å; G538-I540 PolarHBondContact O-N 3.16Å; G538-I540 VanDerWaalsContact O-N 3.15Å
539	T	29.7	Very low	35	Very low	145 Å²	145	123 Å²	123	89%	0.89	71%	0.711	S	S	*	*			trans	-55.9	110.8	176.1	38.8	0	0	0	0	110.5
540	I	36.5	Very low	35.8	Very low	143 Å²	143	122.8 Å²	122.8	73%	0.733	70%	0.697	S	S	*	*			trans	-120.7	117.5	168.6	-58.1	178.3	0	0	0	107.5	G538 G542	G538-I540 PolarHBondContact O-N 3.16Å; G538-I540 VanDerWaalsContact O-N 3.15Å; I540-G542 VanDerWaalsContact C-N 3.31Å; I540-G542 PolarHBondContact O-N 2.69Å
541	D	34.8	Very low	36.8	Very low	159 Å²	159	125.4 Å²	125.4	85%	0.85	70%	0.695	S	S	*	*			trans	-63.4	86.6	174.8	-159.1	5.4	0	0	0	108.9
542	G	35.7	Very low	37.8	Very low	43 Å²	43	124.6 Å²	124.6	44%	0.443	69%	0.691	S	S	.	*	G	3₁₀ helix	trans	-98.2	26.7	-155.6	0	0	0	0	0	117.3	I540 D544 D545	I540-G542 VanDerWaalsContact C-N 3.31Å; I540-G542 PolarHBondContact O-N 2.69Å; G542-D544 PolarHBondContact O-N 2.78Å; G542-D545 PolarHBondContact O-N 2.9Å
543	K	41	Very low	38.7	Very low	191 Å²	191	123.6 Å²	123.6	83%	0.83	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-70.9	-20.6	174.9	-95.5	178.7	179.1	166.9	0	113.6
544	D	39.1	Very low	39.9	Very low	141 Å²	141	121.3 Å²	121.3	75%	0.754	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-87.6	-7.4	178.7	-66.3	-30.4	0	0	0	113.6	G542 A548	G542-D544 PolarHBondContact O-N 2.78Å; D544-A548 PolarHBondContact O-N 3.44Å
545	D	47.8	Very low	41.2	Very low	94 Å²	94	120.5 Å²	120.5	50%	0.503	66%	0.658	S	S	.	*	H	α-helix	trans	-90.5	-26.9	-173	-130.5	6.4	0	0	0	113.8	G542 F547 A548 L549	G542-D545 PolarHBondContact O-N 2.9Å; D545-F547 VanDerWaalsContact C-N 3.35Å; D545-A548 PolarHBondContact O-N 3.24Å; D545-L549 VanDerWaalsContact O-CB 3.27Å; D545-L549 WeakPolarHBondContact O-CB 3.44Å; D545-L549 WeakPolarHBondContact O-CG 3.36Å; D545-L549 PolarHBondContact O-N 3.42Å
546	L	43.1	Very low	42.4	Very low	121 Å²	121	114.4 Å²	114.4	63%	0.634	64%	0.635	S	S	*	*	H	α-helix	trans	-67.9	-37.8	175.1	-173.6	70.8	0	0	0	111.3	L550	L546-L550 HydrophobicContact CG-CD1 4.23Å; L546-L550 VanDerWaalsContact O-CB 3.31Å; L546-L550 WeakPolarHBondContact O-CB 3.5Å; L546-L550 WeakPolarHBondContact O-CG 3.48Å; L546-L550 PolarHBondContact O-N 2.95Å
547	F	44.1	Very low	43.6	Very low	166 Å²	166	114.1 Å²	114.1	73%	0.728	63%	0.63	S	S	*	*	H	α-helix	trans	-70.4	-38	175.7	-122.6	-85.6	0	0	0	110.9	D545 K551	D545-F547 VanDerWaalsContact C-N 3.35Å; F547-K551 VanDerWaalsContact O-CB 3.25Å; F547-K551 WeakPolarHBondContact O-CB 3.37Å; F547-K551 PolarHBondContact O-N 3.01Å
548	A	51.2	Low	45.4	Very low	48 Å²	48	110.4 Å²	110.4	40%	0.397	61%	0.607	S	S	.	*	H	α-helix	trans	-65.2	-43.3	173.6	0	0	0	0	0	112	D544 D545 K551 Q552	D544-A548 PolarHBondContact O-N 3.44Å; D545-A548 PolarHBondContact O-N 3.24Å; A548-K551 WeakPolarHBondContact O-CB 3.49Å; A548-K551 PolarHBondContact O-N 2.75Å; A548-Q552 WeakPolarHBondContact O-CB 3.3Å; A548-Q552 PolarHBondContact O-N 3.1Å
549	L	45.6	Very low	46.9	Very low	82 Å²	82	107.8 Å²	107.8	43%	0.429	58%	0.58	S	S	.	*	H	α-helix	trans	-63.5	-44	174.1	-84.8	160.5	0	0	0	112.2	D545 K551 Q552 Y553	D545-L549 VanDerWaalsContact O-CB 3.27Å; D545-L549 WeakPolarHBondContact O-CB 3.44Å; D545-L549 WeakPolarHBondContact O-CG 3.36Å; D545-L549 PolarHBondContact O-N 3.42Å; L549-K551 VanDerWaalsContact C-N 3.31Å; L549-K551 PolarHBondContact O-N 2.81Å; L549-Q552 PolarHBondContact O-N 3.42Å; L549-Y553 WeakPolarHBondContact O-CB 3.47Å; L549-Y553 PolarHBondContact O-N 3.02Å
550	L	47.7	Very low	48.2	Very low	89 Å²	89	104.5 Å²	104.5	47%	0.466	56%	0.556	S	S	.	*	H	α-helix	trans	-61.4	-40.5	172.9	-85.4	161.4	0	0	0	111	L546 Q552 Y553 V554	L546-L550 HydrophobicContact CG-CD1 4.23Å; L546-L550 VanDerWaalsContact O-CB 3.31Å; L546-L550 WeakPolarHBondContact O-CB 3.5Å; L546-L550 WeakPolarHBondContact O-CG 3.48Å; L546-L550 PolarHBondContact O-N 2.95Å; L550-Q552 VanDerWaalsContact C-N 3.34Å; L550-Y553 PolarHBondContact O-N 3.29Å; L550-V554 VanDerWaalsContact O-CB 3.25Å; L550-V554 WeakPolarHBondContact O-CB 3.25Å; L550-V554 WeakPolarHBondContact O-CG2 3.5Å; L550-V554 PolarHBondContact O-N 3.09Å
551	K	52.3	Low	49.5	Very low	158 Å²	158	104.7 Å²	104.7	69%	0.687	55%	0.554	S	S	*	*	H	α-helix	trans	-66.7	-36.3	177.4	-153.8	177	-172.7	-174.9	0	111.9	F547 A548 L549 S555	F547-K551 VanDerWaalsContact O-CB 3.25Å; F547-K551 WeakPolarHBondContact O-CB 3.37Å; F547-K551 PolarHBondContact O-N 3.01Å; A548-K551 WeakPolarHBondContact O-CB 3.49Å; A548-K551 PolarHBondContact O-N 2.75Å; L549-K551 VanDerWaalsContact C-N 3.31Å; L549-K551 PolarHBondContact O-N 2.81Å; K551-S555 PolarHBondContact O-N 3.3Å; K551-S555 PolarHBondContact O-OG 3.46Å
552	Q	52.3	Low	50.9	Low	138 Å²	138	104.7 Å²	104.7	65%	0.645	55%	0.547	S	S	*	.	H	α-helix	trans	-70.3	-43.1	175.2	-161.6	176.6	11.5	0	0	111.7	A548 L549 L550 S555	A548-Q552 WeakPolarHBondContact O-CB 3.3Å; A548-Q552 PolarHBondContact O-N 3.1Å; L549-Q552 PolarHBondContact O-N 3.42Å; L550-Q552 VanDerWaalsContact C-N 3.34Å; Q552-S555 PolarHBondContact O-N 3.4Å
553	Y	46	Very low	52.2	Low	139 Å²	139	106.9 Å²	106.9	55%	0.545	55%	0.547	S	S	.	.	H	α-helix	trans	-69.1	-32.9	176.9	-108	-93.2	0	0	0	113.7	L549 L550 S555 I563	L549-Y553 WeakPolarHBondContact O-CB 3.47Å; L549-Y553 PolarHBondContact O-N 3.02Å; L550-Y553 PolarHBondContact O-N 3.29Å; Y553-S555 VanDerWaalsContact C-N 3.26Å; Y553-I563 HydrophobicContact CD1-CD1 4.4Å
554	V	51.4	Low	53.2	Low	85 Å²	85	103 Å²	103	52%	0.515	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-13.4	175	173.9	0	0	0	0	111.7	L550 I560	L550-V554 VanDerWaalsContact O-CB 3.25Å; L550-V554 WeakPolarHBondContact O-CB 3.25Å; L550-V554 WeakPolarHBondContact O-CG2 3.5Å; L550-V554 PolarHBondContact O-N 3.09Å; V554-I560 HydrophobicContact CG1-CD1 4.34Å; V554-I560 WeakPolarHBondContact O-CD1 3.49Å
555	S	52.6	Low	54.5	Low	95 Å²	95	99 Å²	99	66%	0.664	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-12.9	175.8	-57.7	0	0	0	0	113.5	K551 Q552 Y553	K551-S555 PolarHBondContact O-N 3.3Å; K551-S555 PolarHBondContact O-OG 3.46Å; Q552-S555 PolarHBondContact O-N 3.4Å; Y553-S555 VanDerWaalsContact C-N 3.26Å
556	D	52.2	Low	55.5	Low	80 Å²	80	99.8 Å²	99.8	43%	0.428	52%	0.517	S	S	.	.			trans	-96.5	113.9	175.7	179.6	10.4	0	0	0	110.1	A558 G559 I560	D556-A558 PolarHBondContact O-N 3.35Å; D556-A558 PolarHBondContact OD1-N 3.45Å; D556-A558 VanDerWaalsContact OD1-N 3.09Å; D556-G559 WeakPolarHBondContact O-CA 3.16Å; D556-G559 PolarHBondContact O-N 3.17Å; D556-I560 PolarHBondContact O-N 3.09Å; D556-I560 VanDerWaalsContact O-N 3.09Å
557	P	56.6	Low	56.5	Low	96 Å²	96	99.4 Å²	99.4	62%	0.623	51%	0.511	S	S	*	.	H	α-helix	trans	-53.8	-35.8	177.3	-23	31.8	0	0	0	113	I560 E561	P557-I560 PolarHBondContact O-N 3.1Å; P557-E561 PolarHBondContact O-N 3.3Å
558	A	65.4	Low	57.5	Low	49 Å²	49	95.8 Å²	95.8	41%	0.405	50%	0.498	S	S	.	.	H	α-helix	trans	-71.2	-32.5	178.4	0	0	0	0	0	112.1	D556 K562	D556-A558 PolarHBondContact O-N 3.35Å; D556-A558 PolarHBondContact OD1-N 3.45Å; D556-A558 VanDerWaalsContact OD1-N 3.09Å; A558-K562 WeakPolarHBondContact O-CG 3.22Å; A558-K562 PolarHBondContact O-N 2.99Å; A558-K562 VanDerWaalsContact O-N 3.08Å
559	G	59.5	Low	58.3	Low	1 Å²	1	98.1 Å²	98.1	1%	0.01	50%	0.501	C	S	.	.	H	α-helix	trans	-65.1	-45.4	172.8	0	0	0	0	0	112.1	D556 K562 I563	D556-G559 WeakPolarHBondContact O-CA 3.16Å; D556-G559 PolarHBondContact O-N 3.17Å; G559-K562 PolarHBondContact O-N 2.95Å; G559-I563 WeakPolarHBondContact O-CG1 3.48Å; G559-I563 PolarHBondContact O-N 3.16Å
560	I	56.8	Low	59	Low	76 Å²	76	97.8 Å²	97.8	39%	0.39	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-45.6	175.2	-68.3	173.2	0	0	0	111	V554 D556 P557 K562 I563 H564	V554-I560 HydrophobicContact CG1-CD1 4.34Å; V554-I560 WeakPolarHBondContact O-CD1 3.49Å; D556-I560 PolarHBondContact O-N 3.09Å; D556-I560 VanDerWaalsContact O-N 3.09Å; P557-I560 PolarHBondContact O-N 3.1Å; I560-K562 VanDerWaalsContact C-N 3.33Å; I560-K562 PolarHBondContact O-N 2.93Å; I560-I563 PolarHBondContact O-N 3.15Å; I560-H564 VanDerWaalsContact O-CB 3.29Å; I560-H564 WeakPolarHBondContact O-CB 3.26Å; I560-H564 PolarHBondContact O-N 3.39Å
561	E	63.3	Low	59.7	Low	148 Å²	148	96.2 Å²	96.2	69%	0.692	50%	0.497	S	S	*	.	H	α-helix	trans	-60.8	-40.4	177.8	-78.3	-170.1	170.5	0	0	112.3	P557 H564 A565	P557-E561 PolarHBondContact O-N 3.3Å; E561-H564 PolarHBondContact O-N 3.44Å; E561-A565 VanDerWaalsContact O-CB 3.28Å; E561-A565 WeakPolarHBondContact O-CB 3.4Å; E561-A565 PolarHBondContact O-N 3.41Å
562	K	66.1	Low	60.3	Low	159 Å²	159	92 Å²	92	69%	0.691	49%	0.487	S	S	*	.	H	α-helix	trans	-63.9	-43.7	174.5	-79.4	179.1	-179.6	175.2	0	112.6	A558 G559 I560 H564 A565 K566	A558-K562 WeakPolarHBondContact O-CG 3.22Å; A558-K562 PolarHBondContact O-N 2.99Å; A558-K562 VanDerWaalsContact O-N 3.08Å; G559-K562 PolarHBondContact O-N 2.95Å; I560-K562 VanDerWaalsContact C-N 3.33Å; I560-K562 PolarHBondContact O-N 2.93Å; K562-H564 VanDerWaalsContact C-N 3.35Å; K562-A565 PolarHBondContact O-N 3.45Å; K562-K566 WeakPolarHBondContact O-CB 3.31Å; K562-K566 PolarHBondContact O-N 3.05Å
563	I	62.4	Low	61	Low	88 Å²	88	89.1 Å²	89.1	45%	0.451	48%	0.476	S	S	.	.	H	α-helix	trans	-63.8	-44	176.7	-68.2	167.7	0	0	0	110	Y553 G559 I560 K566 F567	Y553-I563 HydrophobicContact CD1-CD1 4.4Å; G559-I563 WeakPolarHBondContact O-CG1 3.48Å; G559-I563 PolarHBondContact O-N 3.16Å; I560-I563 PolarHBondContact O-N 3.15Å; I563-K566 PolarHBondContact O-N 3.39Å; I563-F567 VanDerWaalsContact O-CB 3.27Å; I563-F567 WeakPolarHBondContact O-CB 3.49Å; I563-F567 PolarHBondContact O-N 3.07Å
564	H	62.1	Low	61.6	Low	111 Å²	111	84.5 Å²	84.5	51%	0.514	47%	0.467	S	S	.	.	H	α-helix	trans	-63.5	-44	178.3	-172.5	-106.9	0	0	0	111.7	I560 E561 K562 F567 L568	I560-H564 VanDerWaalsContact O-CB 3.29Å; I560-H564 WeakPolarHBondContact O-CB 3.26Å; I560-H564 PolarHBondContact O-N 3.39Å; E561-H564 PolarHBondContact O-N 3.44Å; K562-H564 VanDerWaalsContact C-N 3.35Å; H564-F567 PolarHBondContact O-N 3.09Å; H564-L568 WeakPolarHBondContact O-CB 3.48Å; H564-L568 WeakPolarHBondContact O-CG 3.48Å; H564-L568 PolarHBondContact O-N 3Å
565	A	66.5	Low	62	Low	57 Å²	57	84.6 Å²	84.6	47%	0.471	46%	0.461	S	S	.	.	H	α-helix	trans	-61	-45.4	174.7	0	0	0	0	0	111.8	E561 K562 F567 L568 E569	E561-A565 VanDerWaalsContact O-CB 3.28Å; E561-A565 WeakPolarHBondContact O-CB 3.4Å; E561-A565 PolarHBondContact O-N 3.41Å; K562-A565 PolarHBondContact O-N 3.45Å; A565-F567 VanDerWaalsContact C-N 3.34Å; A565-F567 PolarHBondContact O-N 3.4Å; A565-L568 PolarHBondContact O-N 3.07Å; A565-E569 WeakPolarHBondContact O-CB 3.14Å; A565-E569 PolarHBondContact O-N 3.03Å
566	K	68.4	Low	62.6	Low	109 Å²	109	83.4 Å²	83.4	47%	0.474	45%	0.451	S	S	.	.	H	α-helix	trans	-67.5	-35.4	178.4	-163.7	53.2	164.8	179.1	0	112.3	K562 I563 E569 C570	K562-K566 WeakPolarHBondContact O-CB 3.31Å; K562-K566 PolarHBondContact O-N 3.05Å; I563-K566 PolarHBondContact O-N 3.39Å; K566-E569 WeakPolarHBondContact CD-OE2 3.38Å; K566-E569 IonicContact NZ-OE1 3.56Å; K566-E569 PolarHBondContact NZ-OE1 3.28Å; K566-E569 IonicContact NZ-OE2 3.73Å; K566-E569 PolarHBondContact NZ-OE2 2.67Å; K566-E569 PolarHBondContact O-N 2.96Å; K566-C570 PolarHBondContact O-N 3.36Å; K566-C570 PolarHBondContact O-SG 3.46Å
567	F	64.2	Low	63.1	Low	113 Å²	113	86.7 Å²	86.7	50%	0.496	46%	0.457	S	S	.	.	H	α-helix	trans	-65.6	-44	174.4	-173.1	-104.1	0	0	0	111.8	I563 H564 A565 E569 C570 L571	I563-F567 VanDerWaalsContact O-CB 3.27Å; I563-F567 WeakPolarHBondContact O-CB 3.49Å; I563-F567 PolarHBondContact O-N 3.07Å; H564-F567 PolarHBondContact O-N 3.09Å; A565-F567 VanDerWaalsContact C-N 3.34Å; A565-F567 PolarHBondContact O-N 3.4Å; F567-E569 VanDerWaalsContact C-N 3.34Å; F567-C570 PolarHBondContact O-N 3.18Å; F567-L571 HydrophobicContact CD1-CD1 3.73Å; F567-L571 HydrophobicContact CD1-CG 4.33Å; F567-L571 HydrophobicContact CE1-CD1 3.38Å; F567-L571 HydrophobicContact CE1-CG 4.07Å; F567-L571 HydrophobicContact CZ-CD1 4.04Å; F567-L571 HydrophobicContact CZ-CG 4.32Å; F567-L571 WeakPolarHBondContact O-CG 3.47Å; F567-L571 PolarHBondContact O-N 3.42Å
568	L	64.2	Low	63.4	Low	90 Å²	90	86.3 Å²	86.3	47%	0.471	45%	0.449	S	S	.	.	H	α-helix	trans	-62.6	-39.2	173.9	-73.6	172.8	0	0	0	112.3	H564 A565 L571 S572	H564-L568 WeakPolarHBondContact O-CB 3.48Å; H564-L568 WeakPolarHBondContact O-CG 3.48Å; H564-L568 PolarHBondContact O-N 3Å; A565-L568 PolarHBondContact O-N 3.07Å; L568-L571 PolarHBondContact O-N 3.14Å; L568-S572 WeakPolarHBondContact O-CB 3.34Å; L568-S572 PolarHBondContact O-N 3.41Å
569	E	68.6	Low	63	Low	98 Å²	98	90.9 Å²	90.9	46%	0.458	46%	0.456	S	S	.	.	H	α-helix	trans	-60.9	-48.6	174	-170	-165.4	142.2	0	0	111.2	A565 K566 F567 L571 S572 D573	A565-E569 WeakPolarHBondContact O-CB 3.14Å; A565-E569 PolarHBondContact O-N 3.03Å; K566-E569 WeakPolarHBondContact CD-OE2 3.38Å; K566-E569 IonicContact NZ-OE1 3.56Å; K566-E569 PolarHBondContact NZ-OE1 3.28Å; K566-E569 IonicContact NZ-OE2 3.73Å; K566-E569 PolarHBondContact NZ-OE2 2.67Å; K566-E569 PolarHBondContact O-N 2.96Å; F567-E569 VanDerWaalsContact C-N 3.34Å; E569-L571 VanDerWaalsContact C-N 3.33Å; E569-L571 PolarHBondContact O-N 3.15Å; E569-S572 PolarHBondContact O-N 3.14Å; E569-D573 PolarHBondContact O-N 2.75Å
570	C	61.1	Low	63	Low	74 Å²	74	95.1 Å²	95.1	50%	0.5	47%	0.472	S	S	.	.	H	α-helix	trans	-63.5	-36.4	176.8	-69.8	0	0	0	0	113	K566 F567 A574	K566-C570 PolarHBondContact O-N 3.36Å; K566-C570 PolarHBondContact O-SG 3.46Å; F567-C570 PolarHBondContact O-N 3.18Å; C570-A574 WeakPolarHBondContact O-CB 3.13Å; C570-A574 PolarHBondContact O-N 2.97Å
571	L	62.8	Low	63.3	Low	57 Å²	57	96 Å²	96	30%	0.298	48%	0.477	S	S	.	.	H	α-helix	trans	-67.1	-43.3	175.4	-78.2	176.5	0	0	0	111.9	F567 L568 E569 D573 A574 E575	F567-L571 HydrophobicContact CD1-CD1 3.73Å; F567-L571 HydrophobicContact CD1-CG 4.33Å; F567-L571 HydrophobicContact CE1-CD1 3.38Å; F567-L571 HydrophobicContact CE1-CG 4.07Å; F567-L571 HydrophobicContact CZ-CD1 4.04Å; F567-L571 HydrophobicContact CZ-CG 4.32Å; F567-L571 WeakPolarHBondContact O-CG 3.47Å; F567-L571 PolarHBondContact O-N 3.42Å; L568-L571 PolarHBondContact O-N 3.14Å; E569-L571 VanDerWaalsContact C-N 3.33Å; E569-L571 PolarHBondContact O-N 3.15Å; L571-D573 VanDerWaalsContact C-N 3.34Å; L571-D573 PolarHBondContact O-N 3.45Å; L571-A574 PolarHBondContact O-N 3.2Å; L571-E575 PolarHBondContact O-N 3.42Å
572	S	64	Low	63	Low	70 Å²	70	94.9 Å²	94.9	49%	0.49	47%	0.472	S	S	.	.	H	α-helix	trans	-61.3	-41.6	175.6	-177.3	0	0	0	0	111.9	L568 E569 E575 T576	L568-S572 WeakPolarHBondContact O-CB 3.34Å; L568-S572 PolarHBondContact O-N 3.41Å; E569-S572 PolarHBondContact O-N 3.14Å; S572-E575 PolarHBondContact O-N 3.34Å; S572-T576 WeakPolarHBondContact O-CB 3.28Å; S572-T576 PolarHBondContact O-N 3.46Å; S572-T576 PolarHBondContact O-OG1 3.15Å
573	D	67.3	Low	62.9	Low	76 Å²	76	90.4 Å²	90.4	41%	0.406	45%	0.454	S	S	.	.	H	α-helix	trans	-63.2	-42.8	173.8	-173.7	49.7	0	0	0	111.7	E569 L571 T576 R577	E569-D573 PolarHBondContact O-N 2.75Å; L571-D573 VanDerWaalsContact C-N 3.34Å; L571-D573 PolarHBondContact O-N 3.45Å; D573-T576 PolarHBondContact O-N 3.49Å; D573-R577 VanDerWaalsContact O-CG 3.3Å; D573-R577 WeakPolarHBondContact O-CG 3.18Å; D573-R577 PolarHBondContact O-N 2.77Å; D573-R577 IonicContact OD1-NE 2.8Å; D573-R577 IonicContact OD1-NH2 3.91Å; D573-R577 IonicContact OD2-CZ 3.15Å; D573-R577 IonicContact OD2-NE 2.75Å; D573-R577 PolarHBondContact OD2-NE 2.98Å; D573-R577 IonicContact OD2-NH2 2.77Å; D573-R577 PolarHBondContact OD2-NH2 2.74Å
574	A	58.5	Low	62.9	Low	43 Å²	43	90.2 Å²	90.2	36%	0.355	45%	0.451	S	S	.	.	H	α-helix	trans	-64.3	-43.9	176.7	0	0	0	0	0	112.8	C570 L571 T576 R577 L578	C570-A574 WeakPolarHBondContact O-CB 3.13Å; C570-A574 PolarHBondContact O-N 2.97Å; L571-A574 PolarHBondContact O-N 3.2Å; A574-T576 VanDerWaalsContact C-N 3.33Å; A574-T576 PolarHBondContact O-N 3.13Å; A574-R577 PolarHBondContact O-N 3.3Å; A574-L578 WeakPolarHBondContact O-CG 3.37Å; A574-L578 PolarHBondContact O-N 2.92Å
575	E	59.5	Low	62.9	Low	86 Å²	86	88.6 Å²	88.6	40%	0.402	45%	0.446	S	S	.	.	H	α-helix	trans	-61.6	-42.7	175.9	-169.3	-174.4	158.8	0	0	110.9	L571 S572 R577 L578 R579	L571-E575 PolarHBondContact O-N 3.42Å; S572-E575 PolarHBondContact O-N 3.34Å; E575-R577 PolarHBondContact O-N 3.13Å; E575-L578 PolarHBondContact O-N 3.46Å; E575-R579 WeakPolarHBondContact O-CG 3.4Å; E575-R579 PolarHBondContact O-N 3.42Å; E575-R579 IonicContact OE1-CZ 3.53Å; E575-R579 IonicContact OE1-NE 3.45Å; E575-R579 PolarHBondContact OE1-NE 3.12Å; E575-R579 IonicContact OE1-NH2 3.21Å; E575-R579 PolarHBondContact OE1-NH2 3.3Å
576	T	65.7	Low	62.6	Low	71 Å²	71	92.1 Å²	92.1	44%	0.436	45%	0.448	S	S	.	.	H	α-helix	trans	-61.5	-43.1	177.1	-56.4	0	0	0	0	111.5	S572 D573 A574 R579 Y580	S572-T576 WeakPolarHBondContact O-CB 3.28Å; S572-T576 PolarHBondContact O-N 3.46Å; S572-T576 PolarHBondContact O-OG1 3.15Å; D573-T576 PolarHBondContact O-N 3.49Å; A574-T576 VanDerWaalsContact C-N 3.33Å; A574-T576 PolarHBondContact O-N 3.13Å; T576-R579 PolarHBondContact O-N 2.93Å; T576-Y580 PolarHBondContact O-N 2.85Å
577	R	61.9	Low	62.3	Low	149 Å²	149	89.8 Å²	89.8	56%	0.562	44%	0.439	S	S	*	.	H	α-helix	trans	-66	-38.6	175.9	-70.4	174.2	-169	-150.1	5.8	112.7	D573 A574 E575 Y580 L581	D573-R577 VanDerWaalsContact O-CG 3.3Å; D573-R577 WeakPolarHBondContact O-CG 3.18Å; D573-R577 PolarHBondContact O-N 2.77Å; D573-R577 IonicContact OD1-NE 2.8Å; D573-R577 IonicContact OD1-NH2 3.91Å; D573-R577 IonicContact OD2-CZ 3.15Å; D573-R577 IonicContact OD2-NE 2.75Å; D573-R577 PolarHBondContact OD2-NE 2.98Å; D573-R577 IonicContact OD2-NH2 2.77Å; D573-R577 PolarHBondContact OD2-NH2 2.74Å; A574-R577 PolarHBondContact O-N 3.3Å; E575-R577 PolarHBondContact O-N 3.13Å; R577-Y580 WeakPolarHBondContact O-CB 3.26Å; R577-Y580 PolarHBondContact O-N 3.14Å; R577-L581 WeakPolarHBondContact O-CG 3.3Å; R577-L581 PolarHBondContact O-N 3.44Å
578	L	63.6	Low	62	Low	88 Å²	88	87.4 Å²	87.4	46%	0.461	43%	0.432	S	S	.	.	H	α-helix	trans	-66	-44.8	176.4	-77.9	169.1	0	0	0	111.5	A574 E575 Y580 L581 E582	A574-L578 WeakPolarHBondContact O-CG 3.37Å; A574-L578 PolarHBondContact O-N 2.92Å; E575-L578 PolarHBondContact O-N 3.46Å; L578-Y580 VanDerWaalsContact C-N 3.26Å; L578-Y580 PolarHBondContact O-N 3.34Å; L578-L581 PolarHBondContact O-N 2.92Å; L578-L581 VanDerWaalsContact O-N 3.15Å; L578-E582 WeakPolarHBondContact O-CB 3.39Å; L578-E582 PolarHBondContact O-N 2.93Å
579	R	57.8	Low	61.6	Low	144 Å²	144	86.9 Å²	86.9	54%	0.543	43%	0.429	S	S	.	.	H	α-helix	trans	-60.1	-36.7	173.8	-72	-175	-173	-109.7	5.1	112.2	E575 T576 E582 M583	E575-R579 WeakPolarHBondContact O-CG 3.4Å; E575-R579 PolarHBondContact O-N 3.42Å; E575-R579 IonicContact OE1-CZ 3.53Å; E575-R579 IonicContact OE1-NE 3.45Å; E575-R579 PolarHBondContact OE1-NE 3.12Å; E575-R579 IonicContact OE1-NH2 3.21Å; E575-R579 PolarHBondContact OE1-NH2 3.3Å; T576-R579 PolarHBondContact O-N 2.93Å; R579-E582 PolarHBondContact O-N 2.87Å; R579-M583 WeakPolarHBondContact O-CB 3.37Å; R579-M583 PolarHBondContact O-N 2.82Å
580	Y	57.5	Low	61.1	Low	91 Å²	91	87.2 Å²	87.2	36%	0.357	43%	0.43	S	S	.	.	H	α-helix	trans	-62.7	-46.6	173.9	179.3	-95.9	0	0	0	112	T576 R577 L578 M583 H584	T576-Y580 PolarHBondContact O-N 2.85Å; R577-Y580 WeakPolarHBondContact O-CB 3.26Å; R577-Y580 PolarHBondContact O-N 3.14Å; L578-Y580 VanDerWaalsContact C-N 3.26Å; L578-Y580 PolarHBondContact O-N 3.34Å; Y580-M583 PolarHBondContact O-N 3.3Å; Y580-H584 WeakPolarHBondContact O-CB 3.46Å; Y580-H584 PolarHBondContact O-N 2.88Å
581	L	63.4	Low	61.1	Low	93 Å²	93	89 Å²	89	49%	0.487	43%	0.431	S	S	.	.	H	α-helix	trans	-63.7	-42.2	176.9	-73.9	168.5	0	0	0	111.9	R577 L578 H584 N585	R577-L581 WeakPolarHBondContact O-CG 3.3Å; R577-L581 PolarHBondContact O-N 3.44Å; L578-L581 PolarHBondContact O-N 2.92Å; L578-L581 VanDerWaalsContact O-N 3.15Å; L581-H584 PolarHBondContact O-N 3.32Å; L581-N585 WeakPolarHBondContact O-CB 3.49Å; L581-N585 VanDerWaalsContact O-CG 3.25Å; L581-N585 PolarHBondContact O-N 2.75Å
582	E	58.3	Low	60.7	Low	125 Å²	125	88 Å²	88	58%	0.584	43%	0.426	S	S	*	.	H	α-helix	trans	-61	-46.5	176.6	-168.1	-169.8	165.2	0	0	111.4	L578 R579 H584 N585 R586	L578-E582 WeakPolarHBondContact O-CB 3.39Å; L578-E582 PolarHBondContact O-N 2.93Å; R579-E582 PolarHBondContact O-N 2.87Å; E582-H584 VanDerWaalsContact C-N 3.34Å; E582-H584 PolarHBondContact O-N 2.84Å; E582-N585 PolarHBondContact O-N 3.4Å; E582-R586 WeakPolarHBondContact O-CB 3.27Å; E582-R586 PolarHBondContact O-N 3.15Å
583	M	62.9	Low	60.4	Low	65 Å²	65	90.5 Å²	90.5	32%	0.32	43%	0.429	S	S	.	.	H	α-helix	trans	-62.4	-41.7	176.5	-165.7	179.9	89.9	0	0	111.6	V505 R579 Y580 R586 I587	V505-M583 HydrophobicContact CG1-CE 3.73Å; V505-M583 HydrophobicContact CG1-SD 4.49Å; R579-M583 WeakPolarHBondContact O-CB 3.37Å; R579-M583 PolarHBondContact O-N 2.82Å; Y580-M583 PolarHBondContact O-N 3.3Å; M583-R586 PolarHBondContact O-N 3.48Å; M583-I587 HydrophobicContact CE-CD1 4.36Å; M583-I587 HydrophobicContact CG-CD1 4.36Å; M583-I587 WeakPolarHBondContact O-CG1 3.48Å; M583-I587 PolarHBondContact O-N 2.83Å
584	H	63.2	Low	60.3	Low	84 Å²	84	92 Å²	92	39%	0.389	43%	0.433	S	S	.	.	H	α-helix	trans	-65.6	-44.1	178	-157.6	68.5	0	0	0	111.9	Y580 L581 E582 R586 I587 L588	Y580-H584 WeakPolarHBondContact O-CB 3.46Å; Y580-H584 PolarHBondContact O-N 2.88Å; L581-H584 PolarHBondContact O-N 3.32Å; E582-H584 VanDerWaalsContact C-N 3.34Å; E582-H584 PolarHBondContact O-N 2.84Å; H584-R586 VanDerWaalsContact C-N 3.3Å; H584-R586 PolarHBondContact O-N 3.07Å; H584-I587 PolarHBondContact O-N 3.34Å; H584-L588 WeakPolarHBondContact O-CG 3.33Å; H584-L588 PolarHBondContact O-N 3.04Å
585	N	61.4	Low	60.4	Low	77 Å²	77	93.7 Å²	93.7	41%	0.412	44%	0.435	S	S	.	.	H	α-helix	trans	-62.4	-37.2	175.6	-73.4	-9.2	0	0	0	111.8	L581 E582 L588 L589	L581-N585 WeakPolarHBondContact O-CB 3.49Å; L581-N585 VanDerWaalsContact O-CG 3.25Å; L581-N585 PolarHBondContact O-N 2.75Å; E582-N585 PolarHBondContact O-N 3.4Å; N585-L588 PolarHBondContact O-N 2.83Å; N585-L589 WeakPolarHBondContact O-CB 3.13Å; N585-L589 VanDerWaalsContact O-CG 3.31Å; N585-L589 WeakPolarHBondContact O-CG 3.36Å; N585-L589 PolarHBondContact O-N 3.18Å
586	R	61.3	Low	60.1	Low	132 Å²	132	90.8 Å²	90.8	50%	0.498	42%	0.422	S	S	.	.	H	α-helix	trans	-64.8	-43.8	175.4	-160.3	-178.4	89.3	-150.6	4.1	111.9	E582 M583 H584 L589 E590	E582-R586 WeakPolarHBondContact O-CB 3.27Å; E582-R586 PolarHBondContact O-N 3.15Å; M583-R586 PolarHBondContact O-N 3.48Å; H584-R586 VanDerWaalsContact C-N 3.3Å; H584-R586 PolarHBondContact O-N 3.07Å; R586-L589 PolarHBondContact O-N 3.18Å; R586-E590 IonicContact NE-OE1 2.81Å; R586-E590 PolarHBondContact O-N 3.25Å
587	I	61.1	Low	59.8	Low	59 Å²	59	91.1 Å²	91.1	30%	0.303	42%	0.421	S	S	.	.	H	α-helix	trans	-62.1	-46.1	175.8	-67.2	165.5	0	0	0	110.2	M583 H584 L589 E590 E591	M583-I587 HydrophobicContact CE-CD1 4.36Å; M583-I587 HydrophobicContact CG-CD1 4.36Å; M583-I587 WeakPolarHBondContact O-CG1 3.48Å; M583-I587 PolarHBondContact O-N 2.83Å; H584-I587 PolarHBondContact O-N 3.34Å; I587-L589 VanDerWaalsContact C-N 3.35Å; I587-L589 PolarHBondContact O-N 3.3Å; I587-E590 PolarHBondContact O-N 2.93Å; I587-E591 HydrophobicContact CG2-CG 4.46Å; I587-E591 WeakPolarHBondContact O-CG 3.49Å; I587-E591 PolarHBondContact O-N 3.12Å
588	L	57.6	Low	59.6	Low	64 Å²	64	92.5 Å²	92.5	34%	0.335	43%	0.426	S	S	.	.	H	α-helix	trans	-61.7	-41.6	177.2	-72.5	171	0	0	0	112.1	H584 N585 E591 L592	H584-L588 WeakPolarHBondContact O-CG 3.33Å; H584-L588 PolarHBondContact O-N 3.04Å; N585-L588 PolarHBondContact O-N 2.83Å; L588-E591 PolarHBondContact O-N 3.17Å; L588-L592 VanDerWaalsContact O-CB 3.31Å; L588-L592 WeakPolarHBondContact O-CB 3.29Å; L588-L592 VanDerWaalsContact O-CG 3.24Å; L588-L592 WeakPolarHBondContact O-CG 3.21Å; L588-L592 PolarHBondContact O-N 3.36Å
589	L	55.7	Low	59.3	Low	79 Å²	79	93.8 Å²	93.8	41%	0.414	43%	0.428	S	S	.	.	H	α-helix	trans	-64.2	-42.6	175.3	-79.4	166.4	0	0	0	111.9	N585 R586 I587 L592 F593 A616	N585-L589 WeakPolarHBondContact O-CB 3.13Å; N585-L589 VanDerWaalsContact O-CG 3.31Å; N585-L589 WeakPolarHBondContact O-CG 3.36Å; N585-L589 PolarHBondContact O-N 3.18Å; R586-L589 PolarHBondContact O-N 3.18Å; I587-L589 VanDerWaalsContact C-N 3.35Å; I587-L589 PolarHBondContact O-N 3.3Å; L589-L592 PolarHBondContact O-N 3.45Å; L589-F593 VanDerWaalsContact O-CB 3.26Å; L589-F593 WeakPolarHBondContact O-CB 3.17Å; L589-F593 PolarHBondContact O-N 2.9Å; L589-A616 HydrophobicContact CD2-CB 3.42Å; L589-A616 VanDerWaalsContact CD2-CB 3.42Å; L589-A616 HydrophobicContact CG-CB 4.14Å
590	E	59	Low	59	Low	104 Å²	104	92.3 Å²	92.3	49%	0.486	43%	0.427	S	S	.	.	H	α-helix	trans	-63	-43.7	174.3	-83.2	173.7	-165.9	0	0	111.8	R586 I587 F593 Q594	R586-E590 IonicContact NE-OE1 2.81Å; R586-E590 PolarHBondContact O-N 3.25Å; I587-E590 PolarHBondContact O-N 2.93Å; E590-F593 PolarHBondContact O-N 2.93Å; E590-Q594 WeakPolarHBondContact O-CB 3.49Å; E590-Q594 WeakPolarHBondContact O-CG 3.41Å; E590-Q594 PolarHBondContact O-N 3.2Å
591	E	61.3	Low	58.4	Low	112 Å²	112	94.2 Å²	94.2	52%	0.523	45%	0.448	S	S	.	.	H	α-helix	trans	-64.4	-44.2	176.4	-74.9	-169.1	166.9	0	0	111.8	I587 L588 F593 Q594 I595	I587-E591 HydrophobicContact CG2-CG 4.46Å; I587-E591 WeakPolarHBondContact O-CG 3.49Å; I587-E591 PolarHBondContact O-N 3.12Å; L588-E591 PolarHBondContact O-N 3.17Å; E591-F593 VanDerWaalsContact C-N 3.34Å; E591-F593 PolarHBondContact O-N 3.16Å; E591-Q594 PolarHBondContact O-N 2.78Å; E591-I595 WeakPolarHBondContact O-CB 3.22Å; E591-I595 WeakPolarHBondContact O-CG1 3.48Å; E591-I595 PolarHBondContact O-N 3.11Å
592	L	54.4	Low	57.8	Low	36 Å²	36	93.7 Å²	93.7	19%	0.188	45%	0.452	C	S	.	.	H	α-helix	trans	-61.8	-42.5	174.7	-75.5	171	0	0	0	111.4	L588 L589 I595 E596 A616	L588-L592 VanDerWaalsContact O-CB 3.31Å; L588-L592 WeakPolarHBondContact O-CB 3.29Å; L588-L592 VanDerWaalsContact O-CG 3.24Å; L588-L592 WeakPolarHBondContact O-CG 3.21Å; L588-L592 PolarHBondContact O-N 3.36Å; L589-L592 PolarHBondContact O-N 3.45Å; L592-I595 PolarHBondContact O-N 2.96Å; L592-E596 WeakPolarHBondContact O-CB 2.96Å; L592-E596 PolarHBondContact O-N 2.88Å; L592-A616 HydrophobicContact CD1-CB 3.74Å
593	F	57.9	Low	57	Low	123 Å²	123	93.8 Å²	93.8	54%	0.539	46%	0.456	S	S	.	.	H	α-helix	trans	-65.1	-39.4	176.9	-160.5	-96.8	0	0	0	111.7	L589 E590 E591 E596 N597	L589-F593 VanDerWaalsContact O-CB 3.26Å; L589-F593 WeakPolarHBondContact O-CB 3.17Å; L589-F593 PolarHBondContact O-N 2.9Å; E590-F593 PolarHBondContact O-N 2.93Å; E591-F593 VanDerWaalsContact C-N 3.34Å; E591-F593 PolarHBondContact O-N 3.16Å; F593-E596 PolarHBondContact O-N 3.2Å; F593-N597 WeakPolarHBondContact CD1-ND2 3.2Å; F593-N597 VanDerWaalsContact CE1-ND2 3.29Å; F593-N597 WeakPolarHBondContact CE1-ND2 3.38Å; F593-N597 WeakPolarHBondContact O-CB 2.96Å; F593-N597 PolarHBondContact O-N 2.91Å
594	Q	63.3	Low	55.8	Low	106 Å²	106	95 Å²	95	50%	0.495	49%	0.486	S	S	.	.	H	α-helix	trans	-66.6	-40.7	173.2	-75.7	-164.5	30.2	0	0	112.7	E590 E591 E596 R598	E590-Q594 WeakPolarHBondContact O-CB 3.49Å; E590-Q594 WeakPolarHBondContact O-CG 3.41Å; E590-Q594 PolarHBondContact O-N 3.2Å; E591-Q594 PolarHBondContact O-N 2.78Å; Q594-E596 VanDerWaalsContact C-N 3.34Å; Q594-R598 VanDerWaalsContact O-CG 3.27Å; Q594-R598 WeakPolarHBondContact O-CG 2.9Å; Q594-R598 PolarHBondContact O-N 3.45Å
595	I	61.9	Low	54.8	Low	80 Å²	80	93.3 Å²	93.3	41%	0.41	49%	0.491	S	S	.	.	H	α-helix	trans	-64	-42.5	176.1	-69.9	163.9	0	0	0	109.9	E591 L592 R598 K599	E591-I595 WeakPolarHBondContact O-CB 3.22Å; E591-I595 WeakPolarHBondContact O-CG1 3.48Å; E591-I595 PolarHBondContact O-N 3.11Å; L592-I595 PolarHBondContact O-N 2.96Å; I595-R598 PolarHBondContact O-N 3.38Å; I595-K599 HydrophobicContact CG2-CD 4.42Å; I595-K599 WeakPolarHBondContact O-CG 3.03Å; I595-K599 PolarHBondContact O-N 3.41Å
596	E	53.5	Low	53.8	Low	25 Å²	25	97.3 Å²	97.3	12%	0.117	51%	0.511	C	S	.	.	H	α-helix	trans	-69.9	-41.6	-179.7	-151.1	84.4	169.9	0	0	111.7	L592 F593 Q594 R598 K599 Q600 L612	L592-E596 WeakPolarHBondContact O-CB 2.96Å; L592-E596 PolarHBondContact O-N 2.88Å; F593-E596 PolarHBondContact O-N 3.2Å; Q594-E596 VanDerWaalsContact C-N 3.34Å; E596-R598 PolarHBondContact O-N 2.98Å; E596-K599 CarbonylContact O-C 3.43Å; E596-K599 WeakPolarHBondContact O-CA 3.12Å; E596-K599 PolarHBondContact O-N 2.92Å; E596-Q600 PolarHBondContact O-N 2.93Å; E596-L612 HydrophobicContact CB-CD1 4.32Å; E596-L612 HydrophobicContact CB-CD2 4.09Å; E596-L612 HydrophobicContact CG-CD1 3.92Å; E596-L612 HydrophobicContact CG-CD2 4.13Å; E596-L612 HydrophobicContact CG-CG 4.42Å
597	N	57.9	Low	53	Low	77 Å²	77	95.4 Å²	95.4	41%	0.412	51%	0.51	S	S	.	.	H	α-helix	trans	-59.1	-36.2	172.7	-86.1	-19.8	0	0	0	111.8	F593 V601	F593-N597 WeakPolarHBondContact CD1-ND2 3.2Å; F593-N597 VanDerWaalsContact CE1-ND2 3.29Å; F593-N597 WeakPolarHBondContact CE1-ND2 3.38Å; F593-N597 WeakPolarHBondContact O-CB 2.96Å; F593-N597 PolarHBondContact O-N 2.91Å; N597-V601 WeakPolarHBondContact O-CG2 3.43Å
598	R	59.4	Low	52.2	Low	179 Å²	179	96.7 Å²	96.7	68%	0.675	52%	0.523	S	S	*	.	H	α-helix	trans	-69.8	-30.8	173.3	-69.7	176.8	-156	-138.2	7.7	112.6	Q594 I595 E596	Q594-R598 VanDerWaalsContact O-CG 3.27Å; Q594-R598 WeakPolarHBondContact O-CG 2.9Å; Q594-R598 PolarHBondContact O-N 3.45Å; I595-R598 PolarHBondContact O-N 3.38Å; E596-R598 PolarHBondContact O-N 2.98Å
599	K	57.7	Low	51.6	Low	115 Å²	115	98.9 Å²	98.9	50%	0.5	53%	0.532	S	S	.	.	H	α-helix	trans	-79.5	-34.7	176.9	-75.3	-176.3	178.1	-177.7	0	113.6	I595 E596 V601 S602 N603	I595-K599 HydrophobicContact CG2-CD 4.42Å; I595-K599 WeakPolarHBondContact O-CG 3.03Å; I595-K599 PolarHBondContact O-N 3.41Å; E596-K599 CarbonylContact O-C 3.43Å; E596-K599 WeakPolarHBondContact O-CA 3.12Å; E596-K599 PolarHBondContact O-N 2.92Å; K599-V601 PolarHBondContact O-N 2.86Å; K599-S602 PolarHBondContact O-N 3.47Å; K599-S602 PolarHBondContact O-OG 3.17Å; K599-S602 VanDerWaalsContact O-OG 3.1Å; K599-N603 PolarHBondContact O-N 2.93Å; K599-N603 VanDerWaalsContact O-N 3.08Å
600	Q	49.9	Very low	50.8	Low	113 Å²	113	96.8 Å²	96.8	53%	0.528	53%	0.526	S	S	.	.	H	α-helix	trans	-62.1	-24.4	175.4	-75.2	-169.4	11	0	0	112.5	E596 S602	E596-Q600 PolarHBondContact O-N 2.93Å; Q600-S602 VanDerWaalsContact C-N 3.31Å
601	V	46.3	Very low	50.1	Low	131 Å²	131	93.8 Å²	93.8	79%	0.794	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-19.7	174	-178.6	0	0	0	0	112.6	N597 K599	N597-V601 WeakPolarHBondContact O-CG2 3.43Å; K599-V601 PolarHBondContact O-N 2.86Å
602	S	49.6	Very low	49.2	Very low	82 Å²	82	89.7 Å²	89.7	57%	0.573	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-24.3	-174	46.3	0	0	0	0	115.2	K599 Q600	K599-S602 PolarHBondContact O-N 3.47Å; K599-S602 PolarHBondContact O-OG 3.17Å; K599-S602 VanDerWaalsContact O-OG 3.1Å; Q600-S602 VanDerWaalsContact C-N 3.31Å
603	N	42.6	Very low	48.7	Very low	126 Å²	126	90.8 Å²	90.8	67%	0.674	50%	0.504	S	S	*	.			trans	-139.4	115.7	177.2	-78	-36.4	0	0	0	109.5	K599 G605	K599-N603 PolarHBondContact O-N 2.93Å; K599-N603 VanDerWaalsContact O-N 3.08Å; N603-G605 PolarHBondContact O-N 3.39Å
604	G	37	Very low	48.1	Very low	91 Å²	91	89.7 Å²	89.7	94%	0.938	50%	0.504	S	S	*	.			trans	-66.3	30	-178.5	0	0	0	0	0	116.1
605	G	42.1	Very low	47	Very low	49 Å²	49	91.5 Å²	91.5	51%	0.505	51%	0.51	S	S	.	.			trans	-95.9	114.2	174.3	0	0	0	0	0	110.9	N603 L607	N603-G605 PolarHBondContact O-N 3.39Å; G605-L607 PolarHBondContact O-N 3.48Å; G605-L607 VanDerWaalsContact O-N 3.14Å
606	I	41.5	Very low	45.9	Very low	161 Å²	161	88.8 Å²	88.8	83%	0.826	50%	0.5	S	S	*	.			trans	-68.3	105.4	168.7	-59.9	168.3	0	0	0	107.3
607	L	43.1	Very low	45.2	Very low	92 Å²	92	95 Å²	95	48%	0.482	52%	0.523	S	S	.	.			trans	-71.8	135.8	164.9	-99.2	107.2	0	0	0	109.1	G605 M609 A611	G605-L607 PolarHBondContact O-N 3.48Å; G605-L607 VanDerWaalsContact O-N 3.14Å; L607-M609 PolarHBondContact O-N 3.42Å; L607-A611 HydrophobicContact CD2-CB 3.88Å
608	P	45.9	Very low	44.1	Very low	86 Å²	86	101.4 Å²	101.4	56%	0.558	55%	0.548	S	S	*	.			trans	-59.5	132.5	173.6	-17.1	28.5	0	0	0	109.5	A610 A611	P608-A610 HydrophobicContact CB-CB 4.32Å; P608-A610 PolarHBondContact O-N 3.02Å; P608-A611 WeakPolarHBondContact O-CB 3.38Å; P608-A611 PolarHBondContact O-N 3.13Å
609	M	43.1	Very low	43.3	Very low	110 Å²	110	97.5 Å²	97.5	54%	0.542	54%	0.541	S	S	.	.	H	α-helix	trans	-46.4	-30.7	172.5	-99	-74.6	-101	0	0	113	L607 A611 L612 F613	L607-M609 PolarHBondContact O-N 3.42Å; M609-A611 VanDerWaalsContact C-N 3.27Å; M609-A611 PolarHBondContact O-N 3.06Å; M609-L612 PolarHBondContact O-N 3.26Å; M609-L612 HydrophobicContact SD-CD1 4.3Å; M609-F613 HydrophobicContact CB-CD2 4.31Å; M609-F613 HydrophobicContact CB-CE2 4.27Å; M609-F613 HydrophobicContact CE-CD2 4.31Å; M609-F613 HydrophobicContact CE-CE2 3.28Å; M609-F613 HydrophobicContact CE-CZ 3.55Å; M609-F613 WeakPolarHBondContact O-CD2 3Å; M609-F613 PolarHBondContact O-N 3.41Å; M609-F613 HydrophobicContact SD-CD2 4.32Å; M609-F613 HydrophobicContact SD-CE2 3.82Å; M609-F613 HydrophobicContact SD-CZ 4.41Å
610	A	38.9	Very low	42.6	Very low	35 Å²	35	96.6 Å²	96.6	29%	0.289	54%	0.543	S	S	.	.	H	α-helix	trans	-53.6	-38.5	173.2	0	0	0	0	0	114	V416 P608 N614	V416-A610 HydrophobicContact CG1-CB 3.81Å; P608-A610 HydrophobicContact CB-CB 4.32Å; P608-A610 PolarHBondContact O-N 3.02Å; A610-N614 WeakPolarHBondContact O-CB 2.95Å; A610-N614 PolarHBondContact O-N 3.22Å; A610-N614 PolarHBondContact O-ND2 2.65Å
611	A	46.1	Very low	42.2	Very low	40 Å²	40	95.7 Å²	95.7	33%	0.331	54%	0.544	S	S	.	.	H	α-helix	trans	-72	-38.9	180	0	0	0	0	0	111.7	L607 P608 M609 K615	L607-A611 HydrophobicContact CD2-CB 3.88Å; P608-A611 WeakPolarHBondContact O-CB 3.38Å; P608-A611 PolarHBondContact O-N 3.13Å; M609-A611 VanDerWaalsContact C-N 3.27Å; M609-A611 PolarHBondContact O-N 3.06Å; A611-K615 WeakPolarHBondContact O-CB 2.95Å; A611-K615 PolarHBondContact O-N 2.96Å; A611-K615 VanDerWaalsContact O-N 3.12Å
612	L	41.7	Very low	41.9	Very low	27 Å²	27	93.6 Å²	93.6	14%	0.141	53%	0.53	C	S	.	.	H	α-helix	trans	-63.9	-44.4	172.5	-81.1	162.1	0	0	0	111.4	E596 M609 K615 A616	E596-L612 HydrophobicContact CB-CD1 4.32Å; E596-L612 HydrophobicContact CB-CD2 4.09Å; E596-L612 HydrophobicContact CG-CD1 3.92Å; E596-L612 HydrophobicContact CG-CD2 4.13Å; E596-L612 HydrophobicContact CG-CG 4.42Å; M609-L612 PolarHBondContact O-N 3.26Å; M609-L612 HydrophobicContact SD-CD1 4.3Å; L612-K615 PolarHBondContact O-N 3.47Å; L612-A616 PolarHBondContact O-N 3.34Å
613	F	43.6	Very low	41.4	Very low	58 Å²	58	94.3 Å²	94.3	25%	0.254	53%	0.527	S	S	.	.	H	α-helix	trans	-65.9	-41.1	177.8	-79.7	-62	0	0	0	113	P420 M609 K615 A616 Y617	P420-F613 HydrophobicContact CG-CD1 4.35Å; M609-F613 HydrophobicContact CB-CD2 4.31Å; M609-F613 HydrophobicContact CB-CE2 4.27Å; M609-F613 HydrophobicContact CE-CD2 4.31Å; M609-F613 HydrophobicContact CE-CE2 3.28Å; M609-F613 HydrophobicContact CE-CZ 3.55Å; M609-F613 WeakPolarHBondContact O-CD2 3Å; M609-F613 PolarHBondContact O-N 3.41Å; M609-F613 HydrophobicContact SD-CD2 4.32Å; M609-F613 HydrophobicContact SD-CE2 3.82Å; M609-F613 HydrophobicContact SD-CZ 4.41Å; F613-K615 PolarHBondContact O-N 3.16Å; F613-A616 PolarHBondContact O-N 3.32Å; F613-Y617 VanDerWaalsContact O-CB 3.23Å; F613-Y617 WeakPolarHBondContact O-CB 3.46Å; F613-Y617 PolarHBondContact O-N 3.13Å
614	N	44.6	Very low	41.4	Very low	100 Å²	100	92.2 Å²	92.2	54%	0.535	52%	0.517	S	S	.	.	H	α-helix	trans	-61.6	-36.3	174.2	-85.3	-31.6	0	0	0	111.8	A610 Y617 F618	A610-N614 WeakPolarHBondContact O-CB 2.95Å; A610-N614 PolarHBondContact O-N 3.22Å; A610-N614 PolarHBondContact O-ND2 2.65Å; N614-Y617 PolarHBondContact O-N 2.93Å; N614-F618 WeakPolarHBondContact O-CD2 3.31Å; N614-F618 PolarHBondContact O-N 3.46Å
615	K	40.8	Very low	41.7	Very low	145 Å²	145	92.3 Å²	92.3	63%	0.63	49%	0.487	S	S	*	.	H	α-helix	trans	-74.6	-24	178.4	-138.3	176.2	-171.1	179.9	0	113.9	A611 L612 F613	A611-K615 WeakPolarHBondContact O-CB 2.95Å; A611-K615 PolarHBondContact O-N 2.96Å; A611-K615 VanDerWaalsContact O-N 3.12Å; L612-K615 PolarHBondContact O-N 3.47Å; F613-K615 PolarHBondContact O-N 3.16Å
616	A	38.8	Very low	41.7	Very low	23 Å²	23	95.6 Å²	95.6	19%	0.19	49%	0.485	C	S	.	.	H	α-helix	trans	-89.2	-21.2	173.1	0	0	0	0	0	113.3	L589 L592 L612 F613	L589-A616 HydrophobicContact CD2-CB 3.42Å; L589-A616 VanDerWaalsContact CD2-CB 3.42Å; L589-A616 HydrophobicContact CG-CB 4.14Å; L592-A616 HydrophobicContact CD1-CB 3.74Å; L612-A616 PolarHBondContact O-N 3.34Å; F613-A616 PolarHBondContact O-N 3.32Å
617	Y	39.5	Very low	41.7	Very low	156 Å²	156	90.2 Å²	90.2	61%	0.612	46%	0.457	S	S	*	.	H	α-helix	trans	-77.8	-37.2	176.2	179.4	-93.7	0	0	0	112.4	F613 N614	F613-Y617 VanDerWaalsContact O-CB 3.23Å; F613-Y617 WeakPolarHBondContact O-CB 3.46Å; F613-Y617 PolarHBondContact O-N 3.13Å; N614-Y617 PolarHBondContact O-N 2.93Å
618	F	34	Very low	41.5	Very low	210 Å²	210	90 Å²	90	92%	0.921	46%	0.455	S	S	*	.			trans	-71.4	0	167.9	-93.4	-80.4	0	0	0	111	N614	N614-F618 WeakPolarHBondContact O-CD2 3.31Å; N614-F618 PolarHBondContact O-N 3.46Å

Retrieved 618 of 618 residues in 352.7 ms (Link to these results)

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