A0A096MWE9_PAPAN Loading...

Differentially expressed in FDCP 8 homolog

Positively regulates lysosome peripheral distribution and ruffled border formation in osteoclasts. Involved in bone resorption.

AlphaFold DB , UniProt , Accession A0A096MWE9, Species PAPAN (Papio anubis, Olive baboon), Gene DEF8, Length 512 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	35.8	Very low	28.6	Very low	243 Å²	243	140.5 Å²	140.5	100%	1.197	81%	0.807	S	S	*	*				0	118.5	0	-78.6	174	161.1	0	0	107.2
2	T	24.7	Very low	28.9	Very low	136 Å²	136	146.2 Å²	146.2	83%	0.834	81%	0.806	S	S	*	*			trans	-145.1	112	-175.3	-38	0	0	0	0	108
3	V	26.5	Very low	29	Very low	144 Å²	144	144.8 Å²	144.8	87%	0.873	79%	0.79	S	S	*	*			trans	-94.6	114.1	-176.1	-179.5	0	0	0	0	109.1	S5	V3-S5 PolarHBondContact O-N 3.33Å
4	L	26.2	Very low	29.1	Very low	163 Å²	163	139.4 Å²	139.4	85%	0.853	78%	0.775	S	S	*	*			trans	-76.1	118.4	173	-77.7	164.3	0	0	0	109.8
5	S	25.5	Very low	29.2	Very low	111 Å²	111	137.5 Å²	137.5	78%	0.776	76%	0.76	S	S	*	*			trans	-87	110.9	174.8	-173.5	0	0	0	0	110.3	V3 R7	V3-S5 PolarHBondContact O-N 3.33Å; S5-R7 PolarHBondContact O-N 3.46Å
6	L	27.3	Very low	29.1	Very low	171 Å²	171	137.6 Å²	137.6	90%	0.895	75%	0.754	S	S	*	*			trans	-77.6	104.6	170.9	-77.6	164.7	0	0	0	109.7
7	R	29.6	Very low	29.1	Very low	234 Å²	234	135.6 Å²	135.6	88%	0.883	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-72.5	126.3	165	-83.6	-174.8	167.7	-170.3	-3.6	109.8	S5	S5-R7 PolarHBondContact O-N 3.46Å
8	A	28.5	Very low	29.2	Very low	91 Å²	91	139.6 Å²	139.6	75%	0.752	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-69.7	141.4	165.5	0	0	0	0	0	110.5
9	P	29.3	Very low	29.2	Very low	100 Å²	100	135.4 Å²	135.4	65%	0.649	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-71.3	149.7	174.8	28.6	-33.2	0	0	0	112
10	G	30.9	Very low	29	Very low	45 Å²	45	134.2 Å²	134.2	46%	0.464	73%	0.728	S	S	.	*	P	Polyproline II helix	trans	-76.5	162.3	-179.8	0	0	0	0	0	113.9	W12 Q13	G10-W12 PolarHBondContact O-N 3.5Å; G10-Q13 PolarHBondContact O-N 3.04Å
11	P	30.2	Very low	29	Very low	108 Å²	108	136.9 Å²	136.9	70%	0.701	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-13.8	-168.3	24	-34.9	0	0	0	115.8
12	W	31.8	Very low	28.7	Very low	208 Å²	208	128.5 Å²	128.5	79%	0.788	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-26.2	-177.9	-68.7	94.8	0	0	0	114.3	G10 A14 I15	G10-W12 PolarHBondContact O-N 3.5Å; W12-A14 VanDerWaalsContact C-N 3.29Å; W12-A14 PolarHBondContact O-N 3.4Å; W12-I15 HydrophobicContact CE3-CD1 4.39Å
13	Q	30.4	Very low	28.9	Very low	128 Å²	128	128.9 Å²	128.9	60%	0.598	69%	0.693	S	S	*	*	H	α-helix	trans	-72.8	-21.3	178.3	-73.7	-178.4	-29.2	0	0	113.2	G10 I15	G10-Q13 PolarHBondContact O-N 3.04Å; Q13-I15 VanDerWaalsContact C-N 3.35Å; Q13-I15 PolarHBondContact O-N 3.28Å
14	A	30.1	Very low	28.8	Very low	70 Å²	70	128 Å²	128	58%	0.579	68%	0.683	S	S	*	*	H	α-helix	trans	-71.8	-26.9	179.2	0	0	0	0	0	113.6	W12	W12-A14 VanDerWaalsContact C-N 3.29Å; W12-A14 PolarHBondContact O-N 3.4Å
15	I	31.3	Very low	28.8	Very low	110 Å²	110	125.2 Å²	125.2	56%	0.564	67%	0.673	S	S	*	*	H	α-helix	trans	-76.2	-40	-177.4	-61.2	175.3	0	0	0	110.6	W12 Q13 V17 W18 A19	W12-I15 HydrophobicContact CE3-CD1 4.39Å; Q13-I15 VanDerWaalsContact C-N 3.35Å; Q13-I15 PolarHBondContact O-N 3.28Å; I15-V17 VanDerWaalsContact C-N 3.32Å; I15-V17 PolarHBondContact O-N 3.01Å; I15-W18 WeakPolarHBondContact O-CB 3.26Å; I15-W18 PolarHBondContact O-N 3.29Å; I15-A19 PolarHBondContact O-N 3.43Å
16	Q	27.2	Very low	28.7	Very low	140 Å²	140	125.2 Å²	125.2	65%	0.654	67%	0.67	S	S	*	*	H	α-helix	trans	-63.9	-37.1	-176.3	-153.3	162.9	5.7	0	0	112.1	W18 A19	Q16-W18 PolarHBondContact O-N 2.95Å; Q16-A19 PolarHBondContact O-N 2.94Å
17	V	29.9	Very low	28.7	Very low	103 Å²	103	127.8 Å²	127.8	62%	0.624	67%	0.668	S	S	*	*	H	α-helix	trans	-65.7	-19.2	174.7	179.6	0	0	0	0	113	I15	I15-V17 VanDerWaalsContact C-N 3.32Å; I15-V17 PolarHBondContact O-N 3.01Å
18	W	29.8	Very low	28.5	Very low	207 Å²	207	123 Å²	123	78%	0.784	67%	0.665	S	S	*	*	H	α-helix	trans	-82.9	-33.1	175.2	-124.3	71.4	0	0	0	112.6	I15 Q16 R21 A22	I15-W18 WeakPolarHBondContact O-CB 3.26Å; I15-W18 PolarHBondContact O-N 3.29Å; Q16-W18 PolarHBondContact O-N 2.95Å; W18-R21 PolarHBondContact O-N 3.25Å; W18-A22 PolarHBondContact O-N 3.12Å
19	A	28.8	Very low	28.3	Very low	60 Å²	60	122.7 Å²	122.7	50%	0.496	66%	0.662	S	S	.	*	H	α-helix	trans	-63.9	-48.4	178.5	0	0	0	0	0	112	I15 Q16 R21 A22	I15-A19 PolarHBondContact O-N 3.43Å; Q16-A19 PolarHBondContact O-N 2.94Å; A19-R21 PolarHBondContact O-N 2.93Å; A19-A22 WeakPolarHBondContact O-CB 3.5Å; A19-A22 PolarHBondContact O-N 3.35Å; A19-A22 VanDerWaalsContact O-N 3.13Å
20	D	26.8	Very low	28.1	Very low	111 Å²	111	125.2 Å²	125.2	59%	0.594	68%	0.675	S	S	*	*	H	α-helix	trans	-61.4	-28.4	177.3	-71.2	-31.3	0	0	0	112.6
21	R	27.6	Very low	27.8	Very low	191 Å²	191	128.9 Å²	128.9	72%	0.721	69%	0.689	S	S	*	*	H	α-helix	trans	-78.9	-21.2	-179.9	-148.4	172.4	-170.1	-178	2.6	113.2	W18 A19 L23	W18-R21 PolarHBondContact O-N 3.25Å; A19-R21 PolarHBondContact O-N 2.93Å; R21-L23 VanDerWaalsContact C-N 3.31Å
22	A	29.5	Very low	27.6	Very low	67 Å²	67	129 Å²	129	55%	0.554	69%	0.693	S	S	*	*	H	α-helix	trans	-72.1	-24.6	173.7	0	0	0	0	0	112.7	W18 A19 L24	W18-A22 PolarHBondContact O-N 3.12Å; A19-A22 WeakPolarHBondContact O-CB 3.5Å; A19-A22 PolarHBondContact O-N 3.35Å; A19-A22 VanDerWaalsContact O-N 3.13Å; A22-L24 PolarHBondContact O-N 3.22Å
23	L	29.3	Very low	27.3	Very low	145 Å²	145	127.9 Å²	127.9	76%	0.759	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	5.7	-179.4	-66.7	171.9	0	0	0	114.6	R21	R21-L23 VanDerWaalsContact C-N 3.31Å
24	L	25	Very low	27.1	Very low	125 Å²	125	128.3 Å²	128.3	65%	0.654	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	9.1	-174.1	-73.3	170.8	0	0	0	114.8	A22	A22-L24 PolarHBondContact O-N 3.22Å
25	T	25.1	Very low	26.9	Very low	104 Å²	104	132.7 Å²	132.7	64%	0.638	72%	0.72	S	S	*	*			trans	-106.7	124.6	174.6	56.4	0	0	0	0	111.9	R27	T25-R27 PolarHBondContact O-N 2.93Å
26	P	24.3	Very low	26.5	Very low	111 Å²	111	131 Å²	131	72%	0.721	73%	0.73	S	S	*	*			trans	-77	107.7	177.3	30	-32.6	0	0	0	110.5	T28	P26-T28 VanDerWaalsContact C-N 3.32Å; P26-T28 HydrophobicContact CB-CG2 4.48Å; P26-T28 PolarHBondContact O-N 3.42Å
27	R	27.1	Very low	26.4	Very low	226 Å²	226	130.8 Å²	130.8	85%	0.853	74%	0.738	S	S	*	*			trans	-69	85.1	170.6	-83.1	-171.9	169.3	-173.2	-2.1	111	T25 A29	T25-R27 PolarHBondContact O-N 2.93Å; R27-A29 PolarHBondContact O-N 3.29Å
28	T	25.7	Very low	26.1	Very low	134 Å²	134	130.5 Å²	130.5	82%	0.822	75%	0.747	S	S	*	*			trans	-87.6	83.9	174	53	0	0	0	0	111.9	P26	P26-T28 VanDerWaalsContact C-N 3.32Å; P26-T28 HydrophobicContact CB-CG2 4.48Å; P26-T28 PolarHBondContact O-N 3.42Å
29	A	25	Very low	25.8	Very low	84 Å²	84	125.1 Å²	125.1	69%	0.694	75%	0.746	S	S	*	*			trans	-157.8	97.6	163	0	0	0	0	0	111.2	R27	R27-A29 PolarHBondContact O-N 3.29Å
30	V	23.8	Very low	25.6	Very low	152 Å²	152	126.7 Å²	126.7	92%	0.921	76%	0.759	S	S	*	*			trans	-124.4	91.2	160.7	179.3	0	0	0	0	106.8
31	T	25.2	Very low	25.5	Very low	122 Å²	122	127.7 Å²	127.7	75%	0.748	77%	0.769	S	S	*	*			trans	-100.2	114.9	174.7	44	0	0	0	0	109.2	Q33	T31-Q33 PolarHBondContact O-N 3.46Å
32	S	26.4	Very low	25.3	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	77%	0.773	S	S	*	*			trans	-62.2	128.7	168.4	-177.7	0	0	0	0	109.8
33	Q	25.2	Very low	25.1	Very low	184 Å²	184	127.5 Å²	127.5	86%	0.86	78%	0.782	S	S	*	*			trans	-129.1	132.3	161.2	-82.3	-173	-30.9	0	0	109.2	T31	T31-Q33 PolarHBondContact O-N 3.46Å
34	V	25.5	Very low	25	Very low	136 Å²	136	126.1 Å²	126.1	82%	0.824	78%	0.782	S	S	*	*			trans	-89	139	-177.5	176.3	0	0	0	0	108.9	G36	V34-G36 PolarHBondContact O-N 3.4Å
35	L	25.9	Very low	25	Very low	162 Å²	162	128.5 Å²	128.5	85%	0.848	79%	0.794	S	S	*	*			trans	-67.9	110.4	177.2	-77.3	161.5	0	0	0	111.1
36	G	23.2	Very low	25.2	Very low	76 Å²	76	129.4 Å²	129.4	78%	0.784	80%	0.802	S	S	*	*			trans	-98.2	105.8	161.6	0	0	0	0	0	109.7	V34	V34-G36 PolarHBondContact O-N 3.4Å
37	V	25.2	Very low	25.1	Very low	135 Å²	135	128 Å²	128	82%	0.818	81%	0.808	S	S	*	*			trans	-88	113.2	-179.7	-177.9	0	0	0	0	109.8
38	A	23.6	Very low	25	Very low	97 Å²	97	121.1 Å²	121.1	80%	0.802	81%	0.807	S	S	*	*			trans	-106.8	111.1	170.5	0	0	0	0	0	109.6
39	A	23.8	Very low	25	Very low	94 Å²	94	124 Å²	124	78%	0.777	81%	0.811	S	S	*	*			trans	-81.8	116.7	179.6	0	0	0	0	0	111.1
40	A	25.1	Very low	25.2	Very low	93 Å²	93	127.2 Å²	127.2	77%	0.769	82%	0.822	S	S	*	*			trans	-92.8	104.9	170.9	0	0	0	0	0	110
41	V	23.2	Very low	25.4	Very low	131 Å²	131	125.1 Å²	125.1	79%	0.794	82%	0.82	S	S	*	*			trans	-79.4	124.4	173.5	177.8	0	0	0	0	109.2
42	V	25	Very low	25.5	Very low	132 Å²	132	122.7 Å²	122.7	80%	0.8	82%	0.82	S	S	*	*			trans	-117.4	116.2	173.6	-179.4	0	0	0	0	109.1
43	T	24.8	Very low	25.5	Very low	122 Å²	122	129.4 Å²	129.4	75%	0.748	83%	0.828	S	S	*	*			trans	-88.6	133.6	175.6	43.1	0	0	0	0	111
44	P	27.5	Very low	25.6	Very low	117 Å²	117	124.4 Å²	124.4	76%	0.76	82%	0.819	S	S	*	*			trans	-87.7	151.1	178.6	34.3	-34.6	0	0	0	112.8
45	L	23.8	Very low	25.7	Very low	174 Å²	174	130 Å²	130	91%	0.911	83%	0.825	S	S	*	*			trans	-134.4	156.6	161.8	-79	176.2	0	0	0	110.2
46	P	29.5	Very low	25.9	Very low	123 Å²	123	130.4 Å²	130.4	80%	0.799	82%	0.822	S	S	*	*			trans	-121.2	166.3	-146.3	41.4	-31.2	0	0	0	116.1
47	G	23.3	Very low	26.4	Very low	83 Å²	83	130.2 Å²	130.2	86%	0.856	81%	0.813	S	S	*	*			trans	137.5	128.2	153.1	0	0	0	0	0	115.4
48	G	24.4	Very low	26.8	Very low	80 Å²	80	134.4 Å²	134.4	83%	0.825	81%	0.814	S	S	*	*			trans	144.1	92.6	171	0	0	0	0	0	114
49	H	26.5	Very low	27.6	Very low	195 Å²	195	137.8 Å²	137.8	90%	0.903	81%	0.806	S	S	*	*			trans	-86.9	139.1	175.1	-67.7	-83.9	0	0	0	112.5
50	T	28	Very low	28.9	Very low	151 Å²	151	138.2 Å²	138.2	93%	0.926	80%	0.796	S	S	*	*			trans	-154.9	148.9	132	15.6	0	0	0	0	109.2
51	A	29.3	Very low	30.3	Very low	108 Å²	108	137.1 Å²	137.1	89%	0.893	79%	0.787	S	S	*	*			trans	-102.3	118.5	-169.2	0	0	0	0	0	112.9
52	G	26	Very low	32	Very low	72 Å²	72	138.5 Å²	138.5	74%	0.742	79%	0.786	S	S	*	*			trans	-119.8	110.1	162.7	0	0	0	0	0	109.1	A54	G52-A54 VanDerWaalsContact C-N 3.26Å; G52-A54 PolarHBondContact O-N 3.03Å
53	R	27.3	Very low	34.1	Very low	252 Å²	252	136.7 Å²	136.7	95%	0.951	77%	0.769	S	S	*	*			trans	-82.7	64.2	-169.6	-161	-178.1	-169.3	-179.9	4.5	112.6	R55	R53-R55 PolarHBondContact O-N 2.86Å
54	A	26.7	Very low	36.3	Very low	80 Å²	80	134.1 Å²	134.1	66%	0.661	75%	0.746	S	S	*	*			trans	-58.3	133.3	164.2	0	0	0	0	0	109.2	G52 E56	G52-A54 VanDerWaalsContact C-N 3.26Å; G52-A54 PolarHBondContact O-N 3.03Å; A54-E56 VanDerWaalsContact C-N 3.33Å; A54-E56 PolarHBondContact O-N 2.88Å
55	R	27.9	Very low	38.3	Very low	252 Å²	252	133.1 Å²	133.1	95%	0.951	74%	0.735	S	S	*	*			trans	-93.7	68.9	-178.6	-166.9	179.5	-176	-178.1	0.1	109.2	R53 A57	R53-R55 PolarHBondContact O-N 2.86Å; R55-A57 PolarHBondContact O-N 3.38Å
56	E	29.2	Very low	41	Very low	172 Å²	172	129.6 Å²	129.6	80%	0.804	71%	0.713	S	S	*	*			trans	-54.9	129.5	177.5	-67.1	179.8	142.6	0	0	110.5	A54 R58	A54-E56 VanDerWaalsContact C-N 3.33Å; A54-E56 PolarHBondContact O-N 2.88Å; E56-R58 VanDerWaalsContact C-N 3.26Å; E56-R58 PolarHBondContact O-N 2.83Å
57	A	34	Very low	43.1	Very low	71 Å²	71	127.8 Å²	127.8	59%	0.587	69%	0.693	S	S	*	*			trans	-74	85.6	169.9	0	0	0	0	0	108.1	R55 W59	R55-A57 PolarHBondContact O-N 3.38Å; A57-W59 HydrophobicContact CB-CZ2 4.35Å; A57-W59 PolarHBondContact O-N 3.13Å
58	R	33.4	Very low	45.5	Very low	223 Å²	223	124.1 Å²	124.1	84%	0.842	65%	0.654	S	S	*	*			trans	-71.1	83.5	172.8	-176.8	-179.3	167.4	177.9	-4.1	109.1	E56	E56-R58 VanDerWaalsContact C-N 3.26Å; E56-R58 PolarHBondContact O-N 2.83Å
59	W	42	Very low	48	Very low	168 Å²	168	122.1 Å²	122.1	64%	0.636	63%	0.63	S	S	*	*			trans	-65.9	132.8	170.2	-58.7	119.5	0	0	0	110.1	A57	A57-W59 HydrophobicContact CB-CZ2 4.35Å; A57-W59 PolarHBondContact O-N 3.13Å
60	D	49.8	Very low	50.3	Low	103 Å²	103	120.4 Å²	120.4	55%	0.551	62%	0.615	S	S	*	*			trans	-80.2	119.1	167.5	-85.4	-42.6	0	0	0	109	M62 E63	D60-M62 PolarHBondContact O-N 3.04Å; D60-M62 VanDerWaalsContact O-N 3.11Å; D60-E63 WeakPolarHBondContact O-CB 3.35Å; D60-E63 PolarHBondContact O-N 3.07Å
61	A	55.1	Low	52.5	Low	71 Å²	71	113.9 Å²	113.9	59%	0.587	57%	0.574	S	S	*	*	H	α-helix	trans	-55.6	-30.5	177.9	0	0	0	0	0	112.5	E63 Y64 D65	A61-E63 VanDerWaalsContact C-N 3.28Å; A61-E63 PolarHBondContact O-N 2.98Å; A61-Y64 PolarHBondContact O-N 2.79Å; A61-D65 PolarHBondContact O-N 3.5Å
62	M	58.5	Low	54.7	Low	159 Å²	159	112.6 Å²	112.6	78%	0.783	55%	0.546	S	S	*	.	H	α-helix	trans	-57	-35.7	171.6	-76.3	175.3	52.4	0	0	113.5	D60 E66	D60-M62 PolarHBondContact O-N 3.04Å; D60-M62 VanDerWaalsContact O-N 3.11Å; M62-E66 VanDerWaalsContact O-CB 3.3Å; M62-E66 WeakPolarHBondContact O-CB 3.3Å; M62-E66 PolarHBondContact O-N 2.92Å
63	E	69.9	Low	56.7	Low	94 Å²	94	115.4 Å²	115.4	44%	0.439	54%	0.54	S	S	.	.	H	α-helix	trans	-74.6	-35.5	-180	-156.6	-162.1	153.2	0	0	111.3	D60 A61 K67	D60-E63 WeakPolarHBondContact O-CB 3.35Å; D60-E63 PolarHBondContact O-N 3.07Å; A61-E63 VanDerWaalsContact C-N 3.28Å; A61-E63 PolarHBondContact O-N 2.98Å; E63-K67 WeakPolarHBondContact O-CB 3.43Å; E63-K67 WeakPolarHBondContact O-CD 3.23Å; E63-K67 WeakPolarHBondContact O-CG 3.33Å; E63-K67 PolarHBondContact O-N 3.11Å; E63-K67 WeakPolarHBondContact OE1-CE 3.49Å; E63-K67 IonicContact OE1-NZ 2.75Å; E63-K67 PolarHBondContact OE1-NZ 3.45Å; E63-K67 IonicContact OE2-NZ 3.22Å
64	Y	69.5	Low	58.3	Low	68 Å²	68	106.7 Å²	106.7	27%	0.267	52%	0.522	S	S	.	.	H	α-helix	trans	-63.9	-52.2	171.1	179.4	-80.5	0	0	0	110.5	A61 E66 K67 L68 E363	A61-Y64 PolarHBondContact O-N 2.79Å; Y64-E66 VanDerWaalsContact C-N 3.33Å; Y64-E66 PolarHBondContact O-N 3.2Å; Y64-K67 PolarHBondContact O-N 3.19Å; Y64-L68 HydrophobicContact CE1-CD2 3.88Å; Y64-L68 WeakPolarHBondContact O-CB 3.48Å; Y64-L68 PolarHBondContact O-N 3.19Å; Y64-E363 VanDerWaalsContact OH-CD 3.3Å; Y64-E363 PolarHBondContact OH-OE1 3.09Å; Y64-E363 PolarHBondContact OH-OE2 3.5Å
65	D	71.3	Confident	59.7	Low	97 Å²	97	107.5 Å²	107.5	52%	0.519	51%	0.512	S	S	.	.	H	α-helix	trans	-60.8	-39.7	179.4	-81.4	-29	0	0	0	112.2	A61 L68 A69	A61-D65 PolarHBondContact O-N 3.5Å; D65-L68 PolarHBondContact O-N 2.97Å; D65-A69 WeakPolarHBondContact O-CB 3.38Å; D65-A69 PolarHBondContact O-N 3.42Å
66	E	79.1	Confident	60.9	Low	99 Å²	99	98.4 Å²	98.4	46%	0.463	48%	0.482	S	S	.	.	H	α-helix	trans	-69.3	-43	177.3	-161	-168.2	-179.3	0	0	112.1	M62 Y64 L68 A69 R70	M62-E66 VanDerWaalsContact O-CB 3.3Å; M62-E66 WeakPolarHBondContact O-CB 3.3Å; M62-E66 PolarHBondContact O-N 2.92Å; Y64-E66 VanDerWaalsContact C-N 3.33Å; Y64-E66 PolarHBondContact O-N 3.2Å; E66-L68 VanDerWaalsContact C-N 3.31Å; E66-L68 PolarHBondContact O-N 3.32Å; E66-A69 PolarHBondContact O-N 3.27Å; E66-R70 WeakPolarHBondContact O-CB 3.4Å; E66-R70 VanDerWaalsContact O-CG 3.27Å; E66-R70 WeakPolarHBondContact O-CG 3.4Å; E66-R70 PolarHBondContact O-N 2.7Å; E66-R70 IonicContact OE1-CZ 2.71Å; E66-R70 VanDerWaalsContact OE1-CZ 3.25Å; E66-R70 IonicContact OE1-NE 3.25Å; E66-R70 PolarHBondContact OE1-NE 3.18Å; E66-R70 VanDerWaalsContact OE1-NE 3.1Å; E66-R70 IonicContact OE1-NH2 3.8Å; E66-R70 PolarHBondContact OE1-NH2 3.38Å; E66-R70 IonicContact OE2-CZ 3.57Å; E66-R70 IonicContact OE2-NH2 3.73Å; E66-R70 PolarHBondContact OE2-NH2 3.06Å
67	K	74.7	Confident	61.8	Low	85 Å²	85	91.1 Å²	91.1	37%	0.37	45%	0.448	S	S	.	.	H	α-helix	trans	-57.7	-46.1	173.5	-76.5	166.6	-174.9	163.6	0	110.9	E63 Y64 R70 F71 Y360	E63-K67 WeakPolarHBondContact O-CB 3.43Å; E63-K67 WeakPolarHBondContact O-CD 3.23Å; E63-K67 WeakPolarHBondContact O-CG 3.33Å; E63-K67 PolarHBondContact O-N 3.11Å; E63-K67 WeakPolarHBondContact OE1-CE 3.49Å; E63-K67 IonicContact OE1-NZ 2.75Å; E63-K67 PolarHBondContact OE1-NZ 3.45Å; E63-K67 IonicContact OE2-NZ 3.22Å; Y64-K67 PolarHBondContact O-N 3.19Å; K67-R70 PolarHBondContact O-N 2.87Å; K67-F71 WeakPolarHBondContact O-CB 3.11Å; K67-F71 PolarHBondContact O-N 3.15Å; K67-Y360 HydrophobicContact CB-CD1 4.32Å
68	L	74.2	Confident	62.1	Low	6 Å²	6	92.4 Å²	92.4	3%	0.031	45%	0.451	C	S	.	.	H	α-helix	trans	-67.8	-37	179.9	-169.7	62.2	0	0	0	112.2	Y64 D65 E66 F71 R72 W324	Y64-L68 HydrophobicContact CE1-CD2 3.88Å; Y64-L68 WeakPolarHBondContact O-CB 3.48Å; Y64-L68 PolarHBondContact O-N 3.19Å; D65-L68 PolarHBondContact O-N 2.97Å; E66-L68 VanDerWaalsContact C-N 3.31Å; E66-L68 PolarHBondContact O-N 3.32Å; L68-F71 HydrophobicContact CD1-CD1 4.31Å; L68-F71 PolarHBondContact O-N 3.47Å; L68-R72 WeakPolarHBondContact O-CB 3.5Å; L68-R72 WeakPolarHBondContact O-CD 3.36Å; L68-R72 VanDerWaalsContact O-CG 3.25Å; L68-R72 WeakPolarHBondContact O-CG 3.29Å; L68-R72 PolarHBondContact O-N 3.49Å; L68-W324 HydrophobicContact CD1-CB 4.01Å; L68-W324 HydrophobicContact CD1-CG 4.35Å
69	A	74.8	Confident	62.5	Low	39 Å²	39	90.1 Å²	90.1	32%	0.322	45%	0.447	S	S	.	.	H	α-helix	trans	-66.2	-41.7	173.9	0	0	0	0	0	112.4	D65 E66 R72 Q73	D65-A69 WeakPolarHBondContact O-CB 3.38Å; D65-A69 PolarHBondContact O-N 3.42Å; E66-A69 PolarHBondContact O-N 3.27Å; A69-R72 PolarHBondContact O-N 3.35Å; A69-Q73 WeakPolarHBondContact O-CG 3.31Å; A69-Q73 PolarHBondContact O-N 3.12Å
70	R	75.4	Confident	62.7	Low	158 Å²	158	85.4 Å²	85.4	60%	0.596	44%	0.435	S	S	*	.	H	α-helix	trans	-63.9	-42.8	174.5	-69.6	169.5	-177.8	-168.1	5.6	111.3	E66 K67 Q73	E66-R70 WeakPolarHBondContact O-CB 3.4Å; E66-R70 VanDerWaalsContact O-CG 3.27Å; E66-R70 WeakPolarHBondContact O-CG 3.4Å; E66-R70 PolarHBondContact O-N 2.7Å; E66-R70 IonicContact OE1-CZ 2.71Å; E66-R70 VanDerWaalsContact OE1-CZ 3.25Å; E66-R70 IonicContact OE1-NE 3.25Å; E66-R70 PolarHBondContact OE1-NE 3.18Å; E66-R70 VanDerWaalsContact OE1-NE 3.1Å; E66-R70 IonicContact OE1-NH2 3.8Å; E66-R70 PolarHBondContact OE1-NH2 3.38Å; E66-R70 IonicContact OE2-CZ 3.57Å; E66-R70 IonicContact OE2-NH2 3.73Å; E66-R70 PolarHBondContact OE2-NH2 3.06Å; K67-R70 PolarHBondContact O-N 2.87Å; R70-Q73 PolarHBondContact O-N 3.1Å
71	F	75.2	Confident	62.3	Low	15 Å²	15	87.8 Å²	87.8	7%	0.066	44%	0.44	C	S	.	.	H	α-helix	trans	-59.6	-49.9	173.9	175.6	-105.8	0	0	0	111.8	K67 L68 Q73 A74 H322 L357 Y360	K67-F71 WeakPolarHBondContact O-CB 3.11Å; K67-F71 PolarHBondContact O-N 3.15Å; L68-F71 HydrophobicContact CD1-CD1 4.31Å; L68-F71 PolarHBondContact O-N 3.47Å; F71-Q73 PolarHBondContact O-N 3.05Å; F71-Q73 VanDerWaalsContact O-N 3.11Å; F71-A74 WeakPolarHBondContact O-CB 3.47Å; F71-A74 PolarHBondContact O-N 3.3Å; F71-H322 WeakPolarHBondContact CE1-O 3.32Å; F71-H322 WeakPolarHBondContact CZ-O 3.4Å; F71-L357 HydrophobicContact CE1-CD1 3.76Å; F71-L357 HydrophobicContact CZ-CD1 3.8Å; F71-Y360 HydrophobicContact CB-CG 4.46Å; F71-Y360 AromaticContact CD2-CD2 3.54Å; F71-Y360 HydrophobicContact CD2-CD2 3.54Å; F71-Y360 AromaticContact CD2-CE2 3.62Å; F71-Y360 HydrophobicContact CD2-CE2 3.62Å; F71-Y360 HydrophobicContact CD2-CG 4.25Å; F71-Y360 AromaticContact CE2-CD2 3.83Å; F71-Y360 HydrophobicContact CE2-CD2 3.83Å; F71-Y360 HydrophobicContact CE2-CE2 4.06Å; F71-Y360 HydrophobicContact CG-CD2 4.08Å; F71-Y360 HydrophobicContact CG-CE2 4.42Å; F71-Y360 HydrophobicContact CG-CG 4.35Å
72	R	75.9	Confident	61.4	Low	80 Å²	80	93.5 Å²	93.5	30%	0.302	45%	0.454	S	S	.	.	H	α-helix	trans	-54.6	-29.7	176.9	-81.8	165.1	173.9	165	-2.3	114.4	L68 A69 L76 N323 W324	L68-R72 WeakPolarHBondContact O-CB 3.5Å; L68-R72 WeakPolarHBondContact O-CD 3.36Å; L68-R72 VanDerWaalsContact O-CG 3.25Å; L68-R72 WeakPolarHBondContact O-CG 3.29Å; L68-R72 PolarHBondContact O-N 3.49Å; A69-R72 PolarHBondContact O-N 3.35Å; R72-L76 WeakPolarHBondContact O-CD2 3.5Å; R72-L76 WeakPolarHBondContact O-CG 3.27Å; R72-N323 HydrophobicContact CG-CB 4.37Å; R72-N323 WeakPolarHBondContact CG-O 3.48Å; R72-W324 PolarHBondContact NE-O 2.86Å; R72-W324 PolarHBondContact NH2-O 3.25Å
73	Q	67.8	Low	60.2	Low	132 Å²	132	91.8 Å²	91.8	62%	0.617	46%	0.458	S	S	*	.	H	α-helix	trans	-77.8	-20.3	-179.2	-71.8	170.3	25.6	0	0	113.7	A69 R70 F71	A69-Q73 WeakPolarHBondContact O-CG 3.31Å; A69-Q73 PolarHBondContact O-N 3.12Å; R70-Q73 PolarHBondContact O-N 3.1Å; F71-Q73 PolarHBondContact O-N 3.05Å; F71-Q73 VanDerWaalsContact O-N 3.11Å
74	A	60.8	Low	58.4	Low	69 Å²	69	89.9 Å²	89.9	57%	0.57	46%	0.464	S	S	*	.	H	α-helix	trans	-70.8	-32.3	-173.3	0	0	0	0	0	113.9	F71	F71-A74 WeakPolarHBondContact O-CB 3.47Å; F71-A74 PolarHBondContact O-N 3.3Å
75	H	54.7	Low	56.5	Low	96 Å²	96	92.9 Å²	92.9	44%	0.444	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	41.2	-179.4	-45.2	-70.9	0	0	0	112.4	I265 N323	H75-I265 HydrophobicContact CB-CD1 4.12Å; H75-I265 WeakPolarHBondContact O-CD1 3.33Å; H75-N323 WeakPolarHBondContact CB-OD1 3.4Å; H75-N323 PolarHBondContact O-ND2 3.01Å
76	L	52.8	Low	54.5	Low	62 Å²	62	100 Å²	100	33%	0.325	51%	0.511	S	S	.	.			trans	-78.8	128	163.9	-63.5	-179	0	0	0	110.2	R72	R72-L76 WeakPolarHBondContact O-CD2 3.5Å; R72-L76 WeakPolarHBondContact O-CG 3.27Å
77	N	48.1	Very low	52.1	Low	18 Å²	18	104.3 Å²	104.3	10%	0.096	53%	0.531	C	S	.	.			trans	-50.6	132.7	163.2	166.8	-46.3	0	0	0	109.2	F79 N80 E268	N77-F79 PolarHBondContact O-N 3.04Å; N77-F79 VanDerWaalsContact O-N 3.07Å; N77-F79 PolarHBondContact OD1-N 3.12Å; N77-N80 PolarHBondContact O-N 3.17Å; N77-E268 PolarHBondContact ND2-OE1 3.49Å
78	P	40.3	Very low	49.9	Very low	99 Å²	99	108.9 Å²	108.9	64%	0.643	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-52.7	-33.6	-172.8	-30.1	36.2	0	0	0	115.5	N80 K81	P78-N80 VanDerWaalsContact C-N 3.29Å; P78-N80 PolarHBondContact O-N 3.39Å; P78-K81 PolarHBondContact O-N 3.17Å
79	F	42.3	Very low	47.7	Very low	175 Å²	175	116.3 Å²	116.3	77%	0.768	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-77.9	-11.2	-179.5	-59.5	-71.5	0	0	0	113.7	N77	N77-F79 PolarHBondContact O-N 3.04Å; N77-F79 VanDerWaalsContact O-N 3.07Å; N77-F79 PolarHBondContact OD1-N 3.12Å
80	N	45.8	Very low	45.4	Very low	69 Å²	69	122.7 Å²	122.7	37%	0.369	61%	0.611	S	S	.	*	G	3₁₀ helix	trans	-90.3	3.5	173.5	-77.8	-84.2	0	0	0	113.5	N77 P78 Q82	N77-N80 PolarHBondContact O-N 3.17Å; P78-N80 VanDerWaalsContact C-N 3.29Å; P78-N80 PolarHBondContact O-N 3.39Å; N80-Q82 PolarHBondContact O-N 3.41Å; N80-Q82 VanDerWaalsContact O-N 3.17Å
81	K	41.5	Very low	43	Very low	153 Å²	153	118.7 Å²	118.7	67%	0.665	62%	0.62	S	S	*	*	S	Bend	trans	-68.8	110.8	168.6	-72.7	-173.4	175.4	-176.7	0	109.3	P78 S83	P78-K81 PolarHBondContact O-N 3.17Å; K81-S83 PolarHBondContact O-N 3.29Å
82	Q	36.8	Very low	41.2	Very low	190 Å²	190	124.6 Å²	124.6	89%	0.888	66%	0.659	S	S	*	*			trans	-55.2	128.1	175.4	-66.7	-177.8	0.3	0	0	110.1	N80 G84	N80-Q82 PolarHBondContact O-N 3.41Å; N80-Q82 VanDerWaalsContact O-N 3.17Å; Q82-G84 PolarHBondContact O-N 2.88Å
83	S	33.2	Very low	38.7	Very low	124 Å²	124	124.3 Å²	124.3	87%	0.867	68%	0.681	S	S	*	*			trans	-71.8	92	176.1	55.4	0	0	0	0	109.9	K81	K81-S83 PolarHBondContact O-N 3.29Å
84	G	31.2	Very low	36.8	Very low	54 Å²	54	127.5 Å²	127.5	56%	0.557	70%	0.696	S	S	*	*			trans	-60.9	166	174.3	0	0	0	0	0	112.8	Q82 R86	Q82-G84 PolarHBondContact O-N 2.88Å; G84-R86 PolarHBondContact O-N 2.76Å
85	P	30.5	Very low	35.2	Very low	130 Å²	130	133.7 Å²	133.7	84%	0.844	71%	0.713	S	S	*	*			trans	-59.7	128	-176.4	-21	32.6	0	0	0	111.4	Q87	P85-Q87 PolarHBondContact O-N 2.85Å
86	R	28.6	Very low	33.7	Very low	246 Å²	246	133.6 Å²	133.6	93%	0.928	73%	0.729	S	S	*	*			trans	-68.9	97	172.1	-76.2	-175.3	171.9	-168.9	-3	109.7	G84	G84-R86 PolarHBondContact O-N 2.76Å
87	Q	28.9	Very low	32.9	Very low	190 Å²	190	136.1 Å²	136.1	89%	0.888	75%	0.749	S	S	*	*			trans	-68.6	144.5	156	-67.2	-179	-11.3	0	0	108.5	P85	P85-Q87 PolarHBondContact O-N 2.85Å
88	H	28.7	Very low	31.7	Very low	182 Å²	182	142.3 Å²	142.3	84%	0.843	78%	0.782	S	S	*	*			trans	-136.2	117.1	-168.9	-166.8	80.1	0	0	0	109.1
89	E	29.1	Very low	31	Very low	162 Å²	162	145.3 Å²	145.3	76%	0.757	79%	0.791	S	S	*	*			trans	-119.4	119.1	177.3	-64.7	-163.8	91.3	0	0	110.2
90	Q	26.7	Very low	30.1	Very low	172 Å²	172	143.2 Å²	143.2	80%	0.804	79%	0.793	S	S	*	*			trans	44.4	117	140	-48.8	174.8	48.4	0	0	116.9
91	G	24.8	Very low	29.4	Very low	75 Å²	75	145.1 Å²	145.1	77%	0.773	81%	0.809	S	S	*	*			cis	110.6	169.9	45.2	0	0	0	0	0	109.3
92	P	36.5	Very low	28.7	Very low	138 Å²	138	146.6 Å²	146.6	90%	0.896	82%	0.818	S	S	*	*			cis	-131	-174.5	-10.2	43.2	-26.8	0	0	0	114.7
93	G	23.5	Very low	28.2	Very low	74 Å²	74	146.4 Å²	146.4	76%	0.763	82%	0.817	S	S	*	*			trans	94.2	148.1	168.5	0	0	0	0	0	115.5
94	E	28.2	Very low	27.8	Very low	200 Å²	200	144.2 Å²	144.2	94%	0.935	81%	0.806	S	S	*	*			cis	-128.8	-156.9	-0.8	-68.5	-177.2	110.4	0	0	111.3
95	E	26.2	Very low	27.6	Very low	199 Å²	199	149.4 Å²	149.4	93%	0.93	82%	0.821	S	S	*	*			trans	-93.8	179.4	-155.6	-60.8	-174.7	126.2	0	0	118
96	A	24.2	Very low	27.6	Very low	93 Å²	93	149.3 Å²	149.3	77%	0.769	82%	0.82	S	S	*	*			trans	-75.2	-176.7	-168.2	0	0	0	0	0	114.4
97	P	35.5	Very low	27.4	Very low	116 Å²	116	147 Å²	147	75%	0.753	82%	0.82	S	S	*	*			cis	-143.8	179.6	19.2	43.9	-22.9	0	0	0	120.1
98	D	23.9	Very low	27.5	Very low	147 Å²	147	145.7 Å²	145.7	79%	0.786	82%	0.818	S	S	*	*			trans	-8.6	150.2	166.8	-62.2	-57.7	0	0	0	123
99	I	25	Very low	27.7	Very low	163 Å²	163	142.8 Å²	142.8	84%	0.836	82%	0.816	S	S	*	*				-167.1	134.7	115.5	-94	150.7	0	0	0	110.9
100	T	23.8	Very low	28.3	Very low	131 Å²	131	141.3 Å²	141.3	80%	0.804	82%	0.82	S	S	*	*			trans	-131.1	155.5	158.9	54.1	0	0	0	0	109.2
101	P	31.8	Very low	28.2	Very low	108 Å²	108	137 Å²	137	70%	0.701	82%	0.821	S	S	*	*				-136.2	162.6	99.9	24.2	-2.6	0	0	0	111.7
102	E	26.5	Very low	28.3	Very low	184 Å²	184	142.4 Å²	142.4	86%	0.86	83%	0.826	S	S	*	*				62.2	106.6	58.2	-146.8	168.2	-146.9	0	0	111
103	E	26.4	Very low	28.4	Very low	187 Å²	187	141.1 Å²	141.1	87%	0.874	82%	0.818	S	S	*	*				-160.1	176.3	76	-92.2	-163.1	81.4	0	0	110
104	A	24.7	Very low	28.5	Very low	77 Å²	77	144.5 Å²	144.5	64%	0.636	81%	0.814	S	S	*	*			cis	-171.8	-167.9	-22.3	0	0	0	0	0	108.5
105	L	26.5	Very low	28.3	Very low	164 Å²	164	142.4 Å²	142.4	86%	0.859	80%	0.802	S	S	*	*			trans	-139.7	157.4	171.3	-86.2	171.6	0	0	0	111
106	P	30.7	Very low	28.1	Very low	128 Å²	128	142.3 Å²	142.3	83%	0.831	79%	0.793	S	S	*	*			trans	-131.5	167.4	145.6	15.2	7.1	0	0	0	114.3
107	E	23.1	Very low	28.1	Very low	197 Å²	197	143 Å²	143	92%	0.921	79%	0.791	S	S	*	*			trans	-107	-173.8	-162.6	-58.4	-172.6	110.9	0	0	116.4
108	L	31	Very low	28	Very low	163 Å²	163	142.6 Å²	142.6	85%	0.853	79%	0.789	S	S	*	*			trans	-70.8	179.8	175.7	-59.4	160.6	0	0	0	112.5
109	P	34.6	Very low	28.1	Very low	121 Å²	121	142.4 Å²	142.4	79%	0.786	78%	0.783	S	S	*	*				-149.1	-153.6	89.2	48.3	-29.1	0	0	0	112.6
110	P	41.8	Very low	28.2	Very low	131 Å²	131	143.7 Å²	143.7	85%	0.851	78%	0.777	S	S	*	*				-134.1	-172.6	-121.5	33.2	-6.9	0	0	0	116.7
111	G	24.5	Very low	28.2	Very low	80 Å²	80	143.8 Å²	143.8	83%	0.825	78%	0.777	S	S	*	*			trans	179.5	90.2	169.8	0	0	0	0	0	117.1
112	E	25.3	Very low	28.4	Very low	190 Å²	190	147.2 Å²	147.2	89%	0.888	79%	0.786	S	S	*	*			trans	-104.4	-175.5	163	-110.3	-174.4	-146.6	0	0	109.9
113	P	39.8	Very low	28.3	Very low	111 Å²	111	146.1 Å²	146.1	72%	0.721	79%	0.786	S	S	*	*			cis	-119.2	-150.2	6.8	40	-20.6	0	0	0	111.3
114	E	26.2	Very low	28.9	Very low	145 Å²	145	145.4 Å²	145.4	68%	0.678	79%	0.787	S	S	*	*			cis	-155.7	158.6	2.7	-136.4	-147.3	-153	0	0	105.4
115	F	23.3	Very low	28.9	Very low	155 Å²	155	145.3 Å²	145.3	68%	0.68	79%	0.794	S	S	*	*			cis	-155.7	-148.8	-5.9	-147.4	-10.9	0	0	0	105.9
116	R	22	Very low	29.4	Very low	197 Å²	197	146.4 Å²	146.4	74%	0.743	80%	0.8	S	S	*	*			cis	-158	173.4	1.5	-145.1	160.7	-135.8	-165.4	8.6	110
117	C	23.7	Very low	29.5	Very low	108 Å²	108	145.8 Å²	145.8	73%	0.73	80%	0.799	S	S	*	*			trans	-143	169.6	168.7	-153.1	0	0	0	0	109.3
118	P	33.9	Very low	30	Very low	108 Å²	108	145.1 Å²	145.1	70%	0.701	80%	0.796	S	S	*	*				-152.4	161.8	82.5	41.1	-23	0	0	0	117.3
119	E	25	Very low	30	Very low	142 Å²	142	143.5 Å²	143.5	66%	0.664	79%	0.788	S	S	*	*			trans	47.7	152.9	138.1	-66.4	-160.5	127	0	0	122
120	R	26.9	Very low	29.8	Very low	191 Å²	191	146 Å²	146	72%	0.721	79%	0.789	S	S	*	*			cis	-166.7	167.8	9.1	-129.9	178.8	-153.9	179.4	19.7	113.5
121	V	25.5	Very low	29.1	Very low	132 Å²	132	148.5 Å²	148.5	80%	0.8	79%	0.787	S	S	*	*			trans	70.7	152	152.2	172.6	0	0	0	0	118.6
122	M	34.8	Very low	29.7	Very low	180 Å²	180	150.4 Å²	150.4	89%	0.887	79%	0.787	S	S	*	*			trans	-104.2	155.1	178.5	-41.2	171	-166.1	0	0	110.9
123	D	25.5	Very low	29.9	Very low	161 Å²	161	151.7 Å²	151.7	86%	0.861	78%	0.784	S	S	*	*			trans	-154.4	163.9	142.9	-153.3	-2	0	0	0	111.7
124	L	37.8	Very low	29.6	Very low	172 Å²	172	151.9 Å²	151.9	90%	0.901	79%	0.785	S	S	*	*			trans	-107.2	116.3	177	-72.1	166.9	0	0	0	110.3
125	G	25.8	Very low	29.9	Very low	76 Å²	76	151.9 Å²	151.9	78%	0.784	80%	0.795	S	S	*	*			trans	-142.6	117.5	178.9	0	0	0	0	0	113.2
126	L	36.8	Very low	30.6	Very low	186 Å²	186	147.4 Å²	147.4	97%	0.974	79%	0.792	S	S	*	*			trans	-84.1	126.8	163.6	-72	169.8	0	0	0	109.1
127	S	32.3	Very low	31.4	Very low	116 Å²	116	145 Å²	145	81%	0.811	79%	0.793	S	S	*	*			trans	-139.9	126	160.7	61.8	0	0	0	0	109
128	E	33.3	Very low	32.4	Very low	183 Å²	183	145.8 Å²	145.8	86%	0.855	78%	0.784	S	S	*	*			trans	-79	-172.9	178	-62.1	-179.9	108	0	0	111.5
129	D	30.3	Very low	33	Very low	129 Å²	129	147.1 Å²	147.1	69%	0.69	79%	0.785	S	S	*	*			trans	60.7	101.3	169.8	-62.5	-32.3	0	0	0	118
130	H	30.7	Very low	34.2	Very low	174 Å²	174	140.6 Å²	140.6	81%	0.806	76%	0.755	S	S	*	*				-145.5	134.7	69.6	-111.3	86.5	0	0	0	115	S132	H130-S132 PolarHBondContact O-N 3.44Å
131	F	28.4	Very low	35.5	Very low	183 Å²	183	136.3 Å²	136.3	80%	0.803	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-57.9	122.6	157.1	-78.6	-103.7	0	0	0	109.9	R133	F131-R133 PolarHBondContact O-N 2.87Å; F131-R133 VanDerWaalsContact O-N 3.09Å
132	S	35.6	Very low	37.8	Very low	119 Å²	119	133 Å²	133	83%	0.832	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-58.3	116.2	165.4	-53.9	0	0	0	0	108.8	H130	H130-S132 PolarHBondContact O-N 3.44Å
133	R	31	Very low	39.8	Very low	217 Å²	217	126.4 Å²	126.4	82%	0.819	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-50.8	135.5	-175.9	-71.5	175.6	169.3	176.3	-4.7	110.9	F131 V135	F131-R133 PolarHBondContact O-N 2.87Å; F131-R133 VanDerWaalsContact O-N 3.09Å; R133-V135 PolarHBondContact O-N 3.35Å
134	P	33.3	Very low	42.3	Very low	115 Å²	115	126 Å²	126	75%	0.747	70%	0.695	S	S	*	*			trans	-65.5	104.7	175.5	26.7	-33.4	0	0	0	110	G136	P134-G136 PolarHBondContact O-N 2.89Å
135	V	32.4	Very low	44.2	Very low	146 Å²	146	121.7 Å²	121.7	89%	0.885	67%	0.67	S	S	*	*	S	Bend	trans	-72.2	99	179.7	-179.9	0	0	0	0	109.7	R133	R133-V135 PolarHBondContact O-N 3.35Å
136	G	38.6	Very low	46.8	Very low	60 Å²	60	118.1 Å²	118.1	62%	0.619	63%	0.633	S	S	*	*			trans	78.4	96	172.6	0	0	0	0	0	113.8	P134 F138	P134-G136 PolarHBondContact O-N 2.89Å; G136-F138 VanDerWaalsContact C-N 3.34Å; G136-F138 PolarHBondContact O-N 2.94Å
137	L	37.8	Very low	49	Very low	146 Å²	146	115.7 Å²	115.7	76%	0.764	61%	0.611	S	S	*	*			trans	-70.2	89	169.7	-161.4	84.2	0	0	0	109.6	L139	L137-L139 HydrophobicContact CD2-CD2 4.29Å; L137-L139 PolarHBondContact O-N 2.93Å
138	F	44.1	Very low	51.5	Low	125 Å²	125	115.6 Å²	115.6	55%	0.548	60%	0.598	S	S	.	*			trans	-75.3	93.7	-174.3	-143.4	-86	0	0	0	111.3	G136 A140 A149 K180	G136-F138 VanDerWaalsContact C-N 3.34Å; G136-F138 PolarHBondContact O-N 2.94Å; F138-A140 HydrophobicContact CD1-CB 3.79Å; F138-A140 HydrophobicContact CE1-CB 4.15Å; F138-A140 PolarHBondContact O-N 3.38Å; F138-A149 HydrophobicContact CE1-CB 3.94Å; F138-A149 HydrophobicContact CZ-CB 4.21Å; F138-K180 PolarHBondContact O-NZ 3.45Å
139	L	46.9	Very low	53.8	Low	137 Å²	137	107.2 Å²	107.2	72%	0.717	56%	0.56	S	S	*	*			trans	-72.4	46.2	174.9	-67.6	173.4	0	0	0	112.6	L137 S141	L137-L139 HydrophobicContact CD2-CD2 4.29Å; L137-L139 PolarHBondContact O-N 2.93Å; L139-S141 PolarHBondContact O-N 3.05Å; L139-S141 PolarHBondContact O-OG 2.84Å
140	A	51.2	Low	56.5	Low	4 Å²	4	101.7 Å²	101.7	3%	0.033	53%	0.53	C	S	.	.			trans	-69.8	114.3	159.3	0	0	0	0	0	108.1	F138 Q145 L146 K180	F138-A140 HydrophobicContact CD1-CB 3.79Å; F138-A140 HydrophobicContact CE1-CB 4.15Å; F138-A140 PolarHBondContact O-N 3.38Å; A140-Q145 VanDerWaalsContact CA-OE1 3.29Å; A140-Q145 HydrophobicContact CB-CB 3.94Å; A140-L146 HydrophobicContact CB-CD2 3.62Å; A140-L146 HydrophobicContact CB-CG 3.89Å; A140-K180 PolarHBondContact O-NZ 2.82Å
141	S	53.8	Low	59.2	Low	101 Å²	101	97.6 Å²	97.6	71%	0.706	51%	0.511	S	S	*	.			trans	-100.1	-10.9	-172.7	-62.7	0	0	0	0	113	L139	L139-S141 PolarHBondContact O-N 3.05Å; L139-S141 PolarHBondContact O-OG 2.84Å
142	D	72.9	Confident	62	Low	63 Å²	63	93.4 Å²	93.4	34%	0.337	49%	0.494	S	S	.	.	S	Bend	trans	-133.2	166.9	180	75.3	59.1	0	0	0	114.2	Q144 Q145 L146	D142-Q144 VanDerWaalsContact C-N 3.28Å; D142-Q144 PolarHBondContact O-N 3.2Å; D142-Q144 VanDerWaalsContact OD1-CA 3.31Å; D142-Q144 WeakPolarHBondContact OD1-CA 3.48Å; D142-Q144 VanDerWaalsContact OD1-CB 3.3Å; D142-Q144 WeakPolarHBondContact OD1-CB 3.42Å; D142-Q144 PolarHBondContact OD1-N 3.04Å; D142-Q145 PolarHBondContact OD1-N 2.66Å; D142-Q145 VanDerWaalsContact OD2-CG 3.3Å; D142-Q145 WeakPolarHBondContact OD2-CG 3.39Å; D142-Q145 PolarHBondContact OD2-NE2 3.05Å; D142-L146 PolarHBondContact O-N 3.38Å
143	V	76.7	Confident	64.4	Low	41 Å²	41	88 Å²	88	25%	0.248	46%	0.456	C	S	.	.	H	α-helix	trans	-72.2	-14.9	-175.7	165.4	0	0	0	0	113.4	R147 L181 L184	V143-R147 VanDerWaalsContact CG1-NH2 3.32Å; V143-R147 WeakPolarHBondContact O-CD 3.47Å; V143-R147 VanDerWaalsContact O-CG 3.25Å; V143-R147 WeakPolarHBondContact O-CG 3.5Å; V143-R147 PolarHBondContact O-NE 2.84Å; V143-L181 HydrophobicContact CB-CD1 4.46Å; V143-L181 HydrophobicContact CG1-CD1 3.9Å; V143-L184 HydrophobicContact CG2-CB 3.76Å; V143-L184 HydrophobicContact CG2-CD1 4.48Å
144	Q	77.9	Confident	67.1	Low	152 Å²	152	80.7 Å²	80.7	71%	0.71	43%	0.43	S	S	*	.	H	α-helix	trans	-90.1	-45.8	177.6	-175.5	168.7	-42.9	0	0	110.8	D142 L146 R147 Q148	D142-Q144 VanDerWaalsContact C-N 3.28Å; D142-Q144 PolarHBondContact O-N 3.2Å; D142-Q144 VanDerWaalsContact OD1-CA 3.31Å; D142-Q144 WeakPolarHBondContact OD1-CA 3.48Å; D142-Q144 VanDerWaalsContact OD1-CB 3.3Å; D142-Q144 WeakPolarHBondContact OD1-CB 3.42Å; D142-Q144 PolarHBondContact OD1-N 3.04Å; Q144-L146 VanDerWaalsContact C-N 3.28Å; Q144-L146 PolarHBondContact O-N 2.71Å; Q144-R147 WeakPolarHBondContact O-CB 3.31Å; Q144-R147 PolarHBondContact O-N 3.02Å; Q144-Q148 PolarHBondContact O-N 3.2Å
145	Q	79.1	Confident	69.7	Low	83 Å²	83	79.8 Å²	79.8	39%	0.388	42%	0.416	S	S	.	.	H	α-helix	trans	-54.1	-43.9	171.5	-69.1	171.8	6.9	0	0	111.6	A140 D142 R147 Q148 A149	A140-Q145 VanDerWaalsContact CA-OE1 3.29Å; A140-Q145 HydrophobicContact CB-CB 3.94Å; D142-Q145 PolarHBondContact OD1-N 2.66Å; D142-Q145 VanDerWaalsContact OD2-CG 3.3Å; D142-Q145 WeakPolarHBondContact OD2-CG 3.39Å; D142-Q145 PolarHBondContact OD2-NE2 3.05Å; Q145-R147 PolarHBondContact O-N 2.77Å; Q145-Q148 PolarHBondContact O-N 2.8Å; Q145-A149 WeakPolarHBondContact O-CB 3.34Å; Q145-A149 PolarHBondContact O-N 3.35Å
146	L	79.4	Confident	72.2	Confident	1 Å²	1	75.5 Å²	75.5	1%	0.005	39%	0.39	C	S	.	.	H	α-helix	trans	-65.6	-34.3	176.3	-73.1	173.2	0	0	0	113.6	A140 D142 Q144 I150 L177 K180 L181 L184	A140-L146 HydrophobicContact CB-CD2 3.62Å; A140-L146 HydrophobicContact CB-CG 3.89Å; D142-L146 PolarHBondContact O-N 3.38Å; Q144-L146 VanDerWaalsContact C-N 3.28Å; Q144-L146 PolarHBondContact O-N 2.71Å; L146-I150 WeakPolarHBondContact O-CB 3.32Å; L146-I150 WeakPolarHBondContact O-CD1 3.45Å; L146-I150 WeakPolarHBondContact O-CG1 3.48Å; L146-I150 PolarHBondContact O-N 3.1Å; L146-I150 VanDerWaalsContact O-N 3.09Å; L146-L177 HydrophobicContact CD2-CD2 4.05Å; L146-K180 HydrophobicContact CD1-CB 4.33Å; L146-K180 HydrophobicContact CD1-CD 4.33Å; L146-K180 HydrophobicContact CD1-CG 3.95Å; L146-K180 HydrophobicContact CD2-CB 4.4Å; L146-K180 HydrophobicContact CD2-CD 4Å; L146-K180 HydrophobicContact CD2-CG 4.31Å; L146-L181 HydrophobicContact CB-CB 4.22Å; L146-L181 HydrophobicContact CB-CD1 4.12Å; L146-L181 HydrophobicContact CD1-CB 4.45Å; L146-L184 HydrophobicContact CD1-CD1 3.75Å; L146-L184 HydrophobicContact CD1-CG 4.49Å
147	R	82.6	Confident	74.5	Confident	134 Å²	134	73.9 Å²	73.9	51%	0.506	37%	0.367	S	S	.	.	H	α-helix	trans	-67.7	-42.1	174.8	-71.1	170.6	-155.6	-157.4	6.8	111.3	V143 Q144 Q145 I150 E151 L181	V143-R147 VanDerWaalsContact CG1-NH2 3.32Å; V143-R147 WeakPolarHBondContact O-CD 3.47Å; V143-R147 VanDerWaalsContact O-CG 3.25Å; V143-R147 WeakPolarHBondContact O-CG 3.5Å; V143-R147 PolarHBondContact O-NE 2.84Å; Q144-R147 WeakPolarHBondContact O-CB 3.31Å; Q144-R147 PolarHBondContact O-N 3.02Å; Q145-R147 PolarHBondContact O-N 2.77Å; R147-I150 WeakPolarHBondContact O-CB 3.19Å; R147-I150 PolarHBondContact O-N 2.81Å; R147-E151 PolarHBondContact O-N 3.23Å; R147-L181 HydrophobicContact CG-CD1 4.08Å; R147-L181 HydrophobicContact CG-CD2 3.72Å
148	Q	85.4	Confident	76.8	Confident	115 Å²	115	73.4 Å²	73.4	54%	0.537	36%	0.364	S	S	.	.	H	α-helix	trans	-63.1	-50.1	177.1	177.1	171.9	-14.8	0	0	111.3	Q144 Q145 I150 E151 E152	Q144-Q148 PolarHBondContact O-N 3.2Å; Q145-Q148 PolarHBondContact O-N 2.8Å; Q148-I150 PolarHBondContact O-N 2.64Å; Q148-E151 PolarHBondContact O-N 3.46Å; Q148-E152 HydrophobicContact CG-CG 4.38Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.49Å; Q148-E152 PolarHBondContact NE2-OE1 3.48Å; Q148-E152 WeakPolarHBondContact O-CG 3.28Å; Q148-E152 PolarHBondContact O-N 2.91Å
149	A	82.5	Confident	78.7	Confident	6 Å²	6	74.7 Å²	74.7	5%	0.05	37%	0.372	C	S	.	.	H	α-helix	trans	-60.7	-31.9	177.7	0	0	0	0	0	113	F138 Q145 C153 L177	F138-A149 HydrophobicContact CE1-CB 3.94Å; F138-A149 HydrophobicContact CZ-CB 4.21Å; Q145-A149 WeakPolarHBondContact O-CB 3.34Å; Q145-A149 PolarHBondContact O-N 3.35Å; A149-C153 WeakPolarHBondContact O-CB 3.39Å; A149-C153 PolarHBondContact O-N 2.67Å; A149-L177 HydrophobicContact CB-CD1 4.15Å; A149-L177 HydrophobicContact CB-CD2 4.17Å
150	I	86.5	Confident	80.6	Confident	13 Å²	13	70.2 Å²	70.2	7%	0.067	35%	0.349	C	S	.	.	H	α-helix	trans	-64.3	-39.5	171.3	-77.2	166.4	0	0	0	111.6	L146 R147 Q148 K154 L174 L177 R178 L181	L146-I150 WeakPolarHBondContact O-CB 3.32Å; L146-I150 WeakPolarHBondContact O-CD1 3.45Å; L146-I150 WeakPolarHBondContact O-CG1 3.48Å; L146-I150 PolarHBondContact O-N 3.1Å; L146-I150 VanDerWaalsContact O-N 3.09Å; R147-I150 WeakPolarHBondContact O-CB 3.19Å; R147-I150 PolarHBondContact O-N 2.81Å; Q148-I150 PolarHBondContact O-N 2.64Å; I150-K154 WeakPolarHBondContact O-CG 3.42Å; I150-K154 PolarHBondContact O-N 2.95Å; I150-K154 VanDerWaalsContact O-N 3.17Å; I150-L174 HydrophobicContact CB-CD1 4.38Å; I150-L174 HydrophobicContact CG2-CD1 3.87Å; I150-L174 WeakPolarHBondContact O-CD1 3.38Å; I150-L177 HydrophobicContact CD1-CB 4.39Å; I150-L177 HydrophobicContact CG1-CB 3.62Å; I150-R178 HydrophobicContact CD1-CB 4.48Å; I150-R178 HydrophobicContact CD1-CG 3.9Å; I150-R178 HydrophobicContact CG1-CG 4.21Å; I150-R178 HydrophobicContact CG2-CG 4.44Å; I150-L181 HydrophobicContact CD1-CB 3.93Å; I150-L181 HydrophobicContact CD1-CD2 3.45Å; I150-L181 VanDerWaalsContact CD1-CD2 3.45Å; I150-L181 HydrophobicContact CD1-CG 4.32Å
151	E	87.5	Confident	82	Confident	88 Å²	88	74.3 Å²	74.3	41%	0.411	38%	0.375	S	S	.	.	H	α-helix	trans	-73.7	-47.1	-178.4	-149.2	62.9	-138.3	0	0	111.6	R147 Q148 C153 K154 Q155	R147-E151 PolarHBondContact O-N 3.23Å; Q148-E151 PolarHBondContact O-N 3.46Å; E151-C153 VanDerWaalsContact C-N 3.25Å; E151-C153 PolarHBondContact O-N 2.97Å; E151-K154 WeakPolarHBondContact O-CB 3.32Å; E151-K154 PolarHBondContact O-N 3.28Å; E151-K154 WeakPolarHBondContact OE1-CD 3.48Å; E151-K154 IonicContact OE1-NZ 3.45Å; E151-K154 PolarHBondContact OE1-NZ 2.91Å; E151-K154 IonicContact OE2-NZ 3.89Å; E151-K154 PolarHBondContact OE2-NZ 2.87Å; E151-Q155 PolarHBondContact O-N 3.36Å; E151-Q155 VanDerWaalsContact O-N 3.17Å
152	E	86.2	Confident	83	Confident	96 Å²	96	77.6 Å²	77.6	45%	0.449	38%	0.379	S	S	.	.	H	α-helix	trans	-55.1	-43.1	172.2	-67.6	166.7	176.4	0	0	110.9	Q148 K154 Q155 V156	Q148-E152 HydrophobicContact CG-CG 4.38Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.49Å; Q148-E152 PolarHBondContact NE2-OE1 3.48Å; Q148-E152 WeakPolarHBondContact O-CG 3.28Å; Q148-E152 PolarHBondContact O-N 2.91Å; E152-K154 VanDerWaalsContact C-N 3.3Å; E152-K154 PolarHBondContact O-N 3.06Å; E152-Q155 PolarHBondContact O-N 3.06Å; E152-V156 WeakPolarHBondContact O-CG2 3.45Å; E152-V156 PolarHBondContact O-N 3.22Å
153	C	86.6	Confident	82.9	Confident	4 Å²	4	82.4 Å²	82.4	3%	0.027	40%	0.4	C	S	.	.	H	α-helix	trans	-69.5	-22	178.1	-164.5	0	0	0	0	113.9	A149 E151 I157 A170 R173 L174 L177	A149-C153 WeakPolarHBondContact O-CB 3.39Å; A149-C153 PolarHBondContact O-N 2.67Å; E151-C153 VanDerWaalsContact C-N 3.25Å; E151-C153 PolarHBondContact O-N 2.97Å; C153-I157 WeakPolarHBondContact O-CD1 3.48Å; C153-I157 VanDerWaalsContact O-CG1 3.27Å; C153-I157 WeakPolarHBondContact O-CG1 3.27Å; C153-A170 PolarHBondContact SG-O 3.29Å; C153-A170 VanDerWaalsContact SG-O 3.33Å; C153-R173 PolarHBondContact SG-NE 3.34Å; C153-R173 PolarHBondContact SG-NH2 3.38Å; C153-L174 HydrophobicContact CB-CD1 4.4Å; C153-L177 HydrophobicContact CB-CD1 4.03Å
154	K	86.9	Confident	83.2	Confident	64 Å²	64	82.1 Å²	82.1	28%	0.278	40%	0.399	S	S	.	.	H	α-helix	trans	-73.3	-46	169.3	-69.7	162.6	177.4	172.5	0	111.4	I150 E151 E152 V156 I157 L158 L174	I150-K154 WeakPolarHBondContact O-CG 3.42Å; I150-K154 PolarHBondContact O-N 2.95Å; I150-K154 VanDerWaalsContact O-N 3.17Å; E151-K154 WeakPolarHBondContact O-CB 3.32Å; E151-K154 PolarHBondContact O-N 3.28Å; E151-K154 WeakPolarHBondContact OE1-CD 3.48Å; E151-K154 IonicContact OE1-NZ 3.45Å; E151-K154 PolarHBondContact OE1-NZ 2.91Å; E151-K154 IonicContact OE2-NZ 3.89Å; E151-K154 PolarHBondContact OE2-NZ 2.87Å; E152-K154 VanDerWaalsContact C-N 3.3Å; E152-K154 PolarHBondContact O-N 3.06Å; K154-V156 VanDerWaalsContact C-N 3.29Å; K154-V156 PolarHBondContact O-N 3.31Å; K154-I157 WeakPolarHBondContact O-CB 3.07Å; K154-I157 PolarHBondContact O-N 3.43Å; K154-L158 PolarHBondContact O-N 3.37Å; K154-L174 HydrophobicContact CG-CD1 4.16Å; K154-L174 HydrophobicContact CG-CD2 4.11Å
155	Q	88.2	Confident	83	Confident	97 Å²	97	80.7 Å²	80.7	45%	0.453	39%	0.393	S	S	.	.	H	α-helix	trans	-59.5	-44.5	-177.3	-60.4	-61	-6.4	0	0	110.5	E151 E152 I157 L158 E159	E151-Q155 PolarHBondContact O-N 3.36Å; E151-Q155 VanDerWaalsContact O-N 3.17Å; E152-Q155 PolarHBondContact O-N 3.06Å; Q155-I157 PolarHBondContact O-N 3.11Å; Q155-I157 VanDerWaalsContact O-N 3.17Å; Q155-L158 WeakPolarHBondContact O-CB 3.45Å; Q155-L158 PolarHBondContact O-N 2.93Å; Q155-E159 WeakPolarHBondContact O-CG 3.03Å; Q155-E159 PolarHBondContact O-N 2.85Å
156	V	85.6	Confident	82.9	Confident	56 Å²	56	84 Å²	84	34%	0.339	41%	0.406	S	S	.	.	H	α-helix	trans	-59	-28.5	174.3	174	0	0	0	0	113.3	E152 K154 L160 A170	E152-V156 WeakPolarHBondContact O-CG2 3.45Å; E152-V156 PolarHBondContact O-N 3.22Å; K154-V156 VanDerWaalsContact C-N 3.29Å; K154-V156 PolarHBondContact O-N 3.31Å; V156-L160 HydrophobicContact CG1-CD1 3.94Å; V156-L160 WeakPolarHBondContact O-CB 3.36Å; V156-L160 VanDerWaalsContact O-CD1 3.24Å; V156-L160 WeakPolarHBondContact O-CD1 3.37Å; V156-L160 WeakPolarHBondContact O-CG 3.18Å; V156-L160 PolarHBondContact O-N 3.24Å; V156-A170 HydrophobicContact CG1-CB 4.49Å
157	I	87.1	Confident	83	Confident	25 Å²	25	85.7 Å²	85.7	13%	0.128	41%	0.414	C	S	.	.	H	α-helix	trans	-74.3	-33.9	175.3	-68	160.6	0	0	0	111.5	C153 K154 Q155 Q167 A170 V171 L174	C153-I157 WeakPolarHBondContact O-CD1 3.48Å; C153-I157 VanDerWaalsContact O-CG1 3.27Å; C153-I157 WeakPolarHBondContact O-CG1 3.27Å; K154-I157 WeakPolarHBondContact O-CB 3.07Å; K154-I157 PolarHBondContact O-N 3.43Å; Q155-I157 PolarHBondContact O-N 3.11Å; Q155-I157 VanDerWaalsContact O-N 3.17Å; I157-Q167 HydrophobicContact CG2-CG 4.03Å; I157-Q167 PolarHBondContact O-NE2 3.49Å; I157-Q167 VanDerWaalsContact O-NE2 3.12Å; I157-A170 HydrophobicContact CD1-CB 4.34Å; I157-A170 HydrophobicContact CG1-CB 3.54Å; I157-V171 HydrophobicContact CD1-CB 4.48Å; I157-V171 HydrophobicContact CD1-CG2 3.84Å; I157-V171 HydrophobicContact CG1-CG2 4.16Å; I157-V171 HydrophobicContact CG2-CG2 4.03Å; I157-L174 HydrophobicContact CD1-CB 4Å; I157-L174 HydrophobicContact CD1-CD2 3.61Å; I157-L174 HydrophobicContact CD1-CG 4.43Å
158	L	85.4	Confident	82.7	Confident	136 Å²	136	83.9 Å²	83.9	71%	0.712	41%	0.41	S	S	*	.	H	α-helix	trans	-76.5	-30.1	178.9	-62.4	172.5	0	0	0	112.5	K154 Q155	K154-L158 PolarHBondContact O-N 3.37Å; Q155-L158 WeakPolarHBondContact O-CB 3.45Å; Q155-L158 PolarHBondContact O-N 2.93Å
159	E	85	Confident	82.4	Confident	152 Å²	152	83.4 Å²	83.4	71%	0.71	41%	0.411	S	S	*	.	H	α-helix	trans	-80.5	-15.9	176.5	-68.5	174.3	174.2	0	0	113.6	Q155	Q155-E159 WeakPolarHBondContact O-CG 3.03Å; Q155-E159 PolarHBondContact O-N 2.85Å
160	L	86.6	Confident	82.2	Confident	43 Å²	43	83.2 Å²	83.2	23%	0.225	41%	0.409	C	S	.	.	S	Bend	trans	-89.6	141.2	-177.8	-79.3	170	0	0	0	112.4	V156 E162 K166 Q167 A170	V156-L160 HydrophobicContact CG1-CD1 3.94Å; V156-L160 WeakPolarHBondContact O-CB 3.36Å; V156-L160 VanDerWaalsContact O-CD1 3.24Å; V156-L160 WeakPolarHBondContact O-CD1 3.37Å; V156-L160 WeakPolarHBondContact O-CG 3.18Å; V156-L160 PolarHBondContact O-N 3.24Å; L160-E162 PolarHBondContact O-N 3.22Å; L160-K166 HydrophobicContact CD1-CB 4.12Å; L160-K166 HydrophobicContact CD2-CB 4.13Å; L160-Q167 HydrophobicContact CB-CB 4.09Å; L160-Q167 HydrophobicContact CB-CG 4.28Å; L160-Q167 PolarHBondContact O-NE2 2.82Å; L160-Q167 VanDerWaalsContact O-NE2 3.16Å; L160-A170 HydrophobicContact CD1-CB 4.29Å
161	P	80.3	Confident	81.9	Confident	91 Å²	91	85.4 Å²	85.4	59%	0.591	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-56.8	137.8	176.3	-25.4	34.4	0	0	0	112.9	S164	P161-S164 VanDerWaalsContact O-CB 3.31Å; P161-S164 WeakPolarHBondContact O-CB 3.41Å; P161-S164 PolarHBondContact O-N 3.1Å; P161-S164 PolarHBondContact O-OG 3.13Å
162	E	74.2	Confident	81.3	Confident	170 Å²	170	84.6 Å²	84.6	79%	0.794	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	141.5	-178.7	-63.7	-167	154.6	0	0	112.5	L160 S164	L160-E162 PolarHBondContact O-N 3.22Å; E162-S164 PolarHBondContact O-N 3.47Å
163	Q	70.8	Confident	80.9	Confident	164 Å²	164	85.2 Å²	85.2	77%	0.766	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	-1.4	-179	-49	-171.8	13.8	0	0	116.3	K168	Q163-K168 WeakPolarHBondContact O-CE 3.5Å
164	S	82.8	Confident	80.7	Confident	34 Å²	34	85.8 Å²	85.8	24%	0.238	43%	0.425	C	S	.	.			trans	-63.6	144.6	175.5	67.9	0	0	0	0	112.2	P161 E162 K166 Q167 K168	P161-S164 VanDerWaalsContact O-CB 3.31Å; P161-S164 WeakPolarHBondContact O-CB 3.41Å; P161-S164 PolarHBondContact O-N 3.1Å; P161-S164 PolarHBondContact O-OG 3.13Å; E162-S164 PolarHBondContact O-N 3.47Å; S164-K166 PolarHBondContact O-N 2.84Å; S164-Q167 WeakPolarHBondContact O-CA 3.25Å; S164-Q167 WeakPolarHBondContact O-CB 3.39Å; S164-Q167 PolarHBondContact O-N 2.93Å; S164-Q167 PolarHBondContact OG-N 3.45Å; S164-K168 PolarHBondContact O-N 3.33Å
165	E	74.1	Confident	79.9	Confident	122 Å²	122	86.9 Å²	86.9	57%	0.57	43%	0.433	S	S	*	.	H	α-helix	trans	-55.2	-38.1	179	-61.6	-50.8	130.2	0	0	112.2	Q167 K168 D169	E165-Q167 VanDerWaalsContact C-N 3.26Å; E165-Q167 PolarHBondContact O-N 3.02Å; E165-K168 WeakPolarHBondContact O-CA 3.38Å; E165-K168 WeakPolarHBondContact O-CB 3.3Å; E165-K168 PolarHBondContact O-N 3.44Å; E165-K168 IonicContact OE1-NZ 2.74Å; E165-K168 PolarHBondContact OE1-NZ 2.77Å; E165-K168 WeakPolarHBondContact OE2-CD 3.19Å; E165-K168 IonicContact OE2-NZ 3.67Å; E165-K168 PolarHBondContact OE2-NZ 3.1Å; E165-D169 PolarHBondContact O-N 2.98Å
166	K	76.6	Confident	79.1	Confident	153 Å²	153	88 Å²	88	67%	0.665	44%	0.437	S	S	*	.	H	α-helix	trans	-60.3	-34.3	175.6	-64.7	-179.6	179.6	177.9	0	112.8	L160 S164 A170	L160-K166 HydrophobicContact CD1-CB 4.12Å; L160-K166 HydrophobicContact CD2-CB 4.13Å; S164-K166 PolarHBondContact O-N 2.84Å; K166-A170 WeakPolarHBondContact O-CB 3.29Å; K166-A170 PolarHBondContact O-N 3.33Å; K166-A170 VanDerWaalsContact O-N 3.08Å
167	Q	83	Confident	78.8	Confident	36 Å²	36	86.1 Å²	86.1	17%	0.168	43%	0.426	C	S	.	.	H	α-helix	trans	-70.4	-40.3	174.8	-165.9	-174.6	57.2	0	0	110.6	I157 L160 S164 E165 A170 V171	I157-Q167 HydrophobicContact CG2-CG 4.03Å; I157-Q167 PolarHBondContact O-NE2 3.49Å; I157-Q167 VanDerWaalsContact O-NE2 3.12Å; L160-Q167 HydrophobicContact CB-CB 4.09Å; L160-Q167 HydrophobicContact CB-CG 4.28Å; L160-Q167 PolarHBondContact O-NE2 2.82Å; L160-Q167 VanDerWaalsContact O-NE2 3.16Å; S164-Q167 WeakPolarHBondContact O-CA 3.25Å; S164-Q167 WeakPolarHBondContact O-CB 3.39Å; S164-Q167 PolarHBondContact O-N 2.93Å; S164-Q167 PolarHBondContact OG-N 3.45Å; E165-Q167 VanDerWaalsContact C-N 3.26Å; E165-Q167 PolarHBondContact O-N 3.02Å; Q167-A170 PolarHBondContact O-N 3.1Å; Q167-V171 WeakPolarHBondContact O-CG2 3.37Å; Q167-V171 PolarHBondContact O-N 2.78Å
168	K	76.4	Confident	78.3	Confident	97 Å²	97	91 Å²	91	42%	0.422	44%	0.442	S	S	.	.	H	α-helix	trans	-62	-46.7	174.8	-57.5	175.4	-166.4	167	0	111.4	Q163 S164 E165 A170 V171 V172	Q163-K168 WeakPolarHBondContact O-CE 3.5Å; S164-K168 PolarHBondContact O-N 3.33Å; E165-K168 WeakPolarHBondContact O-CA 3.38Å; E165-K168 WeakPolarHBondContact O-CB 3.3Å; E165-K168 PolarHBondContact O-N 3.44Å; E165-K168 IonicContact OE1-NZ 2.74Å; E165-K168 PolarHBondContact OE1-NZ 2.77Å; E165-K168 WeakPolarHBondContact OE2-CD 3.19Å; E165-K168 IonicContact OE2-NZ 3.67Å; E165-K168 PolarHBondContact OE2-NZ 3.1Å; K168-A170 VanDerWaalsContact C-N 3.33Å; K168-A170 PolarHBondContact O-N 2.94Å; K168-V171 WeakPolarHBondContact O-CB 3.28Å; K168-V171 PolarHBondContact O-N 2.67Å; K168-V171 VanDerWaalsContact O-N 3.16Å; K168-V172 WeakPolarHBondContact O-CG2 3.46Å; K168-V172 PolarHBondContact O-N 3.07Å
169	D	77.3	Confident	77.3	Confident	105 Å²	105	88.1 Å²	88.1	56%	0.561	43%	0.427	S	S	*	.	H	α-helix	trans	-57.8	-43.5	174.7	-74.7	-27.7	0	0	0	112.1	E165 V172 R173	E165-D169 PolarHBondContact O-N 2.98Å; D169-V172 PolarHBondContact O-N 2.88Å; D169-R173 WeakPolarHBondContact O-CB 3Å; D169-R173 PolarHBondContact O-N 2.97Å
170	A	79.9	Confident	76.7	Confident	1 Å²	1	84.2 Å²	84.2	1%	0.008	41%	0.408	C	S	.	.	H	α-helix	trans	-65.7	-37.6	177.1	0	0	0	0	0	112.1	C153 V156 I157 L160 K166 Q167 K168 R173 L174	C153-A170 PolarHBondContact SG-O 3.29Å; C153-A170 VanDerWaalsContact SG-O 3.33Å; V156-A170 HydrophobicContact CG1-CB 4.49Å; I157-A170 HydrophobicContact CD1-CB 4.34Å; I157-A170 HydrophobicContact CG1-CB 3.54Å; L160-A170 HydrophobicContact CD1-CB 4.29Å; K166-A170 WeakPolarHBondContact O-CB 3.29Å; K166-A170 PolarHBondContact O-N 3.33Å; K166-A170 VanDerWaalsContact O-N 3.08Å; Q167-A170 PolarHBondContact O-N 3.1Å; K168-A170 VanDerWaalsContact C-N 3.33Å; K168-A170 PolarHBondContact O-N 2.94Å; A170-R173 PolarHBondContact O-N 2.97Å; A170-L174 WeakPolarHBondContact O-CB 3.36Å; A170-L174 PolarHBondContact O-N 3.25Å
171	V	79.9	Confident	76.3	Confident	60 Å²	60	83.1 Å²	83.1	36%	0.364	40%	0.402	S	S	.	.	H	α-helix	trans	-64	-43.4	172.5	169.8	0	0	0	0	111.6	I157 Q167 K168 R173 L174 I175	I157-V171 HydrophobicContact CD1-CB 4.48Å; I157-V171 HydrophobicContact CD1-CG2 3.84Å; I157-V171 HydrophobicContact CG1-CG2 4.16Å; I157-V171 HydrophobicContact CG2-CG2 4.03Å; Q167-V171 WeakPolarHBondContact O-CG2 3.37Å; Q167-V171 PolarHBondContact O-N 2.78Å; K168-V171 WeakPolarHBondContact O-CB 3.28Å; K168-V171 PolarHBondContact O-N 2.67Å; K168-V171 VanDerWaalsContact O-N 3.16Å; V171-R173 PolarHBondContact O-N 3.42Å; V171-L174 WeakPolarHBondContact O-CB 3.36Å; V171-L174 PolarHBondContact O-N 3.46Å; V171-I175 HydrophobicContact CG1-CD1 4.18Å; V171-I175 WeakPolarHBondContact O-CG1 3.21Å; V171-I175 PolarHBondContact O-N 3.08Å
172	V	74.1	Confident	75.8	Confident	71 Å²	71	85.4 Å²	85.4	43%	0.43	41%	0.405	S	S	.	.	H	α-helix	trans	-61.4	-43.9	175	172.4	0	0	0	0	110.9	K168 D169 L174 I175 H176	K168-V172 WeakPolarHBondContact O-CG2 3.46Å; K168-V172 PolarHBondContact O-N 3.07Å; D169-V172 PolarHBondContact O-N 2.88Å; V172-L174 PolarHBondContact O-N 2.61Å; V172-I175 WeakPolarHBondContact O-CB 3.47Å; V172-I175 PolarHBondContact O-N 3.08Å; V172-H176 PolarHBondContact O-N 2.9Å
173	R	78.6	Confident	75.4	Confident	108 Å²	108	84 Å²	84	41%	0.408	40%	0.398	S	S	.	.	H	α-helix	trans	-61.1	-41.6	175.4	-170.8	177.3	66.6	-123.6	-0.3	112.2	C153 D169 A170 V171 I175 H176 L177	C153-R173 PolarHBondContact SG-NE 3.34Å; C153-R173 PolarHBondContact SG-NH2 3.38Å; D169-R173 WeakPolarHBondContact O-CB 3Å; D169-R173 PolarHBondContact O-N 2.97Å; A170-R173 PolarHBondContact O-N 2.97Å; V171-R173 PolarHBondContact O-N 3.42Å; R173-I175 VanDerWaalsContact C-N 3.31Å; R173-I175 PolarHBondContact O-N 2.94Å; R173-H176 PolarHBondContact O-N 3.07Å; R173-L177 HydrophobicContact CG-CD1 4.24Å; R173-L177 WeakPolarHBondContact O-CG 3.33Å; R173-L177 PolarHBondContact O-N 3.09Å
174	L	81.3	Confident	75.1	Confident	16 Å²	16	80.3 Å²	80.3	8%	0.084	38%	0.384	C	S	.	.	H	α-helix	trans	-61.8	-37.2	175	177.8	62.1	0	0	0	112.2	I150 C153 K154 I157 A170 V171 V172 R178	I150-L174 HydrophobicContact CB-CD1 4.38Å; I150-L174 HydrophobicContact CG2-CD1 3.87Å; I150-L174 WeakPolarHBondContact O-CD1 3.38Å; C153-L174 HydrophobicContact CB-CD1 4.4Å; K154-L174 HydrophobicContact CG-CD1 4.16Å; K154-L174 HydrophobicContact CG-CD2 4.11Å; I157-L174 HydrophobicContact CD1-CB 4Å; I157-L174 HydrophobicContact CD1-CD2 3.61Å; I157-L174 HydrophobicContact CD1-CG 4.43Å; A170-L174 WeakPolarHBondContact O-CB 3.36Å; A170-L174 PolarHBondContact O-N 3.25Å; V171-L174 WeakPolarHBondContact O-CB 3.36Å; V171-L174 PolarHBondContact O-N 3.46Å; V172-L174 PolarHBondContact O-N 2.61Å; L174-R178 HydrophobicContact CD1-CG 4.47Å; L174-R178 WeakPolarHBondContact O-CB 3.33Å; L174-R178 VanDerWaalsContact O-CG 3.28Å; L174-R178 WeakPolarHBondContact O-CG 3.49Å; L174-R178 PolarHBondContact O-N 3.03Å; L174-R178 VanDerWaalsContact O-N 3.11Å
175	I	71.2	Confident	74.3	Confident	88 Å²	88	84.3 Å²	84.3	45%	0.451	40%	0.397	S	S	.	.	H	α-helix	trans	-65.3	-49.1	175	-67.7	163.8	0	0	0	110.4	V171 V172 R173 L177 R178 L179	V171-I175 HydrophobicContact CG1-CD1 4.18Å; V171-I175 WeakPolarHBondContact O-CG1 3.21Å; V171-I175 PolarHBondContact O-N 3.08Å; V172-I175 WeakPolarHBondContact O-CB 3.47Å; V172-I175 PolarHBondContact O-N 3.08Å; R173-I175 VanDerWaalsContact C-N 3.31Å; R173-I175 PolarHBondContact O-N 2.94Å; I175-L177 PolarHBondContact O-N 3.44Å; I175-R178 PolarHBondContact O-N 2.85Å; I175-L179 HydrophobicContact CG2-CD1 3.95Å; I175-L179 HydrophobicContact CG2-CG 4.46Å; I175-L179 WeakPolarHBondContact O-CG 3.23Å; I175-L179 PolarHBondContact O-N 2.91Å
176	H	71.9	Confident	73.4	Confident	119 Å²	119	82.1 Å²	82.1	55%	0.551	39%	0.389	S	S	*	.	H	α-helix	trans	-59.7	-42.5	178	-68.2	162.3	0	0	0	113	V172 R173 R178 L179 K180	V172-H176 PolarHBondContact O-N 2.9Å; R173-H176 PolarHBondContact O-N 3.07Å; H176-R178 PolarHBondContact O-N 3.33Å; H176-L179 PolarHBondContact O-N 3.11Å; H176-K180 PolarHBondContact O-N 3.45Å
177	L	78.4	Confident	71.9	Confident	17 Å²	17	78.8 Å²	78.8	9%	0.089	38%	0.383	C	S	.	.	H	α-helix	trans	-64.3	-39.5	177	-69.8	167.7	0	0	0	112.1	L146 A149 I150 C153 R173 I175 L181	L146-L177 HydrophobicContact CD2-CD2 4.05Å; A149-L177 HydrophobicContact CB-CD1 4.15Å; A149-L177 HydrophobicContact CB-CD2 4.17Å; I150-L177 HydrophobicContact CD1-CB 4.39Å; I150-L177 HydrophobicContact CG1-CB 3.62Å; C153-L177 HydrophobicContact CB-CD1 4.03Å; R173-L177 HydrophobicContact CG-CD1 4.24Å; R173-L177 WeakPolarHBondContact O-CG 3.33Å; R173-L177 PolarHBondContact O-N 3.09Å; I175-L177 PolarHBondContact O-N 3.44Å; L177-L181 WeakPolarHBondContact O-CB 3.31Å; L177-L181 PolarHBondContact O-N 3.47Å
178	R	77.3	Confident	70.7	Confident	128 Å²	128	83.8 Å²	83.8	48%	0.483	41%	0.411	S	S	.	.	H	α-helix	trans	-65	-40.7	174.7	-75.7	173.4	178.3	-167.8	2.2	112.6	I150 L174 I175 H176 L181 Q182	I150-R178 HydrophobicContact CD1-CB 4.48Å; I150-R178 HydrophobicContact CD1-CG 3.9Å; I150-R178 HydrophobicContact CG1-CG 4.21Å; I150-R178 HydrophobicContact CG2-CG 4.44Å; L174-R178 HydrophobicContact CD1-CG 4.47Å; L174-R178 WeakPolarHBondContact O-CB 3.33Å; L174-R178 VanDerWaalsContact O-CG 3.28Å; L174-R178 WeakPolarHBondContact O-CG 3.49Å; L174-R178 PolarHBondContact O-N 3.03Å; L174-R178 VanDerWaalsContact O-N 3.11Å; I175-R178 PolarHBondContact O-N 2.85Å; H176-R178 PolarHBondContact O-N 3.33Å; R178-L181 PolarHBondContact O-N 2.86Å; R178-Q182 PolarHBondContact O-N 2.91Å; R178-Q182 VanDerWaalsContact O-N 3.07Å
179	L	63.7	Low	69.5	Low	76 Å²	76	85.2 Å²	85.2	40%	0.398	42%	0.419	S	S	.	.	H	α-helix	trans	-61.6	-50.8	175.1	-70.9	167.5	0	0	0	110.8	I175 H176 L181 Q182 E183	I175-L179 HydrophobicContact CG2-CD1 3.95Å; I175-L179 HydrophobicContact CG2-CG 4.46Å; I175-L179 WeakPolarHBondContact O-CG 3.23Å; I175-L179 PolarHBondContact O-N 2.91Å; H176-L179 PolarHBondContact O-N 3.11Å; L179-L181 VanDerWaalsContact C-N 3.3Å; L179-L181 PolarHBondContact O-N 3.42Å; L179-Q182 CarbonylContact O-C 3.59Å; L179-Q182 WeakPolarHBondContact O-CA 3.49Å; L179-Q182 WeakPolarHBondContact O-CB 3.41Å; L179-Q182 PolarHBondContact O-N 3.38Å; L179-E183 WeakPolarHBondContact O-CG 3.45Å; L179-E183 PolarHBondContact O-N 3.07Å
180	K	73.1	Confident	68.1	Low	70 Å²	70	87.2 Å²	87.2	30%	0.304	43%	0.43	S	S	.	.	H	α-helix	trans	-61.4	-34.8	178.2	-165.4	178.6	175.8	-161.7	0	112.9	F138 A140 L146 H176 Q182 E183 L184	F138-K180 PolarHBondContact O-NZ 3.45Å; A140-K180 PolarHBondContact O-NZ 2.82Å; L146-K180 HydrophobicContact CD1-CB 4.33Å; L146-K180 HydrophobicContact CD1-CD 4.33Å; L146-K180 HydrophobicContact CD1-CG 3.95Å; L146-K180 HydrophobicContact CD2-CB 4.4Å; L146-K180 HydrophobicContact CD2-CD 4Å; L146-K180 HydrophobicContact CD2-CG 4.31Å; H176-K180 PolarHBondContact O-N 3.45Å; K180-Q182 VanDerWaalsContact C-N 3.31Å; K180-Q182 PolarHBondContact O-N 2.91Å; K180-E183 PolarHBondContact O-N 2.92Å; K180-L184 PolarHBondContact O-N 3.26Å; K180-L184 VanDerWaalsContact O-N 3.15Å
181	L	78.4	Confident	66.7	Low	20 Å²	20	94.4 Å²	94.4	11%	0.105	46%	0.463	C	S	.	.	H	α-helix	trans	-68.7	-27.7	172.6	179.1	60.9	0	0	0	112.9	V143 L146 R147 I150 L177 R178 L179 K185	V143-L181 HydrophobicContact CB-CD1 4.46Å; V143-L181 HydrophobicContact CG1-CD1 3.9Å; L146-L181 HydrophobicContact CB-CB 4.22Å; L146-L181 HydrophobicContact CB-CD1 4.12Å; L146-L181 HydrophobicContact CD1-CB 4.45Å; R147-L181 HydrophobicContact CG-CD1 4.08Å; R147-L181 HydrophobicContact CG-CD2 3.72Å; I150-L181 HydrophobicContact CD1-CB 3.93Å; I150-L181 HydrophobicContact CD1-CD2 3.45Å; I150-L181 VanDerWaalsContact CD1-CD2 3.45Å; I150-L181 HydrophobicContact CD1-CG 4.32Å; L177-L181 WeakPolarHBondContact O-CB 3.31Å; L177-L181 PolarHBondContact O-N 3.47Å; R178-L181 PolarHBondContact O-N 2.86Å; L179-L181 VanDerWaalsContact C-N 3.3Å; L179-L181 PolarHBondContact O-N 3.42Å; L181-K185 WeakPolarHBondContact O-CB 3.49Å; L181-K185 WeakPolarHBondContact O-CD 3.49Å; L181-K185 VanDerWaalsContact O-CG 3.27Å; L181-K185 WeakPolarHBondContact O-CG 3.22Å
182	Q	68.6	Low	65.5	Low	139 Å²	139	96.6 Å²	96.6	65%	0.65	48%	0.479	S	S	*	.	H	α-helix	trans	-80.6	-36.1	175.3	-173	170.2	-18.2	0	0	111.6	R178 L179 K180 K185 D186	R178-Q182 PolarHBondContact O-N 2.91Å; R178-Q182 VanDerWaalsContact O-N 3.07Å; L179-Q182 CarbonylContact O-C 3.59Å; L179-Q182 WeakPolarHBondContact O-CA 3.49Å; L179-Q182 WeakPolarHBondContact O-CB 3.41Å; L179-Q182 PolarHBondContact O-N 3.38Å; K180-Q182 VanDerWaalsContact C-N 3.31Å; K180-Q182 PolarHBondContact O-N 2.91Å; Q182-K185 PolarHBondContact O-N 3.24Å; Q182-K185 VanDerWaalsContact O-N 3.15Å; Q182-D186 PolarHBondContact O-N 2.96Å
183	E	65.4	Low	65.2	Low	139 Å²	139	96.3 Å²	96.3	65%	0.65	48%	0.475	S	S	*	.	H	α-helix	trans	-58.9	-48.6	172.4	-69.7	171.8	157	0	0	111.5	L179 K180 K185 D186	L179-E183 WeakPolarHBondContact O-CG 3.45Å; L179-E183 PolarHBondContact O-N 3.07Å; K180-E183 PolarHBondContact O-N 2.92Å; E183-K185 PolarHBondContact O-N 3.25Å; E183-K185 VanDerWaalsContact O-N 3.12Å; E183-D186 PolarHBondContact O-N 2.93Å
184	L	65.9	Low	65.3	Low	88 Å²	88	94.8 Å²	94.8	46%	0.461	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	10	176	-61	-173.3	0	0	0	114.6	V143 L146 K180	V143-L184 HydrophobicContact CG2-CB 3.76Å; V143-L184 HydrophobicContact CG2-CD1 4.48Å; L146-L184 HydrophobicContact CD1-CD1 3.75Å; L146-L184 HydrophobicContact CD1-CG 4.49Å; K180-L184 PolarHBondContact O-N 3.26Å; K180-L184 VanDerWaalsContact O-N 3.15Å
185	K	64.6	Low	65.4	Low	118 Å²	118	100.2 Å²	100.2	51%	0.513	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-13.3	175.3	-85.4	-177.5	175.8	-174.3	0	114.2	L181 Q182 E183 P187	L181-K185 WeakPolarHBondContact O-CB 3.49Å; L181-K185 WeakPolarHBondContact O-CD 3.49Å; L181-K185 VanDerWaalsContact O-CG 3.27Å; L181-K185 WeakPolarHBondContact O-CG 3.22Å; Q182-K185 PolarHBondContact O-N 3.24Å; Q182-K185 VanDerWaalsContact O-N 3.15Å; E183-K185 PolarHBondContact O-N 3.25Å; E183-K185 VanDerWaalsContact O-N 3.12Å; K185-P187 WeakPolarHBondContact O-CD 3.47Å
186	D	54.9	Low	66.2	Low	75 Å²	75	101 Å²	101	40%	0.401	50%	0.502	S	S	.	.	S	Bend	trans	-75.9	117.1	168.7	-133.8	36.6	0	0	0	106.1	Q182 E183 K204 K206	Q182-D186 PolarHBondContact O-N 2.96Å; E183-D186 PolarHBondContact O-N 2.93Å; D186-K204 IonicContact OD2-NZ 3.68Å; D186-K206 WeakPolarHBondContact OD2-CE 2.98Å; D186-K206 IonicContact OD2-NZ 3.8Å; D186-K206 PolarHBondContact OD2-NZ 2.92Å
187	P	47.1	Very low	67.1	Low	83 Å²	83	97.8 Å²	97.8	54%	0.539	49%	0.489	S	S	.	.			trans	-64.1	155.9	-178	24.6	-32.5	0	0	0	112.1	K185 E189	K185-P187 WeakPolarHBondContact O-CD 3.47Å; P187-E189 HydrophobicContact CB-CG 4.27Å; P187-E189 HydrophobicContact CG-CG 3.92Å; P187-E189 PolarHBondContact O-N 2.92Å; P187-E189 VanDerWaalsContact O-N 3.09Å
188	N	56.1	Low	67.5	Low	142 Å²	142	100.9 Å²	100.9	76%	0.759	51%	0.505	S	S	*	.			trans	-77.7	93.4	175.8	-172.4	83.5	0	0	0	110.2	D190	N188-D190 PolarHBondContact ND2-OD2 2.89Å
189	E	50.9	Low	68.1	Low	126 Å²	126	100.1 Å²	100.1	59%	0.589	51%	0.507	S	S	*	.			trans	-102.5	84.7	-172.7	-63.3	-83.4	131	0	0	111.1	P187 E191	P187-E189 HydrophobicContact CB-CG 4.27Å; P187-E189 HydrophobicContact CG-CG 3.92Å; P187-E189 PolarHBondContact O-N 2.92Å; P187-E189 VanDerWaalsContact O-N 3.09Å; E189-E191 PolarHBondContact O-N 3.04Å
190	D	49.2	Very low	69.5	Low	148 Å²	148	96.6 Å²	96.6	79%	0.791	49%	0.488	S	S	*	.			trans	-77.3	53.7	170	-77.9	-68.8	0	0	0	111.9	N188	N188-D190 PolarHBondContact ND2-OD2 2.89Å
191	E	50.8	Low	70.4	Confident	151 Å²	151	99.2 Å²	99.2	71%	0.706	50%	0.496	S	S	*	.	S	Bend	trans	-119.8	148.6	165.4	-93.2	-157.4	160.7	0	0	111	E189 N193	E189-E191 PolarHBondContact O-N 3.04Å; E191-N193 PolarHBondContact O-N 2.96Å
192	P	53.5	Low	71.1	Confident	107 Å²	107	98.2 Å²	98.2	70%	0.695	49%	0.491	S	S	*	.			trans	-67.1	101.8	179.2	28.4	-33.9	0	0	0	109.8	I194	P192-I194 HydrophobicContact CB-CD1 4.34Å; P192-I194 HydrophobicContact CB-CG1 4.47Å; P192-I194 PolarHBondContact O-N 3.01Å
193	N	69.1	Low	72.2	Confident	64 Å²	64	95.4 Å²	95.4	34%	0.342	48%	0.475	S	S	.	.			trans	-72.6	55.1	-171.1	-149.1	-56.3	0	0	0	113.4	E191 Y203 K204	E191-N193 PolarHBondContact O-N 2.96Å; N193-Y203 WeakPolarHBondContact O-CA 3.33Å; N193-K204 HydrophobicContact CB-CB 4.17Å; N193-K204 PolarHBondContact O-N 2.9Å; N193-K204 VanDerWaalsContact O-N 3.13Å; N193-K204 WeakPolarHBondContact OD1-CB 3.43Å
194	I	79.2	Confident	73.3	Confident	77 Å²	77	91.5 Å²	91.5	40%	0.395	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	106.4	-173.3	-56.6	176.9	0	0	0	108.7	P192 R201 F202	P192-I194 HydrophobicContact CB-CD1 4.34Å; P192-I194 HydrophobicContact CB-CG1 4.47Å; P192-I194 PolarHBondContact O-N 3.01Å; I194-R201 HydrophobicContact CG2-CB 4.17Å; I194-F202 CarbonylContact C-O 3.49Å; I194-F202 VanDerWaalsContact CA-O 3.27Å; I194-F202 WeakPolarHBondContact CA-O 3.21Å
195	R	84.5	Confident	74.1	Confident	129 Å²	129	89.3 Å²	89.3	49%	0.487	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	134.6	173.5	-63.6	-175.6	174.9	-150.9	-6.9	109.8	F202 Y229	R195-F202 HydrophobicContact CB-CB 4.47Å; R195-F202 PolarHBondContact N-O 3.03Å; R195-F202 WeakPolarHBondContact O-CB 3.32Å; R195-F202 PolarHBondContact O-N 3.31Å; R195-Y229 HydrophobicContact CG-CE1 4.23Å; R195-Y229 PolarHBondContact NE-OH 3.23Å
196	V	88.6	Confident	74.4	Confident	106 Å²	106	90.7 Å²	90.7	64%	0.642	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	126	175	-175	0	0	0	0	109.5	H200 R201	V196-H200 WeakPolarHBondContact CA-O 3.3Å; V196-R201 HydrophobicContact CG2-CG 4.41Å
197	L	89.2	Confident	75	Confident	51 Å²	51	89.3 Å²	89.3	27%	0.267	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	122	178.1	177.6	63	0	0	0	109.8	E199 H200 F202 L243 I246	L197-E199 PolarHBondContact O-N 3.19Å; L197-H200 PolarHBondContact N-O 3.05Å; L197-H200 VanDerWaalsContact N-O 3.08Å; L197-H200 VanDerWaalsContact O-CB 3.31Å; L197-H200 WeakPolarHBondContact O-CB 3.42Å; L197-H200 PolarHBondContact O-CD2 3.08Å; L197-H200 PolarHBondContact O-N 3.4Å; L197-F202 HydrophobicContact CB-CD2 4.41Å; L197-F202 HydrophobicContact CB-CE2 4.42Å; L197-L243 HydrophobicContact CD2-CD1 4.42Å; L197-L243 HydrophobicContact CD2-CG 4.35Å; L197-L243 WeakPolarHBondContact CD2-O 3.44Å; L197-I246 HydrophobicContact CD2-CB 4.18Å
198	L	88.1	Confident	75.6	Confident	81 Å²	81	94.3 Å²	94.3	42%	0.424	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	48.9	-176.9	-55.4	177.9	0	0	0	112.1	H200 I246 P249 C250	L198-H200 PolarHBondContact O-CD2 3.35Å; L198-H200 VanDerWaalsContact O-CD2 3.29Å; L198-H200 PolarHBondContact O-N 2.87Å; L198-I246 HydrophobicContact CD1-CG2 4.46Å; L198-I246 WeakPolarHBondContact CD1-O 3.32Å; L198-P249 CarbonylContact O-C 3.56Å; L198-P249 WeakPolarHBondContact O-CA 3.34Å; L198-C250 PolarHBondContact O-N 2.72Å
199	E	90.2	Very high	76.1	Confident	113 Å²	113	89.5 Å²	89.5	53%	0.528	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	-1.5	-178.5	-56.1	165.4	-178.9	0	0	115.6	L197 R201 C250 S253	L197-E199 PolarHBondContact O-N 3.19Å; E199-R201 PolarHBondContact O-N 3.5Å; E199-C250 VanDerWaalsContact C-CB 3.44Å; E199-C250 HydrophobicContact CB-CB 4.01Å; E199-C250 WeakPolarHBondContact O-CB 3.44Å; E199-S253 WeakPolarHBondContact OE2-CB 3.47Å; E199-S253 PolarHBondContact OE2-OG 3.28Å
200	H	91.4	Very high	76.6	Confident	2 Å²	2	87.7 Å²	87.7	1%	0.009	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.3	169.1	-63.5	-104.2	0	0	0	109.2	V196 L197 L198 F202 C231 C234 Y236 K248 P249 C250	V196-H200 WeakPolarHBondContact CA-O 3.3Å; L197-H200 PolarHBondContact N-O 3.05Å; L197-H200 VanDerWaalsContact N-O 3.08Å; L197-H200 VanDerWaalsContact O-CB 3.31Å; L197-H200 WeakPolarHBondContact O-CB 3.42Å; L197-H200 PolarHBondContact O-CD2 3.08Å; L197-H200 PolarHBondContact O-N 3.4Å; L198-H200 PolarHBondContact O-CD2 3.35Å; L198-H200 VanDerWaalsContact O-CD2 3.29Å; L198-H200 PolarHBondContact O-N 2.87Å; H200-F202 HydrophobicContact CB-CD2 3.6Å; H200-F202 HydrophobicContact CB-CE1 4.29Å; H200-F202 HydrophobicContact CB-CE2 3.15Å; H200-F202 HydrophobicContact CB-CG 4.34Å; H200-F202 HydrophobicContact CB-CZ 3.51Å; H200-F202 AromaticContact CG-CE2 3.64Å; H200-F202 AromaticContact CG-CZ 3.6Å; H200-F202 AromaticContact ND1-CZ 3.64Å; H200-C231 HydrophobicContact CB-CB 4.22Å; H200-C234 PolarHBondContact ND1-SG 3.28Å; H200-Y236 AromaticContact CE1-CG 3.93Å; H200-K248 PolarHBondContact NE2-O 3.14Å; H200-P249 VanDerWaalsContact NE2-C 3.32Å; H200-P249 PolarHBondContact NE2-O 2.71Å; H200-C250 HydrophobicContact CB-CB 4.36Å; H200-C250 PolarHBondContact NE2-N 2.97Å
201	R	92.7	Very high	78.1	Confident	124 Å²	124	86.7 Å²	86.7	47%	0.468	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	96.9	168.3	-62.6	174.1	71.9	-170.7	2.3	108.6	I194 V196 E199 C231 T232	I194-R201 HydrophobicContact CG2-CB 4.17Å; V196-R201 HydrophobicContact CG2-CG 4.41Å; E199-R201 PolarHBondContact O-N 3.5Å; R201-C231 CarbonylContact O-C 3.51Å; R201-C231 WeakPolarHBondContact O-CA 3.47Å; R201-T232 PolarHBondContact O-N 2.97Å; R201-T232 PolarHBondContact O-OG1 3.08Å
202	F	93	Very high	79.8	Confident	0 Å²	0	82.2 Å²	82.2	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	115.3	-174.5	-79.3	-65.9	0	0	0	112.2	I194 R195 L197 H200 Y229 T230 C231 Y236 L243 I246	I194-F202 CarbonylContact C-O 3.49Å; I194-F202 VanDerWaalsContact CA-O 3.27Å; I194-F202 WeakPolarHBondContact CA-O 3.21Å; R195-F202 HydrophobicContact CB-CB 4.47Å; R195-F202 PolarHBondContact N-O 3.03Å; R195-F202 WeakPolarHBondContact O-CB 3.32Å; R195-F202 PolarHBondContact O-N 3.31Å; L197-F202 HydrophobicContact CB-CD2 4.41Å; L197-F202 HydrophobicContact CB-CE2 4.42Å; H200-F202 HydrophobicContact CB-CD2 3.6Å; H200-F202 HydrophobicContact CB-CE1 4.29Å; H200-F202 HydrophobicContact CB-CE2 3.15Å; H200-F202 HydrophobicContact CB-CG 4.34Å; H200-F202 HydrophobicContact CB-CZ 3.51Å; H200-F202 AromaticContact CG-CE2 3.64Å; H200-F202 AromaticContact CG-CZ 3.6Å; H200-F202 AromaticContact ND1-CZ 3.64Å; F202-Y229 HydrophobicContact CB-CD1 4.07Å; F202-Y229 HydrophobicContact CB-CG 4.44Å; F202-T230 WeakPolarHBondContact CA-O 3.41Å; F202-C231 HydrophobicContact CD1-CB 3.97Å; F202-C231 HydrophobicContact CE1-CB 3.7Å; F202-C231 HydrophobicContact CZ-CB 4.28Å; F202-Y236 AromaticContact CE1-CD1 3.93Å; F202-Y236 HydrophobicContact CE1-CD1 3.93Å; F202-Y236 AromaticContact CZ-CD1 3.8Å; F202-Y236 HydrophobicContact CZ-CD1 3.8Å; F202-Y236 HydrophobicContact CZ-CG 4.46Å; F202-L243 HydrophobicContact CB-CD1 4.29Å; F202-L243 HydrophobicContact CD1-CD1 4.37Å; F202-L243 HydrophobicContact CD2-CD1 3.49Å; F202-L243 VanDerWaalsContact CD2-CD1 3.49Å; F202-L243 HydrophobicContact CE2-CD1 3.83Å; F202-L243 HydrophobicContact CG-CD1 3.81Å; F202-L243 HydrophobicContact CZ-CD1 4.46Å; F202-I246 HydrophobicContact CE1-CD1 4.25Å; F202-I246 HydrophobicContact CE2-CD1 3.62Å; F202-I246 HydrophobicContact CZ-CD1 3.36Å
203	Y	90.8	Very high	81.6	Confident	79 Å²	79	79.7 Å²	79.7	31%	0.31	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	142.1	166.9	70.8	-84.2	0	0	0	110.9	N193 E205 Y229 T230 T232	N193-Y203 WeakPolarHBondContact O-CA 3.33Å; Y203-E205 HydrophobicContact CD2-CB 4.32Å; Y203-E205 HydrophobicContact CE2-CB 3.92Å; Y203-E205 HydrophobicContact CE2-CG 3.89Å; Y203-E205 VanDerWaalsContact CE2-OE1 3.27Å; Y203-E205 WeakPolarHBondContact CE2-OE1 3.33Å; Y203-E205 VanDerWaalsContact OH-CD 3.3Å; Y203-E205 PolarHBondContact OH-OE1 3.1Å; Y203-E205 PolarHBondContact OH-OE2 2.77Å; Y203-Y229 WeakPolarHBondContact O-CA 3.23Å; Y203-T230 WeakPolarHBondContact CD1-O 3.37Å; Y203-T230 HydrophobicContact CE1-CG2 3.71Å; Y203-T230 WeakPolarHBondContact CE1-O 3.15Å; Y203-T230 PolarHBondContact N-O 2.92Å; Y203-T230 PolarHBondContact O-N 3.3Å; Y203-T232 HydrophobicContact CD1-CG2 3.64Å; Y203-T232 HydrophobicContact CE1-CG2 4.21Å
204	K	88.6	Confident	82.7	Confident	58 Å²	58	76.6 Å²	76.6	25%	0.252	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	124	171.2	-174.6	-177.7	175.8	-171.8	0	109.4	D186 N193 Y229	D186-K204 IonicContact OD2-NZ 3.68Å; N193-K204 HydrophobicContact CB-CB 4.17Å; N193-K204 PolarHBondContact O-N 2.9Å; N193-K204 VanDerWaalsContact O-N 3.13Å; N193-K204 WeakPolarHBondContact OD1-CB 3.43Å; K204-Y229 HydrophobicContact CB-CD1 4.15Å; K204-Y229 HydrophobicContact CB-CE1 3.69Å; K204-Y229 HydrophobicContact CG-CE1 4.25Å
205	E	83.8	Confident	83.3	Confident	42 Å²	42	73.5 Å²	73.5	20%	0.196	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.5	-176.1	-163.3	153.7	-131.7	0	0	110.8	Y203 W228 T230	Y203-E205 HydrophobicContact CD2-CB 4.32Å; Y203-E205 HydrophobicContact CE2-CB 3.92Å; Y203-E205 HydrophobicContact CE2-CG 3.89Å; Y203-E205 VanDerWaalsContact CE2-OE1 3.27Å; Y203-E205 WeakPolarHBondContact CE2-OE1 3.33Å; Y203-E205 VanDerWaalsContact OH-CD 3.3Å; Y203-E205 PolarHBondContact OH-OE1 3.1Å; Y203-E205 PolarHBondContact OH-OE2 2.77Å; E205-W228 HydrophobicContact CB-CD2 4.13Å; E205-W228 HydrophobicContact CB-CG 4.38Å; E205-W228 HydrophobicContact CB-CZ2 4.21Å; E205-W228 HydrophobicContact CG-CH2 4.38Å; E205-W228 HydrophobicContact CG-CZ2 3.7Å; E205-W228 PolarHBondContact N-O 3.11Å; E205-W228 PolarHBondContact OE2-NE1 3.2Å; E205-T230 WeakPolarHBondContact OE2-CB 3.31Å; E205-T230 PolarHBondContact OE2-OG1 3.25Å
206	K	70.9	Confident	83.6	Confident	146 Å²	146	71 Å²	71	64%	0.635	34%	0.344	S	S	*	.			trans	-123.1	78.5	174.5	-73.8	-174.6	175.3	-175.5	0	108.1	D186 T227	D186-K206 WeakPolarHBondContact OD2-CE 2.98Å; D186-K206 IonicContact OD2-NZ 3.8Å; D186-K206 PolarHBondContact OD2-NZ 2.92Å; K206-T227 HydrophobicContact CG-CG2 4.19Å
207	S	66.8	Low	83.6	Confident	47 Å²	47	67.9 Å²	67.9	33%	0.329	33%	0.327	S	S	.	.			trans	-117.1	142.2	-173.3	166.5	0	0	0	0	112.9	S209 G223	S207-S209 PolarHBondContact O-N 2.87Å; S207-S209 PolarHBondContact OG-N 3.48Å; S207-G223 CarbonylContact O-C 3.42Å
208	K	61.1	Low	83.6	Confident	188 Å²	188	68.3 Å²	68.3	82%	0.817	33%	0.33	S	S	*	.			trans	-69.6	5.8	177.2	-59.5	-178.5	-179.5	-179.7	0	113.9	V210 L224	K208-V210 PolarHBondContact O-N 3.02Å; K208-L224 HydrophobicContact CB-CD2 4.24Å
209	S	65.5	Low	83.6	Confident	40 Å²	40	68 Å²	68	28%	0.28	33%	0.331	S	S	.	.			trans	-62.2	129.3	175.5	-170.2	0	0	0	0	111.1	S207 K211 Q212 G223	S207-S209 PolarHBondContact O-N 2.87Å; S207-S209 PolarHBondContact OG-N 3.48Å; S209-K211 PolarHBondContact O-N 2.96Å; S209-Q212 PolarHBondContact OG-NE2 2.79Å; S209-Q212 VanDerWaalsContact OG-NE2 3.09Å; S209-G223 WeakPolarHBondContact O-CA 3.34Å
210	V	62.5	Low	83.6	Confident	88 Å²	88	65.9 Å²	65.9	53%	0.533	32%	0.323	S	S	.	.	S	Bend	trans	-68.2	-41.2	-168.5	-167	0	0	0	0	112.6	K208	K208-V210 PolarHBondContact O-N 3.02Å
211	K	79.4	Confident	83.3	Confident	127 Å²	127	65.8 Å²	65.8	55%	0.552	32%	0.322	S	S	*	.			trans	-145.8	131.6	-174.9	-60.1	177.2	-175.1	172.2	0	110.9	S209 I220 W222	S209-K211 PolarHBondContact O-N 2.96Å; K211-I220 HydrophobicContact CB-CG2 4.2Å; K211-I220 HydrophobicContact CG-CG2 4.26Å; K211-W222 HydrophobicContact CD-CZ3 4.45Å; K211-W222 HydrophobicContact CG-CE3 4.43Å; K211-W222 HydrophobicContact CG-CZ3 4.25Å
212	Q	87.4	Confident	82.8	Confident	58 Å²	58	65.2 Å²	65.2	27%	0.271	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	164.9	165.2	-63.7	-66.9	-37.6	0	0	108.4	S209 I220 I221 W228	S209-Q212 PolarHBondContact OG-NE2 2.79Å; S209-Q212 VanDerWaalsContact OG-NE2 3.09Å; Q212-I220 CarbonylContact O-C 3.57Å; Q212-I220 WeakPolarHBondContact O-CA 3.41Å; Q212-I221 HydrophobicContact CB-CB 4.13Å; Q212-I221 HydrophobicContact CB-CD1 4.28Å; Q212-I221 PolarHBondContact N-O 2.8Å; Q212-I221 PolarHBondContact O-N 2.87Å; Q212-W228 HydrophobicContact CG-CZ2 4.2Å
213	T	90.9	Very high	81.9	Confident	53 Å²	53	65.6 Å²	65.6	33%	0.325	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.9	177.3	-51.2	0	0	0	0	110.9	W310	T213-W310 HydrophobicContact CG2-CH2 3.49Å; T213-W310 VanDerWaalsContact CG2-CH2 3.49Å; T213-W310 HydrophobicContact CG2-CZ2 4.22Å; T213-W310 HydrophobicContact CG2-CZ3 3.76Å
214	C	91.6	Very high	81	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.339	C	S	.	.			trans	-80.5	117.2	178.4	176.2	0	0	0	0	111.8	K216 C217 N218 T219 I221 R237 C238 H239	C214-K216 PolarHBondContact O-N 3.31Å; C214-K216 VanDerWaalsContact O-N 3.12Å; C214-C217 PolarHBondContact O-N 2.85Å; C214-C217 PolarHBondContact SG-SG 2.91Å; C214-N218 VanDerWaalsContact O-CA 3.31Å; C214-N218 WeakPolarHBondContact O-CA 3.39Å; C214-N218 PolarHBondContact O-N 3.26Å; C214-T219 WeakPolarHBondContact CB-O 3.39Å; C214-T219 PolarHBondContact N-O 3.47Å; C214-I221 HydrophobicContact CB-CD1 4.02Å; C214-I221 HydrophobicContact CB-CG1 3.92Å; C214-R237 CarbonylContact C-O 3.5Å; C214-R237 WeakPolarHBondContact CA-O 3.45Å; C214-C238 VanDerWaalsContact SG-CA 3.55Å; C214-H239 WeakPolarHBondContact CB-CE1 3.36Å; C214-H239 VanDerWaalsContact CB-ND1 3.3Å; C214-H239 WeakPolarHBondContact CB-ND1 3.25Å; C214-H239 PolarHBondContact SG-ND1 2.87Å; C214-H239 VanDerWaalsContact SG-ND1 3.37Å
215	D	91.9	Very high	80.1	Confident	12 Å²	12	71 Å²	71	6%	0.064	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-9.5	179.1	-68.8	-80	0	0	0	114.5	Y236 R237 R333 R337	D215-Y236 HydrophobicContact CB-CD1 4.29Å; D215-Y236 HydrophobicContact CB-CD2 3.78Å; D215-Y236 HydrophobicContact CB-CE1 3.96Å; D215-Y236 HydrophobicContact CB-CE2 3.39Å; D215-Y236 HydrophobicContact CB-CG 4.21Å; D215-Y236 VanDerWaalsContact CB-CZ 3.49Å; D215-Y236 PolarHBondContact O-OH 3.49Å; D215-Y236 VanDerWaalsContact O-OH 3.07Å; D215-R237 PolarHBondContact N-O 2.75Å; D215-R237 PolarHBondContact OD2-N 2.98Å; D215-R333 IonicContact OD1-CZ 3.38Å; D215-R333 IonicContact OD1-NE 3.67Å; D215-R333 PolarHBondContact OD1-NE 2.8Å; D215-R333 VanDerWaalsContact OD1-NE 3.12Å; D215-R333 IonicContact OD1-NH2 2.79Å; D215-R333 PolarHBondContact OD1-NH2 3.38Å; D215-R333 IonicContact OD2-NH2 3.92Å; D215-R337 IonicContact OD1-CZ 2.76Å; D215-R337 IonicContact OD1-NH1 3.44Å; D215-R337 PolarHBondContact OD1-NH1 2.7Å; D215-R337 IonicContact OD1-NH2 2.7Å; D215-R337 PolarHBondContact OD1-NH2 3Å; D215-R337 VanDerWaalsContact OD1-NH2 3.09Å; D215-R337 IonicContact OD2-CZ 3.67Å; D215-R337 IonicContact OD2-NH1 3.55Å; D215-R337 IonicContact OD2-NH2 2.64Å; D215-R337 PolarHBondContact OD2-NH2 3.36Å
216	K	91.1	Very high	79.7	Confident	75 Å²	75	72.4 Å²	72.4	33%	0.326	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-35	177.9	177.6	60.6	-154.4	-165.4	0	113.9	C214 Y236 C242 L245	C214-K216 PolarHBondContact O-N 3.31Å; C214-K216 VanDerWaalsContact O-N 3.12Å; K216-Y236 WeakPolarHBondContact CA-OH 3.46Å; K216-Y236 WeakPolarHBondContact CB-OH 3.47Å; K216-Y236 PolarHBondContact N-OH 3.3Å; K216-C242 HydrophobicContact CB-CB 4.04Å; K216-C242 HydrophobicContact CG-CB 4.07Å; K216-L245 HydrophobicContact CD-CB 4.35Å; K216-L245 WeakPolarHBondContact CD-O 3.39Å; K216-L245 WeakPolarHBondContact CE-O 3.34Å; K216-L245 HydrophobicContact CG-CB 4.22Å; K216-L245 PolarHBondContact NZ-O 2.8Å
217	C	89.2	Confident	80.2	Confident	41 Å²	41	67.9 Å²	67.9	28%	0.277	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	1.7	-174.1	67.3	0	0	0	0	114.3	C214 T219 H239	C214-C217 PolarHBondContact O-N 2.85Å; C214-C217 PolarHBondContact SG-SG 2.91Å; C217-T219 PolarHBondContact O-N 2.94Å; C217-T219 VanDerWaalsContact O-N 3.15Å; C217-T219 PolarHBondContact SG-OG1 3.5Å; C217-H239 PolarHBondContact SG-ND1 3.27Å
218	N	88.3	Confident	81.3	Confident	61 Å²	61	65.8 Å²	65.8	33%	0.326	34%	0.336	S	S	.	.			trans	55.7	26.7	177.8	-156.4	23.2	0	0	0	115.1	C214 W310	C214-N218 VanDerWaalsContact O-CA 3.31Å; C214-N218 WeakPolarHBondContact O-CA 3.39Å; C214-N218 PolarHBondContact O-N 3.26Å; N218-W310 VanDerWaalsContact OD1-CE2 3.28Å; N218-W310 WeakPolarHBondContact OD1-CZ2 3.22Å
219	T	89.3	Confident	82.8	Confident	73 Å²	73	57.5 Å²	57.5	45%	0.448	30%	0.299	S	S	.	.			trans	-114.5	159.5	175.7	59.3	0	0	0	0	111.7	C214 C217 I221 H239	C214-T219 WeakPolarHBondContact CB-O 3.39Å; C214-T219 PolarHBondContact N-O 3.47Å; C217-T219 PolarHBondContact O-N 2.94Å; C217-T219 VanDerWaalsContact O-N 3.15Å; C217-T219 PolarHBondContact SG-OG1 3.5Å; T219-I221 PolarHBondContact O-N 3.11Å; T219-H239 PolarHBondContact OG1-CE1 3.41Å
220	I	89	Confident	84.1	Confident	69 Å²	69	55.6 Å²	55.6	35%	0.354	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	132.3	-176.2	-60.4	175.6	0	0	0	110.8	K211 Q212 W222 H239	K211-I220 HydrophobicContact CB-CG2 4.2Å; K211-I220 HydrophobicContact CG-CG2 4.26Å; Q212-I220 CarbonylContact O-C 3.57Å; Q212-I220 WeakPolarHBondContact O-CA 3.41Å; I220-W222 HydrophobicContact CB-CZ2 4.49Å; I220-W222 HydrophobicContact CD1-CZ2 4.21Å; I220-W222 HydrophobicContact CG2-CD2 3.88Å; I220-W222 HydrophobicContact CG2-CE3 4.43Å; I220-W222 HydrophobicContact CG2-CG 4.13Å; I220-W222 HydrophobicContact CG2-CZ2 4.18Å; I220-H239 PolarHBondContact O-NE2 3.05Å
221	I	86.8	Confident	85.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	116	161.6	-56.1	165.2	0	0	0	106.4	Q212 C214 T219 G223 Q226 W228 R237	Q212-I221 HydrophobicContact CB-CB 4.13Å; Q212-I221 HydrophobicContact CB-CD1 4.28Å; Q212-I221 PolarHBondContact N-O 2.8Å; Q212-I221 PolarHBondContact O-N 2.87Å; C214-I221 HydrophobicContact CB-CD1 4.02Å; C214-I221 HydrophobicContact CB-CG1 3.92Å; T219-I221 PolarHBondContact O-N 3.11Å; I221-G223 PolarHBondContact O-N 2.93Å; I221-Q226 HydrophobicContact CG2-CB 4.49Å; I221-W228 HydrophobicContact CD1-CB 3.99Å; I221-W228 HydrophobicContact CD1-CG 4.14Å; I221-W228 HydrophobicContact CG2-CB 3.76Å; I221-W228 HydrophobicContact CG2-CD2 3.73Å; I221-W228 HydrophobicContact CG2-CE3 3.64Å; I221-W228 HydrophobicContact CG2-CG 3.85Å; I221-W228 HydrophobicContact CG2-CZ3 4.43Å; I221-R237 HydrophobicContact CD1-CB 4.33Å
222	W	82.1	Confident	86.2	Confident	112 Å²	112	48.5 Å²	48.5	42%	0.424	25%	0.254	S	S	.	.			trans	-90.3	89.9	179.8	-65.4	93.8	0	0	0	109.3	K211 I220 L224 I225 Q226	K211-W222 HydrophobicContact CD-CZ3 4.45Å; K211-W222 HydrophobicContact CG-CE3 4.43Å; K211-W222 HydrophobicContact CG-CZ3 4.25Å; I220-W222 HydrophobicContact CB-CZ2 4.49Å; I220-W222 HydrophobicContact CD1-CZ2 4.21Å; I220-W222 HydrophobicContact CG2-CD2 3.88Å; I220-W222 HydrophobicContact CG2-CE3 4.43Å; I220-W222 HydrophobicContact CG2-CG 4.13Å; I220-W222 HydrophobicContact CG2-CZ2 4.18Å; W222-L224 PolarHBondContact O-N 2.77Å; W222-L224 VanDerWaalsContact O-N 3.12Å; W222-I225 PolarHBondContact O-N 3.07Å; W222-Q226 HydrophobicContact CB-CG 4.33Å; W222-Q226 VanDerWaalsContact N-OE1 3.09Å; W222-Q226 WeakPolarHBondContact O-CB 3.39Å; W222-Q226 PolarHBondContact O-N 3.09Å
223	G	73.9	Confident	86.4	Confident	9 Å²	9	46.7 Å²	46.7	9%	0.093	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-26.5	-161.5	0	0	0	0	0	115.5	S207 S209 I221 I225	S207-G223 CarbonylContact O-C 3.42Å; S209-G223 WeakPolarHBondContact O-CA 3.34Å; I221-G223 PolarHBondContact O-N 2.93Å; G223-I225 PolarHBondContact O-N 3.4Å
224	L	70.9	Confident	86.4	Confident	116 Å²	116	44.3 Å²	44.3	61%	0.607	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-14	173.7	-65.3	168.8	0	0	0	114.4	K208 W222	K208-L224 HydrophobicContact CB-CD2 4.24Å; W222-L224 PolarHBondContact O-N 2.77Å; W222-L224 VanDerWaalsContact O-N 3.12Å
225	I	69.2	Low	86.5	Confident	135 Å²	135	50.4 Å²	50.4	69%	0.692	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.5	-29.4	-170.8	-55	175.3	0	0	0	111.8	W222 G223	W222-I225 PolarHBondContact O-N 3.07Å; G223-I225 PolarHBondContact O-N 3.4Å
226	Q	75.6	Confident	86.5	Confident	71 Å²	71	50.5 Å²	50.5	33%	0.332	26%	0.259	S	S	.	.			trans	-113.6	136.7	-172.4	-63.2	179.1	-13.4	0	0	110.7	I221 W222 W228 H239	I221-Q226 HydrophobicContact CG2-CB 4.49Å; W222-Q226 HydrophobicContact CB-CG 4.33Å; W222-Q226 VanDerWaalsContact N-OE1 3.09Å; W222-Q226 WeakPolarHBondContact O-CB 3.39Å; W222-Q226 PolarHBondContact O-N 3.09Å; Q226-W228 VanDerWaalsContact O-CE3 3.25Å; Q226-H239 PolarHBondContact OE1-CD2 3.12Å; Q226-H239 VanDerWaalsContact OE1-CD2 3.27Å; Q226-H239 PolarHBondContact OE1-NE2 2.86Å
227	T	82.4	Confident	86.6	Confident	51 Å²	51	50.3 Å²	50.3	31%	0.313	26%	0.257	S	S	.	.			trans	-81.5	146	164	53.1	0	0	0	0	110.4	K206 S240	K206-T227 HydrophobicContact CG-CG2 4.19Å; T227-S240 PolarHBondContact O-N 2.97Å; T227-S240 PolarHBondContact O-OG 2.69Å; T227-S240 VanDerWaalsContact O-OG 3.1Å; T227-S240 PolarHBondContact OG1-OG 3.3Å
228	W	89.9	Confident	86.8	Confident	3 Å²	3	48.4 Å²	48.4	1%	0.011	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	172.8	174.2	69.9	96.9	0	0	0	110.9	E205 Q212 I221 Q226 T230 C238	E205-W228 HydrophobicContact CB-CD2 4.13Å; E205-W228 HydrophobicContact CB-CG 4.38Å; E205-W228 HydrophobicContact CB-CZ2 4.21Å; E205-W228 HydrophobicContact CG-CH2 4.38Å; E205-W228 HydrophobicContact CG-CZ2 3.7Å; E205-W228 PolarHBondContact N-O 3.11Å; E205-W228 PolarHBondContact OE2-NE1 3.2Å; Q212-W228 HydrophobicContact CG-CZ2 4.2Å; I221-W228 HydrophobicContact CD1-CB 3.99Å; I221-W228 HydrophobicContact CD1-CG 4.14Å; I221-W228 HydrophobicContact CG2-CB 3.76Å; I221-W228 HydrophobicContact CG2-CD2 3.73Å; I221-W228 HydrophobicContact CG2-CE3 3.64Å; I221-W228 HydrophobicContact CG2-CG 3.85Å; I221-W228 HydrophobicContact CG2-CZ3 4.43Å; Q226-W228 VanDerWaalsContact O-CE3 3.25Å; W228-T230 PolarHBondContact NE1-OG1 3.05Å; W228-C238 WeakPolarHBondContact CA-O 3.36Å; W228-C238 VanDerWaalsContact CB-O 3.28Å; W228-C238 WeakPolarHBondContact CB-O 3.35Å
229	Y	91.8	Very high	86.9	Confident	13 Å²	13	46 Å²	46	5%	0.051	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	137.4	174.7	-70.2	-88.6	0	0	0	109.6	R195 F202 Y203 K204 R237 C238 S240 L243	R195-Y229 HydrophobicContact CG-CE1 4.23Å; R195-Y229 PolarHBondContact NE-OH 3.23Å; F202-Y229 HydrophobicContact CB-CD1 4.07Å; F202-Y229 HydrophobicContact CB-CG 4.44Å; Y203-Y229 WeakPolarHBondContact O-CA 3.23Å; K204-Y229 HydrophobicContact CB-CD1 4.15Å; K204-Y229 HydrophobicContact CB-CE1 3.69Å; K204-Y229 HydrophobicContact CG-CE1 4.25Å; Y229-R237 WeakPolarHBondContact O-CA 3.31Å; Y229-C238 PolarHBondContact N-O 2.78Å; Y229-C238 PolarHBondContact O-N 2.72Å; Y229-S240 WeakPolarHBondContact CE2-OG 3.3Å; Y229-L243 HydrophobicContact CD1-CD2 4.47Å; Y229-L243 HydrophobicContact CD2-CB 4.35Å; Y229-L243 HydrophobicContact CD2-CD1 4.36Å; Y229-L243 HydrophobicContact CD2-CD2 4.03Å; Y229-L243 HydrophobicContact CD2-CG 4.49Å; Y229-L243 HydrophobicContact CE1-CD2 4.4Å; Y229-L243 HydrophobicContact CE2-CD2 3.97Å; Y229-L243 HydrophobicContact CG-CD1 4.16Å; Y229-L243 HydrophobicContact CG-CD2 4.29Å
230	T	92.8	Very high	86.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.2	175.9	-64	0	0	0	0	108.9	F202 Y203 E205 W228 Y236 R237	F202-T230 WeakPolarHBondContact CA-O 3.41Å; Y203-T230 WeakPolarHBondContact CD1-O 3.37Å; Y203-T230 HydrophobicContact CE1-CG2 3.71Å; Y203-T230 WeakPolarHBondContact CE1-O 3.15Å; Y203-T230 PolarHBondContact N-O 2.92Å; Y203-T230 PolarHBondContact O-N 3.3Å; E205-T230 WeakPolarHBondContact OE2-CB 3.31Å; E205-T230 PolarHBondContact OE2-OG1 3.25Å; W228-T230 PolarHBondContact NE1-OG1 3.05Å; T230-Y236 CarbonylContact C-O 3.37Å; T230-Y236 WeakPolarHBondContact CA-O 3.17Å; T230-R237 HydrophobicContact CG2-CG 4.19Å
231	C	93.9	Very high	86.8	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.007	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	126.8	175.4	-179.9	0	0	0	0	110.1	H200 R201 F202 G233 Y235 Y236	H200-C231 HydrophobicContact CB-CB 4.22Å; R201-C231 CarbonylContact O-C 3.51Å; R201-C231 WeakPolarHBondContact O-CA 3.47Å; F202-C231 HydrophobicContact CD1-CB 3.97Å; F202-C231 HydrophobicContact CE1-CB 3.7Å; F202-C231 HydrophobicContact CZ-CB 4.28Å; C231-G233 VanDerWaalsContact C-N 3.28Å; C231-G233 PolarHBondContact O-N 3.36Å; C231-Y235 VanDerWaalsContact O-CA 3.27Å; C231-Y235 WeakPolarHBondContact O-CA 3.3Å; C231-Y235 PolarHBondContact O-N 3.25Å; C231-Y236 PolarHBondContact N-O 3.07Å
232	T	92.2	Very high	87	Confident	66 Å²	66	49.4 Å²	49.4	41%	0.405	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-31.6	179.2	58.5	0	0	0	0	113.4	R201 Y203	R201-T232 PolarHBondContact O-N 2.97Å; R201-T232 PolarHBondContact O-OG1 3.08Å; Y203-T232 HydrophobicContact CD1-CG2 3.64Å; Y203-T232 HydrophobicContact CE1-CG2 4.21Å
233	G	90.9	Very high	87.4	Confident	20 Å²	20	44.3 Å²	44.3	21%	0.206	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-48.6	-175.7	0	0	0	0	0	114.3	C231 S252 L341	C231-G233 VanDerWaalsContact C-N 3.28Å; C231-G233 PolarHBondContact O-N 3.36Å; G233-S252 WeakPolarHBondContact O-CB 3.46Å; G233-L341 WeakPolarHBondContact O-CD2 3.34Å
234	C	92.6	Very high	88.1	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.014	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	9.6	-174.6	71	0	0	0	0	115.1	H200 Y236 C250 V251 R337 L341	H200-C234 PolarHBondContact ND1-SG 3.28Å; C234-Y236 PolarHBondContact O-N 2.99Å; C234-C250 VanDerWaalsContact SG-SG 3.69Å; C234-V251 HydrophobicContact CB-CB 3.96Å; C234-R337 VanDerWaalsContact O-CD 3.27Å; C234-R337 WeakPolarHBondContact O-CD 3.4Å; C234-R337 PolarHBondContact O-NE 2.64Å; C234-L341 HydrophobicContact CB-CD1 4.09Å
235	Y	92.3	Very high	89	Confident	128 Å²	128	49.6 Å²	49.6	50%	0.502	25%	0.25	S	C	.	.			trans	52	31	179.1	-51.7	-76.7	0	0	0	114	C231 R237 R337	C231-Y235 VanDerWaalsContact O-CA 3.27Å; C231-Y235 WeakPolarHBondContact O-CA 3.3Å; C231-Y235 PolarHBondContact O-N 3.25Å; Y235-R237 PolarHBondContact O-NH1 3.3Å; Y235-R337 PolarHBondContact O-NH2 3Å
236	Y	93.1	Very high	90	Very high	15 Å²	15	43.7 Å²	43.7	6%	0.059	22%	0.22	C	C	.	.			trans	-65.6	126.4	168.3	-166.4	-86.3	0	0	0	109.1	H200 F202 D215 K216 T230 C231 C234 C238 I246	H200-Y236 AromaticContact CE1-CG 3.93Å; F202-Y236 AromaticContact CE1-CD1 3.93Å; F202-Y236 HydrophobicContact CE1-CD1 3.93Å; F202-Y236 AromaticContact CZ-CD1 3.8Å; F202-Y236 HydrophobicContact CZ-CD1 3.8Å; F202-Y236 HydrophobicContact CZ-CG 4.46Å; D215-Y236 HydrophobicContact CB-CD1 4.29Å; D215-Y236 HydrophobicContact CB-CD2 3.78Å; D215-Y236 HydrophobicContact CB-CE1 3.96Å; D215-Y236 HydrophobicContact CB-CE2 3.39Å; D215-Y236 HydrophobicContact CB-CG 4.21Å; D215-Y236 VanDerWaalsContact CB-CZ 3.49Å; D215-Y236 PolarHBondContact O-OH 3.49Å; D215-Y236 VanDerWaalsContact O-OH 3.07Å; K216-Y236 WeakPolarHBondContact CA-OH 3.46Å; K216-Y236 WeakPolarHBondContact CB-OH 3.47Å; K216-Y236 PolarHBondContact N-OH 3.3Å; T230-Y236 CarbonylContact C-O 3.37Å; T230-Y236 WeakPolarHBondContact CA-O 3.17Å; C231-Y236 PolarHBondContact N-O 3.07Å; C234-Y236 PolarHBondContact O-N 2.99Å; Y236-C238 HydrophobicContact CE1-CB 4.19Å; Y236-I246 HydrophobicContact CD1-CD1 3.88Å; Y236-I246 HydrophobicContact CE1-CD1 3.48Å; Y236-I246 VanDerWaalsContact CE1-CD1 3.48Å; Y236-I246 HydrophobicContact CE1-CG1 3.79Å
237	R	92.8	Very high	90.6	Very high	71 Å²	71	44.2 Å²	44.2	27%	0.268	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132.2	-177	-64.3	-177.3	-179.6	82.6	-5.1	110.6	C214 D215 I221 Y229 T230 Y235	C214-R237 CarbonylContact C-O 3.5Å; C214-R237 WeakPolarHBondContact CA-O 3.45Å; D215-R237 PolarHBondContact N-O 2.75Å; D215-R237 PolarHBondContact OD2-N 2.98Å; I221-R237 HydrophobicContact CD1-CB 4.33Å; Y229-R237 WeakPolarHBondContact O-CA 3.31Å; T230-R237 HydrophobicContact CG2-CG 4.19Å; Y235-R237 PolarHBondContact O-NH1 3.3Å
238	C	92.6	Very high	90.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	144.2	176.3	65.8	0	0	0	0	114.1	C214 W228 Y229 Y236 C242 I246	C214-C238 VanDerWaalsContact SG-CA 3.55Å; W228-C238 WeakPolarHBondContact CA-O 3.36Å; W228-C238 VanDerWaalsContact CB-O 3.28Å; W228-C238 WeakPolarHBondContact CB-O 3.35Å; Y229-C238 PolarHBondContact N-O 2.78Å; Y229-C238 PolarHBondContact O-N 2.72Å; Y236-C238 HydrophobicContact CE1-CB 4.19Å; C238-C242 HydrophobicContact CB-CB 4.11Å; C238-I246 HydrophobicContact CB-CD1 4.41Å
239	H	90.5	Very high	90.8	Very high	10 Å²	10	47.5 Å²	47.5	5%	0.046	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	150.3	167.9	-54.7	99.9	0	0	0	111	C214 C217 T219 I220 Q226 K241 C242 L243	C214-H239 WeakPolarHBondContact CB-CE1 3.36Å; C214-H239 VanDerWaalsContact CB-ND1 3.3Å; C214-H239 WeakPolarHBondContact CB-ND1 3.25Å; C214-H239 PolarHBondContact SG-ND1 2.87Å; C214-H239 VanDerWaalsContact SG-ND1 3.37Å; C217-H239 PolarHBondContact SG-ND1 3.27Å; T219-H239 PolarHBondContact OG1-CE1 3.41Å; I220-H239 PolarHBondContact O-NE2 3.05Å; Q226-H239 PolarHBondContact OE1-CD2 3.12Å; Q226-H239 VanDerWaalsContact OE1-CD2 3.27Å; Q226-H239 PolarHBondContact OE1-NE2 2.86Å; H239-K241 HydrophobicContact CB-CG 3.97Å; H239-K241 PolarHBondContact O-N 3.38Å; H239-K241 VanDerWaalsContact O-N 3.11Å; H239-C242 HydrophobicContact CB-CB 4.3Å; H239-C242 WeakPolarHBondContact O-CA 3.42Å; H239-C242 WeakPolarHBondContact O-CB 3.26Å; H239-C242 PolarHBondContact O-N 2.95Å; H239-L243 PolarHBondContact O-N 3.43Å
240	S	89.2	Confident	90.8	Very high	44 Å²	44	47.1 Å²	47.1	31%	0.308	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-35	174.3	-62.2	0	0	0	0	113.9	T227 Y229 C242	T227-S240 PolarHBondContact O-N 2.97Å; T227-S240 PolarHBondContact O-OG 2.69Å; T227-S240 VanDerWaalsContact O-OG 3.1Å; T227-S240 PolarHBondContact OG1-OG 3.3Å; Y229-S240 WeakPolarHBondContact CE2-OG 3.3Å; S240-C242 VanDerWaalsContact C-N 3.31Å; S240-C242 PolarHBondContact O-N 3.29Å
241	K	88.4	Confident	90.9	Very high	164 Å²	164	47.8 Å²	47.8	71%	0.713	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-16.2	174.8	68.4	174	-178.3	176.9	0	115.1	H239	H239-K241 HydrophobicContact CB-CG 3.97Å; H239-K241 PolarHBondContact O-N 3.38Å; H239-K241 VanDerWaalsContact O-N 3.11Å
242	C	90.6	Very high	90.8	Very high	6 Å²	6	49.1 Å²	49.1	4%	0.041	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-13.4	-176.7	-69.7	0	0	0	0	113.2	K216 C238 H239 S240 N244 L245	K216-C242 HydrophobicContact CB-CB 4.04Å; K216-C242 HydrophobicContact CG-CB 4.07Å; C238-C242 HydrophobicContact CB-CB 4.11Å; H239-C242 HydrophobicContact CB-CB 4.3Å; H239-C242 WeakPolarHBondContact O-CA 3.42Å; H239-C242 WeakPolarHBondContact O-CB 3.26Å; H239-C242 PolarHBondContact O-N 2.95Å; S240-C242 VanDerWaalsContact C-N 3.31Å; S240-C242 PolarHBondContact O-N 3.29Å; C242-N244 PolarHBondContact O-N 3.17Å; C242-L245 WeakPolarHBondContact O-CB 3.26Å; C242-L245 PolarHBondContact O-N 3.28Å
243	L	89.9	Confident	90.8	Very high	5 Å²	5	46.9 Å²	46.9	3%	0.026	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-52.2	-57.5	-178.6	-177.8	69.6	0	0	0	111.7	L197 F202 Y229 H239 L245 I246	L197-L243 HydrophobicContact CD2-CD1 4.42Å; L197-L243 HydrophobicContact CD2-CG 4.35Å; L197-L243 WeakPolarHBondContact CD2-O 3.44Å; F202-L243 HydrophobicContact CB-CD1 4.29Å; F202-L243 HydrophobicContact CD1-CD1 4.37Å; F202-L243 HydrophobicContact CD2-CD1 3.49Å; F202-L243 VanDerWaalsContact CD2-CD1 3.49Å; F202-L243 HydrophobicContact CE2-CD1 3.83Å; F202-L243 HydrophobicContact CG-CD1 3.81Å; F202-L243 HydrophobicContact CZ-CD1 4.46Å; Y229-L243 HydrophobicContact CD1-CD2 4.47Å; Y229-L243 HydrophobicContact CD2-CB 4.35Å; Y229-L243 HydrophobicContact CD2-CD1 4.36Å; Y229-L243 HydrophobicContact CD2-CD2 4.03Å; Y229-L243 HydrophobicContact CD2-CG 4.49Å; Y229-L243 HydrophobicContact CE1-CD2 4.4Å; Y229-L243 HydrophobicContact CE2-CD2 3.97Å; Y229-L243 HydrophobicContact CG-CD1 4.16Å; Y229-L243 HydrophobicContact CG-CD2 4.29Å; H239-L243 PolarHBondContact O-N 3.43Å; L243-L245 PolarHBondContact O-N 2.86Å; L243-I246 HydrophobicContact CD1-CD1 4.29Å; L243-I246 WeakPolarHBondContact O-CB 3.46Å; L243-I246 VanDerWaalsContact O-CG1 3.27Å; L243-I246 WeakPolarHBondContact O-CG1 3.1Å; L243-I246 PolarHBondContact O-N 3.42Å; L243-I246 VanDerWaalsContact O-N 3.07Å
244	N	88.4	Confident	90.6	Very high	135 Å²	135	51.2 Å²	51.2	72%	0.722	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-71.1	-0.7	-178.7	-61.3	7.6	0	0	0	113.8	C242	C242-N244 PolarHBondContact O-N 3.17Å
245	L	90.2	Very high	90.6	Very high	102 Å²	102	51.4 Å²	51.4	53%	0.534	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-99.2	-1.6	174.4	-54	179	0	0	0	112	K216 C242 L243 S247	K216-L245 HydrophobicContact CD-CB 4.35Å; K216-L245 WeakPolarHBondContact CD-O 3.39Å; K216-L245 WeakPolarHBondContact CE-O 3.34Å; K216-L245 HydrophobicContact CG-CB 4.22Å; K216-L245 PolarHBondContact NZ-O 2.8Å; C242-L245 WeakPolarHBondContact O-CB 3.26Å; C242-L245 PolarHBondContact O-N 3.28Å; L243-L245 PolarHBondContact O-N 2.86Å; L245-S247 PolarHBondContact O-N 2.77Å
246	I	89.6	Confident	90.4	Very high	11 Å²	11	49.3 Å²	49.3	6%	0.056	27%	0.268	C	S	.	.			trans	-68.2	125.6	176.6	-62.6	172.7	0	0	0	109.2	L197 L198 F202 Y236 C238 L243	L197-I246 HydrophobicContact CD2-CB 4.18Å; L198-I246 HydrophobicContact CD1-CG2 4.46Å; L198-I246 WeakPolarHBondContact CD1-O 3.32Å; F202-I246 HydrophobicContact CE1-CD1 4.25Å; F202-I246 HydrophobicContact CE2-CD1 3.62Å; F202-I246 HydrophobicContact CZ-CD1 3.36Å; Y236-I246 HydrophobicContact CD1-CD1 3.88Å; Y236-I246 HydrophobicContact CE1-CD1 3.48Å; Y236-I246 VanDerWaalsContact CE1-CD1 3.48Å; Y236-I246 HydrophobicContact CE1-CG1 3.79Å; C238-I246 HydrophobicContact CB-CD1 4.41Å; L243-I246 HydrophobicContact CD1-CD1 4.29Å; L243-I246 WeakPolarHBondContact O-CB 3.46Å; L243-I246 VanDerWaalsContact O-CG1 3.27Å; L243-I246 WeakPolarHBondContact O-CG1 3.1Å; L243-I246 PolarHBondContact O-N 3.42Å; L243-I246 VanDerWaalsContact O-N 3.07Å
247	S	88.3	Confident	89.9	Confident	82 Å²	82	56.1 Å²	56.1	57%	0.573	30%	0.3	S	S	*	.			trans	-122.3	21.1	-174.2	62.7	0	0	0	0	112.1	L245	L245-S247 PolarHBondContact O-N 2.77Å
248	K	86.1	Confident	89.5	Confident	35 Å²	35	56.8 Å²	56.8	15%	0.152	31%	0.306	C	S	.	.	S	Bend	trans	-135.2	130.3	-169.4	-62.9	175.2	174.9	-177.6	0	109.6	H200 E280	H200-K248 PolarHBondContact NE2-O 3.14Å; K248-E280 HydrophobicContact CD-CG 4.5Å; K248-E280 VanDerWaalsContact CD-OE1 3.28Å; K248-E280 WeakPolarHBondContact CD-OE1 3.19Å; K248-E280 VanDerWaalsContact CE-CD 3.42Å; K248-E280 WeakPolarHBondContact CE-O 3.49Å; K248-E280 WeakPolarHBondContact CE-OE1 3.49Å; K248-E280 IonicContact NZ-OE1 3.09Å; K248-E280 PolarHBondContact NZ-OE1 2.76Å; K248-E280 IonicContact NZ-OE2 2.64Å; K248-E280 PolarHBondContact NZ-OE2 2.72Å
249	P	90.3	Very high	89.4	Confident	87 Å²	87	57.9 Å²	57.9	57%	0.565	32%	0.315	S	S	*	.			trans	-67	165.9	177.7	29.4	-35.3	0	0	0	112.6	L198 H200 V251	L198-P249 CarbonylContact O-C 3.56Å; L198-P249 WeakPolarHBondContact O-CA 3.34Å; H200-P249 VanDerWaalsContact NE2-C 3.32Å; H200-P249 PolarHBondContact NE2-O 2.71Å; P249-V251 PolarHBondContact O-N 3.4Å
250	C	92.4	Very high	89.6	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.034	34%	0.34	C	S	.	.			trans	-71.2	122.1	179.8	-177.5	0	0	0	0	111.8	L198 E199 H200 C234 S252 S253 K254	L198-C250 PolarHBondContact O-N 2.72Å; E199-C250 VanDerWaalsContact C-CB 3.44Å; E199-C250 HydrophobicContact CB-CB 4.01Å; E199-C250 WeakPolarHBondContact O-CB 3.44Å; H200-C250 HydrophobicContact CB-CB 4.36Å; H200-C250 PolarHBondContact NE2-N 2.97Å; C234-C250 VanDerWaalsContact SG-SG 3.69Å; C250-S252 PolarHBondContact O-N 3.48Å; C250-S253 WeakPolarHBondContact O-CA 3.3Å; C250-S253 WeakPolarHBondContact O-CB 3.22Å; C250-S253 PolarHBondContact O-N 2.76Å; C250-K254 PolarHBondContact O-N 3.38Å; C250-K254 VanDerWaalsContact O-N 3.07Å
251	V	93.8	Very high	90	Very high	14 Å²	14	62.4 Å²	62.4	9%	0.085	33%	0.33	C	S	.	.	H	α-helix	trans	-59.9	-34	178.4	-170.2	0	0	0	0	111.6	C234 P249 K254 V255 R337 Y338 L341	C234-V251 HydrophobicContact CB-CB 3.96Å; P249-V251 PolarHBondContact O-N 3.4Å; V251-K254 PolarHBondContact O-N 3.14Å; V251-V255 WeakPolarHBondContact O-CG2 3.37Å; V251-V255 PolarHBondContact O-N 3.2Å; V251-R337 HydrophobicContact CB-CB 4.29Å; V251-R337 HydrophobicContact CG1-CB 4.09Å; V251-R337 HydrophobicContact CG2-CB 4.24Å; V251-Y338 HydrophobicContact CG1-CD2 3.96Å; V251-Y338 HydrophobicContact CG1-CG 4.39Å; V251-L341 HydrophobicContact CB-CD1 4.47Å; V251-L341 HydrophobicContact CG1-CD1 4.36Å
252	S	93.3	Very high	90.4	Very high	30 Å²	30	57.9 Å²	57.9	21%	0.21	31%	0.312	C	S	.	.	H	α-helix	trans	-71	-29.2	175.6	154.9	0	0	0	0	112.9	G233 C250 S256	G233-S252 WeakPolarHBondContact O-CB 3.46Å; C250-S252 PolarHBondContact O-N 3.48Å; S252-S256 PolarHBondContact O-N 3.35Å; S252-S256 VanDerWaalsContact O-N 3.12Å; S252-S256 PolarHBondContact O-OG 2.9Å; S252-S256 VanDerWaalsContact O-OG 3.08Å
253	S	91.4	Very high	90.6	Very high	18 Å²	18	59.6 Å²	59.6	13%	0.126	32%	0.32	C	S	.	.	H	α-helix	trans	-68.4	-45.5	170.4	-169.4	0	0	0	0	110.6	E199 C250 V255 S256 H257	E199-S253 WeakPolarHBondContact OE2-CB 3.47Å; E199-S253 PolarHBondContact OE2-OG 3.28Å; C250-S253 WeakPolarHBondContact O-CA 3.3Å; C250-S253 WeakPolarHBondContact O-CB 3.22Å; C250-S253 PolarHBondContact O-N 2.76Å; S253-V255 VanDerWaalsContact C-N 3.33Å; S253-V255 PolarHBondContact O-N 2.6Å; S253-S256 WeakPolarHBondContact O-CB 3.43Å; S253-S256 PolarHBondContact O-N 2.98Å; S253-H257 PolarHBondContact O-CD2 3.37Å; S253-H257 VanDerWaalsContact O-CD2 3.24Å; S253-H257 PolarHBondContact O-N 2.8Å; S253-H257 VanDerWaalsContact O-N 3.16Å
254	K	87.8	Confident	90.9	Very high	112 Å²	112	64.4 Å²	64.4	49%	0.487	35%	0.346	S	S	.	.	H	α-helix	trans	-55.2	-46.5	172.8	-171.3	-176.8	177.4	-172.4	0	111.7	C250 V251 S256 H257 Q258 Y338	C250-K254 PolarHBondContact O-N 3.38Å; C250-K254 VanDerWaalsContact O-N 3.07Å; V251-K254 PolarHBondContact O-N 3.14Å; K254-S256 VanDerWaalsContact C-N 3.28Å; K254-S256 PolarHBondContact O-N 2.89Å; K254-H257 PolarHBondContact O-N 3.2Å; K254-Q258 VanDerWaalsContact CE-OE1 3.31Å; K254-Q258 PolarHBondContact O-N 2.74Å; K254-Y338 HydrophobicContact CD-CE2 4.23Å; K254-Y338 HydrophobicContact CG-CE2 4.33Å
255	V	90.9	Very high	91.2	Very high	6 Å²	6	59.4 Å²	59.4	4%	0.036	32%	0.319	C	S	.	.	H	α-helix	trans	-61.6	-32.9	177.8	170	0	0	0	0	112.8	V251 S253 Y338 L341 M342	V251-V255 WeakPolarHBondContact O-CG2 3.37Å; V251-V255 PolarHBondContact O-N 3.2Å; S253-V255 VanDerWaalsContact C-N 3.33Å; S253-V255 PolarHBondContact O-N 2.6Å; V255-Y338 HydrophobicContact CB-CE2 4.42Å; V255-Y338 HydrophobicContact CG2-CD2 3.46Å; V255-Y338 VanDerWaalsContact CG2-CD2 3.46Å; V255-Y338 HydrophobicContact CG2-CE2 3.35Å; V255-Y338 HydrophobicContact CG2-CG 4.29Å; V255-L341 HydrophobicContact CG1-CB 4.38Å; V255-L341 HydrophobicContact CG2-CB 4.02Å; V255-L341 HydrophobicContact CG2-CD1 4.42Å; V255-M342 HydrophobicContact CG1-CG 4.39Å; V255-M342 HydrophobicContact CG1-SD 3.91Å; V255-M342 HydrophobicContact CG2-CG 4.1Å; V255-M342 HydrophobicContact CG2-SD 4.38Å
256	S	88.8	Confident	91.3	Very high	83 Å²	83	54.9 Å²	54.9	58%	0.58	30%	0.296	S	S	*	.	H	α-helix	trans	-69.7	-32.1	175.6	-64.3	0	0	0	0	113.3	S252 S253 K254	S252-S256 PolarHBondContact O-N 3.35Å; S252-S256 VanDerWaalsContact O-N 3.12Å; S252-S256 PolarHBondContact O-OG 2.9Å; S252-S256 VanDerWaalsContact O-OG 3.08Å; S253-S256 WeakPolarHBondContact O-CB 3.43Å; S253-S256 PolarHBondContact O-N 2.98Å; K254-S256 VanDerWaalsContact C-N 3.28Å; K254-S256 PolarHBondContact O-N 2.89Å
257	H	83	Confident	91.5	Very high	159 Å²	159	56.2 Å²	56.2	74%	0.736	31%	0.305	S	S	*	.	H	α-helix	trans	-92.1	-33.7	179.6	-68.1	-63.7	0	0	0	114	S253 K254	S253-H257 PolarHBondContact O-CD2 3.37Å; S253-H257 VanDerWaalsContact O-CD2 3.24Å; S253-H257 PolarHBondContact O-N 2.8Å; S253-H257 VanDerWaalsContact O-N 3.16Å; K254-H257 PolarHBondContact O-N 3.2Å
258	Q	85	Confident	91.4	Very high	85 Å²	85	55.1 Å²	55.1	40%	0.397	29%	0.291	S	S	.	.			trans	-138.7	101	179.2	-170	-175.6	24	0	0	109.5	K254 E260 Y338	K254-Q258 VanDerWaalsContact CE-OE1 3.31Å; K254-Q258 PolarHBondContact O-N 2.74Å; Q258-E260 HydrophobicContact CG-CB 4.25Å; Q258-E260 HydrophobicContact CG-CG 4.21Å; Q258-E260 VanDerWaalsContact CG-OE2 3.28Å; Q258-E260 WeakPolarHBondContact CG-OE2 3.46Å; Q258-E260 PolarHBondContact NE2-OE2 3.46Å; Q258-Y338 PolarHBondContact O-OH 2.86Å
259	A	90.5	Very high	91.3	Very high	23 Å²	23	57.5 Å²	57.5	19%	0.19	31%	0.309	C	S	.	.			trans	-104.2	65.4	178.5	0	0	0	0	0	110.6	M342	A259-M342 HydrophobicContact CB-CE 4.26Å; A259-M342 HydrophobicContact CB-SD 3.91Å
260	E	94.8	Very high	91.1	Very high	121 Å²	121	54.3 Å²	54.3	57%	0.565	29%	0.292	S	S	*	.			trans	-131.5	146.5	-174.4	-64.2	173	149.4	0	0	109.7	Q258 Y338	Q258-E260 HydrophobicContact CG-CB 4.25Å; Q258-E260 HydrophobicContact CG-CG 4.21Å; Q258-E260 VanDerWaalsContact CG-OE2 3.28Å; Q258-E260 WeakPolarHBondContact CG-OE2 3.46Å; Q258-E260 PolarHBondContact NE2-OE2 3.46Å; E260-Y338 PolarHBondContact N-OH 3.09Å; E260-Y338 WeakPolarHBondContact O-CE1 3.31Å; E260-Y338 PolarHBondContact O-OH 3.49Å
261	Y	96.9	Very high	91	Very high	28 Å²	28	54.9 Å²	54.9	11%	0.11	29%	0.294	C	S	.	.			trans	-96.7	144.2	177.8	-71.9	-62.8	0	0	0	111.6	L263 Y299 P317 L339 M342 V347 L348 V411	Y261-L263 PolarHBondContact O-N 3.39Å; Y261-Y299 WeakPolarHBondContact CA-OH 3.34Å; Y261-Y299 HydrophobicContact CD1-CE2 4.44Å; Y261-P317 HydrophobicContact CD1-CB 3.9Å; Y261-P317 HydrophobicContact CD1-CG 3.33Å; Y261-P317 HydrophobicContact CD2-CB 4.17Å; Y261-P317 HydrophobicContact CD2-CG 4.39Å; Y261-P317 HydrophobicContact CE1-CB 4.21Å; Y261-P317 HydrophobicContact CE1-CG 3.41Å; Y261-P317 VanDerWaalsContact CE1-CG 3.41Å; Y261-P317 HydrophobicContact CE2-CB 4.5Å; Y261-P317 HydrophobicContact CE2-CG 4.48Å; Y261-P317 HydrophobicContact CG-CB 3.83Å; Y261-P317 HydrophobicContact CG-CG 3.82Å; Y261-L339 HydrophobicContact CD1-CD2 4.25Å; Y261-L339 HydrophobicContact CE1-CD2 3.97Å; Y261-M342 HydrophobicContact CD1-CB 4.47Å; Y261-M342 HydrophobicContact CD1-CE 4.09Å; Y261-M342 HydrophobicContact CD2-CE 4.2Å; Y261-M342 HydrophobicContact CE1-CB 3.5Å; Y261-M342 VanDerWaalsContact CE1-CB 3.5Å; Y261-M342 HydrophobicContact CE1-CE 3.99Å; Y261-M342 HydrophobicContact CE1-CG 4.19Å; Y261-M342 HydrophobicContact CE2-CE 4.07Å; Y261-M342 HydrophobicContact CG-CE 4.24Å; Y261-M342 WeakPolarHBondContact OH-CB 3.28Å; Y261-M342 PolarHBondContact OH-O 3.29Å; Y261-V347 HydrophobicContact CD2-CG2 3.59Å; Y261-V347 HydrophobicContact CE2-CG2 3.45Å; Y261-V347 VanDerWaalsContact CE2-CG2 3.45Å; Y261-L348 HydrophobicContact CD2-CD2 3.69Å; Y261-L348 HydrophobicContact CD2-CG 4.14Å; Y261-L348 HydrophobicContact CE2-CD1 4.4Å; Y261-L348 HydrophobicContact CE2-CD2 4.22Å; Y261-L348 HydrophobicContact CE2-CG 4.18Å; Y261-V411 HydrophobicContact CE1-CG2 4.47Å; Y261-V411 HydrophobicContact CE2-CG2 3.77Å; Y261-V411 WeakPolarHBondContact OH-CG2 3.42Å
262	E	95.7	Very high	90.9	Very high	68 Å²	68	58.9 Å²	58.9	32%	0.318	32%	0.315	S	S	.	.			trans	-68	125.2	153.4	-179.5	54.8	-92.1	0	0	108.1	N264 P267 Y299	E262-N264 WeakPolarHBondContact OE1-CB 3.4Å; E262-N264 PolarHBondContact OE1-N 3.05Å; E262-N264 PolarHBondContact OE1-ND2 3.24Å; E262-P267 HydrophobicContact CG-CG 4.02Å; E262-Y299 HydrophobicContact CB-CD2 4.4Å; E262-Y299 HydrophobicContact CB-CE2 3.78Å; E262-Y299 PolarHBondContact N-OH 3.09Å
263	L	96.1	Very high	90.9	Very high	43 Å²	43	60.4 Å²	60.4	23%	0.225	33%	0.326	C	S	.	.			trans	-115	-7.5	-175.8	-66.3	177.1	0	0	0	112.7	Y261 P317 A318 H322 L348 I353	Y261-L263 PolarHBondContact O-N 3.39Å; L263-P317 HydrophobicContact CD2-CB 4.28Å; L263-A318 VanDerWaalsContact C-CB 3.5Å; L263-A318 WeakPolarHBondContact O-CB 3.32Å; L263-H322 PolarHBondContact O-CD2 3.32Å; L263-H322 PolarHBondContact O-NE2 3.29Å; L263-L348 HydrophobicContact CD2-CD2 4.04Å; L263-I353 HydrophobicContact CD1-CD1 3.93Å; L263-I353 HydrophobicContact CD1-CG1 4.24Å; L263-I353 HydrophobicContact CD1-CG2 4.05Å
264	N	95.1	Very high	90.9	Very high	106 Å²	106	60.4 Å²	60.4	57%	0.567	32%	0.324	S	S	*	.	S	Bend	trans	-69.1	132.4	164.5	-63.7	-80.1	0	0	0	109.7	E262 C266 P267	E262-N264 WeakPolarHBondContact OE1-CB 3.4Å; E262-N264 PolarHBondContact OE1-N 3.05Å; E262-N264 PolarHBondContact OE1-ND2 3.24Å; N264-C266 PolarHBondContact O-N 2.99Å; N264-C266 VanDerWaalsContact O-N 3.08Å; N264-P267 HydrophobicContact CB-CB 4.01Å; N264-P267 HydrophobicContact CB-CG 4.41Å
265	I	95.1	Very high	91.2	Very high	29 Å²	29	59.9 Å²	59.9	15%	0.149	33%	0.326	C	S	.	.	S	Bend	trans	-75.5	101.4	178.2	-62.6	170.1	0	0	0	109.3	H75 A318 R319 H322 N323	H75-I265 HydrophobicContact CB-CD1 4.12Å; H75-I265 WeakPolarHBondContact O-CD1 3.33Å; I265-A318 HydrophobicContact CB-CB 4.46Å; I265-A318 HydrophobicContact CG1-CB 3.77Å; I265-R319 HydrophobicContact CG1-CG 4.2Å; I265-R319 HydrophobicContact CG2-CG 3.82Å; I265-H322 HydrophobicContact CD1-CB 4.01Å; I265-N323 WeakPolarHBondContact CD1-ND2 3.25Å
266	C	92.9	Very high	91.2	Very high	7 Å²	7	65 Å²	65	5%	0.047	35%	0.345	C	S	.	.	S	Bend	trans	51.4	80.8	-177.6	-165.1	0	0	0	0	111.7	N264 E268 D298	N264-C266 PolarHBondContact O-N 2.99Å; N264-C266 VanDerWaalsContact O-N 3.08Å; C266-E268 HydrophobicContact CB-CG 4.43Å; C266-E268 WeakPolarHBondContact O-CG 3.13Å; C266-E268 PolarHBondContact O-N 2.81Å; C266-E268 WeakPolarHBondContact SG-CG 3.27Å; C266-D298 VanDerWaalsContact CA-O 3.22Å; C266-D298 WeakPolarHBondContact CA-O 3.5Å; C266-D298 WeakPolarHBondContact CB-O 3.36Å; C266-D298 PolarHBondContact N-O 2.99Å
267	P	93	Very high	91.4	Very high	40 Å²	40	65.8 Å²	65.8	26%	0.26	34%	0.336	S	S	.	.			trans	-74.1	70.3	-178.4	30.8	-35.6	0	0	0	111.6	E262 N264 T269	E262-P267 HydrophobicContact CG-CG 4.02Å; N264-P267 HydrophobicContact CB-CB 4.01Å; N264-P267 HydrophobicContact CB-CG 4.41Å; P267-T269 PolarHBondContact O-N 3.48Å; P267-T269 PolarHBondContact O-OG1 3.35Å
268	E	87.4	Confident	91.9	Very high	59 Å²	59	58.2 Å²	58.2	28%	0.276	30%	0.301	S	S	.	.			trans	-64.1	124.6	-173.4	-61	-170.2	-143.8	0	0	112.4	N77 C266 Q296	N77-E268 PolarHBondContact ND2-OE1 3.49Å; C266-E268 HydrophobicContact CB-CG 4.43Å; C266-E268 WeakPolarHBondContact O-CG 3.13Å; C266-E268 PolarHBondContact O-N 2.81Å; C266-E268 WeakPolarHBondContact SG-CG 3.27Å; E268-Q296 VanDerWaalsContact CG-NE2 3.28Å; E268-Q296 PolarHBondContact OE2-NE2 3.46Å
269	T	83	Confident	92.3	Very high	85 Å²	85	55.7 Å²	55.7	52%	0.521	29%	0.294	S	S	.	.			trans	-109.9	2	-180	-19.6	0	0	0	0	113.1	P267 S273	P267-T269 PolarHBondContact O-N 3.48Å; P267-T269 PolarHBondContact O-OG1 3.35Å; T269-S273 VanDerWaalsContact O-CB 3.26Å; T269-S273 WeakPolarHBondContact O-CB 3.5Å; T269-S273 PolarHBondContact O-OG 3.27Å
270	G	87.1	Confident	92.3	Very high	20 Å²	20	56.6 Å²	56.6	21%	0.206	30%	0.295	C	S	.	.			trans	77.6	172	-168.4	0	0	0	0	0	113.5	D272 S273 Q274	G270-D272 WeakPolarHBondContact CA-OD1 3.47Å; G270-S273 PolarHBondContact O-OG 3.33Å; G270-Q274 PolarHBondContact O-NE2 3.02Å
271	L	89.9	Confident	92.1	Very high	17 Å²	17	53.5 Å²	53.5	9%	0.089	29%	0.286	C	S	.	.	S	Bend	trans	-96.9	-24.3	177.3	172.3	61.2	0	0	0	112	Q274 Y276 I285 L287 A294 Y303	L271-Q274 PolarHBondContact O-N 3.4Å; L271-Y276 HydrophobicContact CD2-CD1 4.2Å; L271-Y276 HydrophobicContact CG-CD1 3.9Å; L271-Y276 WeakPolarHBondContact O-CA 3.46Å; L271-Y276 PolarHBondContact O-N 2.71Å; L271-I285 HydrophobicContact CD1-CB 4.46Å; L271-I285 HydrophobicContact CD1-CD1 4Å; L271-I285 HydrophobicContact CD2-CG2 4.06Å; L271-L287 HydrophobicContact CD2-CD2 3.86Å; L271-A294 HydrophobicContact CD2-CB 3.91Å; L271-Y303 HydrophobicContact CB-CD2 3.98Å; L271-Y303 HydrophobicContact CB-CE2 4.29Å; L271-Y303 HydrophobicContact CB-CG 4.18Å; L271-Y303 HydrophobicContact CD1-CG 4.34Å
272	D	90.9	Very high	91.9	Very high	98 Å²	98	57.4 Å²	57.4	52%	0.524	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-60.9	-44.6	171.7	54.8	-61.9	0	0	0	112.2	G270 Q274 D275 Y276	G270-D272 WeakPolarHBondContact CA-OD1 3.47Å; D272-Q274 PolarHBondContact O-N 2.95Å; D272-D275 PolarHBondContact O-N 3Å; D272-Y276 HydrophobicContact CB-CE1 4.13Å; D272-Y276 HydrophobicContact CB-CE2 4.33Å
273	S	93	Very high	91.6	Very high	61 Å²	61	56 Å²	56	43%	0.427	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-63.1	-11.2	173.7	65.1	0	0	0	0	114.6	T269 G270	T269-S273 VanDerWaalsContact O-CB 3.26Å; T269-S273 WeakPolarHBondContact O-CB 3.5Å; T269-S273 PolarHBondContact O-OG 3.27Å; G270-S273 PolarHBondContact O-OG 3.33Å
274	Q	92.9	Very high	91.4	Very high	18 Å²	18	58.4 Å²	58.4	8%	0.084	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-104.5	15.8	174.3	-66.6	164	91.1	0	0	111.9	G270 L271 D272 Y276 R277 R282 Y303	G270-Q274 PolarHBondContact O-NE2 3.02Å; L271-Q274 PolarHBondContact O-N 3.4Å; D272-Q274 PolarHBondContact O-N 2.95Å; Q274-Y276 PolarHBondContact O-N 3.15Å; Q274-R277 WeakPolarHBondContact O-CB 3.46Å; Q274-R277 PolarHBondContact O-N 3.06Å; Q274-R277 VanDerWaalsContact O-N 3.08Å; Q274-R282 PolarHBondContact O-NH1 3.49Å; Q274-Y303 PolarHBondContact OE1-O 2.89Å
275	D	93.2	Very high	91.1	Very high	101 Å²	101	53.8 Å²	53.8	54%	0.54	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	30.4	-175.5	-41.7	-81.2	0	0	0	113.7	D272 R277 R282	D272-D275 PolarHBondContact O-N 3Å; D275-R277 VanDerWaalsContact C-N 3.27Å; D275-R277 PolarHBondContact O-N 2.72Å; D275-R282 IonicContact OD2-CZ 2.86Å; D275-R282 IonicContact OD2-NH1 3.48Å; D275-R282 IonicContact OD2-NH2 2.72Å; D275-R282 PolarHBondContact OD2-NH2 2.79Å
276	Y	91.8	Very high	90.3	Very high	113 Å²	113	55.6 Å²	55.6	44%	0.443	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	38.5	-170.8	-55.4	-80.6	0	0	0	113.6	L271 D272 Q274 I285 L287	L271-Y276 HydrophobicContact CD2-CD1 4.2Å; L271-Y276 HydrophobicContact CG-CD1 3.9Å; L271-Y276 WeakPolarHBondContact O-CA 3.46Å; L271-Y276 PolarHBondContact O-N 2.71Å; D272-Y276 HydrophobicContact CB-CE1 4.13Å; D272-Y276 HydrophobicContact CB-CE2 4.33Å; Q274-Y276 PolarHBondContact O-N 3.15Å; Y276-I285 PolarHBondContact O-N 2.91Å; Y276-L287 HydrophobicContact CD1-CD1 3.93Å; Y276-L287 HydrophobicContact CD1-CD2 4.15Å; Y276-L287 HydrophobicContact CD1-CG 4.22Å; Y276-L287 HydrophobicContact CE1-CD1 3.76Å; Y276-L287 HydrophobicContact CE1-CD2 4.39Å; Y276-L287 HydrophobicContact CE1-CG 4.48Å
277	R	92.7	Very high	89.2	Confident	101 Å²	101	61.3 Å²	61.3	38%	0.381	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-126.5	152.1	-179.9	-65.6	164.6	-177	-81.9	-2.7	112.2	Q274 D275 A279 R282 A283	Q274-R277 WeakPolarHBondContact O-CB 3.46Å; Q274-R277 PolarHBondContact O-N 3.06Å; Q274-R277 VanDerWaalsContact O-N 3.08Å; D275-R277 VanDerWaalsContact C-N 3.27Å; D275-R277 PolarHBondContact O-N 2.72Å; R277-A279 PolarHBondContact O-N 2.92Å; R277-R282 WeakPolarHBondContact CD-O 3.46Å; R277-R282 WeakPolarHBondContact CG-O 3.43Å; R277-R282 PolarHBondContact NH1-O 3.02Å; R277-A283 VanDerWaalsContact CA-O 3.31Å; R277-A283 WeakPolarHBondContact CA-O 3.26Å
278	C	92.5	Very high	87.8	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	37%	0.365	C	S	.	.			trans	-58.5	125.8	171.3	175.1	0	0	0	0	111	E280 C281 R282 A283 I285 Y303 C305	C278-E280 PolarHBondContact O-N 3.06Å; C278-E280 VanDerWaalsContact O-N 3.14Å; C278-C281 PolarHBondContact O-N 3.34Å; C278-R282 VanDerWaalsContact O-CA 3.24Å; C278-R282 WeakPolarHBondContact O-CA 3.48Å; C278-R282 PolarHBondContact O-N 3.09Å; C278-A283 PolarHBondContact N-O 2.87Å; C278-I285 HydrophobicContact CB-CD1 4.12Å; C278-I285 HydrophobicContact CB-CG1 4.43Å; C278-Y303 WeakPolarHBondContact CA-O 3.32Å; C278-C305 HydrophobicContact CB-CB 4.09Å; C278-C305 PolarHBondContact SG-N 3.37Å; C278-C305 VanDerWaalsContact SG-N 3.37Å
279	A	93.8	Very high	86.2	Confident	31 Å²	31	70.5 Å²	70.5	26%	0.256	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-38.6	177.2	0	0	0	0	0	113.6	R277 Q302 Y303 Y304	R277-A279 PolarHBondContact O-N 2.92Å; A279-Q302 HydrophobicContact CB-CB 4.05Å; A279-Q302 HydrophobicContact CB-CG 4.48Å; A279-Y303 PolarHBondContact N-O 3.04Å; A279-Y304 HydrophobicContact CB-CD1 4.36Å; A279-Y304 HydrophobicContact CB-CE1 3.9Å
280	E	91	Very high	85	Confident	43 Å²	43	72.9 Å²	72.9	20%	0.201	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-19.3	-168.3	-136.4	-157.2	155.1	0	0	115.4	K248 C278 Y304 C308 C334	K248-E280 HydrophobicContact CD-CG 4.5Å; K248-E280 VanDerWaalsContact CD-OE1 3.28Å; K248-E280 WeakPolarHBondContact CD-OE1 3.19Å; K248-E280 VanDerWaalsContact CE-CD 3.42Å; K248-E280 WeakPolarHBondContact CE-O 3.49Å; K248-E280 WeakPolarHBondContact CE-OE1 3.49Å; K248-E280 IonicContact NZ-OE1 3.09Å; K248-E280 PolarHBondContact NZ-OE1 2.76Å; K248-E280 IonicContact NZ-OE2 2.64Å; K248-E280 PolarHBondContact NZ-OE2 2.72Å; C278-E280 PolarHBondContact O-N 3.06Å; C278-E280 VanDerWaalsContact O-N 3.14Å; E280-Y304 HydrophobicContact CB-CD1 3.89Å; E280-Y304 HydrophobicContact CB-CE1 3.87Å; E280-Y304 HydrophobicContact CG-CE1 4.28Å; E280-C308 HydrophobicContact CB-CB 4.17Å; E280-C308 VanDerWaalsContact OE2-CB 3.25Å; E280-C308 WeakPolarHBondContact OE2-CB 3.49Å; E280-C334 WeakPolarHBondContact OE1-CB 3.47Å
281	C	90.4	Very high	83.3	Confident	55 Å²	55	77.5 Å²	77.5	37%	0.372	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.6	-2.2	-178.3	73.2	0	0	0	0	114.6	C278 A283 C305 C308	C278-C281 PolarHBondContact O-N 3.34Å; C281-A283 PolarHBondContact O-N 2.74Å; C281-C305 VanDerWaalsContact SG-SG 3.64Å; C281-C308 VanDerWaalsContact SG-SG 3.64Å
282	R	92.3	Very high	81.9	Confident	110 Å²	110	78.5 Å²	78.5	42%	0.415	44%	0.437	S	S	.	.			trans	55.1	11.4	178.3	-53.5	-66.7	-74.4	147.9	0.6	115.7	Q274 D275 R277 C278	Q274-R282 PolarHBondContact O-NH1 3.49Å; D275-R282 IonicContact OD2-CZ 2.86Å; D275-R282 IonicContact OD2-NH1 3.48Å; D275-R282 IonicContact OD2-NH2 2.72Å; D275-R282 PolarHBondContact OD2-NH2 2.79Å; R277-R282 WeakPolarHBondContact CD-O 3.46Å; R277-R282 WeakPolarHBondContact CG-O 3.43Å; R277-R282 PolarHBondContact NH1-O 3.02Å; C278-R282 VanDerWaalsContact O-CA 3.24Å; C278-R282 WeakPolarHBondContact O-CA 3.48Å; C278-R282 PolarHBondContact O-N 3.09Å
283	A	90.4	Very high	81.3	Confident	40 Å²	40	80.8 Å²	80.8	33%	0.331	44%	0.444	S	S	.	.			trans	-63.1	140.6	167	0	0	0	0	0	110.1	R277 C278 C281	R277-A283 VanDerWaalsContact CA-O 3.31Å; R277-A283 WeakPolarHBondContact CA-O 3.26Å; C278-A283 PolarHBondContact N-O 2.87Å; C281-A283 PolarHBondContact O-N 2.74Å
284	P	90.9	Very high	81.1	Confident	92 Å²	92	79.4 Å²	79.4	60%	0.597	44%	0.437	S	S	*	.	B	Isolated β-bridge	trans	-65	146.4	178.9	28.8	-35.2	0	0	0	111.4
285	I	89.3	Confident	81	Confident	9 Å²	9	81.7 Å²	81.7	5%	0.046	45%	0.445	C	S	.	.			trans	-110.3	125.8	175.5	-65.8	178.5	0	0	0	107.2	L271 Y276 C278 A294 C305	L271-I285 HydrophobicContact CD1-CB 4.46Å; L271-I285 HydrophobicContact CD1-CD1 4Å; L271-I285 HydrophobicContact CD2-CG2 4.06Å; Y276-I285 PolarHBondContact O-N 2.91Å; C278-I285 HydrophobicContact CB-CD1 4.12Å; C278-I285 HydrophobicContact CB-CG1 4.43Å; I285-A294 HydrophobicContact CG2-CB 3.67Å; I285-C305 HydrophobicContact CG1-CB 4.48Å
286	S	77.4	Confident	81.1	Confident	68 Å²	68	79.6 Å²	79.6	48%	0.476	43%	0.431	S	S	.	.			trans	-82.6	129.9	-178.6	-177.8	0	0	0	0	110.5	R288	S286-R288 VanDerWaalsContact C-N 3.29Å; S286-R288 PolarHBondContact OG-N 3.33Å; S286-R288 VanDerWaalsContact OG-N 3.14Å; S286-R288 PolarHBondContact OG-O 3.41Å; S286-R288 VanDerWaalsContact OG-O 3.08Å
287	L	70	Confident	81.3	Confident	126 Å²	126	74.2 Å²	74.2	66%	0.66	41%	0.41	S	S	*	.	S	Bend	trans	-79.4	-10	170.3	-60.5	178.5	0	0	0	113.1	L271 Y276	L271-L287 HydrophobicContact CD2-CD2 3.86Å; Y276-L287 HydrophobicContact CD1-CD1 3.93Å; Y276-L287 HydrophobicContact CD1-CD2 4.15Å; Y276-L287 HydrophobicContact CD1-CG 4.22Å; Y276-L287 HydrophobicContact CE1-CD1 3.76Å; Y276-L287 HydrophobicContact CE1-CD2 4.39Å; Y276-L287 HydrophobicContact CE1-CG 4.48Å
288	R	63.7	Low	81.5	Confident	220 Å²	220	70.2 Å²	70.2	83%	0.83	40%	0.397	S	S	*	.	S	Bend	trans	-111.2	113.1	-177.6	-67	-170.2	178.7	-157.5	-0.5	111	S286	S286-R288 VanDerWaalsContact C-N 3.29Å; S286-R288 PolarHBondContact OG-N 3.33Å; S286-R288 VanDerWaalsContact OG-N 3.14Å; S286-R288 PolarHBondContact OG-O 3.41Å; S286-R288 VanDerWaalsContact OG-O 3.08Å
289	G	54.5	Low	81.8	Confident	72 Å²	72	71 Å²	71	74%	0.742	40%	0.4	S	S	*	.	S	Bend	trans	30.6	101.5	159.2	0	0	0	0	0	119.5
290	V	57.8	Low	81.9	Confident	136 Å²	136	70.9 Å²	70.9	82%	0.824	40%	0.396	S	S	*	.	S	Bend	trans	69.3	140.4	159.5	-169.7	0	0	0	0	116
291	P	51.3	Low	82.1	Confident	116 Å²	116	68.9 Å²	68.9	75%	0.753	39%	0.386	S	S	*	.	S	Bend	cis	-105.6	20.7	-21.5	39.2	-29.1	0	0	0	112.1	E293	P291-E293 PolarHBondContact O-N 3.46Å
292	S	61.2	Low	82.3	Confident	39 Å²	39	70 Å²	70	27%	0.273	39%	0.386	S	S	.	.			trans	-100.5	50.1	-178.1	-156.2	0	0	0	0	112.4
293	E	77.3	Confident	82.5	Confident	146 Å²	146	67 Å²	67	68%	0.682	38%	0.375	S	S	*	.			trans	-60.5	140.6	177.4	-175.7	-178.5	-148.2	0	0	111.8	P291 R295	P291-E293 PolarHBondContact O-N 3.46Å; E293-R295 PolarHBondContact O-N 2.85Å
294	A	87.8	Confident	82.6	Confident	32 Å²	32	65.6 Å²	65.6	26%	0.264	36%	0.361	S	S	.	.			trans	-70.3	118.5	178	0	0	0	0	0	110.7	L271 I285 Y303	L271-A294 HydrophobicContact CD2-CB 3.91Å; I285-A294 HydrophobicContact CG2-CB 3.67Å; A294-Y303 HydrophobicContact CB-CD1 3.81Å; A294-Y303 HydrophobicContact CB-CE1 4.46Å
295	R	92	Very high	82.7	Confident	66 Å²	66	61.7 Å²	61.7	25%	0.249	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	112.8	178	-66.6	176.5	176.4	-169.7	-5.7	110.3	E293 Y304 H309 N311	E293-R295 PolarHBondContact O-N 2.85Å; R295-Y304 PolarHBondContact N-O 2.7Å; R295-Y304 PolarHBondContact O-N 3.31Å; R295-H309 HydrophobicContact CB-CB 3.98Å; R295-H309 WeakPolarHBondContact CD-O 3.41Å; R295-H309 PolarHBondContact NH1-O 3.49Å; R295-N311 WeakPolarHBondContact CD-OD1 3.39Å
296	Q	94	Very high	82.7	Confident	56 Å²	56	62.5 Å²	62.5	26%	0.262	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	137.6	177.3	-167.7	172.4	42.7	0	0	111.2	E268 Q302 Y303 H309	E268-Q296 VanDerWaalsContact CG-NE2 3.28Å; E268-Q296 PolarHBondContact OE2-NE2 3.46Å; Q296-Q302 WeakPolarHBondContact CA-O 3.47Å; Q296-Y303 HydrophobicContact CB-CD1 3.91Å; Q296-Y303 HydrophobicContact CB-CE1 3.75Å; Q296-Y303 HydrophobicContact CG-CD1 4.39Å; Q296-Y303 HydrophobicContact CG-CE1 4.1Å; Q296-Y303 HydrophobicContact CG-CE2 4.49Å; Q296-Y303 VanDerWaalsContact NE2-CZ 3.33Å; Q296-Y303 PolarHBondContact NE2-OH 2.91Å; Q296-Y303 VanDerWaalsContact NE2-OH 3.14Å; Q296-H309 PolarHBondContact O-NE2 2.95Å; Q296-H309 VanDerWaalsContact O-NE2 3.1Å
297	C	96.7	Very high	83.3	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.344	C	S	.	.			trans	-101.1	114.7	176.5	171.6	0	0	0	0	110.4	Y299 T300 G301 Q302 Y304 S332 S335	C297-Y299 PolarHBondContact O-N 3.13Å; C297-Y299 VanDerWaalsContact O-N 3.15Å; C297-T300 WeakPolarHBondContact CB-OG1 3.22Å; C297-T300 PolarHBondContact O-N 3.25Å; C297-T300 PolarHBondContact SG-OG1 3.35Å; C297-G301 PolarHBondContact O-N 3.4Å; C297-Q302 PolarHBondContact N-O 3.11Å; C297-Y304 HydrophobicContact CB-CD2 3.82Å; C297-Y304 HydrophobicContact CB-CE2 3.37Å; C297-S332 PolarHBondContact SG-N 3.44Å; C297-S335 VanDerWaalsContact SG-CB 3.59Å; C297-S335 PolarHBondContact SG-OG 2.93Å
298	D	97.3	Very high	84.3	Confident	18 Å²	18	58.8 Å²	58.8	10%	0.096	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.7	-174.5	-164.1	-83.1	0	0	0	113.4	C266 T300 I316 R319 R329 K330	C266-D298 VanDerWaalsContact CA-O 3.22Å; C266-D298 WeakPolarHBondContact CA-O 3.5Å; C266-D298 WeakPolarHBondContact CB-O 3.36Å; C266-D298 PolarHBondContact N-O 2.99Å; D298-T300 VanDerWaalsContact C-N 3.34Å; D298-T300 PolarHBondContact O-N 2.93Å; D298-I316 HydrophobicContact CB-CD1 4.41Å; D298-I316 HydrophobicContact CB-CG1 4.41Å; D298-R319 IonicContact OD1-CZ 3.1Å; D298-R319 IonicContact OD1-NE 2.77Å; D298-R319 PolarHBondContact OD1-NE 3.31Å; D298-R319 IonicContact OD1-NH2 2.67Å; D298-R319 PolarHBondContact OD1-NH2 3.08Å; D298-R319 IonicContact OD2-CZ 2.64Å; D298-R319 IonicContact OD2-NE 2.78Å; D298-R319 PolarHBondContact OD2-NE 3.01Å; D298-R319 IonicContact OD2-NH2 3.2Å; D298-R319 PolarHBondContact OD2-NH2 3.23Å; D298-R329 HydrophobicContact CB-CB 3.48Å; D298-R329 VanDerWaalsContact CB-CB 3.48Å; D298-R329 HydrophobicContact CB-CG 4.14Å; D298-K330 PolarHBondContact N-O 3.08Å
299	Y	97.8	Very high	85.8	Confident	16 Å²	16	48.4 Å²	48.4	6%	0.063	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-23.5	176.3	-176.6	-121.8	0	0	0	114.5	Y261 E262 C297 I316 P317 Y338 L339	Y261-Y299 WeakPolarHBondContact CA-OH 3.34Å; Y261-Y299 HydrophobicContact CD1-CE2 4.44Å; E262-Y299 HydrophobicContact CB-CD2 4.4Å; E262-Y299 HydrophobicContact CB-CE2 3.78Å; E262-Y299 PolarHBondContact N-OH 3.09Å; C297-Y299 PolarHBondContact O-N 3.13Å; C297-Y299 VanDerWaalsContact O-N 3.15Å; Y299-I316 HydrophobicContact CD2-CG2 4.49Å; Y299-P317 HydrophobicContact CE2-CG 4.27Å; Y299-Y338 AromaticContact CE1-CD1 3.95Å; Y299-Y338 HydrophobicContact CE1-CD1 3.95Å; Y299-L339 HydrophobicContact CD1-CD1 4.42Å; Y299-L339 HydrophobicContact CD1-CD2 4.4Å; Y299-L339 HydrophobicContact CD1-CG 4.34Å; Y299-L339 HydrophobicContact CD2-CD1 4.31Å; Y299-L339 HydrophobicContact CD2-CD2 3.87Å; Y299-L339 HydrophobicContact CD2-CG 4.46Å; Y299-L339 HydrophobicContact CE1-CD2 4.27Å; Y299-L339 HydrophobicContact CE2-CD2 3.73Å; Y299-L339 HydrophobicContact CG-CD1 4.04Å; Y299-L339 HydrophobicContact CG-CD2 4.22Å; Y299-L339 HydrophobicContact CG-CG 4.32Å
300	T	96.3	Very high	87.6	Confident	29 Å²	29	47.6 Å²	47.6	18%	0.178	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	-5.7	-170.2	56.9	0	0	0	0	114.5	C297 D298 Q302 Y304	C297-T300 WeakPolarHBondContact CB-OG1 3.22Å; C297-T300 PolarHBondContact O-N 3.25Å; C297-T300 PolarHBondContact SG-OG1 3.35Å; D298-T300 VanDerWaalsContact C-N 3.34Å; D298-T300 PolarHBondContact O-N 2.93Å; T300-Q302 PolarHBondContact O-N 3.05Å; T300-Y304 PolarHBondContact OG1-OH 3.01Å; T300-Y304 VanDerWaalsContact OG1-OH 3.09Å
301	G	95.5	Very high	89.4	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.226	C	C	.	.			trans	65.8	-12.3	-175.9	0	0	0	0	0	115.5	C297	C297-G301 PolarHBondContact O-N 3.4Å
302	Q	95.8	Very high	91.5	Very high	78 Å²	78	39.6 Å²	39.6	36%	0.364	20%	0.197	S	C	.	.			trans	-79.5	162.1	-175	-73.6	170.3	11.3	0	0	112.7	A279 Q296 C297 T300 Y304	A279-Q302 HydrophobicContact CB-CB 4.05Å; A279-Q302 HydrophobicContact CB-CG 4.48Å; Q296-Q302 WeakPolarHBondContact CA-O 3.47Å; C297-Q302 PolarHBondContact N-O 3.11Å; T300-Q302 PolarHBondContact O-N 3.05Å; Q302-Y304 HydrophobicContact CB-CE2 3.71Å; Q302-Y304 WeakPolarHBondContact O-CD2 3.27Å; Q302-Y304 VanDerWaalsContact O-CE2 3.3Å; Q302-Y304 WeakPolarHBondContact O-CE2 3.1Å; Q302-Y304 PolarHBondContact OE1-OH 3.09Å
303	Y	94.6	Very high	93.2	Very high	47 Å²	47	43.1 Å²	43.1	18%	0.184	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	138.7	-175.2	-71.8	-92.7	0	0	0	111.6	L271 Q274 C278 A279 A294 Q296	L271-Y303 HydrophobicContact CB-CD2 3.98Å; L271-Y303 HydrophobicContact CB-CE2 4.29Å; L271-Y303 HydrophobicContact CB-CG 4.18Å; L271-Y303 HydrophobicContact CD1-CG 4.34Å; Q274-Y303 PolarHBondContact OE1-O 2.89Å; C278-Y303 WeakPolarHBondContact CA-O 3.32Å; A279-Y303 PolarHBondContact N-O 3.04Å; A294-Y303 HydrophobicContact CB-CD1 3.81Å; A294-Y303 HydrophobicContact CB-CE1 4.46Å; Q296-Y303 HydrophobicContact CB-CD1 3.91Å; Q296-Y303 HydrophobicContact CB-CE1 3.75Å; Q296-Y303 HydrophobicContact CG-CD1 4.39Å; Q296-Y303 HydrophobicContact CG-CE1 4.1Å; Q296-Y303 HydrophobicContact CG-CE2 4.49Å; Q296-Y303 VanDerWaalsContact NE2-CZ 3.33Å; Q296-Y303 PolarHBondContact NE2-OH 2.91Å; Q296-Y303 VanDerWaalsContact NE2-OH 3.14Å
304	Y	93.8	Very high	94.2	Very high	11 Å²	11	36.8 Å²	36.8	4%	0.043	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	152	-169.5	-60.9	-99.4	0	0	0	110.7	A279 E280 R295 C297 T300 Q302 C308 H309	A279-Y304 HydrophobicContact CB-CD1 4.36Å; A279-Y304 HydrophobicContact CB-CE1 3.9Å; E280-Y304 HydrophobicContact CB-CD1 3.89Å; E280-Y304 HydrophobicContact CB-CE1 3.87Å; E280-Y304 HydrophobicContact CG-CE1 4.28Å; R295-Y304 PolarHBondContact N-O 2.7Å; R295-Y304 PolarHBondContact O-N 3.31Å; C297-Y304 HydrophobicContact CB-CD2 3.82Å; C297-Y304 HydrophobicContact CB-CE2 3.37Å; T300-Y304 PolarHBondContact OG1-OH 3.01Å; T300-Y304 VanDerWaalsContact OG1-OH 3.09Å; Q302-Y304 HydrophobicContact CB-CE2 3.71Å; Q302-Y304 WeakPolarHBondContact O-CD2 3.27Å; Q302-Y304 VanDerWaalsContact O-CE2 3.3Å; Q302-Y304 WeakPolarHBondContact O-CE2 3.1Å; Q302-Y304 PolarHBondContact OE1-OH 3.09Å; Y304-C308 HydrophobicContact CD1-CB 4.21Å; Y304-H309 HydrophobicContact CG-CB 4.19Å
305	C	91.8	Very high	94.7	Very high	10 Å²	10	36.9 Å²	36.9	7%	0.068	18%	0.182	C	C	.	.			trans	-79.5	161.6	169	70.2	0	0	0	0	111.3	C278 C281 I285 H307 C308 H309	C278-C305 HydrophobicContact CB-CB 4.09Å; C278-C305 PolarHBondContact SG-N 3.37Å; C278-C305 VanDerWaalsContact SG-N 3.37Å; C281-C305 VanDerWaalsContact SG-SG 3.64Å; I285-C305 HydrophobicContact CG1-CB 4.48Å; C305-H307 PolarHBondContact O-N 3.09Å; C305-C308 PolarHBondContact O-N 3.33Å; C305-H309 PolarHBondContact O-N 3.43Å
306	S	90.4	Very high	95	Very high	26 Å²	26	33.8 Å²	33.8	18%	0.182	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-24.1	179.1	55.7	0	0	0	0	115.6
307	H	89.4	Confident	95.2	Very high	109 Å²	109	31.2 Å²	31.2	51%	0.505	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-23.4	178.2	-68.6	70.1	0	0	0	114	C305 W310	C305-H307 PolarHBondContact O-N 3.09Å; H307-W310 PolarHBondContact O-NE1 3.46Å
308	C	91.5	Very high	95.3	Very high	8 Å²	8	31.2 Å²	31.2	5%	0.054	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-19.5	-177.9	-65.8	0	0	0	0	112.7	E280 C281 Y304 C305 R333	E280-C308 HydrophobicContact CB-CB 4.17Å; E280-C308 VanDerWaalsContact OE2-CB 3.25Å; E280-C308 WeakPolarHBondContact OE2-CB 3.49Å; C281-C308 VanDerWaalsContact SG-SG 3.64Å; Y304-C308 HydrophobicContact CD1-CB 4.21Å; C305-C308 PolarHBondContact O-N 3.33Å; C308-R333 WeakPolarHBondContact O-CB 3.33Å; C308-R333 PolarHBondContact O-N 2.62Å
309	H	94.1	Very high	95.3	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	15%	0.154	C	C	.	.			trans	-132.7	100.9	-177.2	-175.8	-63.9	0	0	0	109.2	R295 Q296 Y304 C305 N311 V331 S332	R295-H309 HydrophobicContact CB-CB 3.98Å; R295-H309 WeakPolarHBondContact CD-O 3.41Å; R295-H309 PolarHBondContact NH1-O 3.49Å; Q296-H309 PolarHBondContact O-NE2 2.95Å; Q296-H309 VanDerWaalsContact O-NE2 3.1Å; Y304-H309 HydrophobicContact CG-CB 4.19Å; C305-H309 PolarHBondContact O-N 3.43Å; H309-N311 PolarHBondContact CE1-OD1 3.02Å; H309-N311 VanDerWaalsContact CE1-OD1 3.29Å; H309-N311 PolarHBondContact ND1-N 3.31Å; H309-N311 PolarHBondContact ND1-OD1 2.75Å; H309-N311 PolarHBondContact O-N 3.36Å; H309-V331 PolarHBondContact CD2-O 3.42Å; H309-V331 PolarHBondContact NE2-O 3.34Å; H309-S332 PolarHBondContact CD2-N 2.97Å; H309-S332 VanDerWaalsContact CD2-N 3.28Å
310	W	93.4	Very high	95.3	Very high	56 Å²	56	29.7 Å²	29.7	21%	0.212	15%	0.151	C	C	.	.			trans	-87.7	7	-173	-55.1	-6	0	0	0	112.4	T213 N218 H307 D312 R333	T213-W310 HydrophobicContact CG2-CH2 3.49Å; T213-W310 VanDerWaalsContact CG2-CH2 3.49Å; T213-W310 HydrophobicContact CG2-CZ2 4.22Å; T213-W310 HydrophobicContact CG2-CZ3 3.76Å; N218-W310 VanDerWaalsContact OD1-CE2 3.28Å; N218-W310 WeakPolarHBondContact OD1-CZ2 3.22Å; H307-W310 PolarHBondContact O-NE1 3.46Å; W310-D312 VanDerWaalsContact C-N 3.3Å; W310-D312 WeakPolarHBondContact CB-OD2 3.37Å; W310-D312 PolarHBondContact N-OD2 3.47Å; W310-R333 HydrophobicContact CB-CG 4.37Å; W310-R333 VanDerWaalsContact CD2-CD 3.43Å; W310-R333 HydrophobicContact CD2-CG 3.76Å; W310-R333 HydrophobicContact CE3-CG 4.42Å; W310-R333 HydrophobicContact CG-CG 3.71Å; W310-R333 HydrophobicContact CZ2-CG 4.48Å
311	N	94.7	Very high	95.3	Very high	59 Å²	59	28.3 Å²	28.3	32%	0.316	14%	0.143	S	C	.	.			trans	66.1	32.8	-167.9	-55.7	-20.1	0	0	0	112.3	R295 H309 K330	R295-N311 WeakPolarHBondContact CD-OD1 3.39Å; H309-N311 PolarHBondContact CE1-OD1 3.02Å; H309-N311 VanDerWaalsContact CE1-OD1 3.29Å; H309-N311 PolarHBondContact ND1-N 3.31Å; H309-N311 PolarHBondContact ND1-OD1 2.75Å; H309-N311 PolarHBondContact O-N 3.36Å; N311-K330 HydrophobicContact CB-CD 4.38Å; N311-K330 HydrophobicContact CB-CG 4.37Å
312	D	96.1	Very high	95.2	Very high	25 Å²	25	30.3 Å²	30.3	13%	0.134	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	141.2	165.8	-47.2	-103.4	0	0	0	109.8	W310 K330 V331 R333 M336	W310-D312 VanDerWaalsContact C-N 3.3Å; W310-D312 WeakPolarHBondContact CB-OD2 3.37Å; W310-D312 PolarHBondContact N-OD2 3.47Å; D312-K330 WeakPolarHBondContact O-CA 3.43Å; D312-V331 HydrophobicContact CB-CG2 4.4Å; D312-V331 WeakPolarHBondContact O-CG2 3.5Å; D312-V331 PolarHBondContact O-N 3.37Å; D312-R333 WeakPolarHBondContact OD1-CD 3.41Å; D312-R333 IonicContact OD1-CZ 3.77Å; D312-R333 IonicContact OD1-NE 3.49Å; D312-R333 IonicContact OD1-NH1 2.69Å; D312-R333 PolarHBondContact OD1-NH1 3.25Å; D312-R333 WeakPolarHBondContact OD2-CD 3.19Å; D312-M336 HydrophobicContact CB-CB 4.06Å; D312-M336 HydrophobicContact CB-CG 4.07Å
313	L	97.9	Very high	95.1	Very high	112 Å²	112	26.7 Å²	26.7	59%	0.586	14%	0.135	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	135	-179.3	-64.9	179.3	0	0	0	110.4	P328 R329 K330	L313-P328 HydrophobicContact CB-CB 3.86Å; L313-R329 WeakPolarHBondContact CA-O 3.12Å; L313-K330 HydrophobicContact CD2-CG 3.91Å
314	A	98.2	Very high	95.2	Very high	14 Å²	14	24.5 Å²	24.5	12%	0.116	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	151	173.3	0	0	0	0	0	111.1	P328 R329 V331 L339	A314-P328 WeakPolarHBondContact O-CA 3.5Å; A314-R329 PolarHBondContact N-O 3.08Å; A314-R329 PolarHBondContact O-N 3.35Å; A314-V331 HydrophobicContact CB-CG1 4.45Å; A314-V331 HydrophobicContact CB-CG2 3.69Å; A314-L339 HydrophobicContact CB-CD1 3.64Å
315	V	98.3	Very high	95.3	Very high	33 Å²	33	25 Å²	25	20%	0.2	13%	0.13	C	C	.	.			trans	-74.1	137.1	169.9	-178.3	0	0	0	0	108.7	V320 F326 P328 L415	V315-V320 HydrophobicContact CG1-CG2 3.44Å; V315-V320 VanDerWaalsContact CG1-CG2 3.44Å; V315-F326 HydrophobicContact CG1-CD1 4.37Å; V315-F326 WeakPolarHBondContact CG2-O 3.37Å; V315-P328 HydrophobicContact CG2-CG 4.49Å; V315-L415 HydrophobicContact CG1-CD2 4.49Å; V315-L415 HydrophobicContact CG2-CD2 4.29Å
316	I	98.3	Very high	95.6	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.01	13%	0.131	C	C	.	.			trans	-104.4	116.9	-169.7	-54.2	-58	0	0	0	110.4	D298 Y299 A318 R319 V320 R329 V331 L339	D298-I316 HydrophobicContact CB-CD1 4.41Å; D298-I316 HydrophobicContact CB-CG1 4.41Å; Y299-I316 HydrophobicContact CD2-CG2 4.49Å; I316-A318 VanDerWaalsContact C-N 3.32Å; I316-A318 HydrophobicContact CG2-CB 4.2Å; I316-A318 PolarHBondContact O-N 2.83Å; I316-R319 HydrophobicContact CB-CB 4.21Å; I316-R319 HydrophobicContact CB-CG 4.09Å; I316-R319 HydrophobicContact CG2-CG 4.14Å; I316-R319 PolarHBondContact O-N 3.24Å; I316-V320 PolarHBondContact O-N 3.03Å; I316-R329 HydrophobicContact CD1-CB 4.06Å; I316-R329 HydrophobicContact CG1-CB 3.62Å; I316-R329 HydrophobicContact CG1-CG 3.56Å; I316-V331 HydrophobicContact CD1-CG1 3.64Å; I316-L339 HydrophobicContact CD1-CD1 4.1Å
317	P	98.2	Very high	95.9	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-54.5	-43.5	-174.2	-24.9	30.7	0	0	0	113.7	Y261 L263 Y299 R319 V320 V321 L339 V411	Y261-P317 HydrophobicContact CD1-CB 3.9Å; Y261-P317 HydrophobicContact CD1-CG 3.33Å; Y261-P317 HydrophobicContact CD2-CB 4.17Å; Y261-P317 HydrophobicContact CD2-CG 4.39Å; Y261-P317 HydrophobicContact CE1-CB 4.21Å; Y261-P317 HydrophobicContact CE1-CG 3.41Å; Y261-P317 VanDerWaalsContact CE1-CG 3.41Å; Y261-P317 HydrophobicContact CE2-CB 4.5Å; Y261-P317 HydrophobicContact CE2-CG 4.48Å; Y261-P317 HydrophobicContact CG-CB 3.83Å; Y261-P317 HydrophobicContact CG-CG 3.82Å; L263-P317 HydrophobicContact CD2-CB 4.28Å; Y299-P317 HydrophobicContact CE2-CG 4.27Å; P317-R319 VanDerWaalsContact C-N 3.34Å; P317-R319 PolarHBondContact O-N 3.49Å; P317-V320 PolarHBondContact O-N 3.02Å; P317-V321 WeakPolarHBondContact O-CG2 3.2Å; P317-V321 PolarHBondContact O-N 2.86Å; P317-L339 HydrophobicContact CG-CD2 3.62Å; P317-V411 HydrophobicContact CB-CG2 4.12Å; P317-V411 HydrophobicContact CG-CG2 4.17Å
318	A	97.6	Very high	96.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-52.1	-48.6	173.7	0	0	0	0	0	112.7	L263 I265 I316 V321 H322	L263-A318 VanDerWaalsContact C-CB 3.5Å; L263-A318 WeakPolarHBondContact O-CB 3.32Å; I265-A318 HydrophobicContact CB-CB 4.46Å; I265-A318 HydrophobicContact CG1-CB 3.77Å; I316-A318 VanDerWaalsContact C-N 3.32Å; I316-A318 HydrophobicContact CG2-CB 4.2Å; I316-A318 PolarHBondContact O-N 2.83Å; A318-V321 PolarHBondContact O-N 3.15Å; A318-H322 WeakPolarHBondContact O-CB 3.33Å; A318-H322 PolarHBondContact O-CD2 3.18Å; A318-H322 VanDerWaalsContact O-CD2 3.28Å; A318-H322 PolarHBondContact O-N 3.01Å
319	R	97.2	Very high	96.6	Very high	3 Å²	3	29.4 Å²	29.4	1%	0.011	15%	0.148	C	C	.	.	H	α-helix	trans	-70.2	-37	-178.2	-66.6	-178.7	176.7	-89.6	3.8	112.1	I265 D298 I316 P317 N323 W324 D325	I265-R319 HydrophobicContact CG1-CG 4.2Å; I265-R319 HydrophobicContact CG2-CG 3.82Å; D298-R319 IonicContact OD1-CZ 3.1Å; D298-R319 IonicContact OD1-NE 2.77Å; D298-R319 PolarHBondContact OD1-NE 3.31Å; D298-R319 IonicContact OD1-NH2 2.67Å; D298-R319 PolarHBondContact OD1-NH2 3.08Å; D298-R319 IonicContact OD2-CZ 2.64Å; D298-R319 IonicContact OD2-NE 2.78Å; D298-R319 PolarHBondContact OD2-NE 3.01Å; D298-R319 IonicContact OD2-NH2 3.2Å; D298-R319 PolarHBondContact OD2-NH2 3.23Å; I316-R319 HydrophobicContact CB-CB 4.21Å; I316-R319 HydrophobicContact CB-CG 4.09Å; I316-R319 HydrophobicContact CG2-CG 4.14Å; I316-R319 PolarHBondContact O-N 3.24Å; P317-R319 VanDerWaalsContact C-N 3.34Å; P317-R319 PolarHBondContact O-N 3.49Å; R319-N323 CarbonylContact O-C 3.56Å; R319-N323 WeakPolarHBondContact O-CA 3.5Å; R319-N323 WeakPolarHBondContact O-CB 3.45Å; R319-N323 PolarHBondContact O-N 2.98Å; R319-W324 PolarHBondContact O-N 2.7Å; R319-D325 CarbonylContact C-O 3.53Å; R319-D325 HydrophobicContact CB-CB 4.06Å; R319-D325 WeakPolarHBondContact CD-OD2 3.25Å; R319-D325 IonicContact NH1-OD2 3.9Å; R319-D325 PolarHBondContact O-N 2.9Å; R319-D325 VanDerWaalsContact O-N 3.14Å
320	V	97.6	Very high	96.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.8	-50.5	174.1	174.5	0	0	0	0	111	V315 I316 P317 W324 D325 F326 L414	V315-V320 HydrophobicContact CG1-CG2 3.44Å; V315-V320 VanDerWaalsContact CG1-CG2 3.44Å; I316-V320 PolarHBondContact O-N 3.03Å; P317-V320 PolarHBondContact O-N 3.02Å; V320-W324 HydrophobicContact CG1-CE3 4.46Å; V320-W324 HydrophobicContact CG1-CZ3 4.45Å; V320-W324 VanDerWaalsContact O-CA 3.23Å; V320-W324 WeakPolarHBondContact O-CA 3.39Å; V320-W324 PolarHBondContact O-N 3.37Å; V320-D325 WeakPolarHBondContact CG2-O 3.36Å; V320-D325 PolarHBondContact N-O 3.03Å; V320-F326 HydrophobicContact CB-CE1 4.29Å; V320-F326 HydrophobicContact CG1-CD1 4.1Å; V320-F326 HydrophobicContact CG1-CE1 3.43Å; V320-F326 VanDerWaalsContact CG1-CE1 3.43Å; V320-F326 HydrophobicContact CG1-CZ 3.75Å; V320-F326 HydrophobicContact CG2-CD1 3.67Å; V320-F326 HydrophobicContact CG2-CE1 3.9Å; V320-F326 HydrophobicContact CG2-CG 4.31Å; V320-L414 HydrophobicContact CG1-CB 3.82Å; V320-L414 HydrophobicContact CG1-CD1 3.5Å; V320-L414 HydrophobicContact CG1-CG 4.29Å
321	V	96.6	Very high	97	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-77.3	-33	-173.3	-178.2	0	0	0	0	112.8	P317 A318 L348 L350 I353 N354 L414	P317-V321 WeakPolarHBondContact O-CG2 3.2Å; P317-V321 PolarHBondContact O-N 2.86Å; A318-V321 PolarHBondContact O-N 3.15Å; V321-L348 HydrophobicContact CG2-CD1 3.89Å; V321-L348 HydrophobicContact CG2-CD2 4.27Å; V321-L350 HydrophobicContact CG1-CD2 4.18Å; V321-L350 HydrophobicContact CG2-CD2 4.14Å; V321-I353 HydrophobicContact CG1-CB 4.06Å; V321-I353 HydrophobicContact CG1-CG2 3.54Å; V321-N354 HydrophobicContact CG1-CB 4.1Å; V321-N354 PolarHBondContact O-ND2 3.36Å; V321-L414 HydrophobicContact CG2-CD1 4.12Å
322	H	94.8	Very high	97	Very high	42 Å²	42	29.8 Å²	29.8	19%	0.194	15%	0.148	C	C	.	.	H	α-helix	trans	-93.7	-27.8	-178.3	-66.6	-63.4	0	0	0	114.7	F71 L263 I265 A318	F71-H322 WeakPolarHBondContact CE1-O 3.32Å; F71-H322 WeakPolarHBondContact CZ-O 3.4Å; L263-H322 PolarHBondContact O-CD2 3.32Å; L263-H322 PolarHBondContact O-NE2 3.29Å; I265-H322 HydrophobicContact CD1-CB 4.01Å; A318-H322 WeakPolarHBondContact O-CB 3.33Å; A318-H322 PolarHBondContact O-CD2 3.18Å; A318-H322 VanDerWaalsContact O-CD2 3.28Å; A318-H322 PolarHBondContact O-N 3.01Å
323	N	93.3	Very high	96.9	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-124	-4.1	-177	-68.7	-28.4	0	0	0	114.3	R72 H75 I265 R319 D325	R72-N323 HydrophobicContact CG-CB 4.37Å; R72-N323 WeakPolarHBondContact CG-O 3.48Å; H75-N323 WeakPolarHBondContact CB-OD1 3.4Å; H75-N323 PolarHBondContact O-ND2 3.01Å; I265-N323 WeakPolarHBondContact CD1-ND2 3.25Å; R319-N323 CarbonylContact O-C 3.56Å; R319-N323 WeakPolarHBondContact O-CA 3.5Å; R319-N323 WeakPolarHBondContact O-CB 3.45Å; R319-N323 PolarHBondContact O-N 2.98Å; N323-D325 HydrophobicContact CB-CB 3.87Å; N323-D325 PolarHBondContact O-N 3.5Å
324	W	95.8	Very high	96.7	Very high	1 Å²	1	27.2 Å²	27.2	0%	0.004	14%	0.135	C	C	.	.			trans	52.5	38.5	-167.5	-150.4	-126.7	0	0	0	111.5	L68 R72 R319 V320 F326 L357 V361 L364 L414 V417 H418	L68-W324 HydrophobicContact CD1-CB 4.01Å; L68-W324 HydrophobicContact CD1-CG 4.35Å; R72-W324 PolarHBondContact NE-O 2.86Å; R72-W324 PolarHBondContact NH2-O 3.25Å; R319-W324 PolarHBondContact O-N 2.7Å; V320-W324 HydrophobicContact CG1-CE3 4.46Å; V320-W324 HydrophobicContact CG1-CZ3 4.45Å; V320-W324 VanDerWaalsContact O-CA 3.23Å; V320-W324 WeakPolarHBondContact O-CA 3.39Å; V320-W324 PolarHBondContact O-N 3.37Å; W324-F326 AromaticContact CD2-CE2 3.53Å; W324-F326 HydrophobicContact CD2-CE2 3.53Å; W324-F326 AromaticContact CD2-CZ 3.75Å; W324-F326 HydrophobicContact CD2-CZ 3.75Å; W324-F326 AromaticContact CE2-CE2 3.64Å; W324-F326 AromaticContact CE2-CZ 3.81Å; W324-F326 AromaticContact CE3-CE2 3.97Å; W324-F326 HydrophobicContact CE3-CE2 3.97Å; W324-F326 AromaticContact CE3-CZ 3.74Å; W324-F326 HydrophobicContact CE3-CZ 3.74Å; W324-F326 AromaticContact CG-CE2 3.79Å; W324-F326 HydrophobicContact CG-CE2 3.79Å; W324-F326 HydrophobicContact CG-CZ 4.46Å; W324-F326 AromaticContact CH2-CZ 3.86Å; W324-F326 HydrophobicContact CH2-CZ 3.86Å; W324-F326 HydrophobicContact CZ2-CE2 4.14Å; W324-F326 AromaticContact CZ2-CZ 3.87Å; W324-F326 HydrophobicContact CZ2-CZ 3.87Å; W324-F326 HydrophobicContact CZ3-CE2 4.44Å; W324-F326 AromaticContact CZ3-CZ 3.8Å; W324-F326 HydrophobicContact CZ3-CZ 3.8Å; W324-F326 AromaticContact NE1-CE2 3.93Å; W324-L357 HydrophobicContact CB-CD1 4.2Å; W324-L357 HydrophobicContact CD2-CD1 4.35Å; W324-L357 HydrophobicContact CE3-CD1 3.98Å; W324-L357 HydrophobicContact CE3-CD2 3.96Å; W324-L357 HydrophobicContact CE3-CG 4.39Å; W324-L357 HydrophobicContact CG-CD1 4.48Å; W324-L357 HydrophobicContact CZ3-CD2 4.03Å; W324-V361 HydrophobicContact CD2-CG2 3.9Å; W324-V361 HydrophobicContact CG-CG2 3.91Å; W324-V361 HydrophobicContact CH2-CG1 4.38Å; W324-V361 HydrophobicContact CZ2-CG1 3.64Å; W324-V361 HydrophobicContact CZ2-CG2 4.48Å; W324-L364 HydrophobicContact CH2-CD1 3.81Å; W324-L364 HydrophobicContact CH2-CD2 4.1Å; W324-L364 HydrophobicContact CH2-CG 3.94Å; W324-L364 HydrophobicContact CZ2-CD1 4.47Å; W324-L364 HydrophobicContact CZ2-CG 4.44Å; W324-L364 HydrophobicContact CZ3-CD1 3.87Å; W324-L364 HydrophobicContact CZ3-CG 4.5Å; W324-L414 HydrophobicContact CH2-CB 4.16Å; W324-L414 HydrophobicContact CH2-CD2 4.34Å; W324-L414 HydrophobicContact CZ3-CB 4.1Å; W324-L414 HydrophobicContact CZ3-CD2 4.24Å; W324-L414 HydrophobicContact CZ3-CG 4.49Å; W324-V417 HydrophobicContact CH2-CB 4.13Å; W324-V417 HydrophobicContact CH2-CG1 4.03Å; W324-V417 HydrophobicContact CZ2-CB 4.17Å; W324-V417 HydrophobicContact CZ2-CG1 3.78Å; W324-H418 HydrophobicContact CZ2-CB 4.33Å
325	D	95.9	Very high	96.6	Very high	23 Å²	23	26.9 Å²	26.9	12%	0.123	13%	0.132	C	C	.	.			trans	-103.7	107.8	-177.8	169.1	26.8	0	0	0	109.5	R319 V320 N323 E327 R329	R319-D325 CarbonylContact C-O 3.53Å; R319-D325 HydrophobicContact CB-CB 4.06Å; R319-D325 WeakPolarHBondContact CD-OD2 3.25Å; R319-D325 IonicContact NH1-OD2 3.9Å; R319-D325 PolarHBondContact O-N 2.9Å; R319-D325 VanDerWaalsContact O-N 3.14Å; V320-D325 WeakPolarHBondContact CG2-O 3.36Å; V320-D325 PolarHBondContact N-O 3.03Å; N323-D325 HydrophobicContact CB-CB 3.87Å; N323-D325 PolarHBondContact O-N 3.5Å; D325-E327 PolarHBondContact OD1-N 3.42Å; D325-R329 IonicContact OD1-CZ 2.65Å; D325-R329 IonicContact OD1-NH2 3.57Å; D325-R329 PolarHBondContact OD1-NH2 2.92Å; D325-R329 IonicContact OD2-CZ 3.84Å; D325-R329 IonicContact OD2-NE 3.56Å; D325-R329 IonicContact OD2-NH2 2.97Å; D325-R329 PolarHBondContact OD2-NH2 3.32Å
326	F	97.4	Very high	96.5	Very high	19 Å²	19	27.4 Å²	27.4	8%	0.083	13%	0.132	C	C	.	.			trans	-102.4	-2.4	-177.7	-61.9	-89.8	0	0	0	113.3	V315 V320 W324 L414 L415 H418	V315-F326 HydrophobicContact CG1-CD1 4.37Å; V315-F326 WeakPolarHBondContact CG2-O 3.37Å; V320-F326 HydrophobicContact CB-CE1 4.29Å; V320-F326 HydrophobicContact CG1-CD1 4.1Å; V320-F326 HydrophobicContact CG1-CE1 3.43Å; V320-F326 VanDerWaalsContact CG1-CE1 3.43Å; V320-F326 HydrophobicContact CG1-CZ 3.75Å; V320-F326 HydrophobicContact CG2-CD1 3.67Å; V320-F326 HydrophobicContact CG2-CE1 3.9Å; V320-F326 HydrophobicContact CG2-CG 4.31Å; W324-F326 AromaticContact CD2-CE2 3.53Å; W324-F326 HydrophobicContact CD2-CE2 3.53Å; W324-F326 AromaticContact CD2-CZ 3.75Å; W324-F326 HydrophobicContact CD2-CZ 3.75Å; W324-F326 AromaticContact CE2-CE2 3.64Å; W324-F326 AromaticContact CE2-CZ 3.81Å; W324-F326 AromaticContact CE3-CE2 3.97Å; W324-F326 HydrophobicContact CE3-CE2 3.97Å; W324-F326 AromaticContact CE3-CZ 3.74Å; W324-F326 HydrophobicContact CE3-CZ 3.74Å; W324-F326 AromaticContact CG-CE2 3.79Å; W324-F326 HydrophobicContact CG-CE2 3.79Å; W324-F326 HydrophobicContact CG-CZ 4.46Å; W324-F326 AromaticContact CH2-CZ 3.86Å; W324-F326 HydrophobicContact CH2-CZ 3.86Å; W324-F326 HydrophobicContact CZ2-CE2 4.14Å; W324-F326 AromaticContact CZ2-CZ 3.87Å; W324-F326 HydrophobicContact CZ2-CZ 3.87Å; W324-F326 HydrophobicContact CZ3-CE2 4.44Å; W324-F326 AromaticContact CZ3-CZ 3.8Å; W324-F326 HydrophobicContact CZ3-CZ 3.8Å; W324-F326 AromaticContact NE1-CE2 3.93Å; F326-L414 HydrophobicContact CE1-CB 3.98Å; F326-L414 WeakPolarHBondContact CE1-O 3.17Å; F326-L414 HydrophobicContact CZ-CB 4.25Å; F326-L414 WeakPolarHBondContact CZ-O 3.32Å; F326-L415 HydrophobicContact CB-CD2 4.44Å; F326-L415 HydrophobicContact CD1-CD2 3.56Å; F326-L415 HydrophobicContact CD1-CG 4.08Å; F326-L415 HydrophobicContact CE1-CD2 4.24Å; F326-L415 HydrophobicContact CE1-CG 4.32Å; F326-L415 HydrophobicContact CG-CD2 4.38Å; F326-H418 HydrophobicContact CD2-CB 4.02Å; F326-H418 AromaticContact CD2-CD2 3.19Å; F326-H418 WeakPolarHBondContact CD2-CD2 3.23Å; F326-H418 AromaticContact CD2-CG 3.62Å; F326-H418 AromaticContact CD2-NE2 3.84Å; F326-H418 HydrophobicContact CE1-CB 4.22Å; F326-H418 HydrophobicContact CE2-CB 3.52Å; F326-H418 AromaticContact CE2-CD2 3.65Å; F326-H418 AromaticContact CE2-CG 3.56Å; F326-H418 AromaticContact CG-CD2 3.57Å; F326-H418 HydrophobicContact CZ-CB 3.62Å
327	E	97.3	Very high	96.4	Very high	127 Å²	127	28.1 Å²	28.1	59%	0.593	14%	0.135	S	C	*	.	S	Bend	trans	-66.3	127.3	-177.9	179.3	60.3	-153.4	0	0	109.2	D325 R329	D325-E327 PolarHBondContact OD1-N 3.42Å; E327-R329 VanDerWaalsContact O-CZ 3.22Å; E327-R329 PolarHBondContact O-NH1 2.97Å
328	P	97.9	Very high	96.3	Very high	47 Å²	47	28.8 Å²	28.8	31%	0.305	14%	0.137	S	C	.	.			trans	-59.1	151.1	-174.9	-26.7	35.6	0	0	0	113.8	L313 A314 V315	L313-P328 HydrophobicContact CB-CB 3.86Å; A314-P328 WeakPolarHBondContact O-CA 3.5Å; V315-P328 HydrophobicContact CG2-CG 4.49Å
329	R	97.8	Very high	96.3	Very high	52 Å²	52	29.3 Å²	29.3	20%	0.196	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	156.2	176	-54.2	-74.5	169.4	-102.7	-3.1	110.4	D298 L313 A314 I316 D325 E327	D298-R329 HydrophobicContact CB-CB 3.48Å; D298-R329 VanDerWaalsContact CB-CB 3.48Å; D298-R329 HydrophobicContact CB-CG 4.14Å; L313-R329 WeakPolarHBondContact CA-O 3.12Å; A314-R329 PolarHBondContact N-O 3.08Å; A314-R329 PolarHBondContact O-N 3.35Å; I316-R329 HydrophobicContact CD1-CB 4.06Å; I316-R329 HydrophobicContact CG1-CB 3.62Å; I316-R329 HydrophobicContact CG1-CG 3.56Å; D325-R329 IonicContact OD1-CZ 2.65Å; D325-R329 IonicContact OD1-NH2 3.57Å; D325-R329 PolarHBondContact OD1-NH2 2.92Å; D325-R329 IonicContact OD2-CZ 3.84Å; D325-R329 IonicContact OD2-NE 3.56Å; D325-R329 IonicContact OD2-NH2 2.97Å; D325-R329 PolarHBondContact OD2-NH2 3.32Å; E327-R329 VanDerWaalsContact O-CZ 3.22Å; E327-R329 PolarHBondContact O-NH1 2.97Å
330	K	97.9	Very high	96.3	Very high	123 Å²	123	32.2 Å²	32.2	54%	0.535	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	129.5	178.1	-70.2	174.7	-177.2	166.3	0	110.1	D298 N311 D312 L313	D298-K330 PolarHBondContact N-O 3.08Å; N311-K330 HydrophobicContact CB-CD 4.38Å; N311-K330 HydrophobicContact CB-CG 4.37Å; D312-K330 WeakPolarHBondContact O-CA 3.43Å; L313-K330 HydrophobicContact CD2-CG 3.91Å
331	V	97.9	Very high	96.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	160.3	-175.9	-69.5	0	0	0	0	113	H309 D312 A314 I316 M336 L339	H309-V331 PolarHBondContact CD2-O 3.42Å; H309-V331 PolarHBondContact NE2-O 3.34Å; D312-V331 HydrophobicContact CB-CG2 4.4Å; D312-V331 WeakPolarHBondContact O-CG2 3.5Å; D312-V331 PolarHBondContact O-N 3.37Å; A314-V331 HydrophobicContact CB-CG1 4.45Å; A314-V331 HydrophobicContact CB-CG2 3.69Å; I316-V331 HydrophobicContact CD1-CG1 3.64Å; V331-M336 HydrophobicContact CG2-CB 3.83Å; V331-L339 HydrophobicContact CG1-CD1 4.47Å
332	S	95.9	Very high	96.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.			trans	-68	158.5	175.4	86.7	0	0	0	0	112.2	C297 H309 C334 S335 M336	C297-S332 PolarHBondContact SG-N 3.44Å; H309-S332 PolarHBondContact CD2-N 2.97Å; H309-S332 VanDerWaalsContact CD2-N 3.28Å; S332-C334 PolarHBondContact O-N 3.25Å; S332-C334 VanDerWaalsContact O-N 3.17Å; S332-C334 PolarHBondContact OG-N 3.09Å; S332-S335 PolarHBondContact O-N 3.34Å; S332-S335 VanDerWaalsContact O-N 3.14Å; S332-S335 WeakPolarHBondContact OG-CB 3.31Å; S332-S335 PolarHBondContact OG-N 3.11Å; S332-S335 PolarHBondContact OG-OG 2.88Å; S332-M336 PolarHBondContact O-N 3.08Å
333	R	93.4	Very high	96.3	Very high	39 Å²	39	34.1 Å²	34.1	15%	0.147	18%	0.177	C	C	.	.	H	α-helix	trans	-62.6	-21.7	176.5	-71.5	-69.4	-72.5	-178.7	-2.7	113.7	D215 C308 W310 D312 R337	D215-R333 IonicContact OD1-CZ 3.38Å; D215-R333 IonicContact OD1-NE 3.67Å; D215-R333 PolarHBondContact OD1-NE 2.8Å; D215-R333 VanDerWaalsContact OD1-NE 3.12Å; D215-R333 IonicContact OD1-NH2 2.79Å; D215-R333 PolarHBondContact OD1-NH2 3.38Å; D215-R333 IonicContact OD2-NH2 3.92Å; C308-R333 WeakPolarHBondContact O-CB 3.33Å; C308-R333 PolarHBondContact O-N 2.62Å; W310-R333 HydrophobicContact CB-CG 4.37Å; W310-R333 VanDerWaalsContact CD2-CD 3.43Å; W310-R333 HydrophobicContact CD2-CG 3.76Å; W310-R333 HydrophobicContact CE3-CG 4.42Å; W310-R333 HydrophobicContact CG-CG 3.71Å; W310-R333 HydrophobicContact CZ2-CG 4.48Å; D312-R333 WeakPolarHBondContact OD1-CD 3.41Å; D312-R333 IonicContact OD1-CZ 3.77Å; D312-R333 IonicContact OD1-NE 3.49Å; D312-R333 IonicContact OD1-NH1 2.69Å; D312-R333 PolarHBondContact OD1-NH1 3.25Å; D312-R333 WeakPolarHBondContact OD2-CD 3.19Å; R333-R337 WeakPolarHBondContact O-CG 3.45Å; R333-R337 PolarHBondContact O-NH1 2.65Å
334	C	93.6	Very high	96.4	Very high	45 Å²	45	37.8 Å²	37.8	30%	0.304	20%	0.203	S	C	.	.	H	α-helix	trans	-81.7	-47.2	173.1	-171.5	0	0	0	0	110.8	E280 S332 M336 R337 Y338	E280-C334 WeakPolarHBondContact OE1-CB 3.47Å; S332-C334 PolarHBondContact O-N 3.25Å; S332-C334 VanDerWaalsContact O-N 3.17Å; S332-C334 PolarHBondContact OG-N 3.09Å; C334-M336 PolarHBondContact O-N 2.85Å; C334-R337 WeakPolarHBondContact O-CB 3.48Å; C334-R337 PolarHBondContact O-N 3.11Å; C334-Y338 PolarHBondContact O-N 2.81Å
335	S	96.3	Very high	96.4	Very high	7 Å²	7	42.3 Å²	42.3	5%	0.049	22%	0.22	C	C	.	.	H	α-helix	trans	-60.9	-45	178.7	-54.7	0	0	0	0	112.2	C297 S332 R337 Y338 L339	C297-S335 VanDerWaalsContact SG-CB 3.59Å; C297-S335 PolarHBondContact SG-OG 2.93Å; S332-S335 PolarHBondContact O-N 3.34Å; S332-S335 VanDerWaalsContact O-N 3.14Å; S332-S335 WeakPolarHBondContact OG-CB 3.31Å; S332-S335 PolarHBondContact OG-N 3.11Å; S332-S335 PolarHBondContact OG-OG 2.88Å; S335-R337 VanDerWaalsContact C-N 3.33Å; S335-R337 PolarHBondContact O-N 3.11Å; S335-Y338 PolarHBondContact O-N 2.87Å; S335-L339 WeakPolarHBondContact O-CB 3.46Å; S335-L339 WeakPolarHBondContact O-CG 3.39Å; S335-L339 PolarHBondContact O-N 2.93Å
336	M	96.5	Very high	96.4	Very high	43 Å²	43	43.5 Å²	43.5	21%	0.212	23%	0.229	C	C	.	.	H	α-helix	trans	-56.7	-45.1	174.5	175.2	-87.4	-72.2	0	0	111.7	D312 V331 S332 C334 A340	D312-M336 HydrophobicContact CB-CB 4.06Å; D312-M336 HydrophobicContact CB-CG 4.07Å; V331-M336 HydrophobicContact CG2-CB 3.83Å; S332-M336 PolarHBondContact O-N 3.08Å; C334-M336 PolarHBondContact O-N 2.85Å; M336-A340 VanDerWaalsContact O-CB 3.28Å; M336-A340 WeakPolarHBondContact O-CB 3.45Å; M336-A340 PolarHBondContact O-N 2.71Å
337	R	95	Very high	96.3	Very high	18 Å²	18	44.8 Å²	44.8	7%	0.068	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-40.3	176.2	-77	178.3	163.8	99.4	4.2	112.6	D215 C234 Y235 V251 R333 C334 S335 L341	D215-R337 IonicContact OD1-CZ 2.76Å; D215-R337 IonicContact OD1-NH1 3.44Å; D215-R337 PolarHBondContact OD1-NH1 2.7Å; D215-R337 IonicContact OD1-NH2 2.7Å; D215-R337 PolarHBondContact OD1-NH2 3Å; D215-R337 VanDerWaalsContact OD1-NH2 3.09Å; D215-R337 IonicContact OD2-CZ 3.67Å; D215-R337 IonicContact OD2-NH1 3.55Å; D215-R337 IonicContact OD2-NH2 2.64Å; D215-R337 PolarHBondContact OD2-NH2 3.36Å; C234-R337 VanDerWaalsContact O-CD 3.27Å; C234-R337 WeakPolarHBondContact O-CD 3.4Å; C234-R337 PolarHBondContact O-NE 2.64Å; Y235-R337 PolarHBondContact O-NH2 3Å; V251-R337 HydrophobicContact CB-CB 4.29Å; V251-R337 HydrophobicContact CG1-CB 4.09Å; V251-R337 HydrophobicContact CG2-CB 4.24Å; R333-R337 WeakPolarHBondContact O-CG 3.45Å; R333-R337 PolarHBondContact O-NH1 2.65Å; C334-R337 WeakPolarHBondContact O-CB 3.48Å; C334-R337 PolarHBondContact O-N 3.11Å; S335-R337 VanDerWaalsContact C-N 3.33Å; S335-R337 PolarHBondContact O-N 3.11Å; R337-L341 WeakPolarHBondContact O-CB 3.43Å; R337-L341 WeakPolarHBondContact O-CD1 3.3Å; R337-L341 VanDerWaalsContact O-CG 3.25Å; R337-L341 WeakPolarHBondContact O-CG 3.39Å; R337-L341 PolarHBondContact O-N 3.1Å; R337-L341 VanDerWaalsContact O-N 3.08Å
338	Y	96.3	Very high	96.3	Very high	14 Å²	14	38.9 Å²	38.9	6%	0.055	21%	0.211	C	C	.	.	H	α-helix	trans	-63.2	-50.3	178.4	-170.1	-93.8	0	0	0	110.4	V251 K254 V255 Q258 E260 Y299 C334 S335 A340 L341 M342	V251-Y338 HydrophobicContact CG1-CD2 3.96Å; V251-Y338 HydrophobicContact CG1-CG 4.39Å; K254-Y338 HydrophobicContact CD-CE2 4.23Å; K254-Y338 HydrophobicContact CG-CE2 4.33Å; V255-Y338 HydrophobicContact CB-CE2 4.42Å; V255-Y338 HydrophobicContact CG2-CD2 3.46Å; V255-Y338 VanDerWaalsContact CG2-CD2 3.46Å; V255-Y338 HydrophobicContact CG2-CE2 3.35Å; V255-Y338 HydrophobicContact CG2-CG 4.29Å; Q258-Y338 PolarHBondContact O-OH 2.86Å; E260-Y338 PolarHBondContact N-OH 3.09Å; E260-Y338 WeakPolarHBondContact O-CE1 3.31Å; E260-Y338 PolarHBondContact O-OH 3.49Å; Y299-Y338 AromaticContact CE1-CD1 3.95Å; Y299-Y338 HydrophobicContact CE1-CD1 3.95Å; C334-Y338 PolarHBondContact O-N 2.81Å; S335-Y338 PolarHBondContact O-N 2.87Å; Y338-A340 PolarHBondContact O-N 3.31Å; Y338-L341 PolarHBondContact O-N 3.24Å; Y338-M342 HydrophobicContact CD1-CG 3.95Å; Y338-M342 HydrophobicContact CE1-CE 4.45Å; Y338-M342 HydrophobicContact CE1-CG 3.6Å; Y338-M342 HydrophobicContact CE1-SD 4.33Å; Y338-M342 HydrophobicContact CE2-CG 4.49Å; Y338-M342 VanDerWaalsContact O-CB 3.3Å; Y338-M342 WeakPolarHBondContact O-CB 3.45Å; Y338-M342 WeakPolarHBondContact O-CG 3.42Å; Y338-M342 PolarHBondContact O-N 2.97Å
339	L	97.7	Very high	96.2	Very high	12 Å²	12	41.9 Å²	41.9	6%	0.063	22%	0.216	C	C	.	.	H	α-helix	trans	-60	-45	176.9	-67.8	173.4	0	0	0	112.1	Y261 Y299 A314 I316 P317 V331 S335 L341 M342 V343	Y261-L339 HydrophobicContact CD1-CD2 4.25Å; Y261-L339 HydrophobicContact CE1-CD2 3.97Å; Y299-L339 HydrophobicContact CD1-CD1 4.42Å; Y299-L339 HydrophobicContact CD1-CD2 4.4Å; Y299-L339 HydrophobicContact CD1-CG 4.34Å; Y299-L339 HydrophobicContact CD2-CD1 4.31Å; Y299-L339 HydrophobicContact CD2-CD2 3.87Å; Y299-L339 HydrophobicContact CD2-CG 4.46Å; Y299-L339 HydrophobicContact CE1-CD2 4.27Å; Y299-L339 HydrophobicContact CE2-CD2 3.73Å; Y299-L339 HydrophobicContact CG-CD1 4.04Å; Y299-L339 HydrophobicContact CG-CD2 4.22Å; Y299-L339 HydrophobicContact CG-CG 4.32Å; A314-L339 HydrophobicContact CB-CD1 3.64Å; I316-L339 HydrophobicContact CD1-CD1 4.1Å; P317-L339 HydrophobicContact CG-CD2 3.62Å; V331-L339 HydrophobicContact CG1-CD1 4.47Å; S335-L339 WeakPolarHBondContact O-CB 3.46Å; S335-L339 WeakPolarHBondContact O-CG 3.39Å; S335-L339 PolarHBondContact O-N 2.93Å; L339-L341 VanDerWaalsContact C-N 3.3Å; L339-L341 PolarHBondContact O-N 2.96Å; L339-M342 PolarHBondContact O-N 3.14Å; L339-M342 VanDerWaalsContact O-N 3.11Å; L339-V343 PolarHBondContact O-N 3.13Å
340	A	96.9	Very high	96.1	Very high	63 Å²	63	39.4 Å²	39.4	52%	0.521	21%	0.206	S	C	.	.	H	α-helix	trans	-63.5	-31.5	178	0	0	0	0	0	113.8	M336 Y338	M336-A340 VanDerWaalsContact O-CB 3.28Å; M336-A340 WeakPolarHBondContact O-CB 3.45Å; M336-A340 PolarHBondContact O-N 2.71Å; Y338-A340 PolarHBondContact O-N 3.31Å
341	L	96.3	Very high	95.9	Very high	49 Å²	49	38.9 Å²	38.9	26%	0.257	20%	0.201	S	C	.	.	H	α-helix	trans	-82.3	-19.3	175	-70.5	167.8	0	0	0	113.3	G233 C234 V251 V255 R337 Y338 L339	G233-L341 WeakPolarHBondContact O-CD2 3.34Å; C234-L341 HydrophobicContact CB-CD1 4.09Å; V251-L341 HydrophobicContact CB-CD1 4.47Å; V251-L341 HydrophobicContact CG1-CD1 4.36Å; V255-L341 HydrophobicContact CG1-CB 4.38Å; V255-L341 HydrophobicContact CG2-CB 4.02Å; V255-L341 HydrophobicContact CG2-CD1 4.42Å; R337-L341 WeakPolarHBondContact O-CB 3.43Å; R337-L341 WeakPolarHBondContact O-CD1 3.3Å; R337-L341 VanDerWaalsContact O-CG 3.25Å; R337-L341 WeakPolarHBondContact O-CG 3.39Å; R337-L341 PolarHBondContact O-N 3.1Å; R337-L341 VanDerWaalsContact O-N 3.08Å; Y338-L341 PolarHBondContact O-N 3.24Å; L339-L341 VanDerWaalsContact C-N 3.3Å; L339-L341 PolarHBondContact O-N 2.96Å
342	M	96.9	Very high	95.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-95.3	-23.6	-179.6	-76.1	-71.8	-68.4	0	0	113.6	V255 A259 Y261 Y338 L339 S344 R345 V347	V255-M342 HydrophobicContact CG1-CG 4.39Å; V255-M342 HydrophobicContact CG1-SD 3.91Å; V255-M342 HydrophobicContact CG2-CG 4.1Å; V255-M342 HydrophobicContact CG2-SD 4.38Å; A259-M342 HydrophobicContact CB-CE 4.26Å; A259-M342 HydrophobicContact CB-SD 3.91Å; Y261-M342 HydrophobicContact CD1-CB 4.47Å; Y261-M342 HydrophobicContact CD1-CE 4.09Å; Y261-M342 HydrophobicContact CD2-CE 4.2Å; Y261-M342 HydrophobicContact CE1-CB 3.5Å; Y261-M342 VanDerWaalsContact CE1-CB 3.5Å; Y261-M342 HydrophobicContact CE1-CE 3.99Å; Y261-M342 HydrophobicContact CE1-CG 4.19Å; Y261-M342 HydrophobicContact CE2-CE 4.07Å; Y261-M342 HydrophobicContact CG-CE 4.24Å; Y261-M342 WeakPolarHBondContact OH-CB 3.28Å; Y261-M342 PolarHBondContact OH-O 3.29Å; Y338-M342 HydrophobicContact CD1-CG 3.95Å; Y338-M342 HydrophobicContact CE1-CE 4.45Å; Y338-M342 HydrophobicContact CE1-CG 3.6Å; Y338-M342 HydrophobicContact CE1-SD 4.33Å; Y338-M342 HydrophobicContact CE2-CG 4.49Å; Y338-M342 VanDerWaalsContact O-CB 3.3Å; Y338-M342 WeakPolarHBondContact O-CB 3.45Å; Y338-M342 WeakPolarHBondContact O-CG 3.42Å; Y338-M342 PolarHBondContact O-N 2.97Å; L339-M342 PolarHBondContact O-N 3.14Å; L339-M342 VanDerWaalsContact O-N 3.11Å; M342-S344 VanDerWaalsContact C-N 3.28Å; M342-S344 PolarHBondContact O-N 3.33Å; M342-S344 VanDerWaalsContact O-N 3.09Å; M342-R345 WeakPolarHBondContact O-CB 3.48Å; M342-R345 PolarHBondContact O-N 3.17Å; M342-V347 HydrophobicContact CE-CG2 3.93Å
343	V	97.1	Very high	95.7	Very high	34 Å²	34	47.1 Å²	47.1	21%	0.206	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-41.2	-165.9	70.2	0	0	0	0	113.9	L339 S410 V411 Q412 L415	L339-V343 PolarHBondContact O-N 3.13Å; V343-S410 WeakPolarHBondContact O-CB 3.33Å; V343-V411 HydrophobicContact CG2-CB 4.07Å; V343-V411 HydrophobicContact CG2-CG1 4.1Å; V343-V411 PolarHBondContact O-N 3.07Å; V343-Q412 HydrophobicContact CG2-CB 4.28Å; V343-Q412 PolarHBondContact O-N 3.09Å; V343-L415 HydrophobicContact CG2-CD1 4.31Å
344	S	95.6	Very high	95.7	Very high	77 Å²	77	45.9 Å²	45.9	54%	0.538	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	1.9	-179.9	-49.5	0	0	0	0	114.5	M342	M342-S344 VanDerWaalsContact C-N 3.28Å; M342-S344 PolarHBondContact O-N 3.33Å; M342-S344 VanDerWaalsContact O-N 3.09Å
345	R	95.1	Very high	95.7	Very high	97 Å²	97	47.3 Å²	47.3	37%	0.366	25%	0.246	S	C	.	.	S	Bend	trans	-84.4	124.8	-179.5	-62.3	-177.6	65.7	112.7	-4.2	110	M342 V347 S410	M342-R345 WeakPolarHBondContact O-CB 3.48Å; M342-R345 PolarHBondContact O-N 3.17Å; R345-V347 HydrophobicContact CB-CG1 4.08Å; R345-V347 PolarHBondContact O-N 2.78Å; R345-S410 WeakPolarHBondContact O-CA 3.34Å; R345-S410 VanDerWaalsContact O-CB 3.25Å; R345-S410 WeakPolarHBondContact O-CB 3.44Å
346	P	95.8	Very high	95.5	Very high	47 Å²	47	51.6 Å²	51.6	31%	0.305	27%	0.267	S	S	.	.			trans	-81.6	82	-176.7	32.9	-35.3	0	0	0	111.1	H401 M408 Y409	P346-H401 HydrophobicContact CB-CB 3.83Å; P346-H401 WeakPolarHBondContact CB-CD2 3.4Å; P346-H401 VanDerWaalsContact CB-CG 3.43Å; P346-H401 HydrophobicContact CG-CB 3.83Å; P346-M408 HydrophobicContact CB-CB 4.34Å; P346-M408 WeakPolarHBondContact O-CE 3.36Å; P346-Y409 CarbonylContact C-O 3.51Å; P346-Y409 WeakPolarHBondContact CA-O 3.33Å
347	V	95.8	Very high	95.3	Very high	46 Å²	46	49.5 Å²	49.5	28%	0.279	26%	0.257	S	S	.	.			trans	-118.1	-6.2	-173.6	-58.9	0	0	0	0	114.1	Y261 M342 R345 Y409	Y261-V347 HydrophobicContact CD2-CG2 3.59Å; Y261-V347 HydrophobicContact CE2-CG2 3.45Å; Y261-V347 VanDerWaalsContact CE2-CG2 3.45Å; M342-V347 HydrophobicContact CE-CG2 3.93Å; R345-V347 HydrophobicContact CB-CG1 4.08Å; R345-V347 PolarHBondContact O-N 2.78Å; V347-Y409 PolarHBondContact N-O 3.12Å; V347-Y409 VanDerWaalsContact N-O 3.08Å
348	L	97.1	Very high	95.1	Very high	3 Å²	3	50 Å²	50	2%	0.016	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	118	-178.2	-61.8	171.6	0	0	0	111	Y261 L263 V321 L350 I353 M408 Y409 V411 L414	Y261-L348 HydrophobicContact CD2-CD2 3.69Å; Y261-L348 HydrophobicContact CD2-CG 4.14Å; Y261-L348 HydrophobicContact CE2-CD1 4.4Å; Y261-L348 HydrophobicContact CE2-CD2 4.22Å; Y261-L348 HydrophobicContact CE2-CG 4.18Å; L263-L348 HydrophobicContact CD2-CD2 4.04Å; V321-L348 HydrophobicContact CG2-CD1 3.89Å; V321-L348 HydrophobicContact CG2-CD2 4.27Å; L348-L350 HydrophobicContact CB-CD2 4.41Å; L348-L350 PolarHBondContact O-N 3.39Å; L348-I353 HydrophobicContact CB-CD1 4.27Å; L348-I353 HydrophobicContact CD2-CD1 3.95Å; L348-M408 CarbonylContact O-C 3.14Å; L348-Y409 WeakPolarHBondContact CB-O 3.39Å; L348-Y409 PolarHBondContact N-O 3.36Å; L348-Y409 PolarHBondContact O-N 3.11Å; L348-V411 HydrophobicContact CD1-CG2 3.81Å; L348-L414 HydrophobicContact CD1-CD1 3.88Å
349	R	96	Very high	94.9	Very high	110 Å²	110	55.2 Å²	55.2	42%	0.415	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	87.3	167.6	-68.1	-175.9	-166	163.6	3.4	110.2	R351 E352 I353 M408	R349-R351 PolarHBondContact O-N 3.05Å; R349-R351 VanDerWaalsContact O-N 3.1Å; R349-E352 HydrophobicContact CB-CB 4.08Å; R349-E352 HydrophobicContact CB-CG 4.15Å; R349-E352 WeakPolarHBondContact CD-OE1 3.26Å; R349-E352 VanDerWaalsContact CD-OE2 3.23Å; R349-E352 WeakPolarHBondContact CD-OE2 3.2Å; R349-E352 IonicContact CZ-OE1 2.62Å; R349-E352 IonicContact CZ-OE2 2.64Å; R349-E352 IonicContact NE-OE1 3.71Å; R349-E352 IonicContact NE-OE2 3.56Å; R349-E352 VanDerWaalsContact NH1-CD 3.25Å; R349-E352 IonicContact NH1-OE1 3.51Å; R349-E352 PolarHBondContact NH1-OE1 2.9Å; R349-E352 IonicContact NH1-OE2 2.7Å; R349-E352 PolarHBondContact NH1-OE2 3.2Å; R349-E352 PolarHBondContact O-N 3.13Å; R349-I353 WeakPolarHBondContact O-CG1 3.3Å; R349-I353 PolarHBondContact O-N 3.03Å; R349-M408 HydrophobicContact CG-CE 4.07Å; R349-M408 HydrophobicContact CG-SD 3.31Å; R349-M408 WeakPolarHBondContact CG-SD 3.42Å
350	L	94.4	Very high	94.6	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-53.3	-37.9	-173.2	-60.3	-178.9	0	0	0	113.1	V321 L348 E352 I353 N354 F358 L364 Y409 L414	V321-L350 HydrophobicContact CG1-CD2 4.18Å; V321-L350 HydrophobicContact CG2-CD2 4.14Å; L348-L350 HydrophobicContact CB-CD2 4.41Å; L348-L350 PolarHBondContact O-N 3.39Å; L350-E352 VanDerWaalsContact C-N 3.32Å; L350-E352 PolarHBondContact O-N 3.16Å; L350-I353 PolarHBondContact O-N 3.21Å; L350-N354 CarbonylContact O-C 3.45Å; L350-N354 WeakPolarHBondContact O-CA 3.37Å; L350-N354 PolarHBondContact O-N 3.01Å; L350-F358 HydrophobicContact CB-CE2 3.68Å; L350-F358 HydrophobicContact CB-CZ 3.87Å; L350-F358 HydrophobicContact CD1-CE2 4.47Å; L350-F358 HydrophobicContact CD1-CZ 4.01Å; L350-L364 HydrophobicContact CD1-CD1 4.14Å; L350-L364 HydrophobicContact CD1-CD2 3.91Å; L350-Y409 HydrophobicContact CB-CD2 4.48Å; L350-Y409 HydrophobicContact CD1-CD1 3.94Å; L350-Y409 HydrophobicContact CD1-CD2 3.67Å; L350-Y409 HydrophobicContact CD1-CE1 4Å; L350-Y409 HydrophobicContact CD1-CE2 3.76Å; L350-Y409 HydrophobicContact CD1-CG 3.77Å; L350-Y409 HydrophobicContact CG-CD2 3.71Å; L350-Y409 HydrophobicContact CG-CE2 4.14Å; L350-Y409 HydrophobicContact CG-CG 4.01Å; L350-L414 HydrophobicContact CD1-CD2 3.81Å; L350-L414 HydrophobicContact CD2-CD1 4.04Å; L350-L414 HydrophobicContact CD2-CD2 4.21Å
351	R	93.6	Very high	94.5	Very high	113 Å²	113	55.8 Å²	55.8	43%	0.426	28%	0.277	S	S	.	.	H	α-helix	trans	-67.1	-29.4	180	-60.9	-177.4	69.4	-145.8	-4	114	R349 F358 E407	R349-R351 PolarHBondContact O-N 3.05Å; R349-R351 VanDerWaalsContact O-N 3.1Å; R351-F358 HydrophobicContact CG-CE2 3.75Å; R351-F358 HydrophobicContact CG-CZ 4.12Å; R351-E407 IonicContact CZ-OE1 3.67Å; R351-E407 IonicContact NE-OE1 3.98Å; R351-E407 IonicContact NH1-OE1 2.66Å; R351-E407 PolarHBondContact NH1-OE1 3.41Å
352	E	95.3	Very high	94.3	Very high	124 Å²	124	58.3 Å²	58.3	58%	0.579	29%	0.288	S	S	*	.	H	α-helix	trans	-84.5	-39.7	176.3	-66.3	178.5	-164.4	0	0	110.8	R349 L350	R349-E352 HydrophobicContact CB-CB 4.08Å; R349-E352 HydrophobicContact CB-CG 4.15Å; R349-E352 WeakPolarHBondContact CD-OE1 3.26Å; R349-E352 VanDerWaalsContact CD-OE2 3.23Å; R349-E352 WeakPolarHBondContact CD-OE2 3.2Å; R349-E352 IonicContact CZ-OE1 2.62Å; R349-E352 IonicContact CZ-OE2 2.64Å; R349-E352 IonicContact NE-OE1 3.71Å; R349-E352 IonicContact NE-OE2 3.56Å; R349-E352 VanDerWaalsContact NH1-CD 3.25Å; R349-E352 IonicContact NH1-OE1 3.51Å; R349-E352 PolarHBondContact NH1-OE1 2.9Å; R349-E352 IonicContact NH1-OE2 2.7Å; R349-E352 PolarHBondContact NH1-OE2 3.2Å; R349-E352 PolarHBondContact O-N 3.13Å; L350-E352 VanDerWaalsContact C-N 3.32Å; L350-E352 PolarHBondContact O-N 3.16Å
353	I	95.3	Very high	94.2	Very high	48 Å²	48	61.1 Å²	61.1	25%	0.246	30%	0.301	C	S	.	.	H	α-helix	trans	-79.8	-43.7	-174.4	-57	162	0	0	0	112.1	L263 V321 L348 R349 L350	L263-I353 HydrophobicContact CD1-CD1 3.93Å; L263-I353 HydrophobicContact CD1-CG1 4.24Å; L263-I353 HydrophobicContact CD1-CG2 4.05Å; V321-I353 HydrophobicContact CG1-CB 4.06Å; V321-I353 HydrophobicContact CG1-CG2 3.54Å; L348-I353 HydrophobicContact CB-CD1 4.27Å; L348-I353 HydrophobicContact CD2-CD1 3.95Å; R349-I353 WeakPolarHBondContact O-CG1 3.3Å; R349-I353 PolarHBondContact O-N 3.03Å; L350-I353 PolarHBondContact O-N 3.21Å
354	N	94.1	Very high	94.1	Very high	14 Å²	14	59.5 Å²	59.5	8%	0.075	29%	0.291	C	S	.	.			trans	-154	80.1	-179.3	-171.5	2.1	0	0	0	111.6	V321 L350 L356 L357	V321-N354 HydrophobicContact CG1-CB 4.1Å; V321-N354 PolarHBondContact O-ND2 3.36Å; L350-N354 CarbonylContact O-C 3.45Å; L350-N354 WeakPolarHBondContact O-CA 3.37Å; L350-N354 PolarHBondContact O-N 3.01Å; N354-L356 PolarHBondContact O-N 3.13Å; N354-L356 PolarHBondContact OD1-N 3.24Å; N354-L357 HydrophobicContact CB-CB 4.45Å; N354-L357 WeakPolarHBondContact O-CB 3.28Å; N354-L357 PolarHBondContact O-N 3.08Å
355	P	93.4	Very high	94.1	Very high	75 Å²	75	59.2 Å²	59.2	49%	0.487	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-62.6	-23.9	179.1	24.4	-33.5	0	0	0	113.5	L357	P355-L357 VanDerWaalsContact C-N 3.26Å; P355-L357 PolarHBondContact O-N 3.12Å
356	L	91.8	Very high	94.1	Very high	96 Å²	96	60 Å²	60	50%	0.503	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-69	-22.6	179.6	-62.8	176.7	0	0	0	112.9	N354 F358 N359 Y360	N354-L356 PolarHBondContact O-N 3.13Å; N354-L356 PolarHBondContact OD1-N 3.24Å; L356-F358 PolarHBondContact O-N 3.16Å; L356-N359 VanDerWaalsContact O-CB 3.32Å; L356-N359 WeakPolarHBondContact O-CB 3.38Å; L356-N359 PolarHBondContact O-N 3.05Å; L356-Y360 HydrophobicContact CB-CE2 4.47Å; L356-Y360 VanDerWaalsContact O-CD2 3.25Å; L356-Y360 WeakPolarHBondContact O-CD2 3.19Å
357	L	91.8	Very high	94.1	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-57.5	-36.6	-179.4	-172.4	66.4	0	0	0	112.3	F71 W324 N354 P355 N359 Y360 V361 L364	F71-L357 HydrophobicContact CE1-CD1 3.76Å; F71-L357 HydrophobicContact CZ-CD1 3.8Å; W324-L357 HydrophobicContact CB-CD1 4.2Å; W324-L357 HydrophobicContact CD2-CD1 4.35Å; W324-L357 HydrophobicContact CE3-CD1 3.98Å; W324-L357 HydrophobicContact CE3-CD2 3.96Å; W324-L357 HydrophobicContact CE3-CG 4.39Å; W324-L357 HydrophobicContact CG-CD1 4.48Å; W324-L357 HydrophobicContact CZ3-CD2 4.03Å; N354-L357 HydrophobicContact CB-CB 4.45Å; N354-L357 WeakPolarHBondContact O-CB 3.28Å; N354-L357 PolarHBondContact O-N 3.08Å; P355-L357 VanDerWaalsContact C-N 3.26Å; P355-L357 PolarHBondContact O-N 3.12Å; L357-N359 PolarHBondContact O-N 2.83Å; L357-Y360 PolarHBondContact O-N 3.34Å; L357-Y360 VanDerWaalsContact O-N 3.13Å; L357-V361 HydrophobicContact CD1-CG2 3.99Å; L357-V361 HydrophobicContact CG-CG2 4.37Å; L357-V361 PolarHBondContact O-N 2.87Å; L357-V361 VanDerWaalsContact O-N 3.1Å; L357-L364 HydrophobicContact CD2-CD1 3.67Å; L357-L364 HydrophobicContact CG-CD1 3.81Å
358	F	92.1	Very high	94.1	Very high	29 Å²	29	58.1 Å²	58.1	13%	0.127	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-67.6	-12.7	176.3	-67.8	-87.1	0	0	0	114	L350 R351 L356 L364 V365 R368	L350-F358 HydrophobicContact CB-CE2 3.68Å; L350-F358 HydrophobicContact CB-CZ 3.87Å; L350-F358 HydrophobicContact CD1-CE2 4.47Å; L350-F358 HydrophobicContact CD1-CZ 4.01Å; R351-F358 HydrophobicContact CG-CE2 3.75Å; R351-F358 HydrophobicContact CG-CZ 4.12Å; L356-F358 PolarHBondContact O-N 3.16Å; F358-L364 HydrophobicContact CD1-CB 3.84Å; F358-L364 HydrophobicContact CE1-CB 3.89Å; F358-V365 HydrophobicContact CB-CG2 4.31Å; F358-V365 HydrophobicContact CD1-CG2 4.34Å; F358-V365 VanDerWaalsContact O-CG2 3.29Å; F358-V365 WeakPolarHBondContact O-CG2 3.42Å; F358-R368 HydrophobicContact CE1-CB 4.45Å
359	N	91.8	Very high	94	Very high	122 Å²	122	62.2 Å²	62.2	65%	0.652	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-88.2	-11.4	175	-57.5	-19.1	0	0	0	112.6	L356 L357	L356-N359 VanDerWaalsContact O-CB 3.32Å; L356-N359 WeakPolarHBondContact O-CB 3.38Å; L356-N359 PolarHBondContact O-N 3.05Å; L357-N359 PolarHBondContact O-N 2.83Å
360	Y	91	Very high	94	Very high	88 Å²	88	58 Å²	58	35%	0.345	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.4	-14.6	-176.1	-62.9	-70.7	0	0	0	113.8	K67 F71 L356 L357	K67-Y360 HydrophobicContact CB-CD1 4.32Å; F71-Y360 HydrophobicContact CB-CG 4.46Å; F71-Y360 AromaticContact CD2-CD2 3.54Å; F71-Y360 HydrophobicContact CD2-CD2 3.54Å; F71-Y360 AromaticContact CD2-CE2 3.62Å; F71-Y360 HydrophobicContact CD2-CE2 3.62Å; F71-Y360 HydrophobicContact CD2-CG 4.25Å; F71-Y360 AromaticContact CE2-CD2 3.83Å; F71-Y360 HydrophobicContact CE2-CD2 3.83Å; F71-Y360 HydrophobicContact CE2-CE2 4.06Å; F71-Y360 HydrophobicContact CG-CD2 4.08Å; F71-Y360 HydrophobicContact CG-CE2 4.42Å; F71-Y360 HydrophobicContact CG-CG 4.35Å; L356-Y360 HydrophobicContact CB-CE2 4.47Å; L356-Y360 VanDerWaalsContact O-CD2 3.25Å; L356-Y360 WeakPolarHBondContact O-CD2 3.19Å; L357-Y360 PolarHBondContact O-N 3.34Å; L357-Y360 VanDerWaalsContact O-N 3.13Å
361	V	93.8	Very high	94.1	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.279	C	S	.	.			trans	-125.9	96	-179	-175.4	0	0	0	0	108.4	W324 L357 E363 L364	W324-V361 HydrophobicContact CD2-CG2 3.9Å; W324-V361 HydrophobicContact CG-CG2 3.91Å; W324-V361 HydrophobicContact CH2-CG1 4.38Å; W324-V361 HydrophobicContact CZ2-CG1 3.64Å; W324-V361 HydrophobicContact CZ2-CG2 4.48Å; L357-V361 HydrophobicContact CD1-CG2 3.99Å; L357-V361 HydrophobicContact CG-CG2 4.37Å; L357-V361 PolarHBondContact O-N 2.87Å; L357-V361 VanDerWaalsContact O-N 3.1Å; V361-E363 VanDerWaalsContact C-N 3.26Å; V361-E363 HydrophobicContact CG1-CB 4.4Å; V361-E363 VanDerWaalsContact CG1-OE2 3.31Å; V361-E363 WeakPolarHBondContact CG1-OE2 3.31Å; V361-E363 PolarHBondContact O-N 3.01Å; V361-L364 HydrophobicContact CB-CB 4.41Å; V361-L364 HydrophobicContact CB-CD1 4.09Å; V361-L364 HydrophobicContact CB-CG 4.3Å; V361-L364 HydrophobicContact CG1-CB 4.18Å; V361-L364 HydrophobicContact CG1-CD1 4.06Å; V361-L364 HydrophobicContact CG1-CG 3.84Å; V361-L364 PolarHBondContact O-N 3.44Å
362	E	92.8	Very high	94.2	Very high	101 Å²	101	55.7 Å²	55.7	47%	0.472	27%	0.273	S	S	.	.	H	α-helix	trans	-63.5	-34.9	-177.2	-172.9	163.9	-155.5	0	0	111.3	L364 V365 E366	E362-L364 PolarHBondContact O-N 2.74Å; E362-V365 WeakPolarHBondContact O-CA 3.23Å; E362-V365 VanDerWaalsContact O-CB 3.3Å; E362-V365 WeakPolarHBondContact O-CB 3.41Å; E362-V365 PolarHBondContact O-N 3.43Å; E362-E366 PolarHBondContact O-N 3.22Å
363	E	95.1	Very high	94.3	Very high	59 Å²	59	50.2 Å²	50.2	28%	0.276	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-29.3	179.7	-51.6	97.3	130.7	0	0	112.6	Y64 V361 I367 V417	Y64-E363 VanDerWaalsContact OH-CD 3.3Å; Y64-E363 PolarHBondContact OH-OE1 3.09Å; Y64-E363 PolarHBondContact OH-OE2 3.5Å; V361-E363 VanDerWaalsContact C-N 3.26Å; V361-E363 HydrophobicContact CG1-CB 4.4Å; V361-E363 VanDerWaalsContact CG1-OE2 3.31Å; V361-E363 WeakPolarHBondContact CG1-OE2 3.31Å; V361-E363 PolarHBondContact O-N 3.01Å; E363-I367 VanDerWaalsContact O-CB 3.3Å; E363-I367 WeakPolarHBondContact O-CB 3.49Å; E363-I367 WeakPolarHBondContact O-CD1 3.23Å; E363-I367 VanDerWaalsContact O-CG1 3.31Å; E363-I367 WeakPolarHBondContact O-CG1 3.41Å; E363-I367 PolarHBondContact O-N 3.37Å; E363-V417 HydrophobicContact CB-CG1 3.78Å
364	L	95.3	Very high	94.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-72.2	-30.1	172.9	-81	177.5	0	0	0	112.4	W324 L350 L357 F358 V361 E362 R368 Y409 L414 V417	W324-L364 HydrophobicContact CH2-CD1 3.81Å; W324-L364 HydrophobicContact CH2-CD2 4.1Å; W324-L364 HydrophobicContact CH2-CG 3.94Å; W324-L364 HydrophobicContact CZ2-CD1 4.47Å; W324-L364 HydrophobicContact CZ2-CG 4.44Å; W324-L364 HydrophobicContact CZ3-CD1 3.87Å; W324-L364 HydrophobicContact CZ3-CG 4.5Å; L350-L364 HydrophobicContact CD1-CD1 4.14Å; L350-L364 HydrophobicContact CD1-CD2 3.91Å; L357-L364 HydrophobicContact CD2-CD1 3.67Å; L357-L364 HydrophobicContact CG-CD1 3.81Å; F358-L364 HydrophobicContact CD1-CB 3.84Å; F358-L364 HydrophobicContact CE1-CB 3.89Å; V361-L364 HydrophobicContact CB-CB 4.41Å; V361-L364 HydrophobicContact CB-CD1 4.09Å; V361-L364 HydrophobicContact CB-CG 4.3Å; V361-L364 HydrophobicContact CG1-CB 4.18Å; V361-L364 HydrophobicContact CG1-CD1 4.06Å; V361-L364 HydrophobicContact CG1-CG 3.84Å; V361-L364 PolarHBondContact O-N 3.44Å; E362-L364 PolarHBondContact O-N 2.74Å; L364-R368 WeakPolarHBondContact O-CB 3.44Å; L364-R368 PolarHBondContact O-N 2.84Å; L364-R368 VanDerWaalsContact O-N 3.08Å; L364-Y409 HydrophobicContact CD2-CE1 4.03Å; L364-L414 HydrophobicContact CD2-CD2 4.23Å; L364-V417 HydrophobicContact CD2-CG1 4.21Å; L364-V417 HydrophobicContact CD2-CG2 3.93Å; L364-V417 HydrophobicContact CG-CG1 4.27Å
365	V	94.9	Very high	94.4	Very high	72 Å²	72	49.2 Å²	49.2	44%	0.436	24%	0.242	S	C	.	.	H	α-helix	trans	-72.7	-46	176.2	-173.8	0	0	0	0	109.8	F358 E362 R368 K369	F358-V365 HydrophobicContact CB-CG2 4.31Å; F358-V365 HydrophobicContact CD1-CG2 4.34Å; F358-V365 VanDerWaalsContact O-CG2 3.29Å; F358-V365 WeakPolarHBondContact O-CG2 3.42Å; E362-V365 WeakPolarHBondContact O-CA 3.23Å; E362-V365 VanDerWaalsContact O-CB 3.3Å; E362-V365 WeakPolarHBondContact O-CB 3.41Å; E362-V365 PolarHBondContact O-N 3.43Å; V365-R368 PolarHBondContact O-N 2.77Å; V365-K369 PolarHBondContact O-N 3.5Å
366	E	95.1	Very high	94.4	Very high	112 Å²	112	48.8 Å²	48.8	52%	0.523	24%	0.236	S	C	.	.	H	α-helix	trans	-59	-52.6	175.2	-64.4	-170.5	139.5	0	0	112	E362 R368 K369 L370	E362-E366 PolarHBondContact O-N 3.22Å; E366-R368 VanDerWaalsContact C-N 3.25Å; E366-R368 PolarHBondContact O-N 3.37Å; E366-K369 PolarHBondContact O-N 3.14Å; E366-K369 VanDerWaalsContact O-N 3.1Å; E366-L370 WeakPolarHBondContact O-CG 3.35Å; E366-L370 PolarHBondContact O-N 2.86Å
367	I	96.1	Very high	94.7	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-63.9	-33	-179.5	-73.2	167.5	0	0	0	111.2	E363 R371 V417 L422 L426	E363-I367 VanDerWaalsContact O-CB 3.3Å; E363-I367 WeakPolarHBondContact O-CB 3.49Å; E363-I367 WeakPolarHBondContact O-CD1 3.23Å; E363-I367 VanDerWaalsContact O-CG1 3.31Å; E363-I367 WeakPolarHBondContact O-CG1 3.41Å; E363-I367 PolarHBondContact O-N 3.37Å; I367-R371 VanDerWaalsContact O-CG 3.3Å; I367-R371 WeakPolarHBondContact O-CG 3.31Å; I367-R371 PolarHBondContact O-N 3.1Å; I367-V417 HydrophobicContact CD1-CB 4.23Å; I367-V417 HydrophobicContact CD1-CG1 4.06Å; I367-V417 HydrophobicContact CD1-CG2 3.74Å; I367-L422 HydrophobicContact CD1-CB 4Å; I367-L422 HydrophobicContact CD1-CD2 4.23Å; I367-L422 HydrophobicContact CD1-CG 4.07Å; I367-L422 HydrophobicContact CG2-CD2 4.17Å; I367-L422 HydrophobicContact CG2-CG 4.48Å; I367-L426 HydrophobicContact CG2-CD2 3.97Å
368	R	95.6	Very high	94.8	Very high	53 Å²	53	47.5 Å²	47.5	20%	0.2	23%	0.226	C	C	.	.	H	α-helix	trans	-67.4	-43.2	172.7	-173.2	175.7	178.9	-130.6	-10.2	112	F358 L364 V365 E366 R371 Q372 D406	F358-R368 HydrophobicContact CE1-CB 4.45Å; L364-R368 WeakPolarHBondContact O-CB 3.44Å; L364-R368 PolarHBondContact O-N 2.84Å; L364-R368 VanDerWaalsContact O-N 3.08Å; V365-R368 PolarHBondContact O-N 2.77Å; E366-R368 VanDerWaalsContact C-N 3.25Å; E366-R368 PolarHBondContact O-N 3.37Å; R368-R371 PolarHBondContact O-N 2.87Å; R368-Q372 VanDerWaalsContact CZ-NE2 3.33Å; R368-Q372 VanDerWaalsContact NH2-NE2 3.19Å; R368-Q372 WeakPolarHBondContact O-CG 3.24Å; R368-Q372 PolarHBondContact O-N 3.02Å; R368-D406 HydrophobicContact CG-CB 4.38Å; R368-D406 IonicContact CZ-OD2 3.18Å; R368-D406 IonicContact NE-OD2 2.7Å; R368-D406 PolarHBondContact NE-OD2 3.25Å; R368-D406 IonicContact NH2-OD2 2.77Å; R368-D406 PolarHBondContact NH2-OD2 2.82Å
369	K	95.2	Very high	94.9	Very high	88 Å²	88	49.3 Å²	49.3	38%	0.383	24%	0.241	S	C	.	.	H	α-helix	trans	-61.1	-48	175.6	173.8	52.6	175.2	148.5	0	111	V365 E366 R371 Q372 D373	V365-K369 PolarHBondContact O-N 3.5Å; E366-K369 PolarHBondContact O-N 3.14Å; E366-K369 VanDerWaalsContact O-N 3.1Å; K369-R371 VanDerWaalsContact C-N 3.32Å; K369-R371 PolarHBondContact O-N 3.37Å; K369-Q372 WeakPolarHBondContact O-CB 3.38Å; K369-Q372 PolarHBondContact O-N 2.91Å; K369-Q372 VanDerWaalsContact O-N 3.1Å; K369-D373 VanDerWaalsContact CD-OD2 3.28Å; K369-D373 WeakPolarHBondContact CD-OD2 3.38Å; K369-D373 WeakPolarHBondContact CE-OD2 3.44Å; K369-D373 IonicContact NZ-OD1 3.38Å; K369-D373 PolarHBondContact NZ-OD1 3Å; K369-D373 IonicContact NZ-OD2 2.9Å; K369-D373 PolarHBondContact NZ-OD2 3.14Å; K369-D373 PolarHBondContact O-N 3.28Å
370	L	96.3	Very high	95.1	Very high	21 Å²	21	44.1 Å²	44.1	11%	0.11	21%	0.212	C	C	.	.	H	α-helix	trans	-57	-41.4	174.6	-69.9	170.1	0	0	0	112.5	E366 D373 I374 L426 H430	E366-L370 WeakPolarHBondContact O-CG 3.35Å; E366-L370 PolarHBondContact O-N 2.86Å; L370-D373 PolarHBondContact O-N 3.14Å; L370-I374 WeakPolarHBondContact O-CB 3.46Å; L370-I374 WeakPolarHBondContact O-CD1 3.4Å; L370-I374 VanDerWaalsContact O-CG1 3.26Å; L370-I374 WeakPolarHBondContact O-CG1 3.36Å; L370-I374 PolarHBondContact O-N 3.48Å; L370-L426 HydrophobicContact CB-CD2 3.59Å; L370-L426 HydrophobicContact CB-CG 3.95Å; L370-L426 HydrophobicContact CD1-CB 4.22Å; L370-L426 HydrophobicContact CD1-CD2 4.16Å; L370-L426 HydrophobicContact CD1-CG 4.22Å; L370-H430 HydrophobicContact CD2-CB 3.82Å
371	R	96.8	Very high	95.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.9	-44.4	173.8	-76.2	174.3	66.8	172.2	5.2	112.3	I367 R368 K369 D373 I374 L375 F402 N405 D406 M408 Y409 L426	I367-R371 VanDerWaalsContact O-CG 3.3Å; I367-R371 WeakPolarHBondContact O-CG 3.31Å; I367-R371 PolarHBondContact O-N 3.1Å; R368-R371 PolarHBondContact O-N 2.87Å; K369-R371 VanDerWaalsContact C-N 3.32Å; K369-R371 PolarHBondContact O-N 3.37Å; R371-D373 VanDerWaalsContact C-N 3.32Å; R371-D373 PolarHBondContact O-N 2.83Å; R371-I374 PolarHBondContact O-N 3.37Å; R371-L375 VanDerWaalsContact O-CG 3.3Å; R371-L375 WeakPolarHBondContact O-CG 3.28Å; R371-L375 PolarHBondContact O-N 3.17Å; R371-F402 HydrophobicContact CG-CB 4.36Å; R371-F402 HydrophobicContact CG-CD1 4.47Å; R371-F402 HydrophobicContact CG-CD2 3.86Å; R371-F402 HydrophobicContact CG-CE2 4.23Å; R371-F402 HydrophobicContact CG-CG 4Å; R371-F402 VanDerWaalsContact CZ-CD1 3.41Å; R371-N405 PolarHBondContact NE-O 3.01Å; R371-N405 PolarHBondContact NH2-O 2.96Å; R371-D406 HydrophobicContact CB-CB 4.25Å; R371-M408 VanDerWaalsContact CZ-O 3.29Å; R371-M408 PolarHBondContact NH1-O 2.9Å; R371-M408 PolarHBondContact NH2-O 2.75Å; R371-Y409 VanDerWaalsContact NH1-CZ 3.34Å; R371-L426 HydrophobicContact CG-CD2 4.07Å
372	Q	95.6	Very high	95.3	Very high	66 Å²	66	44.7 Å²	44.7	31%	0.308	22%	0.22	S	C	.	.	H	α-helix	trans	-60.7	-42.2	176.7	-71.3	172.5	-5.4	0	0	111.6	R368 K369 L375 L376 D406	R368-Q372 VanDerWaalsContact CZ-NE2 3.33Å; R368-Q372 VanDerWaalsContact NH2-NE2 3.19Å; R368-Q372 WeakPolarHBondContact O-CG 3.24Å; R368-Q372 PolarHBondContact O-N 3.02Å; K369-Q372 WeakPolarHBondContact O-CB 3.38Å; K369-Q372 PolarHBondContact O-N 2.91Å; K369-Q372 VanDerWaalsContact O-N 3.1Å; Q372-L375 WeakPolarHBondContact O-CB 3.18Å; Q372-L375 PolarHBondContact O-N 2.99Å; Q372-L376 WeakPolarHBondContact O-CG 3.5Å; Q372-L376 PolarHBondContact O-N 3.48Å; Q372-L376 VanDerWaalsContact O-N 3.08Å; Q372-D406 HydrophobicContact CG-CB 3.75Å; Q372-D406 PolarHBondContact NE2-OD2 3.48Å
373	D	96.1	Very high	95.4	Very high	8 Å²	8	43.7 Å²	43.7	4%	0.043	22%	0.221	C	C	.	.	H	α-helix	trans	-66.5	-41	177.1	-68.9	-32.3	0	0	0	112	K369 L370 R371 L375 L376 M377 F463	K369-D373 VanDerWaalsContact CD-OD2 3.28Å; K369-D373 WeakPolarHBondContact CD-OD2 3.38Å; K369-D373 WeakPolarHBondContact CE-OD2 3.44Å; K369-D373 IonicContact NZ-OD1 3.38Å; K369-D373 PolarHBondContact NZ-OD1 3Å; K369-D373 IonicContact NZ-OD2 2.9Å; K369-D373 PolarHBondContact NZ-OD2 3.14Å; K369-D373 PolarHBondContact O-N 3.28Å; L370-D373 PolarHBondContact O-N 3.14Å; R371-D373 VanDerWaalsContact C-N 3.32Å; R371-D373 PolarHBondContact O-N 2.83Å; D373-L375 VanDerWaalsContact C-N 3.29Å; D373-L375 PolarHBondContact O-N 2.87Å; D373-L376 CarbonylContact O-C 3.24Å; D373-L376 WeakPolarHBondContact O-CA 3.44Å; D373-L376 WeakPolarHBondContact O-CB 3.48Å; D373-L376 PolarHBondContact O-N 3.4Å; D373-L376 VanDerWaalsContact O-N 3.08Å; D373-M377 VanDerWaalsContact O-CG 3.22Å; D373-M377 WeakPolarHBondContact O-CG 3.4Å; D373-M377 PolarHBondContact O-N 3.21Å; D373-F463 HydrophobicContact CB-CB 3.74Å; D373-F463 WeakPolarHBondContact OD1-CA 3.28Å; D373-F463 WeakPolarHBondContact OD1-CB 3.45Å
374	I	96	Very high	95.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.2	-37	172.9	-74.5	163.6	0	0	0	112.1	L370 R371 M377 K378 L396 V403 L426 F433	L370-I374 WeakPolarHBondContact O-CB 3.46Å; L370-I374 WeakPolarHBondContact O-CD1 3.4Å; L370-I374 VanDerWaalsContact O-CG1 3.26Å; L370-I374 WeakPolarHBondContact O-CG1 3.36Å; L370-I374 PolarHBondContact O-N 3.48Å; R371-I374 PolarHBondContact O-N 3.37Å; I374-M377 PolarHBondContact O-N 2.92Å; I374-K378 PolarHBondContact O-N 3.37Å; I374-L396 HydrophobicContact CD1-CD1 4.3Å; I374-L396 HydrophobicContact CG2-CD1 3.74Å; I374-V403 HydrophobicContact CG2-CG1 4.03Å; I374-L426 HydrophobicContact CD1-CD1 3.41Å; I374-L426 VanDerWaalsContact CD1-CD1 3.41Å; I374-L426 HydrophobicContact CD1-CG 3.94Å; I374-F433 HydrophobicContact CG1-CD2 4.13Å; I374-F433 HydrophobicContact CG1-CE2 4.37Å; I374-F433 HydrophobicContact CG2-CE2 4.22Å
375	L	95.3	Very high	95.4	Very high	41 Å²	41	48.4 Å²	48.4	22%	0.215	24%	0.236	C	C	.	.	H	α-helix	trans	-68	-34.3	174.4	-67	164.8	0	0	0	112.2	R371 Q372 D373 P379 V403 D406	R371-L375 VanDerWaalsContact O-CG 3.3Å; R371-L375 WeakPolarHBondContact O-CG 3.28Å; R371-L375 PolarHBondContact O-N 3.17Å; Q372-L375 WeakPolarHBondContact O-CB 3.18Å; Q372-L375 PolarHBondContact O-N 2.99Å; D373-L375 VanDerWaalsContact C-N 3.29Å; D373-L375 PolarHBondContact O-N 2.87Å; L375-P379 VanDerWaalsContact O-CD 3.22Å; L375-P379 WeakPolarHBondContact O-CD 3.43Å; L375-V403 VanDerWaalsContact CD2-C 3.47Å; L375-D406 HydrophobicContact CD1-CB 4.17Å
376	L	94.9	Very high	95.5	Very high	67 Å²	67	48.5 Å²	48.5	35%	0.351	23%	0.232	S	C	.	.	H	α-helix	trans	-73.4	-27.8	172.7	-66.8	169.1	0	0	0	112.8	Q372 D373 P379 P462 F463	Q372-L376 WeakPolarHBondContact O-CG 3.5Å; Q372-L376 PolarHBondContact O-N 3.48Å; Q372-L376 VanDerWaalsContact O-N 3.08Å; D373-L376 CarbonylContact O-C 3.24Å; D373-L376 WeakPolarHBondContact O-CA 3.44Å; D373-L376 WeakPolarHBondContact O-CB 3.48Å; D373-L376 PolarHBondContact O-N 3.4Å; D373-L376 VanDerWaalsContact O-N 3.08Å; L376-P379 WeakPolarHBondContact O-CD 3.25Å; L376-P462 HydrophobicContact CB-CB 4.29Å; L376-P462 HydrophobicContact CD1-CB 4.17Å; L376-P462 HydrophobicContact CD2-CB 4.07Å; L376-P462 HydrophobicContact CG-CB 4.42Å; L376-F463 HydrophobicContact CB-CB 4.35Å; L376-F463 HydrophobicContact CB-CD1 4.47Å; L376-F463 HydrophobicContact CD1-CB 4.43Å
377	M	96.4	Very high	95.5	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-76.4	-34.5	173.4	-67.9	169.9	174.5	0	0	112.8	D373 I374 Y380 F381 H430 F433 A434 I437 F463	D373-M377 VanDerWaalsContact O-CG 3.22Å; D373-M377 WeakPolarHBondContact O-CG 3.4Å; D373-M377 PolarHBondContact O-N 3.21Å; I374-M377 PolarHBondContact O-N 2.92Å; M377-Y380 WeakPolarHBondContact O-CB 3.44Å; M377-Y380 PolarHBondContact O-N 3.47Å; M377-F381 HydrophobicContact CB-CE2 3.73Å; M377-F381 HydrophobicContact CB-CZ 4.15Å; M377-H430 WeakPolarHBondContact CE-CD2 3.34Å; M377-H430 VanDerWaalsContact CE-NE2 3.26Å; M377-H430 WeakPolarHBondContact CE-NE2 3.49Å; M377-F433 HydrophobicContact CE-CB 4.45Å; M377-F433 HydrophobicContact SD-CB 3.5Å; M377-F433 VanDerWaalsContact SD-CB 3.5Å; M377-F433 HydrophobicContact SD-CD2 4.13Å; M377-F433 HydrophobicContact SD-CG 4.36Å; M377-A434 HydrophobicContact CE-CB 3.88Å; M377-I437 HydrophobicContact CB-CD1 3.68Å; M377-I437 HydrophobicContact CG-CD1 3.67Å; M377-F463 HydrophobicContact CE-CB 4.48Å; M377-F463 HydrophobicContact CE-CD1 4.23Å; M377-F463 HydrophobicContact CE-CD2 3.46Å; M377-F463 VanDerWaalsContact CE-CD2 3.46Å; M377-F463 HydrophobicContact CE-CE1 4.32Å; M377-F463 HydrophobicContact CE-CE2 3.55Å; M377-F463 HydrophobicContact CE-CG 3.82Å; M377-F463 HydrophobicContact CE-CZ 4Å; M377-F463 HydrophobicContact CG-CD1 3.63Å; M377-F463 HydrophobicContact CG-CE1 3.67Å; M377-F463 HydrophobicContact CG-CG 4.09Å; M377-F463 HydrophobicContact CG-CZ 4.15Å
378	K	94.9	Very high	95.3	Very high	69 Å²	69	48.4 Å²	48.4	30%	0.3	23%	0.233	S	C	.	.	H	α-helix	trans	-48	-44.5	-177.5	176.7	-174.8	-179.3	-175.8	0	114.6	I374 Y380 F381 I382 L393 V403	I374-K378 PolarHBondContact O-N 3.37Å; K378-Y380 VanDerWaalsContact C-N 3.28Å; K378-Y380 PolarHBondContact O-N 3.49Å; K378-F381 PolarHBondContact O-N 2.9Å; K378-I382 HydrophobicContact CG-CG2 4.34Å; K378-I382 PolarHBondContact O-N 3.17Å; K378-I382 VanDerWaalsContact O-N 3.11Å; K378-L393 HydrophobicContact CG-CD1 4.39Å; K378-L393 HydrophobicContact CG-CD2 4.49Å; K378-V403 HydrophobicContact CD-CB 4.43Å; K378-V403 WeakPolarHBondContact CD-O 3.38Å; K378-V403 WeakPolarHBondContact CE-O 3.43Å; K378-V403 PolarHBondContact NZ-O 3.29Å
379	P	94.4	Very high	95.2	Very high	67 Å²	67	51.2 Å²	51.2	44%	0.435	25%	0.249	S	C	.	.	H	α-helix	trans	-54.4	-35.7	173.5	-29.9	36.2	0	0	0	115.3	L375 L376 T383	L375-P379 VanDerWaalsContact O-CD 3.22Å; L375-P379 WeakPolarHBondContact O-CD 3.43Å; L376-P379 WeakPolarHBondContact O-CD 3.25Å; P379-T383 PolarHBondContact O-N 2.92Å; P379-T383 PolarHBondContact O-OG1 3.08Å
380	Y	96.2	Very high	95.2	Very high	13 Å²	13	49.8 Å²	49.8	5%	0.051	25%	0.253	C	S	.	.	H	α-helix	trans	-65.6	-45.8	178.1	-67.6	-102.3	0	0	0	110.3	M377 K378 T383 C384 I437 C444 K447 F461 P462 F463	M377-Y380 WeakPolarHBondContact O-CB 3.44Å; M377-Y380 PolarHBondContact O-N 3.47Å; K378-Y380 VanDerWaalsContact C-N 3.28Å; K378-Y380 PolarHBondContact O-N 3.49Å; Y380-T383 CarbonylContact O-C 3.56Å; Y380-T383 PolarHBondContact O-N 2.76Å; Y380-T383 PolarHBondContact O-OG1 3.42Å; Y380-C384 WeakPolarHBondContact O-CB 3.33Å; Y380-C384 PolarHBondContact O-N 3.07Å; Y380-C384 VanDerWaalsContact O-N 3.07Å; Y380-I437 HydrophobicContact CD1-CG1 4.44Å; Y380-I437 HydrophobicContact CD1-CG2 3.81Å; Y380-I437 HydrophobicContact CD2-CD1 4.19Å; Y380-I437 HydrophobicContact CE1-CG2 4.03Å; Y380-I437 HydrophobicContact CG-CD1 3.97Å; Y380-I437 HydrophobicContact CG-CG1 4.2Å; Y380-I437 HydrophobicContact CG-CG2 4.24Å; Y380-C444 HydrophobicContact CD1-CB 4.26Å; Y380-K447 HydrophobicContact CD1-CB 3.99Å; Y380-K447 HydrophobicContact CD1-CD 4.17Å; Y380-K447 HydrophobicContact CE1-CB 3.56Å; Y380-K447 PolarHBondContact OH-O 2.91Å; Y380-F461 AromaticContact CE1-CD1 3.97Å; Y380-F461 HydrophobicContact CE1-CD1 3.97Å; Y380-F461 HydrophobicContact CE1-CE1 4.07Å; Y380-F461 AromaticContact CZ-CD1 3.98Å; Y380-P462 WeakPolarHBondContact OH-CD 3.25Å; Y380-F463 HydrophobicContact CE2-CE1 4.42Å
381	F	95.1	Very high	95	Very high	3 Å²	3	56.7 Å²	56.7	1%	0.013	28%	0.278	C	S	.	.	H	α-helix	trans	-70.2	-45.3	-176.9	-54.8	-43	0	0	0	113.6	M377 K378 T383 C384 A387 L392 L393 F433 H436 I437	M377-F381 HydrophobicContact CB-CE2 3.73Å; M377-F381 HydrophobicContact CB-CZ 4.15Å; K378-F381 PolarHBondContact O-N 2.9Å; F381-T383 PolarHBondContact O-N 2.91Å; F381-T383 VanDerWaalsContact O-N 3.12Å; F381-C384 PolarHBondContact O-N 3.23Å; F381-A387 HydrophobicContact CB-CB 3.92Å; F381-A387 HydrophobicContact CD1-CB 3.53Å; F381-A387 HydrophobicContact CE1-CB 4.49Å; F381-A387 HydrophobicContact CG-CB 4.12Å; F381-L392 HydrophobicContact CD1-CD1 3.93Å; F381-L392 HydrophobicContact CE1-CD1 3.65Å; F381-L392 HydrophobicContact CZ-CD1 4.32Å; F381-L393 HydrophobicContact CB-CD1 4.07Å; F381-L393 HydrophobicContact CB-CG 4.13Å; F381-L393 HydrophobicContact CD2-CD2 3.83Å; F381-L393 HydrophobicContact CD2-CG 4.02Å; F381-L393 HydrophobicContact CG-CG 4.47Å; F381-F433 HydrophobicContact CE2-CB 4.03Å; F381-F433 HydrophobicContact CE2-CD1 4.23Å; F381-F433 AromaticContact CE2-CD2 3.56Å; F381-F433 HydrophobicContact CE2-CD2 3.56Å; F381-F433 HydrophobicContact CE2-CE2 4.03Å; F381-F433 AromaticContact CE2-CG 3.67Å; F381-F433 HydrophobicContact CE2-CG 3.67Å; F381-F433 HydrophobicContact CZ-CB 3.59Å; F381-F433 HydrophobicContact CZ-CD1 4.09Å; F381-F433 HydrophobicContact CZ-CD2 4.01Å; F381-F433 AromaticContact CZ-CG 3.63Å; F381-F433 HydrophobicContact CZ-CG 3.63Å; F381-H436 HydrophobicContact CE1-CB 4.47Å; F381-H436 AromaticContact CE1-CD2 3.72Å; F381-I437 HydrophobicContact CE1-CD1 3.76Å; F381-I437 HydrophobicContact CE1-CG1 3.69Å; F381-I437 HydrophobicContact CE2-CD1 4.35Å; F381-I437 HydrophobicContact CZ-CD1 3.6Å; F381-I437 HydrophobicContact CZ-CG1 4.02Å
382	I	93.4	Very high	94.9	Very high	97 Å²	97	57.3 Å²	57.3	50%	0.497	28%	0.281	S	S	.	.	H	α-helix	trans	-64.9	-17.7	177.8	67.6	-179.6	0	0	0	112.7	K378 M388 L393	K378-I382 HydrophobicContact CG-CG2 4.34Å; K378-I382 PolarHBondContact O-N 3.17Å; K378-I382 VanDerWaalsContact O-N 3.11Å; I382-M388 WeakPolarHBondContact O-CE 3.49Å; I382-L393 HydrophobicContact CG2-CD1 3.96Å
383	T	93.9	Very high	94.6	Very high	80 Å²	80	56.1 Å²	56.1	49%	0.491	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	18	173.7	62.5	0	0	0	0	113.1	P379 Y380 F381 K447	P379-T383 PolarHBondContact O-N 2.92Å; P379-T383 PolarHBondContact O-OG1 3.08Å; Y380-T383 CarbonylContact O-C 3.56Å; Y380-T383 PolarHBondContact O-N 2.76Å; Y380-T383 PolarHBondContact O-OG1 3.42Å; F381-T383 PolarHBondContact O-N 2.91Å; F381-T383 VanDerWaalsContact O-N 3.12Å; T383-K447 PolarHBondContact O-NZ 3.12Å; T383-K447 PolarHBondContact OG1-NZ 2.97Å
384	C	96.5	Very high	94.4	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.296	C	S	.	.			trans	-125.9	114.3	176.2	-176.8	0	0	0	0	111	Y380 F381 E386 A387 M388	Y380-C384 WeakPolarHBondContact O-CB 3.33Å; Y380-C384 PolarHBondContact O-N 3.07Å; Y380-C384 VanDerWaalsContact O-N 3.07Å; F381-C384 PolarHBondContact O-N 3.23Å; C384-E386 VanDerWaalsContact C-N 3.33Å; C384-E386 PolarHBondContact O-N 3.29Å; C384-A387 HydrophobicContact CB-CB 3.82Å; C384-A387 PolarHBondContact O-N 3.35Å; C384-M388 WeakPolarHBondContact O-CE 3.38Å; C384-M388 WeakPolarHBondContact O-CG 3.43Å; C384-M388 PolarHBondContact O-N 2.99Å; C384-M388 VanDerWaalsContact O-N 3.09Å
385	R	95.5	Very high	94.2	Very high	158 Å²	158	65 Å²	65	60%	0.596	32%	0.32	S	S	*	.	H	α-helix	trans	-59.7	-40.8	176.5	177	-176.5	167.6	-172.5	-8	112	A387 M388 E389 R443	R385-A387 PolarHBondContact O-N 2.59Å; R385-M388 PolarHBondContact O-N 3.2Å; R385-E389 HydrophobicContact CG-CG 4.32Å; R385-E389 IonicContact CZ-OE1 3.12Å; R385-E389 IonicContact NE-OE1 2.75Å; R385-E389 PolarHBondContact NE-OE1 3.29Å; R385-E389 IonicContact NE-OE2 3.88Å; R385-E389 IonicContact NH2-OE1 2.72Å; R385-E389 PolarHBondContact NH2-OE1 3.24Å; R385-E389 WeakPolarHBondContact O-CB 3.36Å; R385-E389 WeakPolarHBondContact O-CG 3.07Å; R385-E389 PolarHBondContact O-N 3.13Å; R385-R443 VanDerWaalsContact N-CZ 3.34Å; R385-R443 VanDerWaalsContact N-NH2 3.1Å
386	E	96.6	Very high	94	Very high	74 Å²	74	63.5 Å²	63.5	35%	0.346	31%	0.312	S	S	.	.	H	α-helix	trans	-64.2	-42	179.3	-62.8	141.5	-101.2	0	0	111.3	C384 M388 E389 A390 C441 R443	C384-E386 VanDerWaalsContact C-N 3.33Å; C384-E386 PolarHBondContact O-N 3.29Å; E386-M388 VanDerWaalsContact C-N 3.31Å; E386-M388 PolarHBondContact O-N 3.3Å; E386-E389 PolarHBondContact O-N 3.21Å; E386-A390 VanDerWaalsContact O-CB 3.23Å; E386-A390 WeakPolarHBondContact O-CB 3.46Å; E386-A390 PolarHBondContact O-N 3.08Å; E386-C441 PolarHBondContact OE1-SG 3.45Å; E386-C441 VanDerWaalsContact OE1-SG 3.37Å; E386-C441 PolarHBondContact OE2-SG 2.96Å; E386-R443 IonicContact OE1-CZ 2.67Å; E386-R443 IonicContact OE1-NE 2.61Å; E386-R443 IonicContact OE1-NH2 3.59Å; E386-R443 PolarHBondContact OE1-NH2 3Å
387	A	94.8	Very high	93.8	Very high	3 Å²	3	65.5 Å²	65.5	3%	0.025	32%	0.32	C	S	.	.	H	α-helix	trans	-64.7	-33.9	175.4	0	0	0	0	0	113.3	F381 C384 R385 R391 L392	F381-A387 HydrophobicContact CB-CB 3.92Å; F381-A387 HydrophobicContact CD1-CB 3.53Å; F381-A387 HydrophobicContact CE1-CB 4.49Å; F381-A387 HydrophobicContact CG-CB 4.12Å; C384-A387 HydrophobicContact CB-CB 3.82Å; C384-A387 PolarHBondContact O-N 3.35Å; R385-A387 PolarHBondContact O-N 2.59Å; A387-R391 PolarHBondContact O-N 3.47Å; A387-L392 HydrophobicContact CB-CD1 3.92Å; A387-L392 HydrophobicContact CB-CG 4.39Å; A387-L392 PolarHBondContact O-N 3.29Å
388	M	92.1	Very high	93.5	Very high	108 Å²	108	71.4 Å²	71.4	53%	0.532	35%	0.352	S	S	.	.	H	α-helix	trans	-72.3	-41.2	174.4	-73.7	-173.3	-91.2	0	0	112	I382 C384 R385 E386 R391	I382-M388 WeakPolarHBondContact O-CE 3.49Å; C384-M388 WeakPolarHBondContact O-CE 3.38Å; C384-M388 WeakPolarHBondContact O-CG 3.43Å; C384-M388 PolarHBondContact O-N 2.99Å; C384-M388 VanDerWaalsContact O-N 3.09Å; R385-M388 PolarHBondContact O-N 3.2Å; E386-M388 VanDerWaalsContact C-N 3.31Å; E386-M388 PolarHBondContact O-N 3.3Å; M388-R391 PolarHBondContact O-N 3.38Å; M388-R391 VanDerWaalsContact O-N 3.13Å
389	E	94.1	Very high	93.4	Very high	112 Å²	112	70.9 Å²	70.9	52%	0.523	35%	0.348	S	S	.	.	H	α-helix	trans	-66.9	-41	175.5	-73.8	171	158.8	0	0	111.5	R385 E386 R391	R385-E389 HydrophobicContact CG-CG 4.32Å; R385-E389 IonicContact CZ-OE1 3.12Å; R385-E389 IonicContact NE-OE1 2.75Å; R385-E389 PolarHBondContact NE-OE1 3.29Å; R385-E389 IonicContact NE-OE2 3.88Å; R385-E389 IonicContact NH2-OE1 2.72Å; R385-E389 PolarHBondContact NH2-OE1 3.24Å; R385-E389 WeakPolarHBondContact O-CB 3.36Å; R385-E389 WeakPolarHBondContact O-CG 3.07Å; R385-E389 PolarHBondContact O-N 3.13Å; E386-E389 PolarHBondContact O-N 3.21Å; E389-R391 PolarHBondContact O-N 3.04Å
390	A	93.4	Very high	93.3	Very high	58 Å²	58	73.5 Å²	73.5	48%	0.479	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-3.6	170.9	0	0	0	0	0	114.1	E386 L392	E386-A390 VanDerWaalsContact O-CB 3.23Å; E386-A390 WeakPolarHBondContact O-CB 3.46Å; E386-A390 PolarHBondContact O-N 3.08Å; A390-L392 VanDerWaalsContact C-N 3.28Å; A390-L392 HydrophobicContact CB-CD2 4.13Å; A390-L392 HydrophobicContact CB-CG 4.21Å; A390-L392 PolarHBondContact O-N 2.97Å
391	R	93.5	Very high	93.1	Very high	167 Å²	167	73.5 Å²	73.5	63%	0.63	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	35.7	176.2	-58.6	177.4	178.4	-166.5	-0.6	114.7	A387 M388 E389 L393 L394	A387-R391 PolarHBondContact O-N 3.47Å; M388-R391 PolarHBondContact O-N 3.38Å; M388-R391 VanDerWaalsContact O-N 3.13Å; E389-R391 PolarHBondContact O-N 3.04Å; R391-L393 VanDerWaalsContact C-N 3.33Å; R391-L393 PolarHBondContact O-N 3.17Å; R391-L394 HydrophobicContact CB-CB 4.33Å; R391-L394 HydrophobicContact CB-CD1 4.24Å; R391-L394 HydrophobicContact CB-CD2 4.38Å; R391-L394 WeakPolarHBondContact O-CB 3.37Å; R391-L394 PolarHBondContact O-N 2.83Å
392	L	93.5	Very high	93.1	Very high	12 Å²	12	73.4 Å²	73.4	6%	0.063	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-54.8	-44	-170	-63.6	-178.1	0	0	0	113.4	F381 A387 A390 L394 Q395 L432 F433 H436	F381-L392 HydrophobicContact CD1-CD1 3.93Å; F381-L392 HydrophobicContact CE1-CD1 3.65Å; F381-L392 HydrophobicContact CZ-CD1 4.32Å; A387-L392 HydrophobicContact CB-CD1 3.92Å; A387-L392 HydrophobicContact CB-CG 4.39Å; A387-L392 PolarHBondContact O-N 3.29Å; A390-L392 VanDerWaalsContact C-N 3.28Å; A390-L392 HydrophobicContact CB-CD2 4.13Å; A390-L392 HydrophobicContact CB-CG 4.21Å; A390-L392 PolarHBondContact O-N 2.97Å; L392-L394 PolarHBondContact O-N 3.36Å; L392-L394 VanDerWaalsContact O-N 3.16Å; L392-Q395 WeakPolarHBondContact O-CB 3.02Å; L392-Q395 VanDerWaalsContact O-CG 3.28Å; L392-Q395 WeakPolarHBondContact O-CG 3.07Å; L392-Q395 PolarHBondContact O-N 3.22Å; L392-Q395 VanDerWaalsContact O-N 3.13Å; L392-L432 HydrophobicContact CD2-CD2 4.35Å; L392-L432 HydrophobicContact CD2-CG 4.44Å; L392-F433 HydrophobicContact CB-CD1 4.26Å; L392-F433 HydrophobicContact CB-CE1 3.88Å; L392-F433 WeakPolarHBondContact O-CE1 3.37Å; L392-F433 VanDerWaalsContact O-CZ 3.23Å; L392-F433 WeakPolarHBondContact O-CZ 3.27Å; L392-H436 HydrophobicContact CD1-CB 3.73Å; L392-H436 VanDerWaalsContact CD1-CG 3.5Å
393	L	90.6	Very high	92.9	Very high	41 Å²	41	69.9 Å²	69.9	22%	0.215	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-64.3	-18.7	178.3	-72.1	173.1	0	0	0	114.3	K378 F381 I382 R391 Q395 L396 V403	K378-L393 HydrophobicContact CG-CD1 4.39Å; K378-L393 HydrophobicContact CG-CD2 4.49Å; F381-L393 HydrophobicContact CB-CD1 4.07Å; F381-L393 HydrophobicContact CB-CG 4.13Å; F381-L393 HydrophobicContact CD2-CD2 3.83Å; F381-L393 HydrophobicContact CD2-CG 4.02Å; F381-L393 HydrophobicContact CG-CG 4.47Å; I382-L393 HydrophobicContact CG2-CD1 3.96Å; R391-L393 VanDerWaalsContact C-N 3.33Å; R391-L393 PolarHBondContact O-N 3.17Å; L393-Q395 PolarHBondContact O-N 2.93Å; L393-L396 PolarHBondContact O-N 2.7Å; L393-V403 HydrophobicContact CD2-CG1 4.05Å
394	L	90.9	Very high	92.7	Very high	87 Å²	87	72.2 Å²	72.2	46%	0.455	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-77	-9.4	177	-77.2	69.9	0	0	0	112.7	R391 L392 L396 Q397	R391-L394 HydrophobicContact CB-CB 4.33Å; R391-L394 HydrophobicContact CB-CD1 4.24Å; R391-L394 HydrophobicContact CB-CD2 4.38Å; R391-L394 WeakPolarHBondContact O-CB 3.37Å; R391-L394 PolarHBondContact O-N 2.83Å; L392-L394 PolarHBondContact O-N 3.36Å; L392-L394 VanDerWaalsContact O-N 3.16Å; L394-L396 PolarHBondContact O-N 2.99Å; L394-L396 VanDerWaalsContact O-N 3.13Å; L394-Q397 VanDerWaalsContact O-CB 3.23Å; L394-Q397 WeakPolarHBondContact O-CB 3.18Å; L394-Q397 VanDerWaalsContact O-CG 3.31Å; L394-Q397 WeakPolarHBondContact O-CG 3.4Å; L394-Q397 PolarHBondContact O-N 2.72Å
395	Q	91.9	Very high	92.4	Very high	108 Å²	108	74.3 Å²	74.3	51%	0.505	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-61.2	-17.6	167.9	-58.6	-58.8	-38.1	0	0	112.1	L392 L393 I429 L432 F433	L392-Q395 WeakPolarHBondContact O-CB 3.02Å; L392-Q395 VanDerWaalsContact O-CG 3.28Å; L392-Q395 WeakPolarHBondContact O-CG 3.07Å; L392-Q395 PolarHBondContact O-N 3.22Å; L392-Q395 VanDerWaalsContact O-N 3.13Å; L393-Q395 PolarHBondContact O-N 2.93Å; Q395-I429 HydrophobicContact CB-CD1 4.19Å; Q395-I429 HydrophobicContact CB-CG1 4.17Å; Q395-I429 HydrophobicContact CB-CG2 4.36Å; Q395-L432 HydrophobicContact CG-CD2 4.47Å; Q395-F433 HydrophobicContact CB-CE1 4.46Å; Q395-F433 HydrophobicContact CG-CE1 4.45Å
396	L	92.3	Very high	92.2	Very high	10 Å²	10	68 Å²	68	5%	0.052	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-108.2	17.9	176.1	-63.8	167.5	0	0	0	113	I374 L393 L394 D398 R399 Q400 V403 L426 I429 F433	I374-L396 HydrophobicContact CD1-CD1 4.3Å; I374-L396 HydrophobicContact CG2-CD1 3.74Å; L393-L396 PolarHBondContact O-N 2.7Å; L394-L396 PolarHBondContact O-N 2.99Å; L394-L396 VanDerWaalsContact O-N 3.13Å; L396-D398 PolarHBondContact O-N 3.49Å; L396-D398 VanDerWaalsContact O-N 3.14Å; L396-R399 CarbonylContact O-C 3.59Å; L396-R399 VanDerWaalsContact O-C 3.24Å; L396-R399 PolarHBondContact O-N 2.77Å; L396-Q400 PolarHBondContact O-N 3.04Å; L396-V403 HydrophobicContact CB-CG1 4.24Å; L396-V403 HydrophobicContact CD1-CG1 3.52Å; L396-L426 HydrophobicContact CD2-CD1 3.94Å; L396-I429 HydrophobicContact CD1-CG2 4.3Å; L396-I429 HydrophobicContact CD2-CD1 3.78Å; L396-I429 HydrophobicContact CD2-CG2 4.28Å; L396-I429 HydrophobicContact CG-CD1 4.39Å; L396-I429 HydrophobicContact CG-CG2 4.18Å; L396-F433 HydrophobicContact CD1-CE2 4Å; L396-F433 HydrophobicContact CD1-CZ 4.27Å
397	Q	90.7	Very high	91.9	Very high	108 Å²	108	67.5 Å²	67.5	51%	0.505	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-29.8	-175	68.5	-175.1	2.9	0	0	114.5	L394 Q400	L394-Q397 VanDerWaalsContact O-CB 3.23Å; L394-Q397 WeakPolarHBondContact O-CB 3.18Å; L394-Q397 VanDerWaalsContact O-CG 3.31Å; L394-Q397 WeakPolarHBondContact O-CG 3.4Å; L394-Q397 PolarHBondContact O-N 2.72Å; Q397-Q400 WeakPolarHBondContact O-CG 3.25Å; Q397-Q400 PolarHBondContact O-NE2 3.39Å; Q397-Q400 VanDerWaalsContact O-NE2 3.11Å
398	D	89.6	Confident	91.9	Very high	125 Å²	125	69.1 Å²	69.1	67%	0.668	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-5.1	179.7	-64.8	-80.1	0	0	0	112.8	L396	L396-D398 PolarHBondContact O-N 3.49Å; L396-D398 VanDerWaalsContact O-N 3.14Å
399	R	92.8	Very high	92.2	Very high	58 Å²	58	64 Å²	64	22%	0.219	31%	0.312	C	S	.	.			trans	-139	55.4	176.4	-59.8	-175.5	-155.8	-97	-2.9	111.3	L396 H401 F402 D413 D416	L396-R399 CarbonylContact O-C 3.59Å; L396-R399 VanDerWaalsContact O-C 3.24Å; L396-R399 PolarHBondContact O-N 2.77Å; R399-H401 PolarHBondContact O-N 2.86Å; R399-H401 VanDerWaalsContact O-N 3.09Å; R399-F402 HydrophobicContact CB-CD1 4.32Å; R399-F402 HydrophobicContact CB-CD2 4.37Å; R399-F402 HydrophobicContact CB-CG 4.19Å; R399-F402 WeakPolarHBondContact O-CB 3.27Å; R399-F402 PolarHBondContact O-N 3.48Å; R399-D413 WeakPolarHBondContact CD-OD1 3.36Å; R399-D413 IonicContact CZ-OD1 2.7Å; R399-D413 IonicContact NE-OD1 3.77Å; R399-D413 IonicContact NH1-OD1 3.62Å; R399-D413 PolarHBondContact NH1-OD1 2.71Å; R399-D416 IonicContact CZ-OD2 3.62Å; R399-D416 IonicContact NH1-OD2 3.37Å; R399-D416 PolarHBondContact NH1-OD2 3.15Å; R399-D416 VanDerWaalsContact NH1-OD2 3.11Å; R399-D416 IonicContact NH2-OD2 3.38Å; R399-D416 PolarHBondContact NH2-OD2 3.5Å
400	Q	91.2	Very high	92.3	Very high	122 Å²	122	58.9 Å²	58.9	57%	0.57	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-56.9	-30.2	-172.1	-56.8	-173.7	8.7	0	0	113.5	L396 Q397 F402 V403	L396-Q400 PolarHBondContact O-N 3.04Å; Q397-Q400 WeakPolarHBondContact O-CG 3.25Å; Q397-Q400 PolarHBondContact O-NE2 3.39Å; Q397-Q400 VanDerWaalsContact O-NE2 3.11Å; Q400-F402 PolarHBondContact O-N 3.01Å; Q400-F402 VanDerWaalsContact O-N 3.13Å; Q400-V403 WeakPolarHBondContact O-CG2 3.43Å; Q400-V403 PolarHBondContact O-N 2.91Å
401	H	93.3	Very high	92.6	Very high	13 Å²	13	56.3 Å²	56.3	6%	0.06	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-57	-25.5	174	53.8	-66.9	0	0	0	113.9	P346 R399 V403 E404 N405 D413	P346-H401 HydrophobicContact CB-CB 3.83Å; P346-H401 WeakPolarHBondContact CB-CD2 3.4Å; P346-H401 VanDerWaalsContact CB-CG 3.43Å; P346-H401 HydrophobicContact CG-CB 3.83Å; R399-H401 PolarHBondContact O-N 2.86Å; R399-H401 VanDerWaalsContact O-N 3.09Å; H401-V403 VanDerWaalsContact C-N 3.27Å; H401-V403 PolarHBondContact O-N 3.4Å; H401-E404 PolarHBondContact O-N 3.33Å; H401-E404 VanDerWaalsContact O-N 3.09Å; H401-N405 PolarHBondContact O-N 3.08Å; H401-N405 VanDerWaalsContact O-O 3.05Å; H401-D413 IonicContact CD2-OD2 2.77Å; H401-D413 IonicContact CE1-OD2 3.2Å; H401-D413 IonicContact NE2-OD1 2.76Å; H401-D413 IonicContact NE2-OD2 2.74Å; H401-D413 PolarHBondContact NE2-OD2 3.07Å
402	F	94.2	Very high	92.8	Very high	1 Å²	1	51.1 Å²	51.1	0%	0.004	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-70.7	-21.9	177	-75.4	19.4	0	0	0	113	R371 R399 Q400 D413 L422 L426	R371-F402 HydrophobicContact CG-CB 4.36Å; R371-F402 HydrophobicContact CG-CD1 4.47Å; R371-F402 HydrophobicContact CG-CD2 3.86Å; R371-F402 HydrophobicContact CG-CE2 4.23Å; R371-F402 HydrophobicContact CG-CG 4Å; R371-F402 VanDerWaalsContact CZ-CD1 3.41Å; R399-F402 HydrophobicContact CB-CD1 4.32Å; R399-F402 HydrophobicContact CB-CD2 4.37Å; R399-F402 HydrophobicContact CB-CG 4.19Å; R399-F402 WeakPolarHBondContact O-CB 3.27Å; R399-F402 PolarHBondContact O-N 3.48Å; Q400-F402 PolarHBondContact O-N 3.01Å; Q400-F402 VanDerWaalsContact O-N 3.13Å; F402-D413 HydrophobicContact CZ-CB 4.4Å; F402-L422 HydrophobicContact CE2-CD1 3.99Å; F402-L422 HydrophobicContact CE2-CD2 4.14Å; F402-L422 HydrophobicContact CE2-CG 4.4Å; F402-L422 HydrophobicContact CZ-CD1 4.46Å; F402-L422 HydrophobicContact CZ-CD2 3.94Å; F402-L426 HydrophobicContact CD2-CD1 4.03Å; F402-L426 HydrophobicContact CD2-CD2 4.45Å; F402-L426 HydrophobicContact CE2-CD1 4.42Å; F402-L426 HydrophobicContact CE2-CD2 4.32Å
403	V	90.3	Very high	93	Very high	22 Å²	22	50.6 Å²	50.6	13%	0.133	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-98	7.8	170.9	-59.1	0	0	0	0	112.3	I374 L375 K378 L393 L396 Q400 H401	I374-V403 HydrophobicContact CG2-CG1 4.03Å; L375-V403 VanDerWaalsContact CD2-C 3.47Å; K378-V403 HydrophobicContact CD-CB 4.43Å; K378-V403 WeakPolarHBondContact CD-O 3.38Å; K378-V403 WeakPolarHBondContact CE-O 3.43Å; K378-V403 PolarHBondContact NZ-O 3.29Å; L393-V403 HydrophobicContact CD2-CG1 4.05Å; L396-V403 HydrophobicContact CB-CG1 4.24Å; L396-V403 HydrophobicContact CD1-CG1 3.52Å; Q400-V403 WeakPolarHBondContact O-CG2 3.43Å; Q400-V403 PolarHBondContact O-N 2.91Å; H401-V403 VanDerWaalsContact C-N 3.27Å; H401-V403 PolarHBondContact O-N 3.4Å
404	E	88.3	Confident	93.4	Very high	129 Å²	129	48.7 Å²	48.7	60%	0.603	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-44.3	176	-66.1	176.3	160	0	0	112.4	H401	H401-E404 PolarHBondContact O-N 3.33Å; H401-E404 VanDerWaalsContact O-N 3.09Å
405	N	90.1	Very high	93.7	Very high	45 Å²	45	46.4 Å²	46.4	24%	0.241	23%	0.225	C	C	.	.			trans	-159.8	170	178.9	60.7	79	0	0	0	111.5	R371 H401 E407 M408	R371-N405 PolarHBondContact NE-O 3.01Å; R371-N405 PolarHBondContact NH2-O 2.96Å; H401-N405 PolarHBondContact O-N 3.08Å; H401-N405 VanDerWaalsContact O-O 3.05Å; N405-E407 PolarHBondContact OD1-N 3.23Å; N405-E407 VanDerWaalsContact OD1-N 3.09Å; N405-M408 WeakPolarHBondContact OD1-CB 3.35Å; N405-M408 WeakPolarHBondContact OD1-CG 3.31Å; N405-M408 PolarHBondContact OD1-N 2.88Å
406	D	91.3	Very high	94	Very high	26 Å²	26	41.8 Å²	41.8	14%	0.139	20%	0.203	C	C	.	.	S	Bend	trans	-97	-0.6	175.7	69.4	-58	0	0	0	114	R368 R371 Q372 L375	R368-D406 HydrophobicContact CG-CB 4.38Å; R368-D406 IonicContact CZ-OD2 3.18Å; R368-D406 IonicContact NE-OD2 2.7Å; R368-D406 PolarHBondContact NE-OD2 3.25Å; R368-D406 IonicContact NH2-OD2 2.77Å; R368-D406 PolarHBondContact NH2-OD2 2.82Å; R371-D406 HydrophobicContact CB-CB 4.25Å; Q372-D406 HydrophobicContact CG-CB 3.75Å; Q372-D406 PolarHBondContact NE2-OD2 3.48Å; L375-D406 HydrophobicContact CD1-CB 4.17Å
407	E	90.9	Very high	94.2	Very high	63 Å²	63	41.4 Å²	41.4	29%	0.294	20%	0.201	S	C	.	.	S	Bend	trans	-105.6	-30.3	-164.6	-54.3	-156.6	116.4	0	0	115.1	R351 N405 Y409	R351-E407 IonicContact CZ-OE1 3.67Å; R351-E407 IonicContact NE-OE1 3.98Å; R351-E407 IonicContact NH1-OE1 2.66Å; R351-E407 PolarHBondContact NH1-OE1 3.41Å; N405-E407 PolarHBondContact OD1-N 3.23Å; N405-E407 VanDerWaalsContact OD1-N 3.09Å; E407-Y409 WeakPolarHBondContact O-CD2 3.07Å
408	M	95.2	Very high	94.5	Very high	37 Å²	37	40.8 Å²	40.8	18%	0.182	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.3	177.9	-57.9	-58.5	-58.1	0	0	111	P346 L348 R349 R371 N405	P346-M408 HydrophobicContact CB-CB 4.34Å; P346-M408 WeakPolarHBondContact O-CE 3.36Å; L348-M408 CarbonylContact O-C 3.14Å; R349-M408 HydrophobicContact CG-CE 4.07Å; R349-M408 HydrophobicContact CG-SD 3.31Å; R349-M408 WeakPolarHBondContact CG-SD 3.42Å; R371-M408 VanDerWaalsContact CZ-O 3.29Å; R371-M408 PolarHBondContact NH1-O 2.9Å; R371-M408 PolarHBondContact NH2-O 2.75Å; N405-M408 WeakPolarHBondContact OD1-CB 3.35Å; N405-M408 WeakPolarHBondContact OD1-CG 3.31Å; N405-M408 PolarHBondContact OD1-N 2.88Å
409	Y	97.2	Very high	94.8	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	153.7	174.9	-68	-108.2	0	0	0	110.3	P346 V347 L348 L350 L364 R371 E407 D413 L414	P346-Y409 CarbonylContact C-O 3.51Å; P346-Y409 WeakPolarHBondContact CA-O 3.33Å; V347-Y409 PolarHBondContact N-O 3.12Å; V347-Y409 VanDerWaalsContact N-O 3.08Å; L348-Y409 WeakPolarHBondContact CB-O 3.39Å; L348-Y409 PolarHBondContact N-O 3.36Å; L348-Y409 PolarHBondContact O-N 3.11Å; L350-Y409 HydrophobicContact CB-CD2 4.48Å; L350-Y409 HydrophobicContact CD1-CD1 3.94Å; L350-Y409 HydrophobicContact CD1-CD2 3.67Å; L350-Y409 HydrophobicContact CD1-CE1 4Å; L350-Y409 HydrophobicContact CD1-CE2 3.76Å; L350-Y409 HydrophobicContact CD1-CG 3.77Å; L350-Y409 HydrophobicContact CG-CD2 3.71Å; L350-Y409 HydrophobicContact CG-CE2 4.14Å; L350-Y409 HydrophobicContact CG-CG 4.01Å; L364-Y409 HydrophobicContact CD2-CE1 4.03Å; R371-Y409 VanDerWaalsContact NH1-CZ 3.34Å; E407-Y409 WeakPolarHBondContact O-CD2 3.07Å; Y409-D413 HydrophobicContact CD1-CB 4.24Å; Y409-L414 HydrophobicContact CD1-CD2 3.86Å; Y409-L414 HydrophobicContact CG-CD2 4.27Å
410	S	97.8	Very high	95	Very high	3 Å²	3	36 Å²	36	2%	0.021	19%	0.192	C	C	.	.			trans	-103.6	161.8	167.6	69.4	0	0	0	0	110.2	V343 R345 Q412 D413 L414	V343-S410 WeakPolarHBondContact O-CB 3.33Å; R345-S410 WeakPolarHBondContact O-CA 3.34Å; R345-S410 VanDerWaalsContact O-CB 3.25Å; R345-S410 WeakPolarHBondContact O-CB 3.44Å; S410-Q412 PolarHBondContact O-N 3.12Å; S410-D413 WeakPolarHBondContact CB-OD2 3.27Å; S410-D413 PolarHBondContact N-OD2 2.87Å; S410-D413 WeakPolarHBondContact O-CB 3.27Å; S410-D413 PolarHBondContact O-N 3.28Å; S410-D413 VanDerWaalsContact O-N 3.09Å; S410-D413 PolarHBondContact OG-N 2.81Å; S410-D413 VanDerWaalsContact OG-N 3.11Å; S410-D413 PolarHBondContact OG-OD2 3.36Å; S410-L414 WeakPolarHBondContact O-CG 3.35Å; S410-L414 PolarHBondContact O-N 2.89Å
411	V	98.3	Very high	95.2	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.024	19%	0.19	C	C	.	.	H	α-helix	trans	-64.5	-31	175.3	175.4	0	0	0	0	110.8	Y261 P317 V343 L348 D413 L414 L415	Y261-V411 HydrophobicContact CE1-CG2 4.47Å; Y261-V411 HydrophobicContact CE2-CG2 3.77Å; Y261-V411 WeakPolarHBondContact OH-CG2 3.42Å; P317-V411 HydrophobicContact CB-CG2 4.12Å; P317-V411 HydrophobicContact CG-CG2 4.17Å; V343-V411 HydrophobicContact CG2-CB 4.07Å; V343-V411 HydrophobicContact CG2-CG1 4.1Å; V343-V411 PolarHBondContact O-N 3.07Å; L348-V411 HydrophobicContact CD1-CG2 3.81Å; V411-D413 VanDerWaalsContact C-N 3.34Å; V411-D413 PolarHBondContact O-N 2.9Å; V411-L414 PolarHBondContact O-N 3.24Å; V411-L415 HydrophobicContact CG1-CD1 4.11Å; V411-L415 WeakPolarHBondContact O-CG 3.08Å; V411-L415 PolarHBondContact O-N 2.72Å
412	Q	98.1	Very high	95.4	Very high	59 Å²	59	36.4 Å²	36.4	28%	0.276	19%	0.188	S	C	.	.	H	α-helix	trans	-61.6	-39.7	172.1	-173.6	57.2	54.6	0	0	112	V343 S410 L414 L415 D416	V343-Q412 HydrophobicContact CG2-CB 4.28Å; V343-Q412 PolarHBondContact O-N 3.09Å; S410-Q412 PolarHBondContact O-N 3.12Å; Q412-L414 VanDerWaalsContact C-N 3.35Å; Q412-L414 PolarHBondContact O-N 3.04Å; Q412-L415 PolarHBondContact O-N 2.8Å; Q412-D416 VanDerWaalsContact NE2-CG 3.34Å; Q412-D416 PolarHBondContact NE2-OD1 2.9Å; Q412-D416 PolarHBondContact NE2-OD2 2.99Å; Q412-D416 PolarHBondContact O-N 3.46Å
413	D	98	Very high	95.4	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-59.2	-48.4	174.4	-59.1	-45.4	0	0	0	110.4	R399 H401 F402 Y409 S410 V411 L415 D416 V417 L422	R399-D413 WeakPolarHBondContact CD-OD1 3.36Å; R399-D413 IonicContact CZ-OD1 2.7Å; R399-D413 IonicContact NE-OD1 3.77Å; R399-D413 IonicContact NH1-OD1 3.62Å; R399-D413 PolarHBondContact NH1-OD1 2.71Å; H401-D413 IonicContact CD2-OD2 2.77Å; H401-D413 IonicContact CE1-OD2 3.2Å; H401-D413 IonicContact NE2-OD1 2.76Å; H401-D413 IonicContact NE2-OD2 2.74Å; H401-D413 PolarHBondContact NE2-OD2 3.07Å; F402-D413 HydrophobicContact CZ-CB 4.4Å; Y409-D413 HydrophobicContact CD1-CB 4.24Å; S410-D413 WeakPolarHBondContact CB-OD2 3.27Å; S410-D413 PolarHBondContact N-OD2 2.87Å; S410-D413 WeakPolarHBondContact O-CB 3.27Å; S410-D413 PolarHBondContact O-N 3.28Å; S410-D413 VanDerWaalsContact O-N 3.09Å; S410-D413 PolarHBondContact OG-N 2.81Å; S410-D413 VanDerWaalsContact OG-N 3.11Å; S410-D413 PolarHBondContact OG-OD2 3.36Å; V411-D413 VanDerWaalsContact C-N 3.34Å; V411-D413 PolarHBondContact O-N 2.9Å; D413-L415 VanDerWaalsContact C-N 3.34Å; D413-L415 PolarHBondContact O-N 2.81Å; D413-D416 CarbonylContact O-C 3.56Å; D413-D416 WeakPolarHBondContact O-CA 3.44Å; D413-D416 PolarHBondContact O-N 3.31Å; D413-V417 WeakPolarHBondContact O-CG2 3.43Å; D413-V417 PolarHBondContact O-N 2.84Å; D413-L422 HydrophobicContact CB-CD2 4.23Å
414	L	98.1	Very high	95.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-37	-177.7	-48.6	-179.3	0	0	0	112.3	V320 V321 W324 F326 L348 L350 L364 Y409 S410 V411 Q412 D416 V417 H418	V320-L414 HydrophobicContact CG1-CB 3.82Å; V320-L414 HydrophobicContact CG1-CD1 3.5Å; V320-L414 HydrophobicContact CG1-CG 4.29Å; V321-L414 HydrophobicContact CG2-CD1 4.12Å; W324-L414 HydrophobicContact CH2-CB 4.16Å; W324-L414 HydrophobicContact CH2-CD2 4.34Å; W324-L414 HydrophobicContact CZ3-CB 4.1Å; W324-L414 HydrophobicContact CZ3-CD2 4.24Å; W324-L414 HydrophobicContact CZ3-CG 4.49Å; F326-L414 HydrophobicContact CE1-CB 3.98Å; F326-L414 WeakPolarHBondContact CE1-O 3.17Å; F326-L414 HydrophobicContact CZ-CB 4.25Å; F326-L414 WeakPolarHBondContact CZ-O 3.32Å; L348-L414 HydrophobicContact CD1-CD1 3.88Å; L350-L414 HydrophobicContact CD1-CD2 3.81Å; L350-L414 HydrophobicContact CD2-CD1 4.04Å; L350-L414 HydrophobicContact CD2-CD2 4.21Å; L364-L414 HydrophobicContact CD2-CD2 4.23Å; Y409-L414 HydrophobicContact CD1-CD2 3.86Å; Y409-L414 HydrophobicContact CG-CD2 4.27Å; S410-L414 WeakPolarHBondContact O-CG 3.35Å; S410-L414 PolarHBondContact O-N 2.89Å; V411-L414 PolarHBondContact O-N 3.24Å; Q412-L414 VanDerWaalsContact C-N 3.35Å; Q412-L414 PolarHBondContact O-N 3.04Å; L414-D416 VanDerWaalsContact C-N 3.3Å; L414-D416 PolarHBondContact O-N 2.98Å; L414-V417 PolarHBondContact O-N 3.38Å; L414-H418 PolarHBondContact O-N 3.37Å
415	L	98.2	Very high	96.1	Very high	40 Å²	40	36.3 Å²	36.3	21%	0.209	21%	0.205	C	C	.	.	H	α-helix	trans	-63.9	-33.7	171.7	-77.8	163.5	0	0	0	112.8	V315 F326 V343 V411 Q412 D413 A419	V315-L415 HydrophobicContact CG1-CD2 4.49Å; V315-L415 HydrophobicContact CG2-CD2 4.29Å; F326-L415 HydrophobicContact CB-CD2 4.44Å; F326-L415 HydrophobicContact CD1-CD2 3.56Å; F326-L415 HydrophobicContact CD1-CG 4.08Å; F326-L415 HydrophobicContact CE1-CD2 4.24Å; F326-L415 HydrophobicContact CE1-CG 4.32Å; F326-L415 HydrophobicContact CG-CD2 4.38Å; V343-L415 HydrophobicContact CG2-CD1 4.31Å; V411-L415 HydrophobicContact CG1-CD1 4.11Å; V411-L415 WeakPolarHBondContact O-CG 3.08Å; V411-L415 PolarHBondContact O-N 2.72Å; Q412-L415 PolarHBondContact O-N 2.8Å; D413-L415 VanDerWaalsContact C-N 3.34Å; D413-L415 PolarHBondContact O-N 2.81Å; L415-A419 VanDerWaalsContact O-CB 3.31Å; L415-A419 WeakPolarHBondContact O-CB 3.06Å; L415-A419 PolarHBondContact O-N 3.48Å
416	D	98.1	Very high	96.4	Very high	10 Å²	10	34.2 Å²	34.2	5%	0.053	19%	0.194	C	C	.	.	H	α-helix	trans	-83.5	-23.4	176	-65.8	-47.5	0	0	0	113.2	R399 Q412 D413 L414 G420 R421 L422	R399-D416 IonicContact CZ-OD2 3.62Å; R399-D416 IonicContact NH1-OD2 3.37Å; R399-D416 PolarHBondContact NH1-OD2 3.15Å; R399-D416 VanDerWaalsContact NH1-OD2 3.11Å; R399-D416 IonicContact NH2-OD2 3.38Å; R399-D416 PolarHBondContact NH2-OD2 3.5Å; Q412-D416 VanDerWaalsContact NE2-CG 3.34Å; Q412-D416 PolarHBondContact NE2-OD1 2.9Å; Q412-D416 PolarHBondContact NE2-OD2 2.99Å; Q412-D416 PolarHBondContact O-N 3.46Å; D413-D416 CarbonylContact O-C 3.56Å; D413-D416 WeakPolarHBondContact O-CA 3.44Å; D413-D416 PolarHBondContact O-N 3.31Å; L414-D416 VanDerWaalsContact C-N 3.3Å; L414-D416 PolarHBondContact O-N 2.98Å; D416-G420 PolarHBondContact O-N 3.04Å; D416-R421 PolarHBondContact O-N 3.32Å; D416-R421 IonicContact OD1-CZ 2.72Å; D416-R421 VanDerWaalsContact OD1-CZ 3.22Å; D416-R421 IonicContact OD1-NE 2.77Å; D416-R421 PolarHBondContact OD1-NE 3.19Å; D416-R421 IonicContact OD1-NH2 3.74Å; D416-R421 PolarHBondContact OD1-NH2 3.44Å; D416-L422 HydrophobicContact CB-CB 3.81Å; D416-L422 WeakPolarHBondContact O-CB 3.42Å; D416-L422 PolarHBondContact O-N 2.95Å
417	V	97.3	Very high	96.7	Very high	2 Å²	2	36 Å²	36	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-64.3	-58.5	165.4	178.9	0	0	0	0	109.2	W324 E363 L364 I367 D413 L414 A419 G420 L422	W324-V417 HydrophobicContact CH2-CB 4.13Å; W324-V417 HydrophobicContact CH2-CG1 4.03Å; W324-V417 HydrophobicContact CZ2-CB 4.17Å; W324-V417 HydrophobicContact CZ2-CG1 3.78Å; E363-V417 HydrophobicContact CB-CG1 3.78Å; L364-V417 HydrophobicContact CD2-CG1 4.21Å; L364-V417 HydrophobicContact CD2-CG2 3.93Å; L364-V417 HydrophobicContact CG-CG1 4.27Å; I367-V417 HydrophobicContact CD1-CB 4.23Å; I367-V417 HydrophobicContact CD1-CG1 4.06Å; I367-V417 HydrophobicContact CD1-CG2 3.74Å; D413-V417 WeakPolarHBondContact O-CG2 3.43Å; D413-V417 PolarHBondContact O-N 2.84Å; L414-V417 PolarHBondContact O-N 3.38Å; V417-A419 PolarHBondContact O-N 3.46Å; V417-G420 WeakPolarHBondContact O-CA 3.42Å; V417-G420 PolarHBondContact O-N 3.43Å; V417-L422 HydrophobicContact CG2-CD2 3.93Å
418	H	96.3	Very high	97	Very high	95 Å²	95	39.5 Å²	39.5	44%	0.44	22%	0.222	S	C	.	.	H	α-helix	trans	-60.1	-32.5	-175.7	173.9	35.8	0	0	0	112.9	W324 F326 L414 G420	W324-H418 HydrophobicContact CZ2-CB 4.33Å; F326-H418 HydrophobicContact CD2-CB 4.02Å; F326-H418 AromaticContact CD2-CD2 3.19Å; F326-H418 WeakPolarHBondContact CD2-CD2 3.23Å; F326-H418 AromaticContact CD2-CG 3.62Å; F326-H418 AromaticContact CD2-NE2 3.84Å; F326-H418 HydrophobicContact CE1-CB 4.22Å; F326-H418 HydrophobicContact CE2-CB 3.52Å; F326-H418 AromaticContact CE2-CD2 3.65Å; F326-H418 AromaticContact CE2-CG 3.56Å; F326-H418 AromaticContact CG-CD2 3.57Å; F326-H418 HydrophobicContact CZ-CB 3.62Å; L414-H418 PolarHBondContact O-N 3.37Å; H418-G420 VanDerWaalsContact C-N 3.3Å; H418-G420 PolarHBondContact O-N 3.33Å
419	A	96.7	Very high	97.1	Very high	48 Å²	48	38.6 Å²	38.6	40%	0.397	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	11.5	175.3	0	0	0	0	0	114.4	L415 V417 R421	L415-A419 VanDerWaalsContact O-CB 3.31Å; L415-A419 WeakPolarHBondContact O-CB 3.06Å; L415-A419 PolarHBondContact O-N 3.48Å; V417-A419 PolarHBondContact O-N 3.46Å; A419-R421 HydrophobicContact CB-CG 4.5Å; A419-R421 VanDerWaalsContact CB-CZ 3.49Å; A419-R421 PolarHBondContact O-N 2.87Å
420	G	95.4	Very high	97.1	Very high	36 Å²	36	40.1 Å²	40.1	37%	0.371	22%	0.224	S	C	.	.	S	Bend	trans	69	-25.4	-180	0	0	0	0	0	116.1	D416 V417 H418 L422 G423 C424	D416-G420 PolarHBondContact O-N 3.04Å; V417-G420 WeakPolarHBondContact O-CA 3.42Å; V417-G420 PolarHBondContact O-N 3.43Å; H418-G420 VanDerWaalsContact C-N 3.3Å; H418-G420 PolarHBondContact O-N 3.33Å; G420-L422 PolarHBondContact O-N 2.82Å; G420-L422 VanDerWaalsContact O-N 3.08Å; G420-G423 PolarHBondContact O-N 3.44Å; G420-C424 PolarHBondContact O-N 3.11Å
421	R	96.3	Very high	97.1	Very high	137 Å²	137	44 Å²	44	52%	0.517	25%	0.248	S	C	.	.	H	α-helix	trans	-48.3	-41	-175.1	-67.7	-170.7	-66	-88.1	-4	113.8	D416 A419 S425	D416-R421 PolarHBondContact O-N 3.32Å; D416-R421 IonicContact OD1-CZ 2.72Å; D416-R421 VanDerWaalsContact OD1-CZ 3.22Å; D416-R421 IonicContact OD1-NE 2.77Å; D416-R421 PolarHBondContact OD1-NE 3.19Å; D416-R421 IonicContact OD1-NH2 3.74Å; D416-R421 PolarHBondContact OD1-NH2 3.44Å; A419-R421 HydrophobicContact CB-CG 4.5Å; A419-R421 VanDerWaalsContact CB-CZ 3.49Å; A419-R421 PolarHBondContact O-N 2.87Å; R421-S425 WeakPolarHBondContact O-CB 3.37Å; R421-S425 PolarHBondContact O-N 2.72Å; R421-S425 VanDerWaalsContact O-N 3.08Å
422	L	96.5	Very high	97.1	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-72.2	-36.2	-177	-167.9	57.8	0	0	0	112.4	I367 F402 D413 D416 V417 G420 L426	I367-L422 HydrophobicContact CD1-CB 4Å; I367-L422 HydrophobicContact CD1-CD2 4.23Å; I367-L422 HydrophobicContact CD1-CG 4.07Å; I367-L422 HydrophobicContact CG2-CD2 4.17Å; I367-L422 HydrophobicContact CG2-CG 4.48Å; F402-L422 HydrophobicContact CE2-CD1 3.99Å; F402-L422 HydrophobicContact CE2-CD2 4.14Å; F402-L422 HydrophobicContact CE2-CG 4.4Å; F402-L422 HydrophobicContact CZ-CD1 4.46Å; F402-L422 HydrophobicContact CZ-CD2 3.94Å; D413-L422 HydrophobicContact CB-CD2 4.23Å; D416-L422 HydrophobicContact CB-CB 3.81Å; D416-L422 WeakPolarHBondContact O-CB 3.42Å; D416-L422 PolarHBondContact O-N 2.95Å; V417-L422 HydrophobicContact CG2-CD2 3.93Å; G420-L422 PolarHBondContact O-N 2.82Å; G420-L422 VanDerWaalsContact O-N 3.08Å; L422-L426 WeakPolarHBondContact O-CB 3.43Å; L422-L426 PolarHBondContact O-N 3.29Å
423	G	95.9	Very high	97.1	Very high	16 Å²	16	44.5 Å²	44.5	17%	0.165	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-50.3	176.2	0	0	0	0	0	111.1	G420 T427	G420-G423 PolarHBondContact O-N 3.44Å; G423-T427 VanDerWaalsContact O-CB 3.27Å; G423-T427 WeakPolarHBondContact O-CB 3.31Å; G423-T427 PolarHBondContact O-N 2.64Å; G423-T427 PolarHBondContact O-OG1 3.06Å
424	C	96.2	Very high	97.1	Very high	79 Å²	79	45.3 Å²	45.3	53%	0.534	26%	0.259	S	S	.	.	H	α-helix	trans	-58.6	-56.7	176.9	-56.2	0	0	0	0	111.8	G420 L426 T427 E428	G420-C424 PolarHBondContact O-N 3.11Å; C424-L426 VanDerWaalsContact C-N 3.34Å; C424-L426 PolarHBondContact O-N 3.5Å; C424-T427 PolarHBondContact O-N 2.65Å; C424-T427 VanDerWaalsContact O-N 3.15Å; C424-E428 WeakPolarHBondContact O-CG 3.44Å; C424-E428 PolarHBondContact O-N 2.7Å
425	S	96.5	Very high	97.1	Very high	55 Å²	55	50 Å²	50	39%	0.385	28%	0.28	S	S	.	.	H	α-helix	trans	-61.8	-39.6	-176	178	0	0	0	0	112.8	R421 I429	R421-S425 WeakPolarHBondContact O-CB 3.37Å; R421-S425 PolarHBondContact O-N 2.72Å; R421-S425 VanDerWaalsContact O-N 3.08Å; S425-I429 VanDerWaalsContact O-CG1 3.26Å; S425-I429 WeakPolarHBondContact O-CG1 3.38Å; S425-I429 PolarHBondContact O-N 2.91Å; S425-I429 VanDerWaalsContact O-N 3.1Å
426	L	96.8	Very high	97.1	Very high	2 Å²	2	49 Å²	49	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-72.5	-32	178.7	-163.3	66.5	0	0	0	112	I367 L370 R371 I374 L396 F402 L422 C424 H430	I367-L426 HydrophobicContact CG2-CD2 3.97Å; L370-L426 HydrophobicContact CB-CD2 3.59Å; L370-L426 HydrophobicContact CB-CG 3.95Å; L370-L426 HydrophobicContact CD1-CB 4.22Å; L370-L426 HydrophobicContact CD1-CD2 4.16Å; L370-L426 HydrophobicContact CD1-CG 4.22Å; R371-L426 HydrophobicContact CG-CD2 4.07Å; I374-L426 HydrophobicContact CD1-CD1 3.41Å; I374-L426 VanDerWaalsContact CD1-CD1 3.41Å; I374-L426 HydrophobicContact CD1-CG 3.94Å; L396-L426 HydrophobicContact CD2-CD1 3.94Å; F402-L426 HydrophobicContact CD2-CD1 4.03Å; F402-L426 HydrophobicContact CD2-CD2 4.45Å; F402-L426 HydrophobicContact CE2-CD1 4.42Å; F402-L426 HydrophobicContact CE2-CD2 4.32Å; L422-L426 WeakPolarHBondContact O-CB 3.43Å; L422-L426 PolarHBondContact O-N 3.29Å; C424-L426 VanDerWaalsContact C-N 3.34Å; C424-L426 PolarHBondContact O-N 3.5Å; L426-H430 WeakPolarHBondContact O-CB 3.39Å; L426-H430 PolarHBondContact O-N 2.76Å
427	T	97.5	Very high	97.1	Very high	64 Å²	64	48.5 Å²	48.5	39%	0.393	27%	0.271	S	S	.	.	H	α-helix	trans	-68.4	-41.1	174.4	-59.5	0	0	0	0	111.9	G423 C424 H430 T431	G423-T427 VanDerWaalsContact O-CB 3.27Å; G423-T427 WeakPolarHBondContact O-CB 3.31Å; G423-T427 PolarHBondContact O-N 2.64Å; G423-T427 PolarHBondContact O-OG1 3.06Å; C424-T427 PolarHBondContact O-N 2.65Å; C424-T427 VanDerWaalsContact O-N 3.15Å; T427-H430 PolarHBondContact O-N 3.13Å; T427-T431 VanDerWaalsContact O-CB 3.32Å; T427-T431 WeakPolarHBondContact O-CB 3.3Å; T427-T431 PolarHBondContact O-N 2.82Å; T427-T431 PolarHBondContact O-OG1 3.35Å
428	E	97.6	Very high	97.1	Very high	136 Å²	136	51.8 Å²	51.8	64%	0.636	29%	0.285	S	S	*	.	H	α-helix	trans	-60.2	-49.4	173.2	-71.6	168.6	-169	0	0	111.2	C424 T431 L432	C424-E428 WeakPolarHBondContact O-CG 3.44Å; C424-E428 PolarHBondContact O-N 2.7Å; E428-T431 PolarHBondContact O-N 3.5Å; E428-L432 PolarHBondContact O-N 3.27Å
429	I	97.2	Very high	97.1	Very high	17 Å²	17	53.2 Å²	53.2	9%	0.087	30%	0.295	C	S	.	.	H	α-helix	trans	-61.3	-47	177.8	-69	169.4	0	0	0	111	Q395 L396 S425 T431 L432 F433	Q395-I429 HydrophobicContact CB-CD1 4.19Å; Q395-I429 HydrophobicContact CB-CG1 4.17Å; Q395-I429 HydrophobicContact CB-CG2 4.36Å; L396-I429 HydrophobicContact CD1-CG2 4.3Å; L396-I429 HydrophobicContact CD2-CD1 3.78Å; L396-I429 HydrophobicContact CD2-CG2 4.28Å; L396-I429 HydrophobicContact CG-CD1 4.39Å; L396-I429 HydrophobicContact CG-CG2 4.18Å; S425-I429 VanDerWaalsContact O-CG1 3.26Å; S425-I429 WeakPolarHBondContact O-CG1 3.38Å; S425-I429 PolarHBondContact O-N 2.91Å; S425-I429 VanDerWaalsContact O-N 3.1Å; I429-T431 VanDerWaalsContact C-N 3.31Å; I429-T431 PolarHBondContact O-N 2.93Å; I429-L432 PolarHBondContact O-N 3.36Å; I429-F433 HydrophobicContact CG2-CD1 4.16Å; I429-F433 HydrophobicContact CG2-CD2 4.09Å; I429-F433 HydrophobicContact CG2-CE1 3.7Å; I429-F433 HydrophobicContact CG2-CE2 3.65Å; I429-F433 HydrophobicContact CG2-CG 4.34Å; I429-F433 HydrophobicContact CG2-CZ 3.43Å; I429-F433 VanDerWaalsContact CG2-CZ 3.43Å; I429-F433 WeakPolarHBondContact O-CB 3.47Å; I429-F433 VanDerWaalsContact O-CD1 3.25Å; I429-F433 WeakPolarHBondContact O-CD1 3.28Å; I429-F433 WeakPolarHBondContact O-CG 3.46Å; I429-F433 PolarHBondContact O-N 3.12Å
430	H	97.5	Very high	97.1	Very high	33 Å²	33	55 Å²	55	15%	0.153	30%	0.298	C	S	.	.	H	α-helix	trans	-60.3	-39.6	176.4	175	-94.6	0	0	0	112.2	L370 M377 L426 T427 F433 A434	L370-H430 HydrophobicContact CD2-CB 3.82Å; M377-H430 WeakPolarHBondContact CE-CD2 3.34Å; M377-H430 VanDerWaalsContact CE-NE2 3.26Å; M377-H430 WeakPolarHBondContact CE-NE2 3.49Å; L426-H430 WeakPolarHBondContact O-CB 3.39Å; L426-H430 PolarHBondContact O-N 2.76Å; T427-H430 PolarHBondContact O-N 3.13Å; H430-F433 PolarHBondContact O-N 3.03Å; H430-A434 WeakPolarHBondContact O-CB 3.42Å; H430-A434 PolarHBondContact O-N 3.42Å
431	T	97.8	Very high	97.2	Very high	84 Å²	84	53.2 Å²	53.2	52%	0.515	28%	0.281	S	S	.	.	H	α-helix	trans	-67	-44	177.8	-58.1	0	0	0	0	111.6	T427 E428 I429 F433 A434 K435	T427-T431 VanDerWaalsContact O-CB 3.32Å; T427-T431 WeakPolarHBondContact O-CB 3.3Å; T427-T431 PolarHBondContact O-N 2.82Å; T427-T431 PolarHBondContact O-OG1 3.35Å; E428-T431 PolarHBondContact O-N 3.5Å; I429-T431 VanDerWaalsContact C-N 3.31Å; I429-T431 PolarHBondContact O-N 2.93Å; T431-F433 VanDerWaalsContact C-N 3.32Å; T431-F433 PolarHBondContact O-N 3.09Å; T431-A434 PolarHBondContact O-N 3.1Å; T431-K435 WeakPolarHBondContact O-CB 3.27Å; T431-K435 PolarHBondContact O-N 3.45Å
432	L	97.8	Very high	97.2	Very high	74 Å²	74	54.5 Å²	54.5	39%	0.387	29%	0.292	S	S	.	.	H	α-helix	trans	-59.3	-43.5	173	176.1	64.1	0	0	0	111.6	L392 Q395 E428 I429 K435 H436	L392-L432 HydrophobicContact CD2-CD2 4.35Å; L392-L432 HydrophobicContact CD2-CG 4.44Å; Q395-L432 HydrophobicContact CG-CD2 4.47Å; E428-L432 PolarHBondContact O-N 3.27Å; I429-L432 PolarHBondContact O-N 3.36Å; L432-K435 PolarHBondContact O-N 3Å; L432-H436 PolarHBondContact O-N 3.34Å
433	F	97.9	Very high	97.1	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.4	-46.5	179.4	-76.9	12.1	0	0	0	112	I374 M377 F381 L392 Q395 L396 I429 H430 T431 H436 I437	I374-F433 HydrophobicContact CG1-CD2 4.13Å; I374-F433 HydrophobicContact CG1-CE2 4.37Å; I374-F433 HydrophobicContact CG2-CE2 4.22Å; M377-F433 HydrophobicContact CE-CB 4.45Å; M377-F433 HydrophobicContact SD-CB 3.5Å; M377-F433 VanDerWaalsContact SD-CB 3.5Å; M377-F433 HydrophobicContact SD-CD2 4.13Å; M377-F433 HydrophobicContact SD-CG 4.36Å; F381-F433 HydrophobicContact CE2-CB 4.03Å; F381-F433 HydrophobicContact CE2-CD1 4.23Å; F381-F433 AromaticContact CE2-CD2 3.56Å; F381-F433 HydrophobicContact CE2-CD2 3.56Å; F381-F433 HydrophobicContact CE2-CE2 4.03Å; F381-F433 AromaticContact CE2-CG 3.67Å; F381-F433 HydrophobicContact CE2-CG 3.67Å; F381-F433 HydrophobicContact CZ-CB 3.59Å; F381-F433 HydrophobicContact CZ-CD1 4.09Å; F381-F433 HydrophobicContact CZ-CD2 4.01Å; F381-F433 AromaticContact CZ-CG 3.63Å; F381-F433 HydrophobicContact CZ-CG 3.63Å; L392-F433 HydrophobicContact CB-CD1 4.26Å; L392-F433 HydrophobicContact CB-CE1 3.88Å; L392-F433 WeakPolarHBondContact O-CE1 3.37Å; L392-F433 VanDerWaalsContact O-CZ 3.23Å; L392-F433 WeakPolarHBondContact O-CZ 3.27Å; Q395-F433 HydrophobicContact CB-CE1 4.46Å; Q395-F433 HydrophobicContact CG-CE1 4.45Å; L396-F433 HydrophobicContact CD1-CE2 4Å; L396-F433 HydrophobicContact CD1-CZ 4.27Å; I429-F433 HydrophobicContact CG2-CD1 4.16Å; I429-F433 HydrophobicContact CG2-CD2 4.09Å; I429-F433 HydrophobicContact CG2-CE1 3.7Å; I429-F433 HydrophobicContact CG2-CE2 3.65Å; I429-F433 HydrophobicContact CG2-CG 4.34Å; I429-F433 HydrophobicContact CG2-CZ 3.43Å; I429-F433 VanDerWaalsContact CG2-CZ 3.43Å; I429-F433 WeakPolarHBondContact O-CB 3.47Å; I429-F433 VanDerWaalsContact O-CD1 3.25Å; I429-F433 WeakPolarHBondContact O-CD1 3.28Å; I429-F433 WeakPolarHBondContact O-CG 3.46Å; I429-F433 PolarHBondContact O-N 3.12Å; H430-F433 PolarHBondContact O-N 3.03Å; T431-F433 VanDerWaalsContact C-N 3.32Å; T431-F433 PolarHBondContact O-N 3.09Å; F433-H436 PolarHBondContact O-N 3.32Å; F433-I437 WeakPolarHBondContact O-CG1 3.39Å; F433-I437 PolarHBondContact O-N 3.12Å; F433-I437 VanDerWaalsContact O-N 3.11Å
434	A	97.9	Very high	97.1	Very high	19 Å²	19	58 Å²	58	16%	0.157	30%	0.3	C	S	.	.	H	α-helix	trans	-62	-42.4	174.9	0	0	0	0	0	111.9	M377 H430 T431 H436 I437 K438 F463	M377-A434 HydrophobicContact CE-CB 3.88Å; H430-A434 WeakPolarHBondContact O-CB 3.42Å; H430-A434 PolarHBondContact O-N 3.42Å; T431-A434 PolarHBondContact O-N 3.1Å; A434-H436 PolarHBondContact O-N 2.84Å; A434-I437 PolarHBondContact O-N 3.28Å; A434-K438 WeakPolarHBondContact O-CB 3.41Å; A434-K438 WeakPolarHBondContact O-CG 3.42Å; A434-K438 PolarHBondContact O-N 3.09Å; A434-F463 HydrophobicContact CB-CE2 4.35Å
435	K	97.9	Very high	97.1	Very high	99 Å²	99	57.6 Å²	57.6	43%	0.43	29%	0.29	S	S	.	.	H	α-helix	trans	-59.9	-45.5	176.8	-171	-173.1	-180	-68.8	0	111.7	T431 L432 I437 L439 D440	T431-K435 WeakPolarHBondContact O-CB 3.27Å; T431-K435 PolarHBondContact O-N 3.45Å; L432-K435 PolarHBondContact O-N 3Å; K435-I437 PolarHBondContact O-N 3.04Å; K435-L439 HydrophobicContact CG-CB 4.49Å; K435-L439 HydrophobicContact CG-CD1 4.29Å; K435-L439 WeakPolarHBondContact O-CA 3.45Å; K435-L439 WeakPolarHBondContact O-CB 3.46Å; K435-L439 PolarHBondContact O-N 2.82Å; K435-D440 WeakPolarHBondContact CG-OD2 3.32Å; K435-D440 IonicContact NZ-OD1 3.99Å; K435-D440 PolarHBondContact NZ-OD1 3.46Å; K435-D440 IonicContact NZ-OD2 3.93Å; K435-D440 PolarHBondContact NZ-OD2 2.84Å; K435-D440 PolarHBondContact O-N 2.97Å
436	H	98.2	Very high	97	Very high	18 Å²	18	59.2 Å²	59.2	8%	0.083	31%	0.307	C	S	.	.	I	π-helix	trans	-59.4	-47.3	175.1	178	83	0	0	0	111.9	F381 L392 L432 F433 A434 C441	F381-H436 HydrophobicContact CE1-CB 4.47Å; F381-H436 AromaticContact CE1-CD2 3.72Å; L392-H436 HydrophobicContact CD1-CB 3.73Å; L392-H436 VanDerWaalsContact CD1-CG 3.5Å; L432-H436 PolarHBondContact O-N 3.34Å; F433-H436 PolarHBondContact O-N 3.32Å; A434-H436 PolarHBondContact O-N 2.84Å; H436-C441 VanDerWaalsContact CE1-CB 3.43Å; H436-C441 WeakPolarHBondContact CE1-CB 3.32Å; H436-C441 VanDerWaalsContact O-CB 3.32Å; H436-C441 WeakPolarHBondContact O-CB 3.49Å; H436-C441 PolarHBondContact O-N 2.93Å; H436-C441 VanDerWaalsContact O-N 3.11Å
437	I	97.9	Very high	96.9	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.32	C	S	.	.	I	π-helix	trans	-69	-39.2	-174.6	-69.7	167.7	0	0	0	112.3	M377 Y380 F381 F433 A434 K435 C444 Q445 F461 F463	M377-I437 HydrophobicContact CB-CD1 3.68Å; M377-I437 HydrophobicContact CG-CD1 3.67Å; Y380-I437 HydrophobicContact CD1-CG1 4.44Å; Y380-I437 HydrophobicContact CD1-CG2 3.81Å; Y380-I437 HydrophobicContact CD2-CD1 4.19Å; Y380-I437 HydrophobicContact CE1-CG2 4.03Å; Y380-I437 HydrophobicContact CG-CD1 3.97Å; Y380-I437 HydrophobicContact CG-CG1 4.2Å; Y380-I437 HydrophobicContact CG-CG2 4.24Å; F381-I437 HydrophobicContact CE1-CD1 3.76Å; F381-I437 HydrophobicContact CE1-CG1 3.69Å; F381-I437 HydrophobicContact CE2-CD1 4.35Å; F381-I437 HydrophobicContact CZ-CD1 3.6Å; F381-I437 HydrophobicContact CZ-CG1 4.02Å; F433-I437 WeakPolarHBondContact O-CG1 3.39Å; F433-I437 PolarHBondContact O-N 3.12Å; F433-I437 VanDerWaalsContact O-N 3.11Å; A434-I437 PolarHBondContact O-N 3.28Å; K435-I437 PolarHBondContact O-N 3.04Å; I437-C444 HydrophobicContact CB-CB 4.27Å; I437-C444 HydrophobicContact CG1-CB 4.33Å; I437-C444 HydrophobicContact CG2-CB 4.21Å; I437-C444 CarbonylContact O-C 3.54Å; I437-C444 WeakPolarHBondContact O-CB 3.33Å; I437-Q445 WeakPolarHBondContact O-CG 3.44Å; I437-Q445 PolarHBondContact O-N 2.69Å; I437-F461 HydrophobicContact CG2-CD1 3.58Å; I437-F461 HydrophobicContact CG2-CE1 3.5Å; I437-F461 HydrophobicContact CG2-CG 4.49Å; I437-F461 HydrophobicContact CG2-CZ 4.37Å; I437-F463 HydrophobicContact CB-CZ 4.21Å; I437-F463 HydrophobicContact CD1-CE1 4.02Å; I437-F463 HydrophobicContact CD1-CZ 4.1Å; I437-F463 HydrophobicContact CG2-CE1 4.15Å; I437-F463 HydrophobicContact CG2-CZ 3.79Å
438	K	96.9	Very high	96.7	Very high	71 Å²	71	60.3 Å²	60.3	31%	0.309	31%	0.313	S	S	.	.	I	π-helix	trans	-96	-30	-170.9	-68.5	-176.6	163.9	-169.8	0	115.4	A434 Q445 F461 D464	A434-K438 WeakPolarHBondContact O-CB 3.41Å; A434-K438 WeakPolarHBondContact O-CG 3.42Å; A434-K438 PolarHBondContact O-N 3.09Å; K438-Q445 VanDerWaalsContact O-CD 3.25Å; K438-Q445 VanDerWaalsContact O-CG 3.31Å; K438-Q445 WeakPolarHBondContact O-CG 3.27Å; K438-Q445 PolarHBondContact O-NE2 3.49Å; K438-F461 HydrophobicContact CD-CD2 4.38Å; K438-F461 HydrophobicContact CG-CD2 3.96Å; K438-F461 HydrophobicContact CG-CE2 3.81Å; K438-F461 HydrophobicContact CG-CZ 4.22Å; K438-D464 WeakPolarHBondContact CE-OD1 3.2Å; K438-D464 IonicContact NZ-OD1 3.11Å; K438-D464 PolarHBondContact NZ-OD1 2.88Å; K438-D464 IonicContact NZ-OD2 2.71Å
439	L	96.3	Very high	96.6	Very high	124 Å²	124	56.7 Å²	56.7	65%	0.649	30%	0.295	S	S	*	.	I	π-helix	trans	-123.8	-46.3	-167.6	-58.4	177.1	0	0	0	112.3	K435 Q445	K435-L439 HydrophobicContact CG-CB 4.49Å; K435-L439 HydrophobicContact CG-CD1 4.29Å; K435-L439 WeakPolarHBondContact O-CA 3.45Å; K435-L439 WeakPolarHBondContact O-CB 3.46Å; K435-L439 PolarHBondContact O-N 2.82Å; L439-Q445 PolarHBondContact O-NE2 2.89Å
440	D	97.1	Very high	96.5	Very high	85 Å²	85	60.3 Å²	60.3	46%	0.455	32%	0.317	S	S	.	.	I	π-helix	trans	-88.1	-22.4	-169.2	-55.1	-25.2	0	0	0	114.5	K435	K435-D440 WeakPolarHBondContact CG-OD2 3.32Å; K435-D440 IonicContact NZ-OD1 3.99Å; K435-D440 PolarHBondContact NZ-OD1 3.46Å; K435-D440 IonicContact NZ-OD2 3.93Å; K435-D440 PolarHBondContact NZ-OD2 2.84Å; K435-D440 PolarHBondContact O-N 2.97Å
441	C	97.3	Very high	96.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.311	C	S	.	.			trans	-125.8	107.6	-174.6	179.4	0	0	0	0	113.4	E386 H436 R443 C444 Q445	E386-C441 PolarHBondContact OE1-SG 3.45Å; E386-C441 VanDerWaalsContact OE1-SG 3.37Å; E386-C441 PolarHBondContact OE2-SG 2.96Å; H436-C441 VanDerWaalsContact CE1-CB 3.43Å; H436-C441 WeakPolarHBondContact CE1-CB 3.32Å; H436-C441 VanDerWaalsContact O-CB 3.32Å; H436-C441 WeakPolarHBondContact O-CB 3.49Å; H436-C441 PolarHBondContact O-N 2.93Å; H436-C441 VanDerWaalsContact O-N 3.11Å; C441-R443 VanDerWaalsContact C-N 3.27Å; C441-R443 PolarHBondContact O-N 3.33Å; C441-C444 HydrophobicContact CB-CB 4.07Å; C441-C444 PolarHBondContact O-N 3.29Å; C441-C444 VanDerWaalsContact SG-SG 3.66Å; C441-Q445 WeakPolarHBondContact O-CG 3.49Å; C441-Q445 PolarHBondContact O-N 2.92Å
442	E	96.1	Very high	96.2	Very high	163 Å²	163	57.6 Å²	57.6	76%	0.762	30%	0.299	S	S	*	.	H	α-helix	trans	-54.7	-39.4	177.5	-61.8	-179.9	169	0	0	112.9	C444 Q445 A446	E442-C444 VanDerWaalsContact C-N 3.27Å; E442-C444 PolarHBondContact O-N 3.15Å; E442-Q445 PolarHBondContact O-N 3.43Å; E442-A446 WeakPolarHBondContact O-CB 3.47Å; E442-A446 PolarHBondContact O-N 3.15Å
443	R	94.8	Very high	96.1	Very high	96 Å²	96	56.8 Å²	56.8	36%	0.362	30%	0.295	S	S	.	.	H	α-helix	trans	-68.6	-24	178.6	172.9	176	52.5	-173	-19.3	113.2	R385 E386 C441 K447	R385-R443 VanDerWaalsContact N-CZ 3.34Å; R385-R443 VanDerWaalsContact N-NH2 3.1Å; E386-R443 IonicContact OE1-CZ 2.67Å; E386-R443 IonicContact OE1-NE 2.61Å; E386-R443 IonicContact OE1-NH2 3.59Å; E386-R443 PolarHBondContact OE1-NH2 3Å; C441-R443 VanDerWaalsContact C-N 3.27Å; C441-R443 PolarHBondContact O-N 3.33Å; R443-K447 WeakPolarHBondContact O-CD 3.48Å; R443-K447 VanDerWaalsContact O-CE 3.27Å; R443-K447 WeakPolarHBondContact O-CE 3.48Å; R443-K447 WeakPolarHBondContact O-CG 3.37Å
444	C	96.7	Very high	95.9	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-81.7	-40	171.8	-70.9	0	0	0	0	110.7	Y380 I437 C441 E442 A446 K447	Y380-C444 HydrophobicContact CD1-CB 4.26Å; I437-C444 HydrophobicContact CB-CB 4.27Å; I437-C444 HydrophobicContact CG1-CB 4.33Å; I437-C444 HydrophobicContact CG2-CB 4.21Å; I437-C444 CarbonylContact O-C 3.54Å; I437-C444 WeakPolarHBondContact O-CB 3.33Å; C441-C444 HydrophobicContact CB-CB 4.07Å; C441-C444 PolarHBondContact O-N 3.29Å; C441-C444 VanDerWaalsContact SG-SG 3.66Å; E442-C444 VanDerWaalsContact C-N 3.27Å; E442-C444 PolarHBondContact O-N 3.15Å; C444-A446 VanDerWaalsContact C-N 3.34Å; C444-A446 PolarHBondContact O-N 3.07Å; C444-K447 WeakPolarHBondContact O-CB 3.47Å; C444-K447 PolarHBondContact O-N 3.5Å; C444-K447 VanDerWaalsContact O-N 3.07Å
445	Q	96.3	Very high	95.6	Very high	70 Å²	70	67.4 Å²	67.4	33%	0.327	34%	0.337	S	S	.	.	H	α-helix	trans	-59.4	-42.5	174.1	-64.9	170.5	41.3	0	0	112.1	I437 K438 L439 C441 E442 K447 G448	I437-Q445 WeakPolarHBondContact O-CG 3.44Å; I437-Q445 PolarHBondContact O-N 2.69Å; K438-Q445 VanDerWaalsContact O-CD 3.25Å; K438-Q445 VanDerWaalsContact O-CG 3.31Å; K438-Q445 WeakPolarHBondContact O-CG 3.27Å; K438-Q445 PolarHBondContact O-NE2 3.49Å; L439-Q445 PolarHBondContact O-NE2 2.89Å; C441-Q445 WeakPolarHBondContact O-CG 3.49Å; C441-Q445 PolarHBondContact O-N 2.92Å; E442-Q445 PolarHBondContact O-N 3.43Å; Q445-K447 PolarHBondContact O-N 3.3Å; Q445-G448 PolarHBondContact O-N 3.28Å
446	A	93.9	Very high	95.3	Very high	88 Å²	88	69.9 Å²	69.9	73%	0.727	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-3.2	176.1	0	0	0	0	0	114.9	E442 C444	E442-A446 WeakPolarHBondContact O-CB 3.47Å; E442-A446 PolarHBondContact O-N 3.15Å; C444-A446 VanDerWaalsContact C-N 3.34Å; C444-A446 PolarHBondContact O-N 3.07Å
447	K	94.6	Very high	94.8	Very high	66 Å²	66	72.1 Å²	72.1	29%	0.287	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	9.6	171.1	-59.4	167.8	-168.6	169	0	112.3	Y380 T383 R443 C444 Q445	Y380-K447 HydrophobicContact CD1-CB 3.99Å; Y380-K447 HydrophobicContact CD1-CD 4.17Å; Y380-K447 HydrophobicContact CE1-CB 3.56Å; Y380-K447 PolarHBondContact OH-O 2.91Å; T383-K447 PolarHBondContact O-NZ 3.12Å; T383-K447 PolarHBondContact OG1-NZ 2.97Å; R443-K447 WeakPolarHBondContact O-CD 3.48Å; R443-K447 VanDerWaalsContact O-CE 3.27Å; R443-K447 WeakPolarHBondContact O-CE 3.48Å; R443-K447 WeakPolarHBondContact O-CG 3.37Å; C444-K447 WeakPolarHBondContact O-CB 3.47Å; C444-K447 PolarHBondContact O-N 3.5Å; C444-K447 VanDerWaalsContact O-N 3.07Å; Q445-K447 PolarHBondContact O-N 3.3Å
448	G	93.8	Very high	94.3	Very high	23 Å²	23	79 Å²	79	24%	0.237	42%	0.415	C	S	.	.			trans	-74	178	166.3	0	0	0	0	0	111.9	Q445 L460	Q445-G448 PolarHBondContact O-N 3.28Å; G448-L460 WeakPolarHBondContact CA-O 3.43Å
449	F	95.1	Very high	94.2	Very high	61 Å²	61	79.2 Å²	79.2	27%	0.268	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-120.8	155.6	-172.9	-65.7	-102.9	0	0	0	111	L460 P462 S474 V476	F449-L460 HydrophobicContact CB-CB 4.4Å; F449-L460 PolarHBondContact N-O 3.49Å; F449-L460 PolarHBondContact O-N 3.11Å; F449-P462 HydrophobicContact CE2-CG 4Å; F449-S474 WeakPolarHBondContact CE1-O 3.45Å; F449-S474 WeakPolarHBondContact CZ-O 3.2Å; F449-V476 HydrophobicContact CB-CB 3.84Å; F449-V476 HydrophobicContact CB-CG2 4.32Å; F449-V476 HydrophobicContact CD1-CB 4.12Å; F449-V476 HydrophobicContact CD1-CG2 4.01Å; F449-V476 HydrophobicContact CD2-CB 3.94Å; F449-V476 HydrophobicContact CD2-CG2 3.44Å; F449-V476 VanDerWaalsContact CD2-CG2 3.44Å; F449-V476 HydrophobicContact CE1-CG2 4.13Å; F449-V476 HydrophobicContact CE2-CG2 3.6Å; F449-V476 HydrophobicContact CG-CB 3.71Å; F449-V476 HydrophobicContact CG-CG2 3.67Å; F449-V476 HydrophobicContact CZ-CG2 3.94Å
450	V	94.9	Very high	94.2	Very high	92 Å²	92	73.4 Å²	73.4	56%	0.558	39%	0.392	S	S	*	.			trans	-115.2	132.3	165.3	179.3	0	0	0	0	107.4	E452	V450-E452 PolarHBondContact O-N 3.33Å; V450-E452 VanDerWaalsContact O-N 3.12Å
451	C	95.6	Very high	94.1	Very high	2 Å²	2	69.8 Å²	69.8	1%	0.014	37%	0.372	C	S	.	.			trans	-64.1	111.2	180	-178.2	0	0	0	0	110.4	L453 C454 R455 L460 H478	C451-L453 PolarHBondContact O-N 3.18Å; C451-C454 VanDerWaalsContact SG-SG 3.69Å; C451-R455 VanDerWaalsContact O-CA 3.31Å; C451-R455 WeakPolarHBondContact O-CA 3.28Å; C451-R455 PolarHBondContact O-N 3.27Å; C451-L460 HydrophobicContact CB-CD1 3.9Å; C451-H478 PolarHBondContact SG-N 3.05Å
452	E	94	Very high	94.1	Very high	59 Å²	59	70.8 Å²	70.8	28%	0.276	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.2	-175.7	-56.1	-173	169.6	0	0	114.2	V450 R455 F477 P490 R494	V450-E452 PolarHBondContact O-N 3.33Å; V450-E452 VanDerWaalsContact O-N 3.12Å; E452-R455 WeakPolarHBondContact O-CG 3.47Å; E452-R455 PolarHBondContact O-NE 3.49Å; E452-R455 VanDerWaalsContact O-NE 3.17Å; E452-F477 HydrophobicContact CB-CE1 4.11Å; E452-F477 HydrophobicContact CG-CE1 4.27Å; E452-P490 HydrophobicContact CB-CG 4.38Å; E452-R494 IonicContact OE1-CZ 3.83Å; E452-R494 IonicContact OE1-NH2 2.76Å; E452-R494 PolarHBondContact OE1-NH2 2.91Å; E452-R494 IonicContact OE2-CZ 3.24Å; E452-R494 VanDerWaalsContact OE2-CZ 3.24Å; E452-R494 IonicContact OE2-NH1 2.7Å; E452-R494 PolarHBondContact OE2-NH1 3.27Å; E452-R494 IonicContact OE2-NH2 2.88Å; E452-R494 PolarHBondContact OE2-NH2 3.18Å
453	L	94.6	Very high	94	Very high	56 Å²	56	63.4 Å²	63.4	29%	0.293	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-54	-174.2	-62.8	170.4	0	0	0	112	C451 F477 C481 N485 P490	C451-L453 PolarHBondContact O-N 3.18Å; L453-F477 HydrophobicContact CD1-CD1 3.83Å; L453-F477 HydrophobicContact CD1-CE1 4.4Å; L453-F477 HydrophobicContact CD1-CG 4.35Å; L453-F477 HydrophobicContact CG-CD1 3.93Å; L453-F477 HydrophobicContact CG-CE1 4.22Å; L453-C481 HydrophobicContact CB-CB 4.39Å; L453-C481 HydrophobicContact CD1-CB 4.18Å; L453-C481 WeakPolarHBondContact CD1-O 3.5Å; L453-N485 HydrophobicContact CD1-CB 3.96Å; L453-N485 HydrophobicContact CD2-CB 4.23Å; L453-P490 HydrophobicContact CD2-CG 3.89Å; L453-P490 HydrophobicContact CG-CG 4.47Å
454	C	94.7	Very high	94.1	Very high	43 Å²	43	59.7 Å²	59.7	29%	0.291	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-34.9	175.3	58.1	0	0	0	0	113	C451 E456 H478	C451-C454 VanDerWaalsContact SG-SG 3.69Å; C454-E456 PolarHBondContact O-N 3.03Å; C454-E456 VanDerWaalsContact O-N 3.17Å; C454-E456 PolarHBondContact SG-O 3.44Å; C454-H478 PolarHBondContact SG-ND1 3.45Å
455	R	91.9	Very high	93.8	Very high	199 Å²	199	64.5 Å²	64.5	75%	0.751	37%	0.365	S	S	*	.			trans	59	16.2	-174.3	-48.7	-178.7	-172.8	175.3	3.9	115.1	C451 E452	C451-R455 VanDerWaalsContact O-CA 3.31Å; C451-R455 WeakPolarHBondContact O-CA 3.28Å; C451-R455 PolarHBondContact O-N 3.27Å; E452-R455 WeakPolarHBondContact O-CG 3.47Å; E452-R455 PolarHBondContact O-NE 3.49Å; E452-R455 VanDerWaalsContact O-NE 3.17Å
456	E	91.1	Very high	93.6	Very high	151 Å²	151	65.4 Å²	65.4	71%	0.706	37%	0.369	S	S	*	.			trans	-124.1	157.4	179.1	-67.1	173.6	-176	0	0	109.2	C454 H478	C454-E456 PolarHBondContact O-N 3.03Å; C454-E456 VanDerWaalsContact O-N 3.17Å; C454-E456 PolarHBondContact SG-O 3.44Å; E456-H478 PolarHBondContact O-CE1 2.92Å
457	G	86.7	Confident	93.7	Very high	65 Å²	65	61.9 Å²	61.9	67%	0.67	34%	0.338	S	S	*	.	S	Bend	trans	100.2	-177.4	-178	0	0	0	0	0	114
458	D	88.2	Confident	93.7	Very high	145 Å²	145	59.8 Å²	59.8	78%	0.775	33%	0.332	S	S	*	.	S	Bend	trans	-75.7	170.3	-177.3	-67.5	-51.2	0	0	0	113.3	L460	D458-L460 PolarHBondContact O-N 3.22Å
459	V	93.9	Very high	93.7	Very high	76 Å²	76	61.2 Å²	61.2	46%	0.461	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-69.7	122.2	175.5	179.6	0	0	0	0	110.3	F461	V459-F461 HydrophobicContact CB-CE2 4.34Å; V459-F461 HydrophobicContact CG1-CE2 3.88Å; V459-F461 HydrophobicContact CG1-CZ 3.89Å; V459-F461 WeakPolarHBondContact O-CD2 3.45Å; V459-F461 WeakPolarHBondContact O-CE2 3.35Å
460	L	96.2	Very high	93.7	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.01	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-93.8	144.1	-174.2	-56.7	-177.5	0	0	0	112.6	G448 F449 C451 D458 T467 V476	G448-L460 WeakPolarHBondContact CA-O 3.43Å; F449-L460 HydrophobicContact CB-CB 4.4Å; F449-L460 PolarHBondContact N-O 3.49Å; F449-L460 PolarHBondContact O-N 3.11Å; C451-L460 HydrophobicContact CB-CD1 3.9Å; D458-L460 PolarHBondContact O-N 3.22Å; L460-T467 HydrophobicContact CB-CG2 4.02Å; L460-T467 HydrophobicContact CD1-CG2 4.2Å; L460-T467 HydrophobicContact CD2-CG2 3.96Å; L460-T467 HydrophobicContact CG-CG2 4.29Å; L460-V476 HydrophobicContact CB-CG1 4.03Å
461	F	96.7	Very high	93.6	Very high	8 Å²	8	60 Å²	60	4%	0.035	33%	0.334	C	S	.	.			trans	-122.1	149.3	174.8	-61.1	-94.5	0	0	0	111	Y380 I437 K438 V459 F463 D464 T467	Y380-F461 AromaticContact CE1-CD1 3.97Å; Y380-F461 HydrophobicContact CE1-CD1 3.97Å; Y380-F461 HydrophobicContact CE1-CE1 4.07Å; Y380-F461 AromaticContact CZ-CD1 3.98Å; I437-F461 HydrophobicContact CG2-CD1 3.58Å; I437-F461 HydrophobicContact CG2-CE1 3.5Å; I437-F461 HydrophobicContact CG2-CG 4.49Å; I437-F461 HydrophobicContact CG2-CZ 4.37Å; K438-F461 HydrophobicContact CD-CD2 4.38Å; K438-F461 HydrophobicContact CG-CD2 3.96Å; K438-F461 HydrophobicContact CG-CE2 3.81Å; K438-F461 HydrophobicContact CG-CZ 4.22Å; V459-F461 HydrophobicContact CB-CE2 4.34Å; V459-F461 HydrophobicContact CG1-CE2 3.88Å; V459-F461 HydrophobicContact CG1-CZ 3.89Å; V459-F461 WeakPolarHBondContact O-CD2 3.45Å; V459-F461 WeakPolarHBondContact O-CE2 3.35Å; F461-F463 HydrophobicContact CB-CD1 4.07Å; F461-F463 HydrophobicContact CB-CD2 4.38Å; F461-F463 HydrophobicContact CB-CE1 3.65Å; F461-F463 HydrophobicContact CB-CE2 4.01Å; F461-F463 HydrophobicContact CB-CG 4.42Å; F461-F463 HydrophobicContact CB-CZ 3.62Å; F461-F463 HydrophobicContact CD1-CE1 4.24Å; F461-F463 HydrophobicContact CD1-CZ 4.14Å; F461-F463 HydrophobicContact CG-CE1 4.25Å; F461-F463 AromaticContact CG-CZ 3.96Å; F461-F463 HydrophobicContact CG-CZ 3.96Å; F461-F463 PolarHBondContact O-N 3.41Å; F461-D464 WeakPolarHBondContact CB-OD2 3.39Å; F461-D464 PolarHBondContact N-OD2 3.28Å; F461-D464 WeakPolarHBondContact O-CB 3.46Å; F461-D464 PolarHBondContact O-N 3.01Å; F461-T467 PolarHBondContact O-OG1 3.09Å
462	P	95.6	Very high	93.5	Very high	21 Å²	21	65.8 Å²	65.8	14%	0.136	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.3	-175.4	-23.4	31.7	0	0	0	115.3	L376 Y380 F449 V469 V476	L376-P462 HydrophobicContact CB-CB 4.29Å; L376-P462 HydrophobicContact CD1-CB 4.17Å; L376-P462 HydrophobicContact CD2-CB 4.07Å; L376-P462 HydrophobicContact CG-CB 4.42Å; Y380-P462 WeakPolarHBondContact OH-CD 3.25Å; F449-P462 HydrophobicContact CE2-CG 4Å; P462-V469 HydrophobicContact CB-CG2 3.96Å; P462-V476 HydrophobicContact CB-CG2 4.13Å; P462-V476 HydrophobicContact CG-CG2 3.76Å
463	F	95.6	Very high	93.5	Very high	9 Å²	9	64 Å²	64	4%	0.039	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	5.1	-178.2	51.6	-96.9	0	0	0	113.7	D373 L376 M377 Y380 A434 I437 F461	D373-F463 HydrophobicContact CB-CB 3.74Å; D373-F463 WeakPolarHBondContact OD1-CA 3.28Å; D373-F463 WeakPolarHBondContact OD1-CB 3.45Å; L376-F463 HydrophobicContact CB-CB 4.35Å; L376-F463 HydrophobicContact CB-CD1 4.47Å; L376-F463 HydrophobicContact CD1-CB 4.43Å; M377-F463 HydrophobicContact CE-CB 4.48Å; M377-F463 HydrophobicContact CE-CD1 4.23Å; M377-F463 HydrophobicContact CE-CD2 3.46Å; M377-F463 VanDerWaalsContact CE-CD2 3.46Å; M377-F463 HydrophobicContact CE-CE1 4.32Å; M377-F463 HydrophobicContact CE-CE2 3.55Å; M377-F463 HydrophobicContact CE-CG 3.82Å; M377-F463 HydrophobicContact CE-CZ 4Å; M377-F463 HydrophobicContact CG-CD1 3.63Å; M377-F463 HydrophobicContact CG-CE1 3.67Å; M377-F463 HydrophobicContact CG-CG 4.09Å; M377-F463 HydrophobicContact CG-CZ 4.15Å; Y380-F463 HydrophobicContact CE2-CE1 4.42Å; A434-F463 HydrophobicContact CB-CE2 4.35Å; I437-F463 HydrophobicContact CB-CZ 4.21Å; I437-F463 HydrophobicContact CD1-CE1 4.02Å; I437-F463 HydrophobicContact CD1-CZ 4.1Å; I437-F463 HydrophobicContact CG2-CE1 4.15Å; I437-F463 HydrophobicContact CG2-CZ 3.79Å; F461-F463 HydrophobicContact CB-CD1 4.07Å; F461-F463 HydrophobicContact CB-CD2 4.38Å; F461-F463 HydrophobicContact CB-CE1 3.65Å; F461-F463 HydrophobicContact CB-CE2 4.01Å; F461-F463 HydrophobicContact CB-CG 4.42Å; F461-F463 HydrophobicContact CB-CZ 3.62Å; F461-F463 HydrophobicContact CD1-CE1 4.24Å; F461-F463 HydrophobicContact CD1-CZ 4.14Å; F461-F463 HydrophobicContact CG-CE1 4.25Å; F461-F463 AromaticContact CG-CZ 3.96Å; F461-F463 HydrophobicContact CG-CZ 3.96Å; F461-F463 PolarHBondContact O-N 3.41Å
464	D	95.2	Very high	93.5	Very high	17 Å²	17	64.9 Å²	64.9	9%	0.091	37%	0.37	C	S	.	.			trans	-80.3	134.8	-176.9	-73.1	-30.4	0	0	0	113.5	K438 F461 H466 T467	K438-D464 WeakPolarHBondContact CE-OD1 3.2Å; K438-D464 IonicContact NZ-OD1 3.11Å; K438-D464 PolarHBondContact NZ-OD1 2.88Å; K438-D464 IonicContact NZ-OD2 2.71Å; F461-D464 WeakPolarHBondContact CB-OD2 3.39Å; F461-D464 PolarHBondContact N-OD2 3.28Å; F461-D464 WeakPolarHBondContact O-CB 3.46Å; F461-D464 PolarHBondContact O-N 3.01Å; D464-H466 PolarHBondContact O-N 3.18Å; D464-T467 HydrophobicContact CB-CG2 3.55Å; D464-T467 PolarHBondContact O-N 2.64Å; D464-T467 PolarHBondContact O-OG1 2.94Å
465	S	91.8	Very high	93.5	Very high	102 Å²	102	63.1 Å²	63.1	71%	0.713	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-23.2	-174.6	56.9	0	0	0	0	115.7
466	H	92.4	Very high	93.7	Very high	89 Å²	89	53.7 Å²	53.7	41%	0.412	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	19.5	-176.8	57	-84.8	0	0	0	112.4	D464 R479	D464-H466 PolarHBondContact O-N 3.18Å; H466-R479 WeakPolarHBondContact O-CB 3.39Å; H466-R479 PolarHBondContact O-N 3.49Å
467	T	94.6	Very high	93.9	Very high	14 Å²	14	46.5 Å²	46.5	9%	0.086	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	172.1	177	66.2	0	0	0	0	113	L460 F461 D464 V476 F477	L460-T467 HydrophobicContact CB-CG2 4.02Å; L460-T467 HydrophobicContact CD1-CG2 4.2Å; L460-T467 HydrophobicContact CD2-CG2 3.96Å; L460-T467 HydrophobicContact CG-CG2 4.29Å; F461-T467 PolarHBondContact O-OG1 3.09Å; D464-T467 HydrophobicContact CB-CG2 3.55Å; D464-T467 PolarHBondContact O-N 2.64Å; D464-T467 PolarHBondContact O-OG1 2.94Å; T467-V476 HydrophobicContact CG2-CG1 3.89Å; T467-F477 CarbonylContact C-O 3.47Å; T467-F477 WeakPolarHBondContact CA-O 3.36Å; T467-F477 WeakPolarHBondContact CB-O 3.16Å
468	S	95	Very high	94.4	Very high	22 Å²	22	45.3 Å²	45.3	15%	0.154	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	139.6	167.9	-72.7	0	0	0	0	110.4	V476 F477 R479	S468-V476 WeakPolarHBondContact O-CA 3.27Å; S468-F477 PolarHBondContact N-O 2.95Å; S468-F477 PolarHBondContact O-N 2.92Å; S468-R479 WeakPolarHBondContact OG-CG 3.07Å
469	V	94.5	Very high	94.8	Very high	53 Å²	53	43.4 Å²	43.4	32%	0.321	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	123.7	-175.4	-169.9	0	0	0	0	108.9	P462 T471 A475 V476	P462-V469 HydrophobicContact CB-CG2 3.96Å; V469-T471 PolarHBondContact O-N 3.32Å; V469-A475 WeakPolarHBondContact CA-O 3.35Å; V469-V476 HydrophobicContact CG2-CG2 4.31Å
470	C	94.8	Very high	94.8	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.007	25%	0.247	C	C	.	.			trans	-67.1	126.2	173	170.9	0	0	0	0	110.5	D472 C473 S474 A475 F477 C489	C470-D472 VanDerWaalsContact C-N 3.29Å; C470-D472 PolarHBondContact O-N 3.34Å; C470-C473 VanDerWaalsContact SG-SG 3.63Å; C470-S474 VanDerWaalsContact O-CA 3.28Å; C470-S474 WeakPolarHBondContact O-CA 3.44Å; C470-S474 PolarHBondContact O-N 3.41Å; C470-A475 PolarHBondContact N-O 3.16Å; C470-F477 HydrophobicContact CB-CE2 4.22Å; C470-C489 HydrophobicContact CB-CB 4.05Å; C470-C489 WeakPolarHBondContact SG-CB 3.49Å
471	T	93.4	Very high	94.8	Very high	125 Å²	125	45.6 Å²	45.6	77%	0.767	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-37.4	-178.4	42.6	0	0	0	0	113.9	V469	V469-T471 PolarHBondContact O-N 3.32Å
472	D	93.6	Very high	94.8	Very high	125 Å²	125	46.3 Å²	46.3	67%	0.668	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-22.5	-165.7	-25	-43.9	0	0	0	113.1	C470	C470-D472 VanDerWaalsContact C-N 3.29Å; C470-D472 PolarHBondContact O-N 3.34Å
473	C	93.4	Very high	94.7	Very high	20 Å²	20	52.4 Å²	52.4	14%	0.135	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	5.9	-173.1	76.6	0	0	0	0	115	C470 A475 C489 K491 C492 L495	C470-C473 VanDerWaalsContact SG-SG 3.63Å; C473-A475 PolarHBondContact O-N 3.08Å; C473-C489 VanDerWaalsContact SG-SG 3.6Å; C473-K491 HydrophobicContact CB-CD 4.34Å; C473-K491 PolarHBondContact O-NZ 2.93Å; C473-C492 PolarHBondContact SG-SG 3.05Å; C473-L495 HydrophobicContact CB-CD1 4.25Å
474	S	93.6	Very high	94.7	Very high	76 Å²	76	58.4 Å²	58.4	53%	0.531	32%	0.316	S	S	.	.			trans	51.8	29.4	176.4	-47.2	0	0	0	0	114.6	F449 C470	F449-S474 WeakPolarHBondContact CE1-O 3.45Å; F449-S474 WeakPolarHBondContact CZ-O 3.2Å; C470-S474 VanDerWaalsContact O-CA 3.28Å; C470-S474 WeakPolarHBondContact O-CA 3.44Å; C470-S474 PolarHBondContact O-N 3.41Å
475	A	94.8	Very high	94.6	Very high	5 Å²	5	60.8 Å²	60.8	4%	0.041	33%	0.328	C	S	.	.			trans	-77.1	134.5	169.4	0	0	0	0	0	110.3	V469 C470 C473 F477 K491	V469-A475 WeakPolarHBondContact CA-O 3.35Å; C470-A475 PolarHBondContact N-O 3.16Å; C473-A475 PolarHBondContact O-N 3.08Å; A475-F477 HydrophobicContact CB-CE2 3.58Å; A475-F477 HydrophobicContact CB-CZ 3.7Å; A475-F477 WeakPolarHBondContact O-CE2 3.41Å; A475-K491 HydrophobicContact CB-CD 3.77Å
476	V	96.3	Very high	94.7	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.012	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	136.5	177.3	-170.6	0	0	0	0	109.5	F449 L460 P462 T467 S468 V469	F449-V476 HydrophobicContact CB-CB 3.84Å; F449-V476 HydrophobicContact CB-CG2 4.32Å; F449-V476 HydrophobicContact CD1-CB 4.12Å; F449-V476 HydrophobicContact CD1-CG2 4.01Å; F449-V476 HydrophobicContact CD2-CB 3.94Å; F449-V476 HydrophobicContact CD2-CG2 3.44Å; F449-V476 VanDerWaalsContact CD2-CG2 3.44Å; F449-V476 HydrophobicContact CE1-CG2 4.13Å; F449-V476 HydrophobicContact CE2-CG2 3.6Å; F449-V476 HydrophobicContact CG-CB 3.71Å; F449-V476 HydrophobicContact CG-CG2 3.67Å; F449-V476 HydrophobicContact CZ-CG2 3.94Å; L460-V476 HydrophobicContact CB-CG1 4.03Å; P462-V476 HydrophobicContact CB-CG2 4.13Å; P462-V476 HydrophobicContact CG-CG2 3.76Å; T467-V476 HydrophobicContact CG2-CG1 3.89Å; S468-V476 WeakPolarHBondContact O-CA 3.27Å; V469-V476 HydrophobicContact CG2-CG2 4.31Å
477	F	96.7	Very high	94.7	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	162.9	175.9	-56.4	-86.6	0	0	0	109.1	E452 L453 T467 S468 C470 A475 R479 Y482 P490	E452-F477 HydrophobicContact CB-CE1 4.11Å; E452-F477 HydrophobicContact CG-CE1 4.27Å; L453-F477 HydrophobicContact CD1-CD1 3.83Å; L453-F477 HydrophobicContact CD1-CE1 4.4Å; L453-F477 HydrophobicContact CD1-CG 4.35Å; L453-F477 HydrophobicContact CG-CD1 3.93Å; L453-F477 HydrophobicContact CG-CE1 4.22Å; T467-F477 CarbonylContact C-O 3.47Å; T467-F477 WeakPolarHBondContact CA-O 3.36Å; T467-F477 WeakPolarHBondContact CB-O 3.16Å; S468-F477 PolarHBondContact N-O 2.95Å; S468-F477 PolarHBondContact O-N 2.92Å; C470-F477 HydrophobicContact CB-CE2 4.22Å; A475-F477 HydrophobicContact CB-CE2 3.58Å; A475-F477 HydrophobicContact CB-CZ 3.7Å; A475-F477 WeakPolarHBondContact O-CE2 3.41Å; F477-R479 PolarHBondContact O-N 3Å; F477-Y482 HydrophobicContact CB-CD2 4.45Å; F477-Y482 HydrophobicContact CB-CG 4.47Å; F477-Y482 AromaticContact CD2-CD2 3.77Å; F477-Y482 HydrophobicContact CD2-CD2 3.77Å; F477-Y482 HydrophobicContact CD2-CE2 4.06Å; F477-Y482 HydrophobicContact CD2-CG 4.35Å; F477-Y482 HydrophobicContact CE2-CD2 4.28Å; F477-Y482 HydrophobicContact CE2-CE2 4.18Å; F477-Y482 HydrophobicContact CG-CD2 4.14Å; F477-P490 HydrophobicContact CE1-CG 3.94Å; F477-P490 HydrophobicContact CZ-CG 4.16Å
478	H	96.8	Very high	94.7	Very high	39 Å²	39	62.6 Å²	62.6	18%	0.181	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	136.1	158.8	-68.6	131.2	0	0	0	108.9	C451 C454 E456 D480 C481 Y482	C451-H478 PolarHBondContact SG-N 3.05Å; C454-H478 PolarHBondContact SG-ND1 3.45Å; E456-H478 PolarHBondContact O-CE1 2.92Å; H478-D480 VanDerWaalsContact C-N 3.32Å; H478-D480 PolarHBondContact O-N 3.34Å; H478-C481 HydrophobicContact CB-CB 4.07Å; H478-C481 PolarHBondContact O-N 3.17Å; H478-Y482 PolarHBondContact O-N 2.99Å
479	R	95.3	Very high	94.8	Very high	106 Å²	106	62 Å²	62	40%	0.4	34%	0.341	S	S	.	.	H	α-helix	trans	-53.4	-52.4	-177.3	-176.5	-170.1	70.2	-167.6	-3.6	110.9	H466 S468 F477 Y482 Y483	H466-R479 WeakPolarHBondContact O-CB 3.39Å; H466-R479 PolarHBondContact O-N 3.49Å; S468-R479 WeakPolarHBondContact OG-CG 3.07Å; F477-R479 PolarHBondContact O-N 3Å; R479-Y482 WeakPolarHBondContact O-CB 3.44Å; R479-Y482 PolarHBondContact O-N 3.4Å; R479-Y482 VanDerWaalsContact O-N 3.15Å; R479-Y483 HydrophobicContact CG-CD2 3.87Å; R479-Y483 HydrophobicContact CG-CE2 3.68Å; R479-Y483 VanDerWaalsContact O-CD2 3.27Å; R479-Y483 WeakPolarHBondContact O-CD2 3.18Å; R479-Y483 PolarHBondContact O-N 3.33Å
480	D	95.6	Very high	94.8	Very high	85 Å²	85	60.8 Å²	60.8	46%	0.455	33%	0.334	S	S	.	.	H	α-helix	trans	-69	-44.9	-171.3	-53.6	-21.3	0	0	0	110.1	H478 Y482 Y483 D484	H478-D480 VanDerWaalsContact C-N 3.32Å; H478-D480 PolarHBondContact O-N 3.34Å; D480-Y482 PolarHBondContact O-N 3.27Å; D480-Y483 PolarHBondContact O-N 3.03Å; D480-Y483 VanDerWaalsContact O-N 3.1Å; D480-D484 VanDerWaalsContact O-CG 3.28Å; D480-D484 PolarHBondContact O-N 2.7Å
481	C	96.3	Very high	94.7	Very high	38 Å²	38	63.8 Å²	63.8	26%	0.257	35%	0.347	S	S	.	.	H	α-helix	trans	-56.3	-34.5	171.7	-57.4	0	0	0	0	113.7	L453 H478 N485	L453-C481 HydrophobicContact CB-CB 4.39Å; L453-C481 HydrophobicContact CD1-CB 4.18Å; L453-C481 WeakPolarHBondContact CD1-O 3.5Å; H478-C481 HydrophobicContact CB-CB 4.07Å; H478-C481 PolarHBondContact O-N 3.17Å; C481-N485 WeakPolarHBondContact O-CB 3.44Å; C481-N485 PolarHBondContact O-N 2.93Å
482	Y	95.7	Very high	94.8	Very high	24 Å²	24	58.8 Å²	58.8	9%	0.094	32%	0.317	C	S	.	.	H	α-helix	trans	-74	-37.1	178.5	-169.7	-122.5	0	0	0	112.1	F477 H478 R479 D480 T487 C489	F477-Y482 HydrophobicContact CB-CD2 4.45Å; F477-Y482 HydrophobicContact CB-CG 4.47Å; F477-Y482 AromaticContact CD2-CD2 3.77Å; F477-Y482 HydrophobicContact CD2-CD2 3.77Å; F477-Y482 HydrophobicContact CD2-CE2 4.06Å; F477-Y482 HydrophobicContact CD2-CG 4.35Å; F477-Y482 HydrophobicContact CE2-CD2 4.28Å; F477-Y482 HydrophobicContact CE2-CE2 4.18Å; F477-Y482 HydrophobicContact CG-CD2 4.14Å; H478-Y482 PolarHBondContact O-N 2.99Å; R479-Y482 WeakPolarHBondContact O-CB 3.44Å; R479-Y482 PolarHBondContact O-N 3.4Å; R479-Y482 VanDerWaalsContact O-N 3.15Å; D480-Y482 PolarHBondContact O-N 3.27Å; Y482-T487 HydrophobicContact CD1-CG2 4.27Å; Y482-T487 HydrophobicContact CE1-CG2 4.18Å; Y482-T487 WeakPolarHBondContact CE2-O 3.3Å; Y482-T487 VanDerWaalsContact O-CA 3.23Å; Y482-T487 WeakPolarHBondContact O-CA 3.31Å; Y482-T487 PolarHBondContact O-N 3.24Å; Y482-T487 PolarHBondContact OH-O 3.35Å; Y482-C489 HydrophobicContact CE2-CB 4.32Å
483	Y	94.6	Very high	94.8	Very high	149 Å²	149	55 Å²	55	58%	0.584	30%	0.304	S	S	*	.	H	α-helix	trans	-68.2	-42.7	171.7	-79.8	-70	0	0	0	112.3	R479 D480 N485 S486 T487	R479-Y483 HydrophobicContact CG-CD2 3.87Å; R479-Y483 HydrophobicContact CG-CE2 3.68Å; R479-Y483 VanDerWaalsContact O-CD2 3.27Å; R479-Y483 WeakPolarHBondContact O-CD2 3.18Å; R479-Y483 PolarHBondContact O-N 3.33Å; D480-Y483 PolarHBondContact O-N 3.03Å; D480-Y483 VanDerWaalsContact O-N 3.1Å; Y483-N485 VanDerWaalsContact C-N 3.28Å; Y483-N485 PolarHBondContact O-N 2.9Å; Y483-S486 WeakPolarHBondContact O-CA 3.44Å; Y483-S486 PolarHBondContact O-N 2.64Å; Y483-T487 HydrophobicContact CD1-CG2 4Å; Y483-T487 HydrophobicContact CE1-CG2 4.18Å
484	D	95.7	Very high	94.8	Very high	135 Å²	135	59.5 Å²	59.5	72%	0.722	32%	0.318	S	S	*	.	H	α-helix	trans	-60.2	-39.3	176	-66.9	-27.3	0	0	0	111.3	D480 S486	D480-D484 VanDerWaalsContact O-CG 3.28Å; D480-D484 PolarHBondContact O-N 2.7Å; D484-S486 PolarHBondContact O-N 3.19Å
485	N	92.9	Very high	94.7	Very high	66 Å²	66	60.1 Å²	60.1	35%	0.353	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	23	171.4	-157.4	61.1	0	0	0	113.5	L453 C481 Y483 T487 T488	L453-N485 HydrophobicContact CD1-CB 3.96Å; L453-N485 HydrophobicContact CD2-CB 4.23Å; C481-N485 WeakPolarHBondContact O-CB 3.44Å; C481-N485 PolarHBondContact O-N 2.93Å; Y483-N485 VanDerWaalsContact C-N 3.28Å; Y483-N485 PolarHBondContact O-N 2.9Å; N485-T487 PolarHBondContact O-N 2.94Å; N485-T487 VanDerWaalsContact O-N 3.13Å; N485-T488 PolarHBondContact ND2-O 2.87Å; N485-T488 WeakPolarHBondContact O-CB 3.47Å; N485-T488 PolarHBondContact O-N 3.39Å
486	S	93.9	Very high	94.6	Very high	90 Å²	90	62.8 Å²	62.8	63%	0.629	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	35.7	178.4	-59.6	0	0	0	0	113.8	Y483 D484 T488	Y483-S486 WeakPolarHBondContact O-CA 3.44Å; Y483-S486 PolarHBondContact O-N 2.64Å; D484-S486 PolarHBondContact O-N 3.19Å; S486-T488 PolarHBondContact O-N 3.09Å
487	T	92.4	Very high	94.4	Very high	72 Å²	72	68.1 Å²	68.1	44%	0.442	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	14.2	-173.3	66.5	0	0	0	0	115.3	Y482 Y483 N485 C489	Y482-T487 HydrophobicContact CD1-CG2 4.27Å; Y482-T487 HydrophobicContact CE1-CG2 4.18Å; Y482-T487 WeakPolarHBondContact CE2-O 3.3Å; Y482-T487 VanDerWaalsContact O-CA 3.23Å; Y482-T487 WeakPolarHBondContact O-CA 3.31Å; Y482-T487 PolarHBondContact O-N 3.24Å; Y482-T487 PolarHBondContact OH-O 3.35Å; Y483-T487 HydrophobicContact CD1-CG2 4Å; Y483-T487 HydrophobicContact CE1-CG2 4.18Å; N485-T487 PolarHBondContact O-N 2.94Å; N485-T487 VanDerWaalsContact O-N 3.13Å; T487-C489 PolarHBondContact O-N 3.47Å
488	T	94.1	Very high	94.1	Very high	82 Å²	82	76.3 Å²	76.3	50%	0.503	39%	0.391	S	S	.	.			trans	-76	123.6	177.7	-63	0	0	0	0	109.6	N485 S486 P490	N485-T488 PolarHBondContact ND2-O 2.87Å; N485-T488 WeakPolarHBondContact O-CB 3.47Å; N485-T488 PolarHBondContact O-N 3.39Å; S486-T488 PolarHBondContact O-N 3.09Å; T488-P490 WeakPolarHBondContact O-CD 3.31Å
489	C	96	Very high	93.7	Very high	8 Å²	8	81 Å²	81	5%	0.054	41%	0.412	C	S	.	.			trans	-88	116.6	178.7	-174.6	0	0	0	0	112.1	C470 C473 Y482 T487 K491 C492 A493	C470-C489 HydrophobicContact CB-CB 4.05Å; C470-C489 WeakPolarHBondContact SG-CB 3.49Å; C473-C489 VanDerWaalsContact SG-SG 3.6Å; Y482-C489 HydrophobicContact CE2-CB 4.32Å; T487-C489 PolarHBondContact O-N 3.47Å; C489-K491 VanDerWaalsContact C-N 3.27Å; C489-K491 PolarHBondContact O-N 3.5Å; C489-C492 HydrophobicContact CB-CB 3.94Å; C489-C492 PolarHBondContact O-N 3.02Å; C489-A493 PolarHBondContact O-N 3.34Å; C489-A493 VanDerWaalsContact O-N 3.09Å
490	P	94.5	Very high	93.3	Very high	29 Å²	29	81.8 Å²	81.8	19%	0.188	42%	0.42	C	S	.	.	H	α-helix	trans	-65.6	-29.5	179.7	27.4	-36.2	0	0	0	112.7	E452 L453 F477 T488 A493 R494	E452-P490 HydrophobicContact CB-CG 4.38Å; L453-P490 HydrophobicContact CD2-CG 3.89Å; L453-P490 HydrophobicContact CG-CG 4.47Å; F477-P490 HydrophobicContact CE1-CG 3.94Å; F477-P490 HydrophobicContact CZ-CG 4.16Å; T488-P490 WeakPolarHBondContact O-CD 3.31Å; P490-A493 PolarHBondContact O-N 3.27Å; P490-R494 WeakPolarHBondContact O-CG 3.33Å; P490-R494 PolarHBondContact O-N 3.29Å; P490-R494 VanDerWaalsContact O-N 3.11Å; P490-R494 PolarHBondContact O-NH1 3.47Å
491	K	93.7	Very high	92.6	Very high	64 Å²	64	81 Å²	81	28%	0.278	42%	0.421	S	S	.	.	H	α-helix	trans	-67.1	-44	173.9	-174.5	-174.6	171	-163.6	0	111.4	C473 A475 C489 A493 R494 L495	C473-K491 HydrophobicContact CB-CD 4.34Å; C473-K491 PolarHBondContact O-NZ 2.93Å; A475-K491 HydrophobicContact CB-CD 3.77Å; C489-K491 VanDerWaalsContact C-N 3.27Å; C489-K491 PolarHBondContact O-N 3.5Å; K491-A493 PolarHBondContact O-N 2.8Å; K491-R494 PolarHBondContact O-N 3.02Å; K491-L495 HydrophobicContact CG-CD1 4.14Å; K491-L495 WeakPolarHBondContact O-CB 3.48Å; K491-L495 VanDerWaalsContact O-CG 3.29Å; K491-L495 WeakPolarHBondContact O-CG 3.48Å; K491-L495 PolarHBondContact O-N 3.19Å
492	C	95.6	Very high	91.8	Very high	20 Å²	20	85.9 Å²	85.9	14%	0.135	44%	0.444	C	S	.	.	H	α-helix	trans	-60.2	-44.5	173.7	-68.2	0	0	0	0	111.7	C473 C489 R494 L495 S496	C473-C492 PolarHBondContact SG-SG 3.05Å; C489-C492 HydrophobicContact CB-CB 3.94Å; C489-C492 PolarHBondContact O-N 3.02Å; C492-R494 PolarHBondContact O-N 3.49Å; C492-L495 PolarHBondContact O-N 2.87Å; C492-S496 WeakPolarHBondContact O-CB 3.39Å; C492-S496 PolarHBondContact O-N 3.29Å; C492-S496 PolarHBondContact O-OG 3.05Å
493	A	92.4	Very high	90.5	Very high	46 Å²	46	92.7 Å²	92.7	38%	0.38	47%	0.474	S	S	.	.	H	α-helix	trans	-57	-48.4	176.5	0	0	0	0	0	112.1	C489 P490 K491 L495 S496 L497	C489-A493 PolarHBondContact O-N 3.34Å; C489-A493 VanDerWaalsContact O-N 3.09Å; P490-A493 PolarHBondContact O-N 3.27Å; K491-A493 PolarHBondContact O-N 2.8Å; A493-L495 VanDerWaalsContact C-N 3.35Å; A493-L495 PolarHBondContact O-N 2.76Å; A493-S496 PolarHBondContact O-N 3.38Å; A493-L497 VanDerWaalsContact O-CD1 3.26Å; A493-L497 WeakPolarHBondContact O-CD1 3.48Å; A493-L497 PolarHBondContact O-N 3.16Å
494	R	93.9	Very high	88.9	Confident	114 Å²	114	93.1 Å²	93.1	43%	0.43	48%	0.481	S	S	.	.	H	α-helix	trans	-63.8	-36	176.7	-66.6	-171.3	-48	-89.4	4.7	113.2	E452 P490 K491 C492 R498	E452-R494 IonicContact OE1-CZ 3.83Å; E452-R494 IonicContact OE1-NH2 2.76Å; E452-R494 PolarHBondContact OE1-NH2 2.91Å; E452-R494 IonicContact OE2-CZ 3.24Å; E452-R494 VanDerWaalsContact OE2-CZ 3.24Å; E452-R494 IonicContact OE2-NH1 2.7Å; E452-R494 PolarHBondContact OE2-NH1 3.27Å; E452-R494 IonicContact OE2-NH2 2.88Å; E452-R494 PolarHBondContact OE2-NH2 3.18Å; P490-R494 WeakPolarHBondContact O-CG 3.33Å; P490-R494 PolarHBondContact O-N 3.29Å; P490-R494 VanDerWaalsContact O-N 3.11Å; P490-R494 PolarHBondContact O-NH1 3.47Å; K491-R494 PolarHBondContact O-N 3.02Å; C492-R494 PolarHBondContact O-N 3.49Å; R494-R498 WeakPolarHBondContact O-CB 3.48Å; R494-R498 VanDerWaalsContact O-CG 3.31Å; R494-R498 WeakPolarHBondContact O-CG 3.24Å; R494-R498 PolarHBondContact O-N 2.73Å; R494-R498 VanDerWaalsContact O-N 3.12Å
495	L	92	Very high	86.9	Confident	88 Å²	88	94.8 Å²	94.8	46%	0.461	49%	0.485	S	S	.	.	H	α-helix	trans	-67.7	-41.5	175.5	-72.4	168.9	0	0	0	111.6	C473 K491 C492 A493 R498 K499	C473-L495 HydrophobicContact CB-CD1 4.25Å; K491-L495 HydrophobicContact CG-CD1 4.14Å; K491-L495 WeakPolarHBondContact O-CB 3.48Å; K491-L495 VanDerWaalsContact O-CG 3.29Å; K491-L495 WeakPolarHBondContact O-CG 3.48Å; K491-L495 PolarHBondContact O-N 3.19Å; C492-L495 PolarHBondContact O-N 2.87Å; A493-L495 VanDerWaalsContact C-N 3.35Å; A493-L495 PolarHBondContact O-N 2.76Å; L495-R498 PolarHBondContact O-N 2.98Å; L495-K499 WeakPolarHBondContact O-CB 3.3Å; L495-K499 PolarHBondContact O-N 3.17Å
496	S	92.4	Very high	85	Confident	61 Å²	61	96.9 Å²	96.9	43%	0.427	50%	0.502	S	S	.	.	H	α-helix	trans	-64	-45.3	176.4	-67.3	0	0	0	0	112.4	C492 A493 K499 Q500	C492-S496 WeakPolarHBondContact O-CB 3.39Å; C492-S496 PolarHBondContact O-N 3.29Å; C492-S496 PolarHBondContact O-OG 3.05Å; A493-S496 PolarHBondContact O-N 3.38Å; S496-K499 PolarHBondContact O-N 2.97Å; S496-Q500 WeakPolarHBondContact O-CG 3.47Å; S496-Q500 PolarHBondContact O-N 3.2Å
497	L	91.4	Very high	83.3	Confident	114 Å²	114	95.4 Å²	95.4	60%	0.597	50%	0.501	S	S	*	.	H	α-helix	trans	-60.6	-46.5	174.5	-92.5	77.7	0	0	0	111.6	A493 K499 Q500 S501	A493-L497 VanDerWaalsContact O-CD1 3.26Å; A493-L497 WeakPolarHBondContact O-CD1 3.48Å; A493-L497 PolarHBondContact O-N 3.16Å; L497-K499 VanDerWaalsContact C-N 3.28Å; L497-K499 PolarHBondContact O-N 3.39Å; L497-Q500 WeakPolarHBondContact O-CB 3.15Å; L497-Q500 PolarHBondContact O-N 3.28Å; L497-Q500 VanDerWaalsContact O-N 3.12Å; L497-S501 PolarHBondContact O-N 3.02Å; L497-S501 PolarHBondContact O-OG 3.12Å
498	R	90.7	Very high	81.5	Confident	172 Å²	172	97.7 Å²	97.7	65%	0.649	52%	0.517	S	S	*	.	H	α-helix	trans	-59.9	-37.9	176.6	-76.6	176.3	176.9	-172.4	-1.7	112.5	R494 L495 S501 L502	R494-R498 WeakPolarHBondContact O-CB 3.48Å; R494-R498 VanDerWaalsContact O-CG 3.31Å; R494-R498 WeakPolarHBondContact O-CG 3.24Å; R494-R498 PolarHBondContact O-N 2.73Å; R494-R498 VanDerWaalsContact O-N 3.12Å; L495-R498 PolarHBondContact O-N 2.98Å; R498-S501 WeakPolarHBondContact CA-OG 3.5Å; R498-S501 PolarHBondContact O-OG 3.22Å; R498-L502 WeakPolarHBondContact O-CD1 3.48Å; R498-L502 VanDerWaalsContact O-CG 3.3Å; R498-L502 WeakPolarHBondContact O-CG 3.41Å; R498-L502 PolarHBondContact O-N 3.01Å
499	K	88.8	Confident	79.6	Confident	139 Å²	139	101.2 Å²	101.2	60%	0.604	53%	0.533	S	S	*	.	H	α-helix	trans	-66.5	-40.3	175.3	-173.3	174.7	-179.9	-178.4	0	111.4	L495 S496 L497 L502 F503	L495-K499 WeakPolarHBondContact O-CB 3.3Å; L495-K499 PolarHBondContact O-N 3.17Å; S496-K499 PolarHBondContact O-N 2.97Å; L497-K499 VanDerWaalsContact C-N 3.28Å; L497-K499 PolarHBondContact O-N 3.39Å; K499-L502 PolarHBondContact O-N 3.33Å; K499-F503 HydrophobicContact CG-CD2 4.33Å; K499-F503 HydrophobicContact CG-CE2 3.84Å; K499-F503 WeakPolarHBondContact O-CD2 3.2Å
500	Q	86.3	Confident	77.5	Confident	122 Å²	122	107.4 Å²	107.4	57%	0.57	57%	0.57	S	S	*	*	H	α-helix	trans	-64.8	-45.5	176.4	-71.7	165.6	-7.2	0	0	112	S496 L497 L502 F503	S496-Q500 WeakPolarHBondContact O-CG 3.47Å; S496-Q500 PolarHBondContact O-N 3.2Å; L497-Q500 WeakPolarHBondContact O-CB 3.15Å; L497-Q500 PolarHBondContact O-N 3.28Å; L497-Q500 VanDerWaalsContact O-N 3.12Å; Q500-L502 PolarHBondContact O-N 3.17Å; Q500-F503 PolarHBondContact O-N 3.36Å
501	S	81.8	Confident	75.5	Confident	69 Å²	69	115 Å²	115	48%	0.483	60%	0.603	S	S	.	*	H	α-helix	trans	-64.1	-26.1	177.2	55.5	0	0	0	0	113.6	L497 R498 F503 Q504	L497-S501 PolarHBondContact O-N 3.02Å; L497-S501 PolarHBondContact O-OG 3.12Å; R498-S501 WeakPolarHBondContact CA-OG 3.5Å; R498-S501 PolarHBondContact O-OG 3.22Å; S501-F503 VanDerWaalsContact C-N 3.26Å; S501-F503 PolarHBondContact O-N 2.96Å; S501-Q504 PolarHBondContact O-N 2.97Å
502	L	78.4	Confident	73.5	Confident	140 Å²	140	120 Å²	120	73%	0.733	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-6.6	174.7	-74.2	167.8	0	0	0	114	R498 K499 Q500	R498-L502 WeakPolarHBondContact O-CD1 3.48Å; R498-L502 VanDerWaalsContact O-CG 3.3Å; R498-L502 WeakPolarHBondContact O-CG 3.41Å; R498-L502 PolarHBondContact O-N 3.01Å; K499-L502 PolarHBondContact O-N 3.33Å; Q500-L502 PolarHBondContact O-N 3.17Å
503	F	69.9	Low	72.4	Confident	166 Å²	166	125 Å²	125	73%	0.728	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	7.9	171.2	-67.8	-63.9	0	0	0	112.8	K499 Q500 S501	K499-F503 HydrophobicContact CG-CD2 4.33Å; K499-F503 HydrophobicContact CG-CE2 3.84Å; K499-F503 WeakPolarHBondContact O-CD2 3.2Å; Q500-F503 PolarHBondContact O-N 3.36Å; S501-F503 VanDerWaalsContact C-N 3.26Å; S501-F503 PolarHBondContact O-N 2.96Å
504	Q	60.8	Low	71.3	Confident	158 Å²	158	129.2 Å²	129.2	74%	0.738	70%	0.698	S	S	*	*			trans	-109.1	80.7	170.9	-69.9	-176.7	-43.8	0	0	109.1	S501	S501-Q504 PolarHBondContact O-N 2.97Å
505	E	52.9	Low	70	Confident	170 Å²	170	130 Å²	130	79%	0.794	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-56.9	153.5	162.1	-76.9	-77.7	116.8	0	0	110.1
506	P	53.7	Low	68.8	Low	110 Å²	110	132.5 Å²	132.5	71%	0.714	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-57.5	139.9	175.8	-22.2	33.6	0	0	0	111.9
507	G	56.7	Low	67.3	Low	59 Å²	59	136.9 Å²	136.9	61%	0.608	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-62.4	150	162.5	0	0	0	0	0	109.9	D509	G507-D509 PolarHBondContact O-N 2.9Å
508	P	55.6	Low	65.7	Low	121 Å²	121	138.5 Å²	138.5	79%	0.786	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-59.6	137.7	-175.3	25.6	-34.9	0	0	0	111.4	V510	P508-V510 PolarHBondContact O-N 2.79Å
509	D	53.8	Low	63.9	Low	155 Å²	155	136.1 Å²	136.1	83%	0.829	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-56.6	127.1	179.7	-66.9	-67.7	0	0	0	111.5	G507 E511	G507-D509 PolarHBondContact O-N 2.9Å; D509-E511 PolarHBondContact O-N 3.42Å
510	V	53	Low	62	Low	139 Å²	139	135.8 Å²	135.8	84%	0.842	78%	0.777	S	S	*	*			trans	-99.2	76.2	170.1	-174.6	0	0	0	0	107.7	P508	P508-V510 PolarHBondContact O-N 2.79Å
511	E	51.2	Low	59.9	Low	188 Å²	188	137 Å²	137	88%	0.879	79%	0.794	S	S	*	*			trans	-71.4	144.6	158.6	-67.9	-164.8	133.6	0	0	109.4	D509	D509-E511 PolarHBondContact O-N 3.42Å
512	A	51.6	Low	58	Low	169 Å²	169	143.2 Å²	143.2	100%	1.397	82%	0.823	S	S	*	*			trans	-142.5	0	-170.4	0	0	0	0	0	111.6

Retrieved 512 of 512 residues in 2994.7 ms (Link to these results)

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