A0A087X9R9_POEFO Loading...

Lactamase, beta

AlphaFold DB , UniProt , Accession A0A087X9R9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 534 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	31.4	Very low	26.5	Very low	245 Å²	245	199.4 Å²	199.4	100%	1.207	89%	0.885	S	S	*	*				0	101.4	0	-94.2	-179.4	-178.3	0	0	108.2
2	F	21.8	Very low	26.8	Very low	209 Å²	209	191.3 Å²	191.3	92%	0.917	88%	0.882	S	S	*	*			trans	-72.2	137.1	171.7	-93.4	-101.1	0	0	0	109.7
3	R	26.4	Very low	26.8	Very low	230 Å²	230	192.2 Å²	192.2	87%	0.868	88%	0.882	S	S	*	*			trans	-129.2	109.1	160.2	-100.5	-172.9	172.1	-175.1	-2	109.3
4	M	26.9	Very low	26.8	Very low	160 Å²	160	188 Å²	188	79%	0.788	88%	0.884	S	S	*	*			trans	-58.2	139.5	163.7	-72.3	164.9	73.5	0	0	110	L6	M4-L6 HydrophobicContact CE-CD1 4.49Å
5	F	27.8	Very low	26.8	Very low	197 Å²	197	183.6 Å²	183.6	86%	0.864	88%	0.882	S	S	*	*			trans	-115	115.3	158.5	-95.4	-83.6	0	0	0	109.3
6	L	25.1	Very low	27.1	Very low	150 Å²	150	179.8 Å²	179.8	79%	0.785	88%	0.876	S	S	*	*			trans	-82.7	135.4	169.6	-94.9	143.9	0	0	0	109.6	M4	M4-L6 HydrophobicContact CE-CD1 4.49Å
7	Y	25.8	Very low	27.1	Very low	224 Å²	224	179.1 Å²	179.1	88%	0.878	88%	0.876	S	S	*	*			trans	-60.2	133.2	170	-106.7	-102	0	0	0	111.6
8	R	26.1	Very low	27.6	Very low	218 Å²	218	175.6 Å²	175.6	82%	0.823	87%	0.869	S	S	*	*			trans	-122.3	118.5	157.9	-89.9	-167.4	174.4	-155.2	-0.5	110.4
9	R	28.1	Very low	27.8	Very low	242 Å²	242	171.2 Å²	171.2	91%	0.913	86%	0.864	S	S	*	*			trans	-58.1	135.6	160.7	-78.2	174.1	165.1	174.6	-5	109.6
10	F	27.6	Very low	28	Very low	191 Å²	191	169.2 Å²	169.2	84%	0.838	86%	0.863	S	S	*	*			trans	-130.7	128.5	154.1	-94.9	-81.5	0	0	0	109.8
11	C	24.6	Very low	28	Very low	127 Å²	127	172.3 Å²	172.3	86%	0.858	86%	0.864	S	S	*	*			trans	-111.6	126.6	172.3	-165.8	0	0	0	0	105.9
12	A	29.6	Very low	27.7	Very low	102 Å²	102	165.2 Å²	165.2	84%	0.843	84%	0.839	S	S	*	*			trans	-175.9	129.5	148	0	0	0	0	0	110.6
13	K	27.6	Very low	27.9	Very low	203 Å²	203	162.3 Å²	162.3	88%	0.883	83%	0.832	S	S	*	*			trans	-72.6	139.9	167.1	-68.4	170.8	173.6	176.9	0	109.9
14	C	26.7	Very low	27.9	Very low	134 Å²	134	158.4 Å²	158.4	91%	0.905	83%	0.827	S	S	*	*			trans	-161.4	129.6	141.7	-98.2	0	0	0	0	109.9
15	S	26.6	Very low	27.8	Very low	122 Å²	122	158.7 Å²	158.7	85%	0.853	83%	0.832	S	S	*	*			trans	-75.6	152.9	-179.7	-46.1	0	0	0	0	112.3
16	P	31	Very low	27.7	Very low	122 Å²	122	155.5 Å²	155.5	79%	0.792	83%	0.828	S	S	*	*			trans	-106.8	147.5	165.7	36.1	-25.7	0	0	0	112.5
17	L	26.9	Very low	28	Very low	169 Å²	169	154.3 Å²	154.3	89%	0.885	83%	0.83	S	S	*	*			trans	-135.5	159.5	165.3	-98	169.8	0	0	0	107.6
18	P	37	Very low	28.1	Very low	115 Å²	115	152.8 Å²	152.8	75%	0.747	83%	0.831	S	S	*	*				-112.3	172.2	-108.5	38.7	-30.4	0	0	0	114.8
19	A	31.2	Very low	28	Very low	92 Å²	92	147.5 Å²	147.5	76%	0.76	83%	0.833	S	S	*	*			trans	-60.9	167.5	177.4	0	0	0	0	0	115
20	P	32.9	Very low	27.9	Very low	131 Å²	131	145.7 Å²	145.7	85%	0.851	83%	0.832	S	S	*	*			trans	-125.7	164.7	139.9	31.5	-16.6	0	0	0	115.1
21	R	27	Very low	27.6	Very low	235 Å²	235	142.1 Å²	142.1	89%	0.887	83%	0.829	S	S	*	*			trans	-71.1	150.4	-161	-77.2	167.5	167.9	179.7	-3.7	118.3
22	S	25.6	Very low	27.6	Very low	97 Å²	97	141.7 Å²	141.7	68%	0.678	82%	0.823	S	S	*	*				72.2	123.7	128.2	73.7	0	0	0	0	122
23	L	25.5	Very low	27.4	Very low	147 Å²	147	146.9 Å²	146.9	77%	0.77	83%	0.827	S	S	*	*				169.6	135.9	96.1	-99.9	151.3	0	0	0	112.3
24	L	25.7	Very low	27.3	Very low	148 Å²	148	144 Å²	144	78%	0.775	82%	0.819	S	S	*	*			trans	17.8	128.7	151.7	-68.6	162.9	0	0	0	121.2
25	L	25.1	Very low	27.2	Very low	167 Å²	167	148.2 Å²	148.2	87%	0.874	82%	0.816	S	S	*	*				166.9	126.6	117.8	-91.9	147.5	0	0	0	111.2
26	T	26.3	Very low	27.1	Very low	129 Å²	129	148.8 Å²	148.8	79%	0.791	82%	0.815	S	S	*	*			trans	-88.6	149.7	157	46	0	0	0	0	108.5
27	P	32	Very low	26.9	Very low	126 Å²	126	150.3 Å²	150.3	82%	0.818	81%	0.811	S	S	*	*				-148.2	175.7	90.9	33.8	-12.5	0	0	0	115.7
28	Q	26.3	Very low	26.8	Very low	192 Å²	192	148 Å²	148	90%	0.897	80%	0.804	S	S	*	*			trans	-50.3	146	-176.7	-63.7	166.8	-31.7	0	0	116.8
29	A	25.7	Very low	26.3	Very low	106 Å²	106	153.3 Å²	153.3	88%	0.876	81%	0.81	S	S	*	*			trans	-166.9	146.3	136.3	0	0	0	0	0	112.8
30	K	24.4	Very low	25.9	Very low	204 Å²	204	158.1 Å²	158.1	89%	0.887	81%	0.813	S	S	*	*			trans	-72.2	147.2	179.6	-64.8	165.8	173.5	173.4	0	112.8
31	C	23.1	Very low	25.4	Very low	116 Å²	116	161.4 Å²	161.4	78%	0.784	82%	0.815	S	S	*	*			trans	-169.2	104.3	146.8	-126.4	0	0	0	0	109.2
32	V	24.5	Very low	25.3	Very low	119 Å²	119	156.9 Å²	156.9	72%	0.721	81%	0.813	S	S	*	*				45.2	104.6	95.7	-173.2	0	0	0	0	113.1	I34	V32-I34 HydrophobicContact CG1-CG1 4.28Å
33	F	24.4	Very low	25.2	Very low	211 Å²	211	155.8 Å²	155.8	93%	0.925	82%	0.817	S	S	*	*			trans	-117.7	116.4	163.7	-113.2	-87.3	0	0	0	109.8
34	I	25.8	Very low	25.2	Very low	141 Å²	141	152.8 Å²	152.8	72%	0.723	82%	0.822	S	S	*	*			trans	-80.4	138.2	177.7	-72.3	169	0	0	0	109.4	V32	V32-I34 HydrophobicContact CG1-CG1 4.28Å
35	R	23.6	Very low	25.2	Very low	223 Å²	223	152.8 Å²	152.8	84%	0.842	82%	0.821	S	S	*	*			trans	-90.6	113.5	178.6	-165	-179	-171.1	-178.4	3.5	108.4
36	T	25.3	Very low	25.2	Very low	135 Å²	135	155.2 Å²	155.2	83%	0.828	83%	0.825	S	S	*	*			trans	-89.4	110.2	172.1	16	0	0	0	0	110.2
37	Q	26.9	Very low	25.1	Very low	153 Å²	153	155.2 Å²	155.2	72%	0.715	82%	0.82	S	S	*	*			trans	-90.9	135.8	160.4	-76.9	-176.5	-8.8	0	0	108.5
38	T	25.1	Very low	24.7	Very low	120 Å²	120	157.3 Å²	157.3	74%	0.736	82%	0.816	S	S	*	*			trans	-114.4	109.1	168	-27.9	0	0	0	0	108.5	F40	T38-F40 HydrophobicContact CG2-CD2 4.14Å; T38-F40 HydrophobicContact CG2-CE2 3.92Å
39	R	25.4	Very low	24.6	Very low	228 Å²	228	156.4 Å²	156.4	86%	0.86	81%	0.81	S	S	*	*			trans	-91.1	142.8	161.8	-82.4	-179.7	170.5	171.6	-2.7	108.1
40	F	22.7	Very low	24.6	Very low	192 Å²	192	162.8 Å²	162.8	84%	0.842	81%	0.811	S	S	*	*			trans	-127.7	130.5	160.8	-94.1	-83.5	0	0	0	109.3	T38	T38-F40 HydrophobicContact CG2-CD2 4.14Å; T38-F40 HydrophobicContact CG2-CE2 3.92Å
41	F	23.1	Very low	24.6	Very low	200 Å²	200	165.3 Å²	165.3	88%	0.877	82%	0.815	S	S	*	*			trans	-148	163.4	164.4	-131.5	-86.2	0	0	0	109.5
42	V	25.3	Very low	24.9	Very low	141 Å²	141	167.3 Å²	167.3	86%	0.855	82%	0.817	S	S	*	*			trans	85.8	126.3	-179.9	-163.5	0	0	0	0	112.4
43	G	24.1	Very low	25.1	Very low	74 Å²	74	171.2 Å²	171.2	76%	0.763	82%	0.824	S	S	*	*			cis	141	131.9	12.2	0	0	0	0	0	107.6
44	G	23.8	Very low	25.3	Very low	84 Å²	84	166 Å²	166	87%	0.866	81%	0.814	S	S	*	*			trans	174.8	116.5	177.4	0	0	0	0	0	113.9
45	I	26.8	Very low	25.8	Very low	148 Å²	148	170.4 Å²	170.4	76%	0.759	82%	0.821	S	S	*	*			trans	-91.1	141.8	-173.5	-67.8	161	0	0	0	110.4
46	F	24.1	Very low	26.1	Very low	217 Å²	217	166.8 Å²	166.8	95%	0.952	82%	0.824	S	S	*	*			trans	-141.9	138.1	143.9	-110.2	-85.2	0	0	0	111
47	N	25.2	Very low	26.3	Very low	130 Å²	130	170 Å²	170	70%	0.695	82%	0.821	S	S	*	*			trans	-104.7	147.8	-170.6	-123.3	-33.4	0	0	0	109.1
48	F	23.4	Very low	26.3	Very low	169 Å²	169	171 Å²	171	74%	0.741	83%	0.831	S	S	*	*				146.3	142.1	112.7	-135.1	-111.7	0	0	0	115.7
49	K	24.6	Very low	26.6	Very low	174 Å²	174	174.5 Å²	174.5	76%	0.757	83%	0.832	S	S	*	*			trans	90	87.4	154.7	-96.6	161.3	-163.6	-179.3	0	121.9
50	R	25.6	Very low	26.8	Very low	239 Å²	239	167.1 Å²	167.1	90%	0.902	83%	0.827	S	S	*	*				12.2	133.7	120.3	-86.3	179	167.7	175.7	-3	118.8
51	R	24.6	Very low	27.7	Very low	258 Å²	258	165.7 Å²	165.7	97%	0.974	83%	0.834	S	S	*	*				-156.8	147	107.5	-117.8	-179.8	-175.6	-178.1	2	112.7
52	L	29.4	Very low	28	Very low	158 Å²	158	159.4 Å²	159.4	83%	0.827	83%	0.825	S	S	*	*			trans	-122.3	150.7	-168.9	-170.1	100.9	0	0	0	107.9
53	K	27.7	Very low	28.8	Very low	201 Å²	201	158 Å²	158	87%	0.874	83%	0.829	S	S	*	*			trans	150.1	144.6	146.5	-88.3	176.5	179.3	-172.1	0	109
54	S	29.9	Very low	29	Very low	101 Å²	101	157.6 Å²	157.6	71%	0.706	82%	0.824	S	S	*	*			cis	-174	128.7	3.5	160.6	0	0	0	0	109.2
55	R	34.7	Very low	29.7	Very low	233 Å²	233	161.2 Å²	161.2	88%	0.879	82%	0.822	S	S	*	*				29.8	125.8	129.5	-115.9	173.9	163.4	178.2	-5.1	121.1
56	T	29.7	Very low	30	Very low	147 Å²	147	160.8 Å²	160.8	90%	0.902	83%	0.826	S	S	*	*				-151.8	142.4	126.6	39.6	0	0	0	0	110.5
57	W	30	Very low	30.3	Very low	203 Å²	203	157.3 Å²	157.3	77%	0.769	82%	0.817	S	S	*	*			trans	-106.3	138.9	178.2	-127.8	57.5	0	0	0	108	Y59	W57-Y59 HydrophobicContact CE3-CD2 4.21Å; W57-Y59 HydrophobicContact CE3-CE2 4.05Å; W57-Y59 AromaticContact CH2-CE2 3.88Å; W57-Y59 HydrophobicContact CH2-CE2 3.88Å; W57-Y59 AromaticContact CH2-CZ 3.98Å; W57-Y59 AromaticContact CZ3-CD2 3.84Å; W57-Y59 HydrophobicContact CZ3-CD2 3.84Å; W57-Y59 AromaticContact CZ3-CE2 3.23Å; W57-Y59 HydrophobicContact CZ3-CE2 3.23Å; W57-Y59 AromaticContact CZ3-CZ 3.83Å
58	L	27.4	Very low	30.7	Very low	174 Å²	174	155.9 Å²	155.9	91%	0.911	82%	0.823	S	S	*	*			trans	-150	125	160.3	-127.1	107.3	0	0	0	110.2
59	Y	31.6	Very low	31.1	Very low	193 Å²	193	153.7 Å²	153.7	76%	0.757	82%	0.823	S	S	*	*			trans	-65.4	141.3	164.1	-85	-82.4	0	0	0	109.8	W57	W57-Y59 HydrophobicContact CE3-CD2 4.21Å; W57-Y59 HydrophobicContact CE3-CE2 4.05Å; W57-Y59 AromaticContact CH2-CE2 3.88Å; W57-Y59 HydrophobicContact CH2-CE2 3.88Å; W57-Y59 AromaticContact CH2-CZ 3.98Å; W57-Y59 AromaticContact CZ3-CD2 3.84Å; W57-Y59 HydrophobicContact CZ3-CD2 3.84Å; W57-Y59 AromaticContact CZ3-CE2 3.23Å; W57-Y59 HydrophobicContact CZ3-CE2 3.23Å; W57-Y59 AromaticContact CZ3-CZ 3.83Å
60	G	28.5	Very low	31.3	Very low	74 Å²	74	148.9 Å²	148.9	76%	0.763	82%	0.823	S	S	*	*			trans	-165.5	101.4	170.1	0	0	0	0	0	111.4	G62	G60-G62 PolarHBondContact O-N 3.24Å
61	V	41.8	Very low	31.5	Very low	161 Å²	161	145.6 Å²	145.6	98%	0.976	82%	0.822	S	S	*	*			trans	-70.9	117	160	173.5	0	0	0	0	106.3
62	G	29.2	Very low	31.5	Very low	68 Å²	68	141.9 Å²	141.9	70%	0.701	81%	0.813	S	S	*	*			trans	-145.3	110.9	179.1	0	0	0	0	0	110.4	G60 G64	G60-G62 PolarHBondContact O-N 3.24Å; G62-G64 PolarHBondContact O-N 3.37Å
63	A	43.3	Very low	31.4	Very low	113 Å²	113	142 Å²	142	93%	0.934	81%	0.814	S	S	*	*			trans	-60.1	114.6	168.6	0	0	0	0	0	109.1
64	G	28.6	Very low	31.3	Very low	65 Å²	65	142.1 Å²	142.1	67%	0.67	81%	0.809	S	S	*	*			trans	-115.8	102.6	-179.5	0	0	0	0	0	110.8	G62 V66	G62-G64 PolarHBondContact O-N 3.37Å; G64-V66 PolarHBondContact O-N 3.19Å
65	I	37.3	Very low	31.2	Very low	160 Å²	160	142.7 Å²	142.7	82%	0.821	81%	0.813	S	S	*	*			trans	-55.8	115.8	163.6	-67.5	165.1	0	0	0	107.8	L67	I65-L67 PolarHBondContact O-N 3.01Å
66	V	33.7	Very low	30.9	Very low	138 Å²	138	138.8 Å²	138.8	84%	0.836	81%	0.81	S	S	*	*			trans	-88.9	101.5	171.5	177.9	0	0	0	0	108.4	G64 A68	G64-V66 PolarHBondContact O-N 3.19Å; V66-A68 PolarHBondContact O-N 3.37Å
67	L	29.8	Very low	30.8	Very low	145 Å²	145	136.9 Å²	136.9	76%	0.759	80%	0.803	S	S	*	*			trans	-69.7	113.9	165.5	-111.8	134	0	0	0	108.8	I65 V69	I65-L67 PolarHBondContact O-N 3.01Å; L67-V69 PolarHBondContact O-N 3.16Å
68	A	33.5	Very low	30.8	Very low	100 Å²	100	131.9 Å²	131.9	83%	0.826	81%	0.805	S	S	*	*			trans	-75.2	103.7	169.6	0	0	0	0	0	109.6	V66 G70	V66-A68 PolarHBondContact O-N 3.37Å; A68-G70 PolarHBondContact O-N 2.71Å
69	V	32.2	Very low	31	Very low	123 Å²	123	131.3 Å²	131.3	75%	0.745	80%	0.802	S	S	*	*			trans	-84	107.5	166.8	176.3	0	0	0	0	107.7	L67 L71	L67-V69 PolarHBondContact O-N 3.16Å; V69-L71 PolarHBondContact O-N 3.48Å
70	G	27.8	Very low	31	Very low	72 Å²	72	127.5 Å²	127.5	74%	0.742	80%	0.804	S	S	*	*			trans	-74.7	113.8	171.9	0	0	0	0	0	110.7	A68 K72	A68-G70 PolarHBondContact O-N 2.71Å; G70-K72 PolarHBondContact O-N 3.35Å
71	L	29.8	Very low	31.3	Very low	170 Å²	170	128.9 Å²	128.9	89%	0.89	80%	0.802	S	S	*	*			trans	-78.8	103.2	164.4	-78.5	165.1	0	0	0	108.2	V69 D73	V69-L71 PolarHBondContact O-N 3.48Å; L71-D73 PolarHBondContact O-N 3.31Å
72	K	26	Very low	30.7	Very low	181 Å²	181	126.6 Å²	126.6	79%	0.787	79%	0.792	S	S	*	*			trans	-81.6	96.4	170.2	-174.7	173.4	-174.8	173.1	0	107.6	G70 R74	G70-K72 PolarHBondContact O-N 3.35Å; K72-R74 PolarHBondContact O-N 2.93Å
73	D	25.9	Very low	31.3	Very low	159 Å²	159	130.8 Å²	130.8	85%	0.85	80%	0.798	S	S	*	*			trans	-74.1	118.8	171.9	-151.2	-6.6	0	0	0	108.8	L71	L71-D73 PolarHBondContact O-N 3.31Å
74	R	25.9	Very low	31	Very low	205 Å²	205	132.3 Å²	132.3	77%	0.774	79%	0.79	S	S	*	*			trans	-105.3	98.4	179.4	-119.9	-175.4	176.4	174.9	-2.8	105.4	K72	K72-R74 PolarHBondContact O-N 2.93Å
75	S	28.6	Very low	31.5	Very low	112 Å²	112	138.7 Å²	138.7	78%	0.783	80%	0.8	S	S	*	*			trans	-100.7	113.5	164.4	64.5	0	0	0	0	108.4
76	D	27.3	Very low	31.4	Very low	152 Å²	152	136.9 Å²	136.9	81%	0.813	80%	0.796	S	S	*	*			trans	-61.2	138.6	-178	-73.6	-43.1	0	0	0	112.8	A78	D76-A78 PolarHBondContact O-N 2.97Å
77	S	27.7	Very low	31.7	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	80%	0.795	S	S	*	*			trans	-68.2	115.1	170.7	53.2	0	0	0	0	111
78	A	30	Very low	32.1	Very low	98 Å²	98	138.4 Å²	138.4	81%	0.81	79%	0.793	S	S	*	*			trans	-93.3	106.6	155	0	0	0	0	0	108.1	D76 S80	D76-A78 PolarHBondContact O-N 2.97Å; A78-S80 PolarHBondContact O-N 2.75Å
79	N	31.8	Very low	32.4	Very low	162 Å²	162	137.2 Å²	137.2	87%	0.866	78%	0.783	S	S	*	*			trans	-61.9	111.1	169.5	-88	-14.4	0	0	0	109.6
80	S	32.2	Very low	33	Very low	112 Å²	112	139.2 Å²	139.2	78%	0.783	79%	0.785	S	S	*	*			trans	-113.6	93.6	155	174.6	0	0	0	0	107.2	A78 C82	A78-S80 PolarHBondContact O-N 2.75Å; S80-C82 PolarHBondContact O-N 3.22Å
81	S	34.9	Very low	34	Very low	104 Å²	104	145.4 Å²	145.4	73%	0.727	79%	0.791	S	S	*	*			trans	-57.4	109.5	168	166.2	0	0	0	0	109.5
82	C	30.2	Very low	35.7	Very low	112 Å²	112	142.7 Å²	142.7	76%	0.757	78%	0.782	S	S	*	*			trans	-152.2	80	147.3	-83.4	0	0	0	0	104.8	S80 D84	S80-C82 PolarHBondContact O-N 3.22Å; C82-D84 PolarHBondContact O-N 2.58Å
83	D	41.1	Very low	38.4	Very low	157 Å²	157	138.2 Å²	138.2	84%	0.84	76%	0.763	S	S	*	*			trans	-62.6	84.5	163.2	-83.8	-47.2	0	0	0	108.3
84	D	36.2	Very low	41.4	Very low	144 Å²	144	135 Å²	135	77%	0.77	75%	0.751	S	S	*	*			trans	-103.4	112.5	153.1	-86.8	-34.4	0	0	0	107.3	C82 V86	C82-D84 PolarHBondContact O-N 2.58Å; D84-V86 PolarHBondContact O-N 2.77Å
85	K	39.5	Very low	44.8	Very low	200 Å²	200	126.7 Å²	126.7	87%	0.87	72%	0.72	S	S	*	*			trans	-51.9	88.2	170.3	-66.9	173.1	177	178.1	0	109.4	E87	K85-E87 PolarHBondContact O-N 3.43Å
86	V	36	Very low	48	Very low	121 Å²	121	123.7 Å²	123.7	73%	0.733	70%	0.697	S	S	*	*			trans	-74.4	87.9	155.6	-175.8	0	0	0	0	104.8	D84 I88	D84-V86 PolarHBondContact O-N 2.77Å; V86-I88 HydrophobicContact CG1-CG1 3.97Å; V86-I88 PolarHBondContact O-N 2.8Å
87	E	38.5	Very low	51.2	Low	174 Å²	174	123 Å²	123	81%	0.813	69%	0.689	S	S	*	*			trans	-52.1	94.9	152.2	-84.6	-177.2	159	0	0	106.3	K85 A89	K85-E87 PolarHBondContact O-N 3.43Å; E87-A89 PolarHBondContact O-N 3.22Å
88	I	39.7	Very low	54.6	Low	141 Å²	141	118 Å²	118	72%	0.723	66%	0.655	S	S	*	*			trans	-69.2	78.8	155.5	-56.4	176.9	0	0	0	103.8	V86 Q90	V86-I88 HydrophobicContact CG1-CG1 3.97Å; V86-I88 PolarHBondContact O-N 2.8Å; I88-Q90 HydrophobicContact CG2-CG 4.31Å; I88-Q90 PolarHBondContact O-N 3.12Å
89	A	39.8	Very low	57.8	Low	75 Å²	75	114.4 Å²	114.4	62%	0.62	62%	0.621	S	S	*	*			trans	-61.2	86	158	0	0	0	0	0	105.4	E87 K91	E87-A89 PolarHBondContact O-N 3.22Å; A89-K91 PolarHBondContact O-N 3.41Å
90	Q	44.6	Very low	61	Low	166 Å²	166	112.1 Å²	112.1	78%	0.776	61%	0.605	S	S	*	*			trans	-52.3	101.6	152.8	-81.3	-177.8	-27.5	0	0	103.9	I88 T92	I88-Q90 HydrophobicContact CG2-CG 4.31Å; I88-Q90 PolarHBondContact O-N 3.12Å; Q90-T92 PolarHBondContact O-N 2.92Å
91	K	48.2	Very low	64.1	Low	202 Å²	202	109.8 Å²	109.8	88%	0.878	59%	0.586	S	S	*	*			trans	-57.1	98.7	168.7	-82.9	-177	175.6	-179.5	0	105.1	A89 H93	A89-K91 PolarHBondContact O-N 3.41Å; K91-H93 PolarHBondContact O-N 2.92Å
92	T	66.6	Low	67.1	Low	113 Å²	113	104.9 Å²	104.9	69%	0.693	55%	0.552	S	S	*	*			trans	-53	130.4	172.1	36.3	0	0	0	0	106.3	Q90	Q90-T92 PolarHBondContact O-N 2.92Å
93	H	80.7	Confident	70.4	Confident	86 Å²	86	103.4 Å²	103.4	40%	0.398	53%	0.531	S	S	.	.			trans	-54.2	133.8	180	-173.1	-96.4	0	0	0	108	K91 Y95 T96 V129	K91-H93 PolarHBondContact O-N 2.92Å; H93-Y95 AromaticContact CE1-CD2 3.53Å; H93-Y95 AromaticContact ND1-CD2 3.83Å; H93-Y95 PolarHBondContact O-N 3.42Å; H93-T96 PolarHBondContact N-OG1 2.95Å; H93-T96 WeakPolarHBondContact O-CB 3.45Å; H93-T96 PolarHBondContact O-N 3.38Å; H93-T96 PolarHBondContact O-OG1 2.9Å; H93-V129 PolarHBondContact CE1-O 3.02Å
94	P	90.3	Very high	73.1	Confident	92 Å²	92	99.7 Å²	99.7	60%	0.597	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-20.3	-170.8	20.1	-31.9	0	0	0	113.3
95	Y	96.2	Very high	76	Confident	30 Å²	30	94.6 Å²	94.6	12%	0.118	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	13.3	178.5	-54.5	-77.6	0	0	0	114.7	H93 E97 A98 I99 V124 V129 F528 A531 R532	H93-Y95 AromaticContact CE1-CD2 3.53Å; H93-Y95 AromaticContact ND1-CD2 3.83Å; H93-Y95 PolarHBondContact O-N 3.42Å; Y95-E97 PolarHBondContact O-N 3.06Å; Y95-A98 PolarHBondContact O-N 3.43Å; Y95-I99 WeakPolarHBondContact O-CB 3.24Å; Y95-I99 VanDerWaalsContact O-CG1 3.24Å; Y95-I99 WeakPolarHBondContact O-CG1 3.24Å; Y95-I99 PolarHBondContact O-N 3.47Å; Y95-V124 HydrophobicContact CE1-CB 4.43Å; Y95-V124 HydrophobicContact CE1-CG1 4.29Å; Y95-V124 HydrophobicContact CE1-CG2 4.02Å; Y95-V124 VanDerWaalsContact OH-CG1 3.3Å; Y95-V124 WeakPolarHBondContact OH-CG1 3.35Å; Y95-V129 HydrophobicContact CD2-CB 3.83Å; Y95-V129 HydrophobicContact CD2-CG1 3.88Å; Y95-V129 HydrophobicContact CD2-CG2 4.22Å; Y95-V129 HydrophobicContact CE2-CB 4.09Å; Y95-V129 HydrophobicContact CE2-CG1 3.62Å; Y95-V129 HydrophobicContact CE2-CG2 4.46Å; Y95-V129 HydrophobicContact CG-CB 4.47Å; Y95-V129 HydrophobicContact CG-CG2 4.44Å; Y95-F528 AromaticContact CD1-CD1 3.67Å; Y95-F528 HydrophobicContact CD1-CD1 3.67Å; Y95-F528 HydrophobicContact CD1-CE1 4.27Å; Y95-F528 HydrophobicContact CE1-CD1 4.41Å; Y95-F528 AromaticContact CG-CD1 3.97Å; Y95-F528 HydrophobicContact CG-CD1 3.97Å; Y95-F528 HydrophobicContact CG-CE1 4.13Å; Y95-A531 HydrophobicContact CD1-CB 3.67Å; Y95-A531 HydrophobicContact CE1-CB 4.08Å; Y95-R532 HydrophobicContact CE1-CB 4.33Å
96	T	95.9	Very high	78.8	Confident	49 Å²	49	85.1 Å²	85.1	30%	0.301	44%	0.442	S	S	.	.	H	α-helix	trans	-55.6	-51	-174.4	-58.1	0	0	0	0	112.3	H93 A98 I99 E100	H93-T96 PolarHBondContact N-OG1 2.95Å; H93-T96 WeakPolarHBondContact O-CB 3.45Å; H93-T96 PolarHBondContact O-N 3.38Å; H93-T96 PolarHBondContact O-OG1 2.9Å; T96-A98 PolarHBondContact O-N 3.47Å; T96-I99 WeakPolarHBondContact O-CB 3.27Å; T96-I99 PolarHBondContact O-N 3.01Å; T96-E100 WeakPolarHBondContact O-CG 3.37Å; T96-E100 PolarHBondContact O-N 3Å
97	E	95.9	Very high	81.8	Confident	137 Å²	137	83 Å²	83	64%	0.64	42%	0.424	S	S	*	.	H	α-helix	trans	-62.8	-42.4	178.5	-172	-173.5	171.4	0	0	111.7	Y95 I99 E100 V101	Y95-E97 PolarHBondContact O-N 3.06Å; E97-I99 VanDerWaalsContact C-N 3.3Å; E97-I99 PolarHBondContact O-N 2.87Å; E97-E100 PolarHBondContact O-N 3.2Å; E97-V101 WeakPolarHBondContact O-CG2 3.39Å; E97-V101 PolarHBondContact O-N 2.94Å
98	A	97.9	Very high	84.5	Confident	4 Å²	4	82.3 Å²	82.3	3%	0.033	41%	0.414	C	S	.	.	H	α-helix	trans	-62.3	-38.2	177.7	0	0	0	0	0	112.1	Y95 T96 S102 Q527 F528 A531	Y95-A98 PolarHBondContact O-N 3.43Å; T96-A98 PolarHBondContact O-N 3.47Å; A98-S102 WeakPolarHBondContact O-CB 3.18Å; A98-S102 PolarHBondContact O-N 3.11Å; A98-S102 PolarHBondContact O-OG 2.86Å; A98-Q527 HydrophobicContact CB-CB 4.09Å; A98-F528 HydrophobicContact CB-CD1 4.44Å; A98-F528 HydrophobicContact CB-CD2 4.14Å; A98-F528 HydrophobicContact CB-CE2 4.21Å; A98-F528 HydrophobicContact CB-CG 4.27Å; A98-F528 HydrophobicContact CB-CZ 4.4Å; A98-A531 HydrophobicContact CB-CB 4.09Å
99	I	98.3	Very high	87.2	Confident	21 Å²	21	76.3 Å²	76.3	11%	0.108	38%	0.383	C	S	.	.	H	α-helix	trans	-64.8	-47.2	175.1	-71.4	165.5	0	0	0	110.4	Y95 T96 E97 S102 R103 W130 F528	Y95-I99 WeakPolarHBondContact O-CB 3.24Å; Y95-I99 VanDerWaalsContact O-CG1 3.24Å; Y95-I99 WeakPolarHBondContact O-CG1 3.24Å; Y95-I99 PolarHBondContact O-N 3.47Å; T96-I99 WeakPolarHBondContact O-CB 3.27Å; T96-I99 PolarHBondContact O-N 3.01Å; E97-I99 VanDerWaalsContact C-N 3.3Å; E97-I99 PolarHBondContact O-N 2.87Å; I99-S102 PolarHBondContact O-N 2.96Å; I99-R103 VanDerWaalsContact O-CB 3.31Å; I99-R103 WeakPolarHBondContact O-CB 3.37Å; I99-R103 PolarHBondContact O-N 3.02Å; I99-W130 HydrophobicContact CD1-CB 4.1Å; I99-W130 HydrophobicContact CD1-CG 4.2Å; I99-W130 HydrophobicContact CG1-CB 3.94Å; I99-W130 HydrophobicContact CG1-CD2 4.13Å; I99-W130 HydrophobicContact CG1-CG 3.79Å; I99-W130 HydrophobicContact CG2-CD2 4.33Å; I99-W130 HydrophobicContact CG2-CG 4.34Å; I99-W130 HydrophobicContact CG2-CZ2 4.43Å; I99-F528 HydrophobicContact CG1-CE1 4.02Å; I99-F528 HydrophobicContact CG1-CZ 3.61Å
100	E	97.8	Very high	89.9	Confident	115 Å²	115	74.6 Å²	74.6	54%	0.537	36%	0.362	S	S	.	.	H	α-helix	trans	-61.6	-48.5	-179.1	-72.9	176.4	174.9	0	0	112.4	T96 E97 S102 R103 D104	T96-E100 WeakPolarHBondContact O-CG 3.37Å; T96-E100 PolarHBondContact O-N 3Å; E97-E100 PolarHBondContact O-N 3.2Å; E100-S102 VanDerWaalsContact C-N 3.32Å; E100-S102 PolarHBondContact O-N 3.48Å; E100-R103 PolarHBondContact O-N 3.34Å; E100-D104 PolarHBondContact O-N 3.07Å; E100-D104 VanDerWaalsContact O-N 3.08Å
101	V	98	Very high	92.3	Very high	63 Å²	63	70.3 Å²	70.3	38%	0.382	36%	0.355	S	S	.	.	H	α-helix	trans	-61.9	-41.5	176.9	173.7	0	0	0	0	111.2	E97 L105 Q527	E97-V101 WeakPolarHBondContact O-CG2 3.39Å; E97-V101 PolarHBondContact O-N 2.94Å; V101-L105 PolarHBondContact O-N 2.91Å; V101-L105 VanDerWaalsContact O-N 3.16Å; V101-Q527 HydrophobicContact CG1-CG 4.09Å
102	S	98.4	Very high	94.5	Very high	1 Å²	1	68.4 Å²	68.4	1%	0.007	35%	0.349	C	S	.	.	H	α-helix	trans	-69.6	-36.7	-180	-61.2	0	0	0	0	112.2	A98 I99 E100 L105 L106 W130	A98-S102 WeakPolarHBondContact O-CB 3.18Å; A98-S102 PolarHBondContact O-N 3.11Å; A98-S102 PolarHBondContact O-OG 2.86Å; I99-S102 PolarHBondContact O-N 2.96Å; E100-S102 VanDerWaalsContact C-N 3.32Å; E100-S102 PolarHBondContact O-N 3.48Å; S102-L105 PolarHBondContact O-N 3.36Å; S102-L106 WeakPolarHBondContact O-CG 3.36Å; S102-L106 PolarHBondContact O-N 2.84Å; S102-W130 VanDerWaalsContact CB-CZ3 3.43Å
103	R	98.5	Very high	95.8	Very high	81 Å²	81	64.8 Å²	64.8	31%	0.306	33%	0.327	S	S	.	.	H	α-helix	trans	-63.5	-46.6	175.2	-175.5	-175.5	-65.1	111.3	4.7	111.5	I99 E100 L105 L106 E107 W130 E132 I134	I99-R103 VanDerWaalsContact O-CB 3.31Å; I99-R103 WeakPolarHBondContact O-CB 3.37Å; I99-R103 PolarHBondContact O-N 3.02Å; E100-R103 PolarHBondContact O-N 3.34Å; R103-L105 VanDerWaalsContact C-N 3.3Å; R103-L105 PolarHBondContact O-N 2.97Å; R103-L106 PolarHBondContact O-N 3.48Å; R103-L106 VanDerWaalsContact O-N 3.15Å; R103-E107 PolarHBondContact O-N 3.44Å; R103-W130 HydrophobicContact CB-CZ2 4.33Å; R103-E132 IonicContact CZ-OE1 2.83Å; R103-E132 IonicContact CZ-OE2 2.79Å; R103-E132 IonicContact NE-OE1 3.32Å; R103-E132 PolarHBondContact NE-OE1 3.21Å; R103-E132 IonicContact NE-OE2 3.57Å; R103-E132 PolarHBondContact NE-OE2 3.42Å; R103-E132 VanDerWaalsContact NE-OE2 3.09Å; R103-E132 IonicContact NH2-OE1 3.84Å; R103-E132 IonicContact NH2-OE2 2.72Å; R103-E132 PolarHBondContact NH2-OE2 3.36Å; R103-I134 HydrophobicContact CG-CD1 4.22Å
104	D	98.1	Very high	96.5	Very high	78 Å²	78	62 Å²	62	42%	0.417	32%	0.321	S	S	.	.	H	α-helix	trans	-58.9	-42.9	176.3	177.1	59.2	0	0	0	111.5	E100 L106 E107 R108	E100-D104 PolarHBondContact O-N 3.07Å; E100-D104 VanDerWaalsContact O-N 3.08Å; D104-L106 VanDerWaalsContact C-N 3.33Å; D104-L106 PolarHBondContact O-N 3.22Å; D104-E107 PolarHBondContact O-N 2.94Å; D104-R108 VanDerWaalsContact O-CG 3.31Å; D104-R108 WeakPolarHBondContact O-CG 3.49Å; D104-R108 PolarHBondContact O-N 3.18Å; D104-R108 IonicContact OD1-CZ 3.15Å; D104-R108 IonicContact OD1-NE 3.64Å; D104-R108 PolarHBondContact OD1-NE 3.06Å; D104-R108 IonicContact OD1-NH2 2.73Å; D104-R108 IonicContact OD2-CZ 2.78Å; D104-R108 IonicContact OD2-NE 3.9Å; D104-R108 PolarHBondContact OD2-NE 3.2Å; D104-R108 IonicContact OD2-NH2 3.73Å; D104-R108 PolarHBondContact OD2-NH2 3.34Å
105	L	97.5	Very high	96.8	Very high	38 Å²	38	58 Å²	58	20%	0.199	30%	0.296	C	S	.	.	H	α-helix	trans	-59.2	-43.5	175.4	179.2	62.1	0	0	0	112.2	V101 S102 R103 I109 T520 K523 I524	V101-L105 PolarHBondContact O-N 2.91Å; V101-L105 VanDerWaalsContact O-N 3.16Å; S102-L105 PolarHBondContact O-N 3.36Å; R103-L105 VanDerWaalsContact C-N 3.3Å; R103-L105 PolarHBondContact O-N 2.97Å; L105-I109 HydrophobicContact CD1-CD1 4.04Å; L105-I109 HydrophobicContact CG-CD1 4.01Å; L105-I109 WeakPolarHBondContact O-CD1 3.47Å; L105-I109 WeakPolarHBondContact O-CG1 3.39Å; L105-I109 PolarHBondContact O-N 3.44Å; L105-I109 VanDerWaalsContact O-N 3.13Å; L105-T520 HydrophobicContact CD2-CG2 3.85Å; L105-T520 HydrophobicContact CG-CG2 4.03Å; L105-K523 HydrophobicContact CD2-CB 3.87Å; L105-K523 HydrophobicContact CD2-CD 4.03Å; L105-I524 HydrophobicContact CD2-CG1 4.25Å
106	L	98.2	Very high	96.9	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-68	-40.8	178.9	-71.8	172.5	0	0	0	112.6	S102 R103 D104 R108 I109 K110 L118 V120 W130 I134 I508 T520 I524	S102-L106 WeakPolarHBondContact O-CG 3.36Å; S102-L106 PolarHBondContact O-N 2.84Å; R103-L106 PolarHBondContact O-N 3.48Å; R103-L106 VanDerWaalsContact O-N 3.15Å; D104-L106 VanDerWaalsContact C-N 3.33Å; D104-L106 PolarHBondContact O-N 3.22Å; L106-R108 VanDerWaalsContact C-N 3.33Å; L106-R108 PolarHBondContact O-N 2.89Å; L106-I109 PolarHBondContact O-N 3.15Å; L106-K110 VanDerWaalsContact O-CB 3.31Å; L106-K110 WeakPolarHBondContact O-CB 3.45Å; L106-K110 PolarHBondContact O-N 3.11Å; L106-L118 HydrophobicContact CB-CD1 4.28Å; L106-L118 HydrophobicContact CB-CD2 4.36Å; L106-L118 HydrophobicContact CD1-CD1 4.15Å; L106-L118 HydrophobicContact CD2-CD1 4.26Å; L106-L118 HydrophobicContact CD2-CD2 4.45Å; L106-L118 HydrophobicContact CG-CD1 4.48Å; L106-V120 HydrophobicContact CD1-CB 3.71Å; L106-V120 HydrophobicContact CD1-CG1 3.57Å; L106-V120 HydrophobicContact CD1-CG2 3.95Å; L106-W130 HydrophobicContact CD1-CH2 3.58Å; L106-W130 HydrophobicContact CD1-CZ2 4.28Å; L106-W130 HydrophobicContact CD1-CZ3 4.37Å; L106-I134 HydrophobicContact CB-CD1 4Å; L106-I134 HydrophobicContact CD1-CD1 4.21Å; L106-I508 HydrophobicContact CD2-CD1 3.92Å; L106-I508 HydrophobicContact CD2-CG1 4.32Å; L106-I508 HydrophobicContact CD2-CG2 4.11Å; L106-T520 HydrophobicContact CD2-CG2 4.08Å; L106-I524 HydrophobicContact CD1-CD1 4.24Å; L106-I524 HydrophobicContact CD2-CD1 4.08Å; L106-I524 HydrophobicContact CG-CD1 4.08Å
107	E	98.2	Very high	97	Very high	78 Å²	78	54.7 Å²	54.7	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-62.7	-40.8	176.5	-76.5	-73.6	-160.9	0	0	111.7	R103 D104 K110 A111 I134	R103-E107 PolarHBondContact O-N 3.44Å; D104-E107 PolarHBondContact O-N 2.94Å; E107-K110 PolarHBondContact O-N 3.32Å; E107-K110 IonicContact OE2-NZ 2.82Å; E107-K110 PolarHBondContact OE2-NZ 3.31Å; E107-A111 WeakPolarHBondContact O-CB 3.07Å; E107-A111 PolarHBondContact O-N 2.67Å; E107-I134 HydrophobicContact CG-CG2 4.27Å; E107-I134 WeakPolarHBondContact OE1-CG2 3.34Å; E107-I134 WeakPolarHBondContact OE2-CG2 3.43Å
108	R	96.8	Very high	97.1	Very high	158 Å²	158	48.3 Å²	48.3	60%	0.596	25%	0.249	S	C	*	.	H	α-helix	trans	-60.7	-46.6	174.2	-70.2	174.7	-166.1	-137.7	9.1	111.9	D104 L106 A111 E112	D104-R108 VanDerWaalsContact O-CG 3.31Å; D104-R108 WeakPolarHBondContact O-CG 3.49Å; D104-R108 PolarHBondContact O-N 3.18Å; D104-R108 IonicContact OD1-CZ 3.15Å; D104-R108 IonicContact OD1-NE 3.64Å; D104-R108 PolarHBondContact OD1-NE 3.06Å; D104-R108 IonicContact OD1-NH2 2.73Å; D104-R108 IonicContact OD2-CZ 2.78Å; D104-R108 IonicContact OD2-NE 3.9Å; D104-R108 PolarHBondContact OD2-NE 3.2Å; D104-R108 IonicContact OD2-NH2 3.73Å; D104-R108 PolarHBondContact OD2-NH2 3.34Å; L106-R108 VanDerWaalsContact C-N 3.33Å; L106-R108 PolarHBondContact O-N 2.89Å; R108-A111 PolarHBondContact O-N 3.42Å; R108-E112 VanDerWaalsContact O-CB 3.31Å; R108-E112 WeakPolarHBondContact O-CB 3.26Å; R108-E112 PolarHBondContact O-N 3.45Å
109	I	95.6	Very high	97.2	Very high	15 Å²	15	48.1 Å²	48.1	8%	0.077	25%	0.248	C	C	.	.	H	α-helix	trans	-65.2	-43.8	179.2	-69.7	158.9	0	0	0	110.7	L105 L106 A111 E112 V113 V515 L517 T520	L105-I109 HydrophobicContact CD1-CD1 4.04Å; L105-I109 HydrophobicContact CG-CD1 4.01Å; L105-I109 WeakPolarHBondContact O-CD1 3.47Å; L105-I109 WeakPolarHBondContact O-CG1 3.39Å; L105-I109 PolarHBondContact O-N 3.44Å; L105-I109 VanDerWaalsContact O-N 3.13Å; L106-I109 PolarHBondContact O-N 3.15Å; I109-A111 VanDerWaalsContact C-N 3.28Å; I109-A111 PolarHBondContact O-N 3.42Å; I109-E112 PolarHBondContact O-N 3.45Å; I109-V113 HydrophobicContact CG2-CG1 4.44Å; I109-V113 VanDerWaalsContact O-CG2 3.26Å; I109-V113 WeakPolarHBondContact O-CG2 3.3Å; I109-V113 PolarHBondContact O-N 3.43Å; I109-V515 HydrophobicContact CG2-CG1 4.34Å; I109-L517 HydrophobicContact CG2-CD2 4.48Å; I109-T520 HydrophobicContact CD1-CG2 3.16Å; I109-T520 WeakPolarHBondContact CD1-OG1 3.42Å
110	K	96.4	Very high	97.2	Very high	40 Å²	40	47.1 Å²	47.1	17%	0.174	24%	0.242	C	C	.	.	H	α-helix	trans	-54.9	-46.9	176.3	-174.6	171.1	127.5	-78.9	0	110.9	L106 E107 G114 A115 L118 I134	L106-K110 VanDerWaalsContact O-CB 3.31Å; L106-K110 WeakPolarHBondContact O-CB 3.45Å; L106-K110 PolarHBondContact O-N 3.11Å; E107-K110 PolarHBondContact O-N 3.32Å; E107-K110 IonicContact OE2-NZ 2.82Å; E107-K110 PolarHBondContact OE2-NZ 3.31Å; K110-G114 CarbonylContact O-C 3.57Å; K110-G114 WeakPolarHBondContact O-CA 3.21Å; K110-G114 PolarHBondContact O-N 3.13Å; K110-G114 VanDerWaalsContact O-N 3.08Å; K110-A115 HydrophobicContact CG-CB 4.16Å; K110-A115 WeakPolarHBondContact CG-O 3.44Å; K110-A115 PolarHBondContact O-N 3.26Å; K110-L118 HydrophobicContact CB-CD2 3.79Å; K110-L118 HydrophobicContact CD-CD2 4.23Å; K110-L118 HydrophobicContact CD-CG 4.4Å; K110-L118 HydrophobicContact CG-CD2 4.26Å; K110-I134 HydrophobicContact CD-CG2 3.78Å
111	A	95.8	Very high	97.2	Very high	76 Å²	76	41.6 Å²	41.6	63%	0.628	22%	0.217	S	C	*	.	H	α-helix	trans	-66.4	-46.2	176.9	0	0	0	0	0	112.5	E107 R108 I109 V113 G114	E107-A111 WeakPolarHBondContact O-CB 3.07Å; E107-A111 PolarHBondContact O-N 2.67Å; R108-A111 PolarHBondContact O-N 3.42Å; I109-A111 VanDerWaalsContact C-N 3.28Å; I109-A111 PolarHBondContact O-N 3.42Å; A111-V113 VanDerWaalsContact C-N 3.34Å; A111-V113 PolarHBondContact O-N 2.85Å; A111-G114 PolarHBondContact O-N 3.04Å
112	E	94.3	Very high	97.3	Very high	162 Å²	162	38.6 Å²	38.6	76%	0.757	20%	0.199	S	C	*	.	H	α-helix	trans	-59.8	-41.9	-178.2	-175.8	-178.3	169.9	0	0	112.2	R108 I109	R108-E112 VanDerWaalsContact O-CB 3.31Å; R108-E112 WeakPolarHBondContact O-CB 3.26Å; R108-E112 PolarHBondContact O-N 3.45Å; I109-E112 PolarHBondContact O-N 3.45Å
113	V	93.7	Very high	97.3	Very high	36 Å²	36	38.6 Å²	38.6	22%	0.218	20%	0.198	C	C	.	.	H	α-helix	trans	-93.7	-2.5	-178.1	-49.4	0	0	0	0	113.3	I109 A111 A115 V515	I109-V113 HydrophobicContact CG2-CG1 4.44Å; I109-V113 VanDerWaalsContact O-CG2 3.26Å; I109-V113 WeakPolarHBondContact O-CG2 3.3Å; I109-V113 PolarHBondContact O-N 3.43Å; A111-V113 VanDerWaalsContact C-N 3.34Å; A111-V113 PolarHBondContact O-N 2.85Å; V113-A115 VanDerWaalsContact C-N 3.27Å; V113-A115 HydrophobicContact CG2-CB 3.67Å; V113-A115 PolarHBondContact O-N 2.94Å; V113-V515 HydrophobicContact CB-CG2 4.12Å; V113-V515 HydrophobicContact CG1-CG1 4.15Å; V113-V515 HydrophobicContact CG2-CG1 4.06Å; V113-V515 HydrophobicContact CG2-CG2 3.7Å
114	G	95.1	Very high	97.3	Very high	28 Å²	28	34.9 Å²	34.9	29%	0.289	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	28	-176.9	0	0	0	0	0	113.8	K110 A111 P116 V370 M512	K110-G114 CarbonylContact O-C 3.57Å; K110-G114 WeakPolarHBondContact O-CA 3.21Å; K110-G114 PolarHBondContact O-N 3.13Å; K110-G114 VanDerWaalsContact O-N 3.08Å; A111-G114 PolarHBondContact O-N 3.04Å; G114-P116 WeakPolarHBondContact O-CD 3.35Å; G114-V370 WeakPolarHBondContact O-CG2 3.46Å; G114-M512 VanDerWaalsContact O-CE 3.31Å; G114-M512 WeakPolarHBondContact O-CE 3.3Å
115	A	96.7	Very high	97.2	Very high	7 Å²	7	33.8 Å²	33.8	6%	0.058	18%	0.179	C	C	.	.			trans	-69	128.2	-179.7	0	0	0	0	0	111	K110 V113 T510 M512	K110-A115 HydrophobicContact CG-CB 4.16Å; K110-A115 WeakPolarHBondContact CG-O 3.44Å; K110-A115 PolarHBondContact O-N 3.26Å; V113-A115 VanDerWaalsContact C-N 3.27Å; V113-A115 HydrophobicContact CG2-CB 3.67Å; V113-A115 PolarHBondContact O-N 2.94Å; A115-T510 WeakPolarHBondContact CB-OG1 3.47Å; A115-M512 HydrophobicContact CB-CB 3.74Å; A115-M512 HydrophobicContact CB-CG 4.3Å
116	P	98.2	Very high	97.1	Very high	10 Å²	10	33.4 Å²	33.4	7%	0.065	18%	0.184	C	C	.	.	S	Bend	trans	-63.9	-41.8	176	-30.2	40.9	0	0	0	113	G114 G135 Y136 L139 Y362 V370	G114-P116 WeakPolarHBondContact O-CD 3.35Å; P116-G135 CarbonylContact O-C 3.6Å; P116-G135 WeakPolarHBondContact O-CA 3.38Å; P116-Y136 PolarHBondContact O-N 3.3Å; P116-L139 HydrophobicContact CB-CB 4.15Å; P116-L139 HydrophobicContact CB-CD1 4.4Å; P116-L139 HydrophobicContact CB-CD2 4.19Å; P116-L139 HydrophobicContact CB-CG 4.48Å; P116-L139 HydrophobicContact CG-CD2 4.02Å; P116-Y362 HydrophobicContact CB-CD2 4.04Å; P116-Y362 HydrophobicContact CB-CE2 4.14Å; P116-Y362 HydrophobicContact CG-CD1 4.37Å; P116-Y362 HydrophobicContact CG-CD2 3.61Å; P116-Y362 HydrophobicContact CG-CE2 4.13Å; P116-Y362 HydrophobicContact CG-CG 3.75Å; P116-V370 HydrophobicContact CG-CG1 3.66Å
117	G	98.2	Very high	97	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	154	-179	0	0	0	0	0	113.7	I134 Y136 T510 N511	G117-I134 CarbonylContact C-O 3.59Å; G117-I134 VanDerWaalsContact CA-O 3.26Å; G117-I134 WeakPolarHBondContact CA-O 3.35Å; G117-Y136 WeakPolarHBondContact CA-O 3.45Å; G117-Y136 PolarHBondContact N-O 3.24Å; G117-T510 WeakPolarHBondContact O-CA 3.45Å; G117-T510 PolarHBondContact O-OG1 2.78Å; G117-N511 PolarHBondContact N-OD1 3.28Å; G117-N511 PolarHBondContact O-N 2.77Å; G117-N511 PolarHBondContact O-OD1 3.01Å
118	L	98.3	Very high	97	Very high	3 Å²	3	39 Å²	39	2%	0.016	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	158.1	170.3	65.5	83.2	0	0	0	110.5	L106 K110 I134 I509	L106-L118 HydrophobicContact CB-CD1 4.28Å; L106-L118 HydrophobicContact CB-CD2 4.36Å; L106-L118 HydrophobicContact CD1-CD1 4.15Å; L106-L118 HydrophobicContact CD2-CD1 4.26Å; L106-L118 HydrophobicContact CD2-CD2 4.45Å; L106-L118 HydrophobicContact CG-CD1 4.48Å; K110-L118 HydrophobicContact CB-CD2 3.79Å; K110-L118 HydrophobicContact CD-CD2 4.23Å; K110-L118 HydrophobicContact CD-CG 4.4Å; K110-L118 HydrophobicContact CG-CD2 4.26Å; L118-I134 HydrophobicContact CD1-CB 3.89Å; L118-I134 HydrophobicContact CD1-CD1 4.01Å; L118-I134 HydrophobicContact CD1-CG1 4.11Å; L118-I134 HydrophobicContact CG-CB 4.11Å; L118-I134 PolarHBondContact N-O 3.24Å; L118-I134 PolarHBondContact O-N 2.71Å; L118-I509 CarbonylContact C-O 3.56Å; L118-I509 VanDerWaalsContact CA-O 3.23Å; L118-I509 WeakPolarHBondContact CA-O 3.47Å
119	I	98.8	Very high	97	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143.1	173.2	54	177.8	0	0	0	108.7	E132 C145 T146 T149 M151 V391 I508 I509	I119-E132 WeakPolarHBondContact CA-O 3.18Å; I119-C145 HydrophobicContact CG2-CB 4.08Å; I119-T146 VanDerWaalsContact CG2-O 3.24Å; I119-T146 WeakPolarHBondContact CG2-O 3.43Å; I119-T149 WeakPolarHBondContact CD1-O 3.01Å; I119-M151 HydrophobicContact CD1-CG 4.21Å; I119-M151 HydrophobicContact CD1-SD 4.25Å; I119-M151 HydrophobicContact CG1-CE 4.44Å; I119-M151 HydrophobicContact CG1-SD 4.16Å; I119-M151 HydrophobicContact CG2-CE 4.19Å; I119-V391 HydrophobicContact CB-CG1 4.02Å; I119-V391 HydrophobicContact CD1-CG1 3.88Å; I119-V391 HydrophobicContact CG1-CG1 3.68Å; I119-I508 WeakPolarHBondContact O-CA 3.49Å; I119-I509 HydrophobicContact CD1-CB 4.08Å; I119-I509 HydrophobicContact CD1-CD1 3.91Å; I119-I509 HydrophobicContact CD1-CG1 4.45Å; I119-I509 HydrophobicContact CG1-CB 3.74Å; I119-I509 HydrophobicContact CG1-CD1 4.34Å; I119-I509 HydrophobicContact CG1-CG1 4.36Å; I119-I509 PolarHBondContact N-O 3.36Å; I119-I509 PolarHBondContact O-N 3.32Å
120	V	98.9	Very high	97.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	143.1	179.1	59.7	0	0	0	0	110.1	L106 V122 W130 S131 E132 T507 I508	L106-V120 HydrophobicContact CD1-CB 3.71Å; L106-V120 HydrophobicContact CD1-CG1 3.57Å; L106-V120 HydrophobicContact CD1-CG2 3.95Å; V120-V122 HydrophobicContact CG2-CG2 4.39Å; V120-W130 HydrophobicContact CB-CH2 4.49Å; V120-W130 HydrophobicContact CG1-CD2 4.39Å; V120-W130 HydrophobicContact CG1-CE3 4.4Å; V120-W130 HydrophobicContact CG1-CH2 3.67Å; V120-W130 HydrophobicContact CG1-CZ2 3.62Å; V120-W130 HydrophobicContact CG1-CZ3 4.05Å; V120-W130 HydrophobicContact CG2-CE3 4.17Å; V120-W130 HydrophobicContact CG2-CH2 4.11Å; V120-W130 HydrophobicContact CG2-CZ3 3.74Å; V120-S131 VanDerWaalsContact O-CA 3.25Å; V120-S131 WeakPolarHBondContact O-CA 3.29Å; V120-S131 PolarHBondContact O-OG 3.38Å; V120-E132 HydrophobicContact CG1-CB 4.01Å; V120-E132 PolarHBondContact N-O 3.38Å; V120-E132 PolarHBondContact O-N 2.95Å; V120-T507 WeakPolarHBondContact CA-O 3.2Å; V120-I508 HydrophobicContact CG2-CG1 4.13Å
121	G	98.8	Very high	97.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	139.6	169.1	0	0	0	0	0	110.1	W130 V506 T507	G121-W130 CarbonylContact C-O 2.94Å; G121-W130 WeakPolarHBondContact CA-O 3.36Å; G121-V506 WeakPolarHBondContact O-CA 3.38Å; G121-T507 PolarHBondContact N-O 3.1Å; G121-T507 PolarHBondContact O-N 3.4Å
122	V	98.9	Very high	97.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.9	171.5	-176.4	0	0	0	0	109.6	V120 V124 V129 W130 V504 V505 V506 I524 F528	V120-V122 HydrophobicContact CG2-CG2 4.39Å; V122-V124 HydrophobicContact CG1-CG2 4.37Å; V122-V129 HydrophobicContact CB-CG2 4.47Å; V122-V129 HydrophobicContact CG1-CG2 4.18Å; V122-V129 WeakPolarHBondContact O-CG2 3.35Å; V122-V129 PolarHBondContact O-N 2.85Å; V122-W130 HydrophobicContact CB-CB 4.32Å; V122-W130 HydrophobicContact CB-CE3 4.31Å; V122-W130 HydrophobicContact CG2-CE3 3.55Å; V122-W130 HydrophobicContact CG2-CZ3 4.11Å; V122-W130 PolarHBondContact N-O 3.19Å; V122-W130 PolarHBondContact O-N 3.36Å; V122-V504 HydrophobicContact CG1-CG1 3.76Å; V122-V505 CarbonylContact C-O 3.58Å; V122-V505 VanDerWaalsContact CA-O 3.31Å; V122-V505 WeakPolarHBondContact CA-O 3.48Å; V122-V506 HydrophobicContact CG1-CG2 4.26Å; V122-V506 HydrophobicContact CG2-CG1 4.24Å; V122-V506 HydrophobicContact CG2-CG2 4.14Å; V122-I524 HydrophobicContact CG2-CG2 3.71Å; V122-F528 HydrophobicContact CB-CD1 4.42Å; V122-F528 HydrophobicContact CB-CE1 4.2Å; V122-F528 HydrophobicContact CB-CE2 4.34Å; V122-F528 HydrophobicContact CB-CZ 4.15Å; V122-F528 HydrophobicContact CG1-CB 4.16Å; V122-F528 HydrophobicContact CG1-CD1 3.66Å; V122-F528 HydrophobicContact CG1-CD2 3.92Å; V122-F528 HydrophobicContact CG1-CE1 3.94Å; V122-F528 HydrophobicContact CG1-CE2 4.19Å; V122-F528 HydrophobicContact CG1-CG 3.63Å; V122-F528 HydrophobicContact CG1-CZ 4.2Å; V122-F528 HydrophobicContact CG2-CD2 4.32Å; V122-F528 HydrophobicContact CG2-CE2 3.98Å; V122-F528 HydrophobicContact CG2-CZ 4.17Å
123	A	98.7	Very high	97.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	139.7	166.7	0	0	0	0	0	110.3	V127 L395 N399 V504 V505	A123-V127 CarbonylContact C-O 3.35Å; A123-V127 WeakPolarHBondContact CA-O 3.38Å; A123-V127 WeakPolarHBondContact CB-O 3.19Å; A123-L395 HydrophobicContact CB-CB 4.42Å; A123-L395 HydrophobicContact CB-CD1 4.28Å; A123-L395 HydrophobicContact CB-CD2 4.05Å; A123-L395 HydrophobicContact CB-CG 4.48Å; A123-N399 WeakPolarHBondContact CB-ND2 3.23Å; A123-V504 CarbonylContact O-C 3.59Å; A123-V504 WeakPolarHBondContact O-CA 3.49Å; A123-V505 HydrophobicContact CB-CB 4.36Å; A123-V505 PolarHBondContact N-O 3.4Å; A123-V505 PolarHBondContact O-N 2.63Å
124	V	97.7	Very high	97.8	Very high	4 Å²	4	22.1 Å²	22.1	2%	0.024	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.9	171.7	-179.4	0	0	0	0	107.7	Y95 V122 G126 V127 V129 G503 V504 F528 R532	Y95-V124 HydrophobicContact CE1-CB 4.43Å; Y95-V124 HydrophobicContact CE1-CG1 4.29Å; Y95-V124 HydrophobicContact CE1-CG2 4.02Å; Y95-V124 VanDerWaalsContact OH-CG1 3.3Å; Y95-V124 WeakPolarHBondContact OH-CG1 3.35Å; V122-V124 HydrophobicContact CG1-CG2 4.37Å; V124-G126 PolarHBondContact O-N 3.31Å; V124-V127 PolarHBondContact N-O 3.38Å; V124-V127 PolarHBondContact O-N 3.45Å; V124-V129 HydrophobicContact CB-CG1 4.17Å; V124-V129 HydrophobicContact CB-CG2 4.15Å; V124-V129 HydrophobicContact CG2-CG2 3.62Å; V124-G503 WeakPolarHBondContact CA-O 3.5Å; V124-V504 HydrophobicContact CG2-CG1 4.29Å; V124-V504 HydrophobicContact CG2-CG2 4.23Å; V124-F528 HydrophobicContact CG2-CB 3.99Å; V124-F528 HydrophobicContact CG2-CD1 3.98Å; V124-F528 HydrophobicContact CG2-CG 4.43Å; V124-R532 HydrophobicContact CG1-CB 4.1Å; V124-R532 HydrophobicContact CG1-CG 3.86Å
125	D	95.8	Very high	98	Very high	55 Å²	55	22 Å²	22	29%	0.294	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	44.4	-179.6	-63.9	-6.3	0	0	0	113.2	V127 P501 Q502 G503 R532	D125-V127 PolarHBondContact O-N 3.23Å; D125-P501 CarbonylContact C-O 3.56Å; D125-P501 WeakPolarHBondContact CA-O 3.37Å; D125-Q502 VanDerWaalsContact OD1-CA 3.23Å; D125-Q502 WeakPolarHBondContact OD1-CA 3.41Å; D125-G503 PolarHBondContact N-O 3.06Å; D125-G503 PolarHBondContact OD1-N 3Å; D125-R532 IonicContact OD1-CZ 3.69Å; D125-R532 IonicContact OD1-NE 3.35Å; D125-R532 PolarHBondContact OD1-NE 2.78Å; D125-R532 IonicContact OD1-NH2 3.09Å; D125-R532 PolarHBondContact OD1-NH2 3.09Å; D125-R532 IonicContact OD2-CZ 3.66Å; D125-R532 IonicContact OD2-NE 2.76Å; D125-R532 PolarHBondContact OD2-NE 3.27Å; D125-R532 IonicContact OD2-NH2 3.02Å; D125-R532 PolarHBondContact OD2-NH2 2.97Å
126	G	95.7	Very high	98.1	Very high	29 Å²	29	26.2 Å²	26.2	30%	0.299	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	-6.6	179.2	0	0	0	0	0	115.4	V124 N399	V124-G126 PolarHBondContact O-N 3.31Å; G126-N399 PolarHBondContact O-ND2 3.12Å
127	V	96.3	Very high	98.1	Very high	94 Å²	94	26 Å²	26	57%	0.57	15%	0.152	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	129	-177.8	-177.5	0	0	0	0	110.2	A123 V124 D125 V129	A123-V127 CarbonylContact C-O 3.35Å; A123-V127 WeakPolarHBondContact CA-O 3.38Å; A123-V127 WeakPolarHBondContact CB-O 3.19Å; V124-V127 PolarHBondContact N-O 3.38Å; V124-V127 PolarHBondContact O-N 3.45Å; D125-V127 PolarHBondContact O-N 3.23Å; V127-V129 PolarHBondContact O-N 3.1Å; V127-V129 VanDerWaalsContact O-N 3.16Å
128	Q	97.8	Very high	98.1	Very high	102 Å²	102	26.9 Å²	26.9	48%	0.477	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	111.9	170.6	-179.7	178.4	-48.9	0	0	109.8	L395	Q128-L395 HydrophobicContact CB-CD1 4.2Å; Q128-L395 HydrophobicContact CG-CD1 3.76Å
129	V	98	Very high	98.1	Very high	22 Å²	22	30 Å²	30	13%	0.133	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-17.7	-176.9	-66.4	0	0	0	0	113	H93 Y95 V122 V124 V127 F528	H93-V129 PolarHBondContact CE1-O 3.02Å; Y95-V129 HydrophobicContact CD2-CB 3.83Å; Y95-V129 HydrophobicContact CD2-CG1 3.88Å; Y95-V129 HydrophobicContact CD2-CG2 4.22Å; Y95-V129 HydrophobicContact CE2-CB 4.09Å; Y95-V129 HydrophobicContact CE2-CG1 3.62Å; Y95-V129 HydrophobicContact CE2-CG2 4.46Å; Y95-V129 HydrophobicContact CG-CB 4.47Å; Y95-V129 HydrophobicContact CG-CG2 4.44Å; V122-V129 HydrophobicContact CB-CG2 4.47Å; V122-V129 HydrophobicContact CG1-CG2 4.18Å; V122-V129 WeakPolarHBondContact O-CG2 3.35Å; V122-V129 PolarHBondContact O-N 2.85Å; V124-V129 HydrophobicContact CB-CG1 4.17Å; V124-V129 HydrophobicContact CB-CG2 4.15Å; V124-V129 HydrophobicContact CG2-CG2 3.62Å; V127-V129 PolarHBondContact O-N 3.1Å; V127-V129 VanDerWaalsContact O-N 3.16Å; V129-F528 HydrophobicContact CG2-CD1 3.76Å; V129-F528 HydrophobicContact CG2-CE1 3.68Å
130	W	98.4	Very high	98	Very high	14 Å²	14	35.4 Å²	35.4	5%	0.053	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	134.7	174.2	178.7	42.7	0	0	0	110.3	I99 S102 R103 L106 V120 G121 V122 E132 I524 F528	I99-W130 HydrophobicContact CD1-CB 4.1Å; I99-W130 HydrophobicContact CD1-CG 4.2Å; I99-W130 HydrophobicContact CG1-CB 3.94Å; I99-W130 HydrophobicContact CG1-CD2 4.13Å; I99-W130 HydrophobicContact CG1-CG 3.79Å; I99-W130 HydrophobicContact CG2-CD2 4.33Å; I99-W130 HydrophobicContact CG2-CG 4.34Å; I99-W130 HydrophobicContact CG2-CZ2 4.43Å; S102-W130 VanDerWaalsContact CB-CZ3 3.43Å; R103-W130 HydrophobicContact CB-CZ2 4.33Å; L106-W130 HydrophobicContact CD1-CH2 3.58Å; L106-W130 HydrophobicContact CD1-CZ2 4.28Å; L106-W130 HydrophobicContact CD1-CZ3 4.37Å; V120-W130 HydrophobicContact CB-CH2 4.49Å; V120-W130 HydrophobicContact CG1-CD2 4.39Å; V120-W130 HydrophobicContact CG1-CE3 4.4Å; V120-W130 HydrophobicContact CG1-CH2 3.67Å; V120-W130 HydrophobicContact CG1-CZ2 3.62Å; V120-W130 HydrophobicContact CG1-CZ3 4.05Å; V120-W130 HydrophobicContact CG2-CE3 4.17Å; V120-W130 HydrophobicContact CG2-CH2 4.11Å; V120-W130 HydrophobicContact CG2-CZ3 3.74Å; G121-W130 CarbonylContact C-O 2.94Å; G121-W130 WeakPolarHBondContact CA-O 3.36Å; V122-W130 HydrophobicContact CB-CB 4.32Å; V122-W130 HydrophobicContact CB-CE3 4.31Å; V122-W130 HydrophobicContact CG2-CE3 3.55Å; V122-W130 HydrophobicContact CG2-CZ3 4.11Å; V122-W130 PolarHBondContact N-O 3.19Å; V122-W130 PolarHBondContact O-N 3.36Å; W130-E132 HydrophobicContact CZ2-CB 4.33Å; W130-E132 PolarHBondContact NE1-OE2 2.59Å; W130-I524 HydrophobicContact CZ3-CD1 4.48Å; W130-I524 HydrophobicContact CZ3-CG2 4.22Å; W130-F528 HydrophobicContact CB-CE1 4.11Å; W130-F528 HydrophobicContact CB-CZ 3.9Å; W130-F528 HydrophobicContact CD2-CZ 4.09Å; W130-F528 AromaticContact CE3-CE2 3.73Å; W130-F528 HydrophobicContact CE3-CE2 3.73Å; W130-F528 AromaticContact CE3-CZ 3.52Å; W130-F528 HydrophobicContact CE3-CZ 3.52Å; W130-F528 HydrophobicContact CG-CZ 4.29Å; W130-F528 HydrophobicContact CZ3-CE2 4.12Å; W130-F528 HydrophobicContact CZ3-CZ 4.32Å
131	S	98.4	Very high	97.9	Very high	27 Å²	27	40.6 Å²	40.6	19%	0.189	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	136.1	163.6	-173.5	0	0	0	0	109.9	V120 P147 V391	V120-S131 VanDerWaalsContact O-CA 3.25Å; V120-S131 WeakPolarHBondContact O-CA 3.29Å; V120-S131 PolarHBondContact O-OG 3.38Å; S131-P147 VanDerWaalsContact OG-CB 3.32Å; S131-P147 WeakPolarHBondContact OG-CB 3.47Å; S131-V391 VanDerWaalsContact OG-CG2 3.25Å; S131-V391 WeakPolarHBondContact OG-CG2 3.37Å
132	E	98.5	Very high	97.8	Very high	43 Å²	43	49.6 Å²	49.6	20%	0.201	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	146.4	-171.5	-170.5	168.3	164.3	0	0	111	R103 I119 V120 W130 I134	R103-E132 IonicContact CZ-OE1 2.83Å; R103-E132 IonicContact CZ-OE2 2.79Å; R103-E132 IonicContact NE-OE1 3.32Å; R103-E132 PolarHBondContact NE-OE1 3.21Å; R103-E132 IonicContact NE-OE2 3.57Å; R103-E132 PolarHBondContact NE-OE2 3.42Å; R103-E132 VanDerWaalsContact NE-OE2 3.09Å; R103-E132 IonicContact NH2-OE1 3.84Å; R103-E132 IonicContact NH2-OE2 2.72Å; R103-E132 PolarHBondContact NH2-OE2 3.36Å; I119-E132 WeakPolarHBondContact CA-O 3.18Å; V120-E132 HydrophobicContact CG1-CB 4.01Å; V120-E132 PolarHBondContact N-O 3.38Å; V120-E132 PolarHBondContact O-N 2.95Å; W130-E132 HydrophobicContact CZ2-CB 4.33Å; W130-E132 PolarHBondContact NE1-OE2 2.59Å; E132-I134 HydrophobicContact CG-CG1 4.2Å
133	G	98.6	Very high	97.8	Very high	20 Å²	20	52.9 Å²	52.9	21%	0.206	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.9	167.1	0	0	0	0	0	110.1
134	I	98.4	Very high	97.8	Very high	6 Å²	6	56.6 Å²	56.6	3%	0.031	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.6	-178.1	-57.1	-178.8	0	0	0	108.4	R103 L106 E107 K110 G117 L118 E132	R103-I134 HydrophobicContact CG-CD1 4.22Å; L106-I134 HydrophobicContact CB-CD1 4Å; L106-I134 HydrophobicContact CD1-CD1 4.21Å; E107-I134 HydrophobicContact CG-CG2 4.27Å; E107-I134 WeakPolarHBondContact OE1-CG2 3.34Å; E107-I134 WeakPolarHBondContact OE2-CG2 3.43Å; K110-I134 HydrophobicContact CD-CG2 3.78Å; G117-I134 CarbonylContact C-O 3.59Å; G117-I134 VanDerWaalsContact CA-O 3.26Å; G117-I134 WeakPolarHBondContact CA-O 3.35Å; L118-I134 HydrophobicContact CD1-CB 3.89Å; L118-I134 HydrophobicContact CD1-CD1 4.01Å; L118-I134 HydrophobicContact CD1-CG1 4.11Å; L118-I134 HydrophobicContact CG-CB 4.11Å; L118-I134 PolarHBondContact N-O 3.24Å; L118-I134 PolarHBondContact O-N 2.71Å; E132-I134 HydrophobicContact CG-CG1 4.2Å
135	G	98.3	Very high	97.9	Very high	27 Å²	27	56.8 Å²	56.8	28%	0.278	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	80	-142.7	-178	0	0	0	0	0	113.3	P116 P144 C145	P116-G135 CarbonylContact O-C 3.6Å; P116-G135 WeakPolarHBondContact O-CA 3.38Å; G135-P144 WeakPolarHBondContact O-CA 3.43Å; G135-C145 PolarHBondContact O-N 3.36Å
136	Y	98.7	Very high	98	Very high	94 Å²	94	56.5 Å²	56.5	37%	0.369	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.5	-168.9	-59.4	-77.5	0	0	0	113.3	P116 G117 L139 R142 V143 N511	P116-Y136 PolarHBondContact O-N 3.3Å; G117-Y136 WeakPolarHBondContact CA-O 3.45Å; G117-Y136 PolarHBondContact N-O 3.24Å; Y136-L139 HydrophobicContact CD2-CD1 3.87Å; Y136-L139 HydrophobicContact CE2-CD1 4.5Å; Y136-L139 HydrophobicContact CG-CD1 4.46Å; Y136-R142 VanDerWaalsContact CD1-C 3.5Å; Y136-R142 HydrophobicContact CD1-CB 4.18Å; Y136-R142 HydrophobicContact CE1-CB 3.8Å; Y136-R142 HydrophobicContact CE1-CG 4.42Å; Y136-V143 CarbonylContact C-O 3.6Å; Y136-V143 VanDerWaalsContact CA-O 3.23Å; Y136-V143 WeakPolarHBondContact CA-O 3.18Å; Y136-V143 WeakPolarHBondContact CB-O 3.42Å; Y136-N511 PolarHBondContact O-ND2 3.04Å
137	A	98.5	Very high	98.1	Very high	6 Å²	6	57.1 Å²	57.1	5%	0.05	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-34.1	167.2	0	0	0	0	0	110.8	V143 C145 T149 S359 R360	A137-V143 PolarHBondContact N-O 2.92Å; A137-C145 PolarHBondContact N-SG 3.3Å; A137-T149 HydrophobicContact CB-CG2 3.58Å; A137-S359 PolarHBondContact O-OG 2.91Å; A137-R360 PolarHBondContact O-N 2.8Å
138	D	98.3	Very high	98.2	Very high	19 Å²	19	57.1 Å²	57.1	10%	0.102	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	106.9	171	-173.8	-31.9	0	0	0	108.3	E140 N141 R142 V143 R360	D138-E140 WeakPolarHBondContact OD1-CB 3.28Å; D138-E140 PolarHBondContact OD1-N 3.28Å; D138-N141 HydrophobicContact CB-CB 4.44Å; D138-N141 VanDerWaalsContact CG-ND2 3.35Å; D138-N141 PolarHBondContact OD1-N 3.45Å; D138-N141 PolarHBondContact OD1-ND2 2.89Å; D138-N141 PolarHBondContact OD2-ND2 2.88Å; D138-R142 CarbonylContact O-C 3.49Å; D138-R142 VanDerWaalsContact O-CA 3.27Å; D138-R142 WeakPolarHBondContact O-CA 3.24Å; D138-R142 PolarHBondContact O-N 3.14Å; D138-V143 HydrophobicContact CB-CB 3.81Å; D138-V143 HydrophobicContact CB-CG2 3.88Å; D138-V143 PolarHBondContact N-O 3.49Å; D138-V143 PolarHBondContact O-N 3.06Å; D138-R360 HydrophobicContact CB-CG 4.03Å; D138-R360 IonicContact OD2-NE 3.87Å
139	L	97.8	Very high	98.2	Very high	67 Å²	67	52.4 Å²	52.4	35%	0.351	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-36.2	-178.5	-177.9	62	0	0	0	111.7	P116 Y136 R142 Y362 V370	P116-L139 HydrophobicContact CB-CB 4.15Å; P116-L139 HydrophobicContact CB-CD1 4.4Å; P116-L139 HydrophobicContact CB-CD2 4.19Å; P116-L139 HydrophobicContact CB-CG 4.48Å; P116-L139 HydrophobicContact CG-CD2 4.02Å; Y136-L139 HydrophobicContact CD2-CD1 3.87Å; Y136-L139 HydrophobicContact CE2-CD1 4.5Å; Y136-L139 HydrophobicContact CG-CD1 4.46Å; L139-R142 PolarHBondContact O-N 3.36Å; L139-Y362 HydrophobicContact CB-CE1 4.02Å; L139-Y362 HydrophobicContact CB-CE2 4.36Å; L139-Y362 WeakPolarHBondContact CB-OH 3.28Å; L139-Y362 PolarHBondContact N-OH 2.92Å; L139-V370 HydrophobicContact CD2-CG1 3.96Å
140	E	96.8	Very high	98.2	Very high	114 Å²	114	51.6 Å²	51.6	53%	0.533	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-41.4	-175.3	-50.9	-179.9	130.2	0	0	110.3	D138 N372	D138-E140 WeakPolarHBondContact OD1-CB 3.28Å; D138-E140 PolarHBondContact OD1-N 3.28Å; E140-N372 PolarHBondContact OE1-ND2 3.17Å
141	N	97.9	Very high	98.2	Very high	110 Å²	110	51 Å²	51	59%	0.588	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	3.1	-178.7	-61.3	-61.1	0	0	0	113.2	D138 V143	D138-N141 HydrophobicContact CB-CB 4.44Å; D138-N141 VanDerWaalsContact CG-ND2 3.35Å; D138-N141 PolarHBondContact OD1-N 3.45Å; D138-N141 PolarHBondContact OD1-ND2 2.89Å; D138-N141 PolarHBondContact OD2-ND2 2.88Å; N141-V143 HydrophobicContact CB-CG2 4.08Å; N141-V143 PolarHBondContact O-N 3.25Å
142	R	97.4	Very high	98.2	Very high	189 Å²	189	50.4 Å²	50.4	71%	0.713	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	36.9	-177.7	-56.2	-177.8	-178.7	-171.9	-0.2	113.5	Y136 D138 L139 P144	Y136-R142 VanDerWaalsContact CD1-C 3.5Å; Y136-R142 HydrophobicContact CD1-CB 4.18Å; Y136-R142 HydrophobicContact CE1-CB 3.8Å; Y136-R142 HydrophobicContact CE1-CG 4.42Å; D138-R142 CarbonylContact O-C 3.49Å; D138-R142 VanDerWaalsContact O-CA 3.27Å; D138-R142 WeakPolarHBondContact O-CA 3.24Å; D138-R142 PolarHBondContact O-N 3.14Å; L139-R142 PolarHBondContact O-N 3.36Å; R142-P144 WeakPolarHBondContact O-CD 3.34Å
143	V	98.6	Very high	98.2	Very high	69 Å²	69	48.4 Å²	48.4	42%	0.418	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	119.3	174	-177.9	0	0	0	0	108.2	Y136 A137 D138 N141	Y136-V143 CarbonylContact C-O 3.6Å; Y136-V143 VanDerWaalsContact CA-O 3.23Å; Y136-V143 WeakPolarHBondContact CA-O 3.18Å; Y136-V143 WeakPolarHBondContact CB-O 3.42Å; A137-V143 PolarHBondContact N-O 2.92Å; D138-V143 HydrophobicContact CB-CB 3.81Å; D138-V143 HydrophobicContact CB-CG2 3.88Å; D138-V143 PolarHBondContact N-O 3.49Å; D138-V143 PolarHBondContact O-N 3.06Å; N141-V143 HydrophobicContact CB-CG2 4.08Å; N141-V143 PolarHBondContact O-N 3.25Å
144	P	98.5	Very high	98.1	Very high	78 Å²	78	47.4 Å²	47.4	51%	0.506	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	147.7	-176.8	28.5	-34.8	0	0	0	111.3	G135 R142	G135-P144 WeakPolarHBondContact O-CA 3.43Å; R142-P144 WeakPolarHBondContact O-CD 3.34Å
145	C	98.4	Very high	98	Very high	7 Å²	7	47.5 Å²	47.5	5%	0.047	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-65.2	137	161.6	-80.1	0	0	0	0	109.4	I119 G135 A137 M151	I119-C145 HydrophobicContact CG2-CB 4.08Å; G135-C145 PolarHBondContact O-N 3.36Å; A137-C145 PolarHBondContact N-SG 3.3Å; C145-M151 WeakPolarHBondContact SG-CE 3.48Å
146	T	98.5	Very high	98	Very high	50 Å²	50	46.2 Å²	46.2	31%	0.307	23%	0.234	S	C	.	.			trans	-129.4	162	170.2	65.1	0	0	0	0	109.4	I119 D148 T149	I119-T146 VanDerWaalsContact CG2-O 3.24Å; I119-T146 WeakPolarHBondContact CG2-O 3.43Å; T146-D148 PolarHBondContact O-N 2.99Å; T146-D148 PolarHBondContact OG1-N 3.17Å; T146-T149 PolarHBondContact N-OG1 2.94Å; T146-T149 VanDerWaalsContact O-CB 3.29Å; T146-T149 WeakPolarHBondContact O-CB 3.32Å; T146-T149 PolarHBondContact O-N 3.45Å; T146-T149 PolarHBondContact O-OG1 3.48Å; T146-T149 PolarHBondContact OG1-OG1 3.3Å
147	P	97.4	Very high	98	Very high	42 Å²	42	41.8 Å²	41.8	27%	0.273	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-31.8	170.5	-35	41.2	0	0	0	115.2	S131 T149	S131-P147 VanDerWaalsContact OG-CB 3.32Å; S131-P147 WeakPolarHBondContact OG-CB 3.47Å; P147-T149 VanDerWaalsContact C-N 3.31Å; P147-T149 PolarHBondContact O-N 3.4Å
148	D	97.9	Very high	98.1	Very high	94 Å²	94	41.5 Å²	41.5	50%	0.503	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	3.3	-177.9	-56	-45.8	0	0	0	113.4	T146 V150 H357	T146-D148 PolarHBondContact O-N 2.99Å; T146-D148 PolarHBondContact OG1-N 3.17Å; D148-V150 PolarHBondContact O-N 3.31Å; D148-H357 WeakPolarHBondContact O-CB 3.45Å
149	T	98.7	Very high	98.1	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.018	21%	0.21	C	C	.	.			trans	-65.8	126.5	177.8	-51.8	0	0	0	0	110	I119 A137 T146 P147 M151	I119-T149 WeakPolarHBondContact CD1-O 3.01Å; A137-T149 HydrophobicContact CB-CG2 3.58Å; T146-T149 PolarHBondContact N-OG1 2.94Å; T146-T149 VanDerWaalsContact O-CB 3.29Å; T146-T149 WeakPolarHBondContact O-CB 3.32Å; T146-T149 PolarHBondContact O-N 3.45Å; T146-T149 PolarHBondContact O-OG1 3.48Å; T146-T149 PolarHBondContact OG1-OG1 3.3Å; P147-T149 VanDerWaalsContact C-N 3.31Å; P147-T149 PolarHBondContact O-N 3.4Å; T149-M151 HydrophobicContact CG2-CE 3.63Å; T149-M151 HydrophobicContact CG2-CG 4Å
150	V	98.6	Very high	98.1	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.03	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-91.6	116.5	179.9	175.1	0	0	0	0	109	D148 N345 I355 H357 R358 S359 L388 T390	D148-V150 PolarHBondContact O-N 3.31Å; V150-N345 HydrophobicContact CG2-CB 4.43Å; V150-I355 HydrophobicContact CB-CG2 4.27Å; V150-I355 HydrophobicContact CG1-CG2 3.78Å; V150-H357 PolarHBondContact N-O 2.81Å; V150-R358 WeakPolarHBondContact O-CA 3.4Å; V150-S359 PolarHBondContact O-N 2.91Å; V150-L388 HydrophobicContact CG1-CB 3.51Å; V150-L388 HydrophobicContact CG1-CD1 4.2Å; V150-L388 HydrophobicContact CG1-CG 4.33Å; V150-T390 HydrophobicContact CG2-CG2 3.88Å
151	M	98.3	Very high	98.2	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	157.8	-177	-65.6	-166.4	-175.7	0	0	111.4	I119 C145 T149 I153 L388 S389 I509 N511	I119-M151 HydrophobicContact CD1-CG 4.21Å; I119-M151 HydrophobicContact CD1-SD 4.25Å; I119-M151 HydrophobicContact CG1-CE 4.44Å; I119-M151 HydrophobicContact CG1-SD 4.16Å; I119-M151 HydrophobicContact CG2-CE 4.19Å; C145-M151 WeakPolarHBondContact SG-CE 3.48Å; T149-M151 HydrophobicContact CG2-CE 3.63Å; T149-M151 HydrophobicContact CG2-CG 4Å; M151-I153 PolarHBondContact O-N 3.16Å; M151-L388 CarbonylContact O-C 3.45Å; M151-L388 VanDerWaalsContact O-CA 3.25Å; M151-L388 WeakPolarHBondContact O-CA 3.26Å; M151-S389 PolarHBondContact N-O 2.91Å; M151-S389 PolarHBondContact O-N 3.44Å; M151-I509 HydrophobicContact CB-CB 4.33Å; M151-I509 HydrophobicContact CB-CG2 3.43Å; M151-I509 VanDerWaalsContact CB-CG2 3.43Å; M151-I509 HydrophobicContact CG-CG2 4.28Å; M151-I509 HydrophobicContact SD-CB 4.36Å; M151-I509 HydrophobicContact SD-CG2 4Å; M151-N511 HydrophobicContact CE-CB 4.32Å; M151-N511 HydrophobicContact SD-CB 4.18Å
152	R	98.3	Very high	98.2	Very high	16 Å²	16	26.8 Å²	26.8	6%	0.06	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	118.8	172.7	-79.9	169.4	173	168.1	0.2	109.9	A154 D349 F361 L388 A475 V476 A478	R152-A154 VanDerWaalsContact C-N 3.29Å; R152-D349 IonicContact CZ-OD2 3.39Å; R152-D349 VanDerWaalsContact CZ-OD2 3.24Å; R152-D349 IonicContact NE-OD2 3.95Å; R152-D349 PolarHBondContact NE-OD2 2.88Å; R152-D349 IonicContact NH2-OD2 3.3Å; R152-D349 PolarHBondContact NH2-OD2 2.82Å; R152-F361 HydrophobicContact CB-CE1 4.02Å; R152-F361 HydrophobicContact CB-CZ 4.27Å; R152-F361 HydrophobicContact CG-CE1 3.78Å; R152-F361 HydrophobicContact CG-CE2 4.14Å; R152-F361 HydrophobicContact CG-CZ 3.56Å; R152-L388 HydrophobicContact CB-CD2 4.25Å; R152-L388 HydrophobicContact CG-CD2 3.61Å; R152-A475 HydrophobicContact CB-CB 4.33Å; R152-V476 PolarHBondContact NH1-O 2.58Å; R152-A478 HydrophobicContact CB-CB 3.54Å
153	I	98.4	Very high	98.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.106	C	C	.	.			trans	-88.5	-3.7	173.7	59.7	164.5	0	0	0	112.8	M151 S155 I156 L160 F387 L394 S480 I509	M151-I153 PolarHBondContact O-N 3.16Å; I153-S155 PolarHBondContact O-N 3.29Å; I153-I156 HydrophobicContact CB-CB 4.18Å; I153-I156 HydrophobicContact CB-CD1 4.35Å; I153-I156 HydrophobicContact CD1-CB 4.22Å; I153-I156 HydrophobicContact CD1-CG2 4.16Å; I153-I156 HydrophobicContact CG1-CB 4.48Å; I153-I156 WeakPolarHBondContact O-CB 3.5Å; I153-I156 WeakPolarHBondContact O-CG1 3.23Å; I153-I156 PolarHBondContact O-N 2.75Å; I153-L160 HydrophobicContact CD1-CD1 3.56Å; I153-F387 HydrophobicContact CD1-CB 3.98Å; I153-F387 HydrophobicContact CG1-CB 4.04Å; I153-F387 VanDerWaalsContact CG1-O 3.24Å; I153-F387 WeakPolarHBondContact CG1-O 3.31Å; I153-F387 PolarHBondContact N-O 3.34Å; I153-F387 VanDerWaalsContact N-O 3.12Å; I153-L394 HydrophobicContact CD1-CD2 4.13Å; I153-L394 HydrophobicContact CG2-CD1 3.82Å; I153-L394 HydrophobicContact CG2-CD2 4.48Å; I153-L394 HydrophobicContact CG2-CG 4.41Å; I153-S480 PolarHBondContact O-OG 2.76Å; I153-I509 HydrophobicContact CG2-CD1 3.78Å; I153-I509 HydrophobicContact CG2-CG1 4.45Å
154	A	96.4	Very high	98.3	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	-136.6	173.7	0	0	0	0	0	110.4	R152 I156 S157 G385 G474 A475	R152-A154 VanDerWaalsContact C-N 3.29Å; A154-I156 PolarHBondContact O-N 3.33Å; A154-S157 VanDerWaalsContact O-CB 3.24Å; A154-S157 WeakPolarHBondContact O-CB 3.34Å; A154-S157 PolarHBondContact O-N 2.75Å; A154-S157 PolarHBondContact O-OG 3.15Å; A154-G385 WeakPolarHBondContact O-CA 3.39Å; A154-G474 VanDerWaalsContact CB-C 3.45Å; A154-G474 WeakPolarHBondContact CB-O 3.19Å; A154-A475 HydrophobicContact CB-CB 3.58Å
155	S	96.9	Very high	98.3	Very high	8 Å²	8	11 Å²	11	6%	0.056	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-5.9	-173.6	-55.1	0	0	0	0	117	I153 S157 K158 Y310 G384 H471	I153-S155 PolarHBondContact O-N 3.29Å; S155-S157 PolarHBondContact O-N 2.86Å; S155-S157 VanDerWaalsContact O-N 3.17Å; S155-K158 WeakPolarHBondContact O-CB 3.35Å; S155-K158 PolarHBondContact O-N 2.92Å; S155-Y310 WeakPolarHBondContact CB-OH 3.37Å; S155-Y310 PolarHBondContact OG-OH 3.43Å; S155-Y310 VanDerWaalsContact OG-OH 3.09Å; S155-G384 WeakPolarHBondContact CA-O 3.19Å; S155-H471 VanDerWaalsContact CB-CE1 3.42Å; S155-H471 WeakPolarHBondContact CB-CE1 3.42Å; S155-H471 PolarHBondContact O-CE1 2.52Å; S155-H471 VanDerWaalsContact O-CE1 3.24Å; S155-H471 PolarHBondContact O-ND1 3.37Å
156	I	98.6	Very high	98.3	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-57.5	-25.1	165	-61.4	172.9	0	0	0	110.5	I153 A154 K158 S159 L160 L394 S480 L482	I153-I156 HydrophobicContact CB-CB 4.18Å; I153-I156 HydrophobicContact CB-CD1 4.35Å; I153-I156 HydrophobicContact CD1-CB 4.22Å; I153-I156 HydrophobicContact CD1-CG2 4.16Å; I153-I156 HydrophobicContact CG1-CB 4.48Å; I153-I156 WeakPolarHBondContact O-CB 3.5Å; I153-I156 WeakPolarHBondContact O-CG1 3.23Å; I153-I156 PolarHBondContact O-N 2.75Å; A154-I156 PolarHBondContact O-N 3.33Å; I156-K158 PolarHBondContact O-N 3.17Å; I156-K158 VanDerWaalsContact O-N 3.09Å; I156-S159 WeakPolarHBondContact O-CB 3.41Å; I156-S159 PolarHBondContact O-N 2.95Å; I156-L160 PolarHBondContact O-N 3Å; I156-L394 HydrophobicContact CD1-CD1 3.98Å; I156-L394 HydrophobicContact CG2-CD2 3.98Å; I156-S480 VanDerWaalsContact CD1-OG 3.3Å; I156-S480 WeakPolarHBondContact CD1-OG 3.37Å; I156-L482 HydrophobicContact CD1-CB 3.95Å; I156-L482 HydrophobicContact CG1-CB 4.38Å; I156-L482 HydrophobicContact CG2-CB 4.34Å; I156-L482 HydrophobicContact CG2-CD2 4.26Å
157	S	98.7	Very high	98.3	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-48.4	-32.8	168.8	-57.4	0	0	0	0	113.7	A154 S155 L160 T161 A383 G385 G386 F387	A154-S157 VanDerWaalsContact O-CB 3.24Å; A154-S157 WeakPolarHBondContact O-CB 3.34Å; A154-S157 PolarHBondContact O-N 2.75Å; A154-S157 PolarHBondContact O-OG 3.15Å; S155-S157 PolarHBondContact O-N 2.86Å; S155-S157 VanDerWaalsContact O-N 3.17Å; S157-L160 PolarHBondContact O-N 3Å; S157-T161 WeakPolarHBondContact O-CB 3.3Å; S157-T161 PolarHBondContact O-N 3.46Å; S157-T161 PolarHBondContact O-OG1 2.65Å; S157-A383 CarbonylContact C-O 3.59Å; S157-G385 WeakPolarHBondContact OG-CA 3.43Å; S157-G386 PolarHBondContact OG-N 2.82Å; S157-F387 PolarHBondContact OG-N 2.88Å
158	K	98.7	Very high	98.4	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-66.7	-44.7	177.1	-67	-169.9	175	70.6	0	111.5	S155 I156 L160 T161 T162 Y310 T312 F315 A383 G384	S155-K158 WeakPolarHBondContact O-CB 3.35Å; S155-K158 PolarHBondContact O-N 2.92Å; I156-K158 PolarHBondContact O-N 3.17Å; I156-K158 VanDerWaalsContact O-N 3.09Å; K158-L160 VanDerWaalsContact C-N 3.32Å; K158-L160 PolarHBondContact O-N 3.31Å; K158-T161 PolarHBondContact O-N 2.75Å; K158-T162 WeakPolarHBondContact O-CB 3.42Å; K158-T162 PolarHBondContact O-N 3.24Å; K158-T162 PolarHBondContact O-OG1 3.48Å; K158-T162 VanDerWaalsContact O-OG1 3.06Å; K158-Y310 HydrophobicContact CD-CE2 4.27Å; K158-Y310 WeakPolarHBondContact CD-OH 3.34Å; K158-Y310 VanDerWaalsContact CE-OH 3.31Å; K158-Y310 WeakPolarHBondContact CE-OH 3.45Å; K158-Y310 PolarHBondContact NZ-OH 3.18Å; K158-T312 PolarHBondContact NZ-OG1 3.2Å; K158-F315 HydrophobicContact CB-CD1 3.83Å; K158-F315 HydrophobicContact CB-CE1 3.47Å; K158-F315 VanDerWaalsContact CB-CE1 3.47Å; K158-F315 HydrophobicContact CB-CE2 4.49Å; K158-F315 HydrophobicContact CB-CG 4.48Å; K158-F315 HydrophobicContact CB-CZ 3.83Å; K158-F315 HydrophobicContact CD-CD1 4.11Å; K158-F315 HydrophobicContact CD-CD2 3.73Å; K158-F315 HydrophobicContact CD-CE1 4.14Å; K158-F315 HydrophobicContact CD-CE2 3.76Å; K158-F315 HydrophobicContact CD-CG 3.9Å; K158-F315 HydrophobicContact CD-CZ 3.96Å; K158-F315 HydrophobicContact CG-CD1 3.6Å; K158-F315 HydrophobicContact CG-CD2 4.16Å; K158-F315 HydrophobicContact CG-CE1 3.73Å; K158-F315 HydrophobicContact CG-CE2 4.28Å; K158-F315 HydrophobicContact CG-CG 3.82Å; K158-F315 HydrophobicContact CG-CZ 4.07Å; K158-A383 WeakPolarHBondContact CA-O 3.41Å; K158-A383 PolarHBondContact N-O 3.43Å; K158-G384 PolarHBondContact NZ-O 2.65Å
159	S	98.6	Very high	98.4	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-62.5	-40.3	177.4	-50.3	0	0	0	0	111.5	I156 T162 A163 G449 H471	I156-S159 WeakPolarHBondContact O-CB 3.41Å; I156-S159 PolarHBondContact O-N 2.95Å; S159-T162 PolarHBondContact O-N 3.11Å; S159-A163 PolarHBondContact O-N 3.4Å; S159-A163 VanDerWaalsContact O-N 3.11Å; S159-G449 PolarHBondContact OG-O 2.87Å; S159-H471 WeakPolarHBondContact OG-CB 3.49Å
160	L	98.8	Very high	98.3	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-61.7	-48.2	172.6	-62.8	172.5	0	0	0	111.1	I153 I156 S157 K158 T162 A163 A164 M334 M337 F338 M343 T346 F397	I153-L160 HydrophobicContact CD1-CD1 3.56Å; I156-L160 PolarHBondContact O-N 3Å; S157-L160 PolarHBondContact O-N 3Å; K158-L160 VanDerWaalsContact C-N 3.32Å; K158-L160 PolarHBondContact O-N 3.31Å; L160-T162 VanDerWaalsContact C-N 3.31Å; L160-T162 PolarHBondContact O-N 3.26Å; L160-A163 WeakPolarHBondContact O-CB 3.25Å; L160-A163 PolarHBondContact O-N 2.74Å; L160-A163 VanDerWaalsContact O-N 3.15Å; L160-A164 PolarHBondContact O-N 2.9Å; L160-A164 VanDerWaalsContact O-N 3.12Å; L160-M334 HydrophobicContact CB-CE 3.76Å; L160-M337 HydrophobicContact CB-CE 4.08Å; L160-M337 HydrophobicContact CD2-CE 4.42Å; L160-M337 WeakPolarHBondContact O-CE 3.24Å; L160-F338 HydrophobicContact CB-CE1 4.33Å; L160-F338 HydrophobicContact CD1-CE1 3.91Å; L160-F338 HydrophobicContact CD1-CZ 4.13Å; L160-F338 HydrophobicContact CD2-CE1 4.23Å; L160-F338 HydrophobicContact CG-CE1 4.39Å; L160-M343 HydrophobicContact CD2-CE 3.91Å; L160-M343 HydrophobicContact CD2-SD 4.41Å; L160-T346 HydrophobicContact CD1-CG2 4.42Å; L160-F397 HydrophobicContact CD2-CB 4.37Å; L160-F397 HydrophobicContact CD2-CD1 3.57Å; L160-F397 HydrophobicContact CD2-CD2 3.71Å; L160-F397 HydrophobicContact CD2-CE1 3.64Å; L160-F397 HydrophobicContact CD2-CE2 3.78Å; L160-F397 HydrophobicContact CD2-CG 3.61Å; L160-F397 HydrophobicContact CD2-CZ 3.75Å; L160-F397 HydrophobicContact CG-CE1 4.32Å; L160-F397 HydrophobicContact CG-CZ 4.48Å
161	T	98.8	Very high	98.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.8	-39.9	179.4	-58.1	0	0	0	0	111.9	S157 K158 A163 A164 A165 F315 L318 L322 F330 A383	S157-T161 WeakPolarHBondContact O-CB 3.3Å; S157-T161 PolarHBondContact O-N 3.46Å; S157-T161 PolarHBondContact O-OG1 2.65Å; K158-T161 PolarHBondContact O-N 2.75Å; T161-A163 VanDerWaalsContact C-N 3.32Å; T161-A163 PolarHBondContact O-N 3.01Å; T161-A164 WeakPolarHBondContact O-CB 3.13Å; T161-A164 PolarHBondContact O-N 2.79Å; T161-A165 PolarHBondContact O-N 3.01Å; T161-F315 HydrophobicContact CG2-CD1 4.38Å; T161-L318 HydrophobicContact CG2-CD2 3.88Å; T161-L318 HydrophobicContact CG2-CG 4.35Å; T161-L322 HydrophobicContact CG2-CD1 3.92Å; T161-F330 HydrophobicContact CG2-CE2 4.06Å; T161-F330 HydrophobicContact CG2-CZ 4.24Å; T161-A383 HydrophobicContact CG2-CB 3.8Å; T161-A383 VanDerWaalsContact OG1-CA 3.28Å; T161-A383 WeakPolarHBondContact OG1-CA 3.31Å; T161-A383 PolarHBondContact OG1-O 3.03Å; T161-A383 VanDerWaalsContact OG1-O 3.1Å
162	T	98.6	Very high	98.3	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-63.1	-39	176	-66.6	0	0	0	0	111.8	K158 S159 L160 A164 A165 A166 L205 L429 Q448	K158-T162 WeakPolarHBondContact O-CB 3.42Å; K158-T162 PolarHBondContact O-N 3.24Å; K158-T162 PolarHBondContact O-OG1 3.48Å; K158-T162 VanDerWaalsContact O-OG1 3.06Å; S159-T162 PolarHBondContact O-N 3.11Å; L160-T162 VanDerWaalsContact C-N 3.31Å; L160-T162 PolarHBondContact O-N 3.26Å; T162-A164 VanDerWaalsContact C-N 3.34Å; T162-A164 PolarHBondContact O-N 3.1Å; T162-A165 WeakPolarHBondContact O-CB 3.49Å; T162-A165 PolarHBondContact O-N 3.28Å; T162-A166 PolarHBondContact O-N 3.49Å; T162-L205 HydrophobicContact CG2-CD2 3.83Å; T162-L205 VanDerWaalsContact OG1-CD2 3.28Å; T162-L205 WeakPolarHBondContact OG1-CD2 3.45Å; T162-L429 HydrophobicContact CG2-CD1 4.3Å; T162-L429 HydrophobicContact CG2-CD2 3.26Å; T162-L429 HydrophobicContact CG2-CG 4.35Å; T162-Q448 HydrophobicContact CG2-CB 3.86Å; T162-Q448 VanDerWaalsContact CG2-O 3.26Å; T162-Q448 WeakPolarHBondContact CG2-O 3.36Å
163	A	98.6	Very high	98.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64	-40.1	175.5	0	0	0	0	0	111.6	S159 L160 T161 A166 R167 M337 F397 F420	S159-A163 PolarHBondContact O-N 3.4Å; S159-A163 VanDerWaalsContact O-N 3.11Å; L160-A163 WeakPolarHBondContact O-CB 3.25Å; L160-A163 PolarHBondContact O-N 2.74Å; L160-A163 VanDerWaalsContact O-N 3.15Å; T161-A163 VanDerWaalsContact C-N 3.32Å; T161-A163 PolarHBondContact O-N 3.01Å; A163-A166 PolarHBondContact O-N 3.41Å; A163-R167 PolarHBondContact O-N 2.79Å; A163-M337 HydrophobicContact CB-SD 4.18Å; A163-F397 HydrophobicContact CB-CE2 3.71Å; A163-F397 HydrophobicContact CB-CZ 3.97Å; A163-F420 HydrophobicContact CB-CE1 4.13Å
164	A	98.6	Very high	98.3	Very high	3 Å²	3	20.6 Å²	20.6	3%	0.025	12%	0.119	C	C	.	.	H	α-helix	trans	-63.8	-41	172.2	0	0	0	0	0	112.5	L160 T161 T162 A166 R167 L168 L322 I333 M334 M337	L160-A164 PolarHBondContact O-N 2.9Å; L160-A164 VanDerWaalsContact O-N 3.12Å; T161-A164 WeakPolarHBondContact O-CB 3.13Å; T161-A164 PolarHBondContact O-N 2.79Å; T162-A164 VanDerWaalsContact C-N 3.34Å; T162-A164 PolarHBondContact O-N 3.1Å; A164-A166 VanDerWaalsContact C-N 3.33Å; A164-A166 PolarHBondContact O-N 2.91Å; A164-R167 WeakPolarHBondContact O-CB 3.27Å; A164-R167 PolarHBondContact O-N 3.2Å; A164-L168 WeakPolarHBondContact O-CG 3.4Å; A164-L168 PolarHBondContact O-N 3.17Å; A164-L322 HydrophobicContact CB-CD1 4.37Å; A164-I333 HydrophobicContact CB-CG2 4.32Å; A164-M334 HydrophobicContact CB-SD 3.73Å; A164-M337 HydrophobicContact CB-SD 3.97Å
165	A	98.8	Very high	98.4	Very high	1 Å²	1	24 Å²	24	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-60.9	-41.7	174.7	0	0	0	0	0	111.9	T161 T162 L168 C169 L174 L205 L322	T161-A165 PolarHBondContact O-N 3.01Å; T162-A165 WeakPolarHBondContact O-CB 3.49Å; T162-A165 PolarHBondContact O-N 3.28Å; A165-L168 PolarHBondContact O-N 3.35Å; A165-C169 PolarHBondContact O-N 3.12Å; A165-L174 HydrophobicContact CB-CD2 4.01Å; A165-L205 HydrophobicContact CB-CD2 4.26Å; A165-L322 HydrophobicContact CB-CD1 4.07Å; A165-L322 HydrophobicContact CB-CD2 3.78Å
166	A	98.5	Very high	98.5	Very high	10 Å²	10	24 Å²	24	8%	0.083	14%	0.137	C	C	.	.	H	α-helix	trans	-62.4	-43.3	175.8	0	0	0	0	0	111.7	T162 A163 A164 L168 C169 E170 L421 L429	T162-A166 PolarHBondContact O-N 3.49Å; A163-A166 PolarHBondContact O-N 3.41Å; A164-A166 VanDerWaalsContact C-N 3.33Å; A164-A166 PolarHBondContact O-N 2.91Å; A166-L168 PolarHBondContact O-N 2.99Å; A166-C169 WeakPolarHBondContact O-CB 3.44Å; A166-C169 PolarHBondContact O-N 3Å; A166-C169 VanDerWaalsContact O-N 3.17Å; A166-E170 WeakPolarHBondContact O-CG 3.46Å; A166-E170 PolarHBondContact O-N 3.5Å; A166-L421 HydrophobicContact CB-CD1 4.16Å; A166-L421 HydrophobicContact CB-CD2 3.89Å; A166-L429 HydrophobicContact CB-CD2 4.33Å
167	R	98.1	Very high	98.4	Very high	62 Å²	62	28.3 Å²	28.3	23%	0.234	16%	0.16	C	C	.	.	H	α-helix	trans	-57.8	-48	173.5	-72.9	-65.5	-64.6	170.6	-17.7	112.5	A163 A164 C169 E170 E171 E340 F420 L421	A163-R167 PolarHBondContact O-N 2.79Å; A164-R167 WeakPolarHBondContact O-CB 3.27Å; A164-R167 PolarHBondContact O-N 3.2Å; R167-C169 PolarHBondContact O-N 3.08Å; R167-E170 IonicContact NH1-OE2 3.36Å; R167-E170 PolarHBondContact NH1-OE2 3.15Å; R167-E170 VanDerWaalsContact NH1-OE2 3.14Å; R167-E170 WeakPolarHBondContact O-CB 3.14Å; R167-E170 PolarHBondContact O-N 3.26Å; R167-E171 WeakPolarHBondContact O-CG 3.18Å; R167-E171 PolarHBondContact O-N 3.4Å; R167-E340 IonicContact NH2-OE1 3.75Å; R167-F420 WeakPolarHBondContact CD-O 3.46Å; R167-F420 HydrophobicContact CG-CE1 4.04Å; R167-F420 HydrophobicContact CG-CE2 4.12Å; R167-F420 HydrophobicContact CG-CZ 3.54Å; R167-F420 PolarHBondContact NH1-O 2.98Å; R167-L421 HydrophobicContact CG-CD2 3.68Å
168	L	98.6	Very high	98.4	Very high	7 Å²	7	28.6 Å²	28.6	4%	0.037	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-31.1	177.8	-67.8	175.1	0	0	0	112.4	A164 A165 A166 G172 K173 L174 L322 A326 I333	A164-L168 WeakPolarHBondContact O-CG 3.4Å; A164-L168 PolarHBondContact O-N 3.17Å; A165-L168 PolarHBondContact O-N 3.35Å; A166-L168 PolarHBondContact O-N 2.99Å; L168-G172 PolarHBondContact O-N 2.91Å; L168-K173 HydrophobicContact CB-CB 4.46Å; L168-K173 HydrophobicContact CD2-CB 4.36Å; L168-K173 HydrophobicContact CD2-CD 3.8Å; L168-K173 PolarHBondContact O-N 3.47Å; L168-L174 HydrophobicContact CB-CB 3.87Å; L168-L174 PolarHBondContact O-N 3.36Å; L168-L322 HydrophobicContact CD1-CB 3.96Å; L168-L322 HydrophobicContact CD1-CD2 4.04Å; L168-L322 HydrophobicContact CD1-CG 4.37Å; L168-A326 HydrophobicContact CD1-CB 4.14Å; L168-A326 HydrophobicContact CD2-CB 3.81Å; L168-I333 HydrophobicContact CD1-CD1 4.47Å
169	C	98.4	Very high	98.4	Very high	55 Å²	55	31.3 Å²	31.3	37%	0.372	18%	0.18	S	C	.	.	H	α-helix	trans	-67.9	-42.9	171.2	-171.5	0	0	0	0	111.8	A165 A166 R167 E171 G172 L174	A165-C169 PolarHBondContact O-N 3.12Å; A166-C169 WeakPolarHBondContact O-CB 3.44Å; A166-C169 PolarHBondContact O-N 3Å; A166-C169 VanDerWaalsContact O-N 3.17Å; R167-C169 PolarHBondContact O-N 3.08Å; C169-E171 PolarHBondContact O-N 3.47Å; C169-G172 PolarHBondContact O-N 2.82Å; C169-L174 WeakPolarHBondContact CA-O 3.37Å
170	E	97.8	Very high	98.4	Very high	29 Å²	29	31.3 Å²	31.3	14%	0.136	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-31.2	176.7	-70.3	178.5	176.8	0	0	113.5	A166 R167 G172 K422 S425	A166-E170 WeakPolarHBondContact O-CG 3.46Å; A166-E170 PolarHBondContact O-N 3.5Å; R167-E170 IonicContact NH1-OE2 3.36Å; R167-E170 PolarHBondContact NH1-OE2 3.15Å; R167-E170 VanDerWaalsContact NH1-OE2 3.14Å; R167-E170 WeakPolarHBondContact O-CB 3.14Å; R167-E170 PolarHBondContact O-N 3.26Å; E170-G172 VanDerWaalsContact C-N 3.26Å; E170-K422 HydrophobicContact CB-CD 4.4Å; E170-K422 HydrophobicContact CG-CD 3.97Å; E170-K422 HydrophobicContact CG-CG 4.26Å; E170-K422 PolarHBondContact O-NZ 3.27Å; E170-K422 WeakPolarHBondContact OE1-CA 3.4Å; E170-K422 VanDerWaalsContact OE1-CB 3.25Å; E170-K422 WeakPolarHBondContact OE1-CB 3.48Å; E170-K422 PolarHBondContact OE1-N 3.05Å; E170-S425 WeakPolarHBondContact OE1-CB 3.5Å; E170-S425 PolarHBondContact OE1-OG 3.33Å
171	E	97.9	Very high	98.4	Very high	91 Å²	91	33 Å²	33	43%	0.425	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-4.7	174.6	-68.8	174.3	-163.2	0	0	113.1	R167 C169 K173	R167-E171 WeakPolarHBondContact O-CG 3.18Å; R167-E171 PolarHBondContact O-N 3.4Å; C169-E171 PolarHBondContact O-N 3.47Å; E171-K173 HydrophobicContact CB-CD 4.24Å; E171-K173 HydrophobicContact CB-CG 4.19Å; E171-K173 PolarHBondContact O-N 3.11Å; E171-K173 WeakPolarHBondContact OE2-CD 3.36Å; E171-K173 VanDerWaalsContact OE2-CE 3.24Å; E171-K173 WeakPolarHBondContact OE2-CE 3.43Å; E171-K173 IonicContact OE2-NZ 2.71Å; E171-K173 PolarHBondContact OE2-NZ 2.94Å
172	G	98.1	Very high	98.3	Very high	67 Å²	67	39 Å²	39	69%	0.691	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.7	10.6	-177.9	0	0	0	0	0	114.6	L168 C169 E170	L168-G172 PolarHBondContact O-N 2.91Å; C169-G172 PolarHBondContact O-N 2.82Å; E170-G172 VanDerWaalsContact C-N 3.26Å
173	K	98.5	Very high	98.3	Very high	93 Å²	93	40 Å²	40	40%	0.404	22%	0.218	S	C	.	.	S	Bend	trans	-83.3	-31.5	179.5	-67.2	176.4	-178.9	163.5	0	112.6	L168 E171	L168-K173 HydrophobicContact CB-CB 4.46Å; L168-K173 HydrophobicContact CD2-CB 4.36Å; L168-K173 HydrophobicContact CD2-CD 3.8Å; L168-K173 PolarHBondContact O-N 3.47Å; E171-K173 HydrophobicContact CB-CD 4.24Å; E171-K173 HydrophobicContact CB-CG 4.19Å; E171-K173 PolarHBondContact O-N 3.11Å; E171-K173 WeakPolarHBondContact OE2-CD 3.36Å; E171-K173 VanDerWaalsContact OE2-CE 3.24Å; E171-K173 WeakPolarHBondContact OE2-CE 3.43Å; E171-K173 IonicContact OE2-NZ 2.71Å; E171-K173 PolarHBondContact OE2-NZ 2.94Å
174	L	98.7	Very high	98.3	Very high	5 Å²	5	40 Å²	40	3%	0.026	22%	0.218	C	C	.	.			trans	-115.6	117.1	179.6	-177.9	67.7	0	0	0	111.3	A165 L168 C169 L176 Y183 V321 L322 A325	A165-L174 HydrophobicContact CB-CD2 4.01Å; L168-L174 HydrophobicContact CB-CB 3.87Å; L168-L174 PolarHBondContact O-N 3.36Å; C169-L174 WeakPolarHBondContact CA-O 3.37Å; L174-L176 HydrophobicContact CD2-CD2 3.61Å; L174-L176 HydrophobicContact CG-CD2 4.04Å; L174-Y183 HydrophobicContact CD1-CE1 4.46Å; L174-Y183 HydrophobicContact CD1-CE2 3.93Å; L174-V321 HydrophobicContact CD1-CG1 3.63Å; L174-L322 HydrophobicContact CD2-CD2 3.59Å; L174-A325 HydrophobicContact CB-CB 4.42Å; L174-A325 HydrophobicContact CD1-CB 4.17Å
175	D	98.4	Very high	98.2	Very high	72 Å²	72	44.6 Å²	44.6	39%	0.385	25%	0.247	S	C	.	.			trans	-90.1	117	162	178.1	-4.1	0	0	0	109.3	D177 A178 K182 Y183	D175-D177 VanDerWaalsContact C-N 3.3Å; D175-D177 PolarHBondContact O-N 3.33Å; D175-D177 PolarHBondContact OD1-N 2.9Å; D175-A178 HydrophobicContact CB-CB 4.03Å; D175-A178 PolarHBondContact OD1-N 3.41Å; D175-K182 IonicContact OD2-NZ 3.97Å; D175-Y183 WeakPolarHBondContact CB-OH 3.32Å; D175-Y183 PolarHBondContact N-OH 2.97Å; D175-Y183 PolarHBondContact O-OH 3.18Å
176	L	97.9	Very high	98	Very high	9 Å²	9	47.5 Å²	47.5	5%	0.047	26%	0.261	C	S	.	.	S	Bend	trans	-73	-20.6	-176.6	-66.5	-179	0	0	0	113.9	L174 T200 S201 R202 L205	L174-L176 HydrophobicContact CD2-CD2 3.61Å; L174-L176 HydrophobicContact CG-CD2 4.04Å; L176-T200 WeakPolarHBondContact O-CB 3.42Å; L176-T200 PolarHBondContact O-OG1 3.46Å; L176-S201 PolarHBondContact O-N 2.87Å; L176-R202 HydrophobicContact CB-CB 4.19Å; L176-R202 WeakPolarHBondContact O-CB 3.25Å; L176-R202 PolarHBondContact O-N 3.09Å; L176-L205 HydrophobicContact CD2-CD1 3.72Å
177	D	98.1	Very high	97.9	Very high	89 Å²	89	47.1 Å²	47.1	48%	0.476	26%	0.257	S	S	.	.	S	Bend	trans	-103.6	-8.2	-174.3	-64.9	-56.5	0	0	0	112.6	D175 T200 R202	D175-D177 VanDerWaalsContact C-N 3.3Å; D175-D177 PolarHBondContact O-N 3.33Å; D175-D177 PolarHBondContact OD1-N 2.9Å; D177-T200 VanDerWaalsContact O-CG2 3.3Å; D177-T200 WeakPolarHBondContact O-CG2 3.19Å; D177-R202 WeakPolarHBondContact OD1-CD 3.09Å; D177-R202 IonicContact OD1-CZ 3.03Å; D177-R202 IonicContact OD1-NE 2.92Å; D177-R202 PolarHBondContact OD1-NE 3.15Å; D177-R202 IonicContact OD1-NH2 2.75Å; D177-R202 IonicContact OD2-CZ 2.7Å; D177-R202 IonicContact OD2-NE 3.41Å; D177-R202 PolarHBondContact OD2-NE 3.37Å; D177-R202 IonicContact OD2-NH2 2.97Å; D177-R202 PolarHBondContact OD2-NH2 2.83Å
178	A	98.4	Very high	97.9	Very high	7 Å²	7	46.1 Å²	46.1	6%	0.058	26%	0.259	C	S	.	.	S	Bend	trans	-64.4	147.8	168.9	0	0	0	0	0	112	D175 V180 K182 Y183	D175-A178 HydrophobicContact CB-CB 4.03Å; D175-A178 PolarHBondContact OD1-N 3.41Å; A178-V180 PolarHBondContact O-N 3.16Å; A178-K182 HydrophobicContact CB-CB 4.38Å; A178-K182 HydrophobicContact CB-CD 3.51Å; A178-Y183 HydrophobicContact CB-CE2 4.22Å
179	P	98.4	Very high	97.8	Very high	56 Å²	56	50.3 Å²	50.3	36%	0.364	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-54.2	138.7	166.9	-22.8	32.3	0	0	0	111	Q181 K182 T198 I199	P179-Q181 PolarHBondContact O-N 3.41Å; P179-Q181 VanDerWaalsContact O-N 3.11Å; P179-K182 WeakPolarHBondContact O-CB 3.28Å; P179-K182 PolarHBondContact O-N 3.31Å; P179-T198 HydrophobicContact CB-CG2 3.85Å; P179-T198 HydrophobicContact CG-CG2 3.82Å; P179-I199 WeakPolarHBondContact CA-O 3.3Å
180	V	98.3	Very high	97.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-56.6	-29.1	177.1	-68.2	0	0	0	0	112.6	A178 K182 Y183 V184 F187 I199 I204 L317 V321	A178-V180 PolarHBondContact O-N 3.16Å; V180-K182 PolarHBondContact O-N 2.64Å; V180-Y183 PolarHBondContact O-N 3.22Å; V180-V184 PolarHBondContact O-N 3.1Å; V180-F187 HydrophobicContact CG2-CD1 4.13Å; V180-I199 HydrophobicContact CG1-CG2 4.13Å; V180-I199 HydrophobicContact CG2-CB 4.22Å; V180-I199 HydrophobicContact CG2-CG2 4.46Å; V180-I199 PolarHBondContact N-O 2.81Å; V180-I204 HydrophobicContact CG1-CD1 3.79Å; V180-L317 HydrophobicContact CB-CD2 4.43Å; V180-L317 HydrophobicContact CG1-CD2 4.32Å; V180-L317 HydrophobicContact CG2-CD2 4.2Å; V180-V321 HydrophobicContact CB-CG2 4.18Å; V180-V321 HydrophobicContact CG1-CG2 4.18Å
181	Q	98.2	Very high	97.6	Very high	35 Å²	35	52.4 Å²	52.4	16%	0.164	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-62.4	-20.6	176.1	-68.9	80.3	4.1	0	0	113.6	P179 Y183 F187 P188	P179-Q181 PolarHBondContact O-N 3.41Å; P179-Q181 VanDerWaalsContact O-N 3.11Å; Q181-Y183 PolarHBondContact O-N 3.38Å; Q181-F187 WeakPolarHBondContact CG-O 3.28Å; Q181-F187 PolarHBondContact NE2-O 3.49Å; Q181-P188 PolarHBondContact NE2-O 3.07Å
182	K	98.2	Very high	97.4	Very high	128 Å²	128	49.8 Å²	49.8	56%	0.557	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-57.2	-35.9	170.5	-179.9	-177.4	175	-171	0	111.3	D175 A178 P179 V180	D175-K182 IonicContact OD2-NZ 3.97Å; A178-K182 HydrophobicContact CB-CB 4.38Å; A178-K182 HydrophobicContact CB-CD 3.51Å; P179-K182 WeakPolarHBondContact O-CB 3.28Å; P179-K182 PolarHBondContact O-N 3.31Å; V180-K182 PolarHBondContact O-N 2.64Å
183	Y	98.3	Very high	97.2	Very high	21 Å²	21	53.2 Å²	53.2	8%	0.082	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-36.1	-177.4	-53.7	-77	0	0	0	112.1	L174 D175 A178 V180 Q181 P185 V321 R324 A325	L174-Y183 HydrophobicContact CD1-CE1 4.46Å; L174-Y183 HydrophobicContact CD1-CE2 3.93Å; D175-Y183 WeakPolarHBondContact CB-OH 3.32Å; D175-Y183 PolarHBondContact N-OH 2.97Å; D175-Y183 PolarHBondContact O-OH 3.18Å; A178-Y183 HydrophobicContact CB-CE2 4.22Å; V180-Y183 PolarHBondContact O-N 3.22Å; Q181-Y183 PolarHBondContact O-N 3.38Å; Y183-P185 WeakPolarHBondContact O-CD 3.5Å; Y183-V321 HydrophobicContact CD2-CG1 3.63Å; Y183-V321 HydrophobicContact CE2-CG1 4.25Å; Y183-V321 HydrophobicContact CG-CG1 3.93Å; Y183-R324 VanDerWaalsContact O-CB 3.27Å; Y183-R324 WeakPolarHBondContact O-CB 3.01Å; Y183-R324 VanDerWaalsContact O-CG 3.24Å; Y183-R324 WeakPolarHBondContact O-CG 3.47Å; Y183-A325 HydrophobicContact CD1-CB 3.81Å; Y183-A325 HydrophobicContact CE1-CB 3.87Å
184	V	98.1	Very high	96.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.284	C	S	.	.			trans	-123.7	74.4	-174.9	-170.4	0	0	0	0	109	V180 E186 F187 L292 L317 A320 V321 R324	V180-V184 PolarHBondContact O-N 3.1Å; V184-E186 HydrophobicContact CG1-CG 3.76Å; V184-E186 PolarHBondContact O-N 3.46Å; V184-E186 VanDerWaalsContact O-N 3.16Å; V184-F187 HydrophobicContact CB-CB 4.35Å; V184-F187 HydrophobicContact CG1-CB 3.94Å; V184-F187 WeakPolarHBondContact O-CB 3.03Å; V184-F187 PolarHBondContact O-N 3.32Å; V184-L292 HydrophobicContact CG1-CD1 3.66Å; V184-L317 HydrophobicContact CB-CD1 4.47Å; V184-L317 HydrophobicContact CG1-CD1 4.38Å; V184-L317 HydrophobicContact CG2-CD1 4.44Å; V184-A320 HydrophobicContact CG1-CB 4.47Å; V184-A320 HydrophobicContact CG2-CB 3.88Å; V184-V321 HydrophobicContact CG2-CB 4.44Å; V184-V321 HydrophobicContact CG2-CG2 3.75Å; V184-R324 HydrophobicContact CG2-CG 4.5Å
185	P	97.1	Very high	96.8	Very high	99 Å²	99	59 Å²	59	64%	0.643	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.4	-177.6	25.6	-35.9	0	0	0	113.5	Y183 F187	Y183-P185 WeakPolarHBondContact O-CD 3.5Å; P185-F187 VanDerWaalsContact C-N 3.28Å; P185-F187 PolarHBondContact O-N 3.02Å
186	E	93.3	Very high	96.8	Very high	63 Å²	63	60.7 Å²	60.7	29%	0.294	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-13.4	174.7	63.7	-89.9	-144.2	0	0	114.1	V184 T289 R324	V184-E186 HydrophobicContact CG1-CG 3.76Å; V184-E186 PolarHBondContact O-N 3.46Å; V184-E186 VanDerWaalsContact O-N 3.16Å; E186-T289 HydrophobicContact CG-CG2 3.94Å; E186-T289 WeakPolarHBondContact OE1-CG2 3.45Å; E186-T289 PolarHBondContact OE1-OG1 3.05Å; E186-R324 IonicContact OE1-NE 3.96Å; E186-R324 IonicContact OE1-NH2 3.24Å; E186-R324 PolarHBondContact OE1-NH2 2.91Å
187	F	97.6	Very high	96.8	Very high	1 Å²	1	61 Å²	61	0%	0.004	33%	0.327	C	S	.	.	S	Bend	trans	-80.4	118.8	173	-166.6	-94.9	0	0	0	109.3	V180 Q181 V184 P185 K190 I199 I211 F295 K296 L317	V180-F187 HydrophobicContact CG2-CD1 4.13Å; Q181-F187 WeakPolarHBondContact CG-O 3.28Å; Q181-F187 PolarHBondContact NE2-O 3.49Å; V184-F187 HydrophobicContact CB-CB 4.35Å; V184-F187 HydrophobicContact CG1-CB 3.94Å; V184-F187 WeakPolarHBondContact O-CB 3.03Å; V184-F187 PolarHBondContact O-N 3.32Å; P185-F187 VanDerWaalsContact C-N 3.28Å; P185-F187 PolarHBondContact O-N 3.02Å; F187-K190 HydrophobicContact CE1-CD 4.48Å; F187-K190 HydrophobicContact CE1-CG 4.08Å; F187-I199 HydrophobicContact CE1-CD1 4.34Å; F187-I211 HydrophobicContact CZ-CD1 4.21Å; F187-F295 HydrophobicContact CE2-CD2 4.42Å; F187-F295 AromaticContact CE2-CE2 3.76Å; F187-F295 HydrophobicContact CE2-CE2 3.76Å; F187-F295 HydrophobicContact CE2-CZ 4.39Å; F187-F295 HydrophobicContact CZ-CE2 4.26Å; F187-K296 HydrophobicContact CD2-CB 3.84Å; F187-K296 HydrophobicContact CE2-CB 3.83Å; F187-L317 HydrophobicContact CB-CD1 4.17Å; F187-L317 HydrophobicContact CD1-CD2 4.11Å; F187-L317 HydrophobicContact CD2-CD1 3.65Å; F187-L317 HydrophobicContact CD2-CD2 4.08Å; F187-L317 HydrophobicContact CD2-CG 4.45Å; F187-L317 HydrophobicContact CE1-CD2 3.88Å; F187-L317 HydrophobicContact CE2-CD1 4.14Å; F187-L317 HydrophobicContact CE2-CD2 3.85Å; F187-L317 HydrophobicContact CE2-CG 4.49Å; F187-L317 HydrophobicContact CG-CD1 3.85Å; F187-L317 HydrophobicContact CG-CD2 4.2Å; F187-L317 HydrophobicContact CZ-CD2 3.74Å
188	P	96.9	Very high	96.7	Very high	41 Å²	41	60 Å²	60	27%	0.266	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-65.1	150.4	-168.1	26.3	-34.2	0	0	0	111.9	Q181 K190 K296	Q181-P188 PolarHBondContact NE2-O 3.07Å; P188-K190 PolarHBondContact O-N 3.21Å; P188-K296 WeakPolarHBondContact CD-O 3.49Å; P188-K296 WeakPolarHBondContact CG-O 3.47Å
189	Q	96.1	Very high	96.7	Very high	95 Å²	95	59.7 Å²	59.7	44%	0.444	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-58.7	128.1	168.5	-176.5	61.1	18.1	0	0	108.8	V197	Q189-V197 PolarHBondContact NE2-O 3.48Å
190	K	96.4	Very high	96.7	Very high	15 Å²	15	57.5 Å²	57.5	7%	0.065	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	145.4	-176.5	-67.7	-62.3	-173.6	175.5	0	111	F187 P188 V197 I199 K296 D298 L300	F187-K190 HydrophobicContact CE1-CD 4.48Å; F187-K190 HydrophobicContact CE1-CG 4.08Å; P188-K190 PolarHBondContact O-N 3.21Å; K190-V197 HydrophobicContact CB-CG2 3.99Å; K190-V197 WeakPolarHBondContact O-CG2 3.42Å; K190-V197 PolarHBondContact O-N 3.08Å; K190-I199 HydrophobicContact CB-CD1 4.45Å; K190-I199 HydrophobicContact CG-CD1 3.93Å; K190-K296 VanDerWaalsContact CE-O 3.32Å; K190-K296 WeakPolarHBondContact CE-O 3.31Å; K190-K296 PolarHBondContact NZ-O 3.11Å; K190-D298 PolarHBondContact NZ-O 3.4Å; K190-L300 HydrophobicContact CB-CD1 3.79Å; K190-L300 HydrophobicContact CB-CG 4.19Å; K190-L300 HydrophobicContact CD-CD2 4.34Å; K190-L300 HydrophobicContact CD-CG 4.34Å; K190-L300 HydrophobicContact CG-CD1 4.26Å; K190-L300 HydrophobicContact CG-CD2 4.25Å; K190-L300 HydrophobicContact CG-CG 4.27Å
191	Q	95.9	Very high	96.7	Very high	113 Å²	113	57.5 Å²	57.5	53%	0.528	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	147.2	170	-68.3	-174.4	-10.6	0	0	110.5	K195 D196	Q191-K195 CarbonylContact C-O 3.49Å; Q191-K195 WeakPolarHBondContact CA-O 3.41Å; Q191-D196 VanDerWaalsContact CG-OD1 3.23Å; Q191-D196 WeakPolarHBondContact CG-OD1 3.5Å; Q191-D196 PolarHBondContact NE2-OD1 3.39Å
192	F	94.9	Very high	96.7	Very high	37 Å²	37	60 Å²	60	16%	0.162	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	125.3	169.1	-168.1	-90.2	0	0	0	108.2	G194 K195 V197 L300 K303	F192-G194 VanDerWaalsContact C-N 3.26Å; F192-G194 PolarHBondContact O-N 3.18Å; F192-K195 PolarHBondContact N-O 3.35Å; F192-K195 PolarHBondContact O-N 2.93Å; F192-K195 VanDerWaalsContact O-N 3.16Å; F192-V197 HydrophobicContact CB-CG1 3.97Å; F192-V197 HydrophobicContact CB-CG2 4.18Å; F192-L300 HydrophobicContact CD2-CB 4.13Å; F192-K303 HydrophobicContact CD1-CB 3.75Å; F192-K303 HydrophobicContact CD1-CG 4.34Å; F192-K303 HydrophobicContact CE1-CB 3.91Å; F192-K303 HydrophobicContact CG-CB 4.1Å; F192-K303 HydrophobicContact CZ-CB 4.4Å
193	D	93.4	Very high	96.7	Very high	138 Å²	138	56.2 Å²	56.2	74%	0.738	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	43.2	-173	-59.1	-25.6	0	0	0	113.4	K195	D193-K195 VanDerWaalsContact C-N 3.25Å; D193-K195 PolarHBondContact O-N 3.46Å
194	G	93.3	Very high	96.7	Very high	65 Å²	65	55.2 Å²	55.2	67%	0.67	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	10.6	177.8	0	0	0	0	0	115.2	F192	F192-G194 VanDerWaalsContact C-N 3.26Å; F192-G194 PolarHBondContact O-N 3.18Å
195	K	96.1	Very high	96.7	Very high	156 Å²	156	55.3 Å²	55.3	68%	0.678	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	139.8	177.6	-63.1	-178.7	-177.9	-179.4	0	110.9	Q191 F192 D193 V197	Q191-K195 CarbonylContact C-O 3.49Å; Q191-K195 WeakPolarHBondContact CA-O 3.41Å; F192-K195 PolarHBondContact N-O 3.35Å; F192-K195 PolarHBondContact O-N 2.93Å; F192-K195 VanDerWaalsContact O-N 3.16Å; D193-K195 VanDerWaalsContact C-N 3.25Å; D193-K195 PolarHBondContact O-N 3.46Å; K195-V197 PolarHBondContact O-N 3.46Å
196	D	97	Very high	96.7	Very high	106 Å²	106	50.7 Å²	50.7	57%	0.567	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.9	135.2	173.4	-67.5	-16.6	0	0	0	110.6	Q191	Q191-D196 VanDerWaalsContact CG-OD1 3.23Å; Q191-D196 WeakPolarHBondContact CG-OD1 3.5Å; Q191-D196 PolarHBondContact NE2-OD1 3.39Å
197	V	97.8	Very high	96.9	Very high	16 Å²	16	47.7 Å²	47.7	10%	0.097	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	145.5	178.3	-66.5	0	0	0	0	110.7	Q189 K190 F192 K195 L300 P304	Q189-V197 PolarHBondContact NE2-O 3.48Å; K190-V197 HydrophobicContact CB-CG2 3.99Å; K190-V197 WeakPolarHBondContact O-CG2 3.42Å; K190-V197 PolarHBondContact O-N 3.08Å; F192-V197 HydrophobicContact CB-CG1 3.97Å; F192-V197 HydrophobicContact CB-CG2 4.18Å; K195-V197 PolarHBondContact O-N 3.46Å; V197-L300 HydrophobicContact CG2-CD1 3.7Å; V197-P304 HydrophobicContact CB-CG 4.1Å; V197-P304 HydrophobicContact CG2-CG 3.91Å
198	T	97.7	Very high	96.8	Very high	67 Å²	67	48.2 Å²	48.2	41%	0.411	26%	0.255	S	S	.	.			trans	-97.6	136.4	179.1	-57	0	0	0	0	110.3	P179 T200 P304	P179-T198 HydrophobicContact CB-CG2 3.85Å; P179-T198 HydrophobicContact CG-CG2 3.82Å; T198-T200 HydrophobicContact CG2-CG2 4.08Å; T198-P304 WeakPolarHBondContact O-CB 3.44Å
199	I	98.4	Very high	96.8	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	24%	0.242	C	C	.	.			trans	-109.6	134.6	167.6	-61.6	172.7	0	0	0	107.3	P179 V180 F187 K190 I204 I211 L300 P304	P179-I199 WeakPolarHBondContact CA-O 3.3Å; V180-I199 HydrophobicContact CG1-CG2 4.13Å; V180-I199 HydrophobicContact CG2-CB 4.22Å; V180-I199 HydrophobicContact CG2-CG2 4.46Å; V180-I199 PolarHBondContact N-O 2.81Å; F187-I199 HydrophobicContact CE1-CD1 4.34Å; K190-I199 HydrophobicContact CB-CD1 4.45Å; K190-I199 HydrophobicContact CG-CD1 3.93Å; I199-I204 HydrophobicContact CG2-CD1 4.1Å; I199-I204 HydrophobicContact CG2-CG1 4.02Å; I199-I211 HydrophobicContact CD1-CD1 4.18Å; I199-I211 HydrophobicContact CD1-CG1 4.11Å; I199-L300 HydrophobicContact CD1-CD1 4.23Å; I199-L300 HydrophobicContact CD1-CD2 3.9Å; I199-P304 HydrophobicContact CG1-CB 4.34Å; I199-P304 HydrophobicContact CG1-CG 3.84Å
200	T	98.6	Very high	96.8	Very high	11 Å²	11	41.8 Å²	41.8	7%	0.067	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-120.1	161.6	176.9	73.3	0	0	0	0	110.8	L176 D177 T198 R202 M203 I204	L176-T200 WeakPolarHBondContact O-CB 3.42Å; L176-T200 PolarHBondContact O-OG1 3.46Å; D177-T200 VanDerWaalsContact O-CG2 3.3Å; D177-T200 WeakPolarHBondContact O-CG2 3.19Å; T198-T200 HydrophobicContact CG2-CG2 4.08Å; T200-R202 VanDerWaalsContact C-N 3.27Å; T200-R202 PolarHBondContact O-N 2.93Å; T200-M203 WeakPolarHBondContact O-CB 3.35Å; T200-M203 PolarHBondContact O-N 3.09Å; T200-M203 VanDerWaalsContact O-N 3.16Å; T200-M203 PolarHBondContact OG1-N 2.61Å; T200-I204 PolarHBondContact O-N 3.41Å; T200-I204 VanDerWaalsContact O-N 3.15Å
201	S	98.4	Very high	96.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.1	-36.1	176.1	-56.5	0	0	0	0	111.9	L176 M203 I204 L205	L176-S201 PolarHBondContact O-N 2.87Å; S201-M203 VanDerWaalsContact C-N 3.3Å; S201-M203 PolarHBondContact O-N 2.83Å; S201-I204 WeakPolarHBondContact O-CB 3.14Å; S201-I204 PolarHBondContact O-N 2.76Å; S201-I204 VanDerWaalsContact O-N 3.09Å; S201-L205 VanDerWaalsContact O-CG 3.31Å; S201-L205 WeakPolarHBondContact O-CG 3.49Å; S201-L205 PolarHBondContact O-N 3.18Å
202	R	97.9	Very high	96.8	Very high	88 Å²	88	36.2 Å²	36.2	33%	0.332	20%	0.195	S	C	.	.	H	α-helix	trans	-57.3	-42.3	174.2	-169.9	178.3	-59.7	-76.1	1	112.3	L176 D177 T200 I204 S206	L176-R202 HydrophobicContact CB-CB 4.19Å; L176-R202 WeakPolarHBondContact O-CB 3.25Å; L176-R202 PolarHBondContact O-N 3.09Å; D177-R202 WeakPolarHBondContact OD1-CD 3.09Å; D177-R202 IonicContact OD1-CZ 3.03Å; D177-R202 IonicContact OD1-NE 2.92Å; D177-R202 PolarHBondContact OD1-NE 3.15Å; D177-R202 IonicContact OD1-NH2 2.75Å; D177-R202 IonicContact OD2-CZ 2.7Å; D177-R202 IonicContact OD2-NE 3.41Å; D177-R202 PolarHBondContact OD2-NE 3.37Å; D177-R202 IonicContact OD2-NH2 2.97Å; D177-R202 PolarHBondContact OD2-NH2 2.83Å; T200-R202 VanDerWaalsContact C-N 3.27Å; T200-R202 PolarHBondContact O-N 2.93Å; R202-I204 VanDerWaalsContact C-N 3.35Å; R202-S206 PolarHBondContact O-N 2.87Å; R202-S206 PolarHBondContact O-OG 2.72Å
203	M	98.1	Very high	96.7	Very high	48 Å²	48	36 Å²	36	24%	0.236	20%	0.195	C	C	.	.	H	α-helix	trans	-67.8	-36	176.3	-65.6	176.4	-176.2	0	0	111.8	T200 S201 S206 H207 L208 S209 P304	T200-M203 WeakPolarHBondContact O-CB 3.35Å; T200-M203 PolarHBondContact O-N 3.09Å; T200-M203 VanDerWaalsContact O-N 3.16Å; T200-M203 PolarHBondContact OG1-N 2.61Å; S201-M203 VanDerWaalsContact C-N 3.3Å; S201-M203 PolarHBondContact O-N 2.83Å; M203-S206 PolarHBondContact O-OG 2.94Å; M203-H207 PolarHBondContact O-N 3.12Å; M203-H207 VanDerWaalsContact O-N 3.16Å; M203-L208 HydrophobicContact CB-CB 4.27Å; M203-L208 WeakPolarHBondContact O-CA 3.44Å; M203-L208 PolarHBondContact O-N 2.81Å; M203-S209 PolarHBondContact O-N 2.83Å; M203-P304 HydrophobicContact SD-CB 3.66Å
204	I	98.3	Very high	96.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-66.6	-47.3	177.5	-68.8	169.8	0	0	0	111.3	V180 I199 T200 S201 R202 S206 H207 A314 F315 L317 L318	V180-I204 HydrophobicContact CG1-CD1 3.79Å; I199-I204 HydrophobicContact CG2-CD1 4.1Å; I199-I204 HydrophobicContact CG2-CG1 4.02Å; T200-I204 PolarHBondContact O-N 3.41Å; T200-I204 VanDerWaalsContact O-N 3.15Å; S201-I204 WeakPolarHBondContact O-CB 3.14Å; S201-I204 PolarHBondContact O-N 2.76Å; S201-I204 VanDerWaalsContact O-N 3.09Å; R202-I204 VanDerWaalsContact C-N 3.35Å; I204-S206 PolarHBondContact O-N 2.82Å; I204-S206 VanDerWaalsContact O-N 3.14Å; I204-H207 PolarHBondContact O-N 2.78Å; I204-A314 HydrophobicContact CG2-CB 4.02Å; I204-A314 WeakPolarHBondContact CG2-O 3.31Å; I204-F315 HydrophobicContact CG2-CD2 4.4Å; I204-L317 HydrophobicContact CD1-CB 4.38Å; I204-L317 HydrophobicContact CD1-CD2 3.79Å; I204-L317 HydrophobicContact CD1-CG 3.99Å; I204-L318 HydrophobicContact CG2-CB 3.86Å; I204-L318 HydrophobicContact CG2-CD2 4.36Å; I204-L318 HydrophobicContact CG2-CG 4.5Å
205	L	97.9	Very high	96.4	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-58	-28.2	-179.1	-72.7	166.8	0	0	0	113.1	T162 A165 L176 S201 L318 Q448 G449	T162-L205 HydrophobicContact CG2-CD2 3.83Å; T162-L205 VanDerWaalsContact OG1-CD2 3.28Å; T162-L205 WeakPolarHBondContact OG1-CD2 3.45Å; A165-L205 HydrophobicContact CB-CD2 4.26Å; L176-L205 HydrophobicContact CD2-CD1 3.72Å; S201-L205 VanDerWaalsContact O-CG 3.31Å; S201-L205 WeakPolarHBondContact O-CG 3.49Å; S201-L205 PolarHBondContact O-N 3.18Å; L205-L318 HydrophobicContact CD2-CD2 3.53Å; L205-L318 HydrophobicContact CG-CD2 4.21Å; L205-Q448 HydrophobicContact CB-CB 4.13Å; L205-Q448 HydrophobicContact CB-CG 4.25Å; L205-Q448 CarbonylContact O-C 3.58Å; L205-Q448 WeakPolarHBondContact O-CA 3.25Å; L205-G449 PolarHBondContact O-N 3.3Å
206	S	96.1	Very high	96.1	Very high	3 Å²	3	27 Å²	27	2%	0.021	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	8.8	179.6	54.2	0	0	0	0	113.8	R202 M203 I204 L208 F308	R202-S206 PolarHBondContact O-N 2.87Å; R202-S206 PolarHBondContact O-OG 2.72Å; M203-S206 PolarHBondContact O-OG 2.94Å; I204-S206 PolarHBondContact O-N 2.82Å; I204-S206 VanDerWaalsContact O-N 3.14Å; S206-L208 VanDerWaalsContact C-N 3.27Å; S206-L208 PolarHBondContact O-N 3.34Å; S206-F308 WeakPolarHBondContact O-CD2 3.47Å
207	H	96.9	Very high	95.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	34.2	-178.1	-68.2	-57.5	0	0	0	115	M203 I204 F308 L309 Y310 S311 F315 Y446	M203-H207 PolarHBondContact O-N 3.12Å; M203-H207 VanDerWaalsContact O-N 3.16Å; I204-H207 PolarHBondContact O-N 2.78Å; H207-F308 HydrophobicContact CB-CD2 3.74Å; H207-F308 HydrophobicContact CB-CE2 3.56Å; H207-F308 HydrophobicContact CB-CZ 4.38Å; H207-F308 CarbonylContact O-C 3.53Å; H207-F308 WeakPolarHBondContact O-CA 3.5Å; H207-L309 WeakPolarHBondContact CB-O 3.28Å; H207-L309 PolarHBondContact O-N 2.87Å; H207-Y310 AromaticContact CD2-CD2 3.51Å; H207-Y310 AromaticContact CD2-CE2 3.92Å; H207-Y310 AromaticContact CE1-CD2 3.93Å; H207-Y310 AromaticContact NE2-CD2 3.26Å; H207-Y310 VanDerWaalsContact NE2-CD2 3.26Å; H207-Y310 WeakPolarHBondContact NE2-CD2 3.47Å; H207-Y310 AromaticContact NE2-CE2 3.25Å; H207-Y310 WeakPolarHBondContact NE2-CE2 3.43Å; H207-S311 PolarHBondContact CE1-N 3.28Å; H207-S311 PolarHBondContact CE1-O 3.02Å; H207-S311 VanDerWaalsContact CE1-O 3.28Å; H207-S311 PolarHBondContact ND1-N 3.21Å; H207-S311 VanDerWaalsContact ND1-N 3.18Å; H207-F315 AromaticContact CE1-CD2 3.55Å; H207-F315 AromaticContact CE1-CE2 3.3Å; H207-F315 WeakPolarHBondContact CE1-CE2 3.25Å; H207-F315 AromaticContact ND1-CE2 3.95Å; H207-F315 AromaticContact NE2-CE2 3.7Å; H207-Y446 AromaticContact CD2-CD1 3.99Å; H207-Y446 AromaticContact CD2-CE1 3.34Å; H207-Y446 WeakPolarHBondContact CD2-CE1 3.07Å; H207-Y446 AromaticContact CD2-CZ 3.62Å; H207-Y446 AromaticContact NE2-CE1 3.93Å; H207-Y446 AromaticContact NE2-CZ 3.89Å
208	L	97	Very high	95.2	Very high	12 Å²	12	26.3 Å²	26.3	6%	0.063	13%	0.131	C	C	.	.			trans	-103.4	8.7	176.8	-66.1	176.4	0	0	0	113.4	M203 S206 G210 P304 G305 F308 V433 T436	M203-L208 HydrophobicContact CB-CB 4.27Å; M203-L208 WeakPolarHBondContact O-CA 3.44Å; M203-L208 PolarHBondContact O-N 2.81Å; S206-L208 VanDerWaalsContact C-N 3.27Å; S206-L208 PolarHBondContact O-N 3.34Å; L208-G210 VanDerWaalsContact C-N 3.31Å; L208-G210 PolarHBondContact O-N 3.4Å; L208-P304 CarbonylContact O-C 3.57Å; L208-P304 WeakPolarHBondContact O-CA 3.26Å; L208-G305 PolarHBondContact O-N 3.48Å; L208-F308 HydrophobicContact CD2-CB 4.2Å; L208-V433 HydrophobicContact CD1-CG1 3.79Å; L208-T436 HydrophobicContact CD1-CG2 4.22Å; L208-T436 HydrophobicContact CD2-CG2 4.16Å; L208-T436 HydrophobicContact CG-CG2 4.21Å
209	S	97.1	Very high	94.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-72.3	-20	-176.8	64.3	0	0	0	0	114.6	M203 I211	M203-S209 PolarHBondContact O-N 2.83Å; S209-I211 PolarHBondContact O-N 2.75Å; S209-I211 PolarHBondContact OG-N 2.86Å
210	G	96.3	Very high	94.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.161	C	C	.	.			trans	76.2	-0.3	-173.9	0	0	0	0	0	114.7	L208 I301 F302	L208-G210 VanDerWaalsContact C-N 3.31Å; L208-G210 PolarHBondContact O-N 3.4Å; G210-I301 PolarHBondContact O-N 3.3Å; G210-F302 WeakPolarHBondContact CA-O 3.24Å
211	I	97.2	Very high	93.8	Very high	6 Å²	6	34.9 Å²	34.9	3%	0.031	16%	0.163	C	C	.	.			trans	-66.9	135	174.3	-62.6	170.2	0	0	0	108.8	F187 I199 S209 F295 L300 S311 H313 A314 L317	F187-I211 HydrophobicContact CZ-CD1 4.21Å; I199-I211 HydrophobicContact CD1-CD1 4.18Å; I199-I211 HydrophobicContact CD1-CG1 4.11Å; S209-I211 PolarHBondContact O-N 2.75Å; S209-I211 PolarHBondContact OG-N 2.86Å; I211-F295 HydrophobicContact CD1-CE2 4.39Å; I211-F295 HydrophobicContact CG2-CD2 3.7Å; I211-F295 HydrophobicContact CG2-CE2 3.8Å; I211-L300 HydrophobicContact CG1-CD2 3.94Å; I211-S311 WeakPolarHBondContact O-CB 3.48Å; I211-S311 PolarHBondContact O-OG 3.26Å; I211-H313 HydrophobicContact CG2-CB 4.11Å; I211-A314 HydrophobicContact CB-CB 4.26Å; I211-A314 HydrophobicContact CD1-CB 4.26Å; I211-L317 HydrophobicContact CD1-CD2 3.81Å
212	R	95.1	Very high	93.3	Very high	5 Å²	5	38.8 Å²	38.8	2%	0.019	18%	0.18	C	C	.	.			trans	-61.6	162.9	-179	67	162.2	-179.6	95.6	-4.4	112.9	E278 L294 D298 I301 S311 H313	R212-E278 IonicContact CZ-OE1 2.78Å; R212-E278 IonicContact CZ-OE2 3.37Å; R212-E278 IonicContact NH1-OE1 2.76Å; R212-E278 PolarHBondContact NH1-OE1 3.28Å; R212-E278 IonicContact NH1-OE2 3.29Å; R212-E278 PolarHBondContact NH1-OE2 2.94Å; R212-E278 IonicContact NH2-OE1 3.91Å; R212-E278 PolarHBondContact NH2-OE1 3.16Å; R212-E278 IonicContact NH2-OE2 3.28Å; R212-L294 PolarHBondContact NH2-O 2.84Å; R212-D298 IonicContact CZ-OD2 3.51Å; R212-D298 IonicContact NE-OD2 2.8Å; R212-D298 PolarHBondContact NE-OD2 3.44Å; R212-D298 IonicContact NH2-OD2 3.36Å; R212-D298 PolarHBondContact NH2-OD2 2.98Å; R212-I301 HydrophobicContact CB-CD1 3.9Å; R212-I301 HydrophobicContact CB-CG1 3.71Å; R212-S311 WeakPolarHBondContact O-CB 3.31Å; R212-S311 PolarHBondContact O-OG 3.45Å; R212-H313 PolarHBondContact NH1-CD2 3.14Å; R212-H313 PolarHBondContact NH1-NE2 2.71Å
213	H	92.8	Very high	92.9	Very high	33 Å²	33	40.6 Å²	40.6	15%	0.153	19%	0.192	C	C	.	.			trans	-92.4	-138.1	163.8	-161.3	24.1	0	0	0	109.4	E273 Y310 T312 H313	H213-E273 IonicContact NE2-OE1 2.67Å; H213-Y310 WeakPolarHBondContact CB-O 3.43Å; H213-T312 PolarHBondContact CE1-OG1 2.92Å; H213-T312 PolarHBondContact ND1-N 3.34Å; H213-H313 PolarHBondContact O-CD2 3.45Å; H213-H313 VanDerWaalsContact O-CD2 3.32Å
214	Y	90.7	Very high	92.2	Very high	9 Å²	9	41.1 Å²	41.1	4%	0.035	20%	0.196	C	C	.	.	S	Bend	trans	-77.3	-27.2	177.6	-53.4	-63.6	0	0	0	113.9	K216 E273 E278 Y279 Y380	Y214-K216 PolarHBondContact O-N 2.98Å; Y214-E273 HydrophobicContact CD2-CG 4Å; Y214-E273 HydrophobicContact CE2-CG 4.07Å; Y214-E278 HydrophobicContact CD1-CB 3.96Å; Y214-Y279 AromaticContact CD2-CD2 3.8Å; Y214-Y279 HydrophobicContact CD2-CD2 3.8Å; Y214-Y279 HydrophobicContact CD2-CE2 4.24Å; Y214-Y279 HydrophobicContact CE1-CD2 4.13Å; Y214-Y279 AromaticContact CE2-CD2 3.28Å; Y214-Y279 HydrophobicContact CE2-CD2 3.28Å; Y214-Y279 AromaticContact CE2-CE2 3.39Å; Y214-Y279 HydrophobicContact CE2-CE2 3.39Å; Y214-Y279 HydrophobicContact CG-CD2 4.4Å; Y214-Y279 AromaticContact CZ-CD2 3.46Å; Y214-Y279 VanDerWaalsContact CZ-CD2 3.46Å; Y214-Y279 AromaticContact CZ-CE2 3.66Å; Y214-Y380 HydrophobicContact CE1-CE2 4.42Å
215	E	89.8	Confident	91.5	Very high	38 Å²	38	42.9 Å²	42.9	18%	0.178	20%	0.204	C	C	.	.			trans	-73.5	124.6	173.2	-179	56.2	-94.4	0	0	110.3	D217 K220 V221 H276	E215-D217 PolarHBondContact OE1-N 3.28Å; E215-K220 HydrophobicContact CG-CD 4.38Å; E215-K220 VanDerWaalsContact OE2-CD 3.31Å; E215-K220 WeakPolarHBondContact OE2-CD 3.31Å; E215-K220 VanDerWaalsContact OE2-CE 3.27Å; E215-K220 WeakPolarHBondContact OE2-CE 3.41Å; E215-K220 IonicContact OE2-NZ 3.14Å; E215-K220 PolarHBondContact OE2-NZ 3.3Å; E215-V221 HydrophobicContact CB-CG2 3.8Å; E215-V221 HydrophobicContact CG-CG2 3.55Å; E215-H276 IonicContact OE2-CE1 3.91Å; E215-H276 PolarHBondContact OE2-CE1 3.21Å
216	K	88.3	Confident	90.9	Very high	123 Å²	123	48 Å²	48	54%	0.535	23%	0.228	S	C	.	.			trans	-90.2	-27.8	-177.7	-62.8	-172.1	-179.5	-170.1	0	112.1	Y214 A218 E278	Y214-K216 PolarHBondContact O-N 2.98Å; K216-A218 PolarHBondContact O-N 3.01Å; K216-A218 VanDerWaalsContact O-N 3.16Å; K216-E278 WeakPolarHBondContact CE-OE1 3.34Å; K216-E278 IonicContact NZ-OE1 3.74Å; K216-E278 PolarHBondContact NZ-OE1 3.35Å; K216-E278 VanDerWaalsContact NZ-OE1 3.12Å
217	D	87.7	Confident	90.4	Very high	78 Å²	78	54 Å²	54	42%	0.417	25%	0.253	S	S	.	.			trans	-76	105.7	-179.3	-176.3	-5	0	0	0	111.6	E215 K219 K220 V221	E215-D217 PolarHBondContact OE1-N 3.28Å; D217-K219 VanDerWaalsContact C-N 3.26Å; D217-K219 PolarHBondContact O-N 3.47Å; D217-K219 WeakPolarHBondContact OD1-CB 3.49Å; D217-K219 PolarHBondContact OD1-N 3.13Å; D217-K220 HydrophobicContact CB-CB 3.96Å; D217-K220 PolarHBondContact O-N 3.37Å; D217-K220 PolarHBondContact OD1-N 3.38Å; D217-V221 WeakPolarHBondContact O-CG2 3.43Å; D217-V221 PolarHBondContact O-N 3.32Å
218	A	89.2	Confident	89.6	Confident	29 Å²	29	54.8 Å²	54.8	24%	0.24	26%	0.26	C	S	.	.	H	α-helix	trans	-59.9	-31.5	178	0	0	0	0	0	114.1	K216 K222 I301	K216-A218 PolarHBondContact O-N 3.01Å; K216-A218 VanDerWaalsContact O-N 3.16Å; A218-K222 WeakPolarHBondContact O-CB 3.36Å; A218-K222 WeakPolarHBondContact O-CG 3.39Å; A218-K222 PolarHBondContact O-N 3.27Å; A218-I301 HydrophobicContact CB-CD1 3.6Å; A218-I301 HydrophobicContact CB-CG2 4.46Å
219	K	89.9	Confident	88.7	Confident	153 Å²	153	59.2 Å²	59.2	67%	0.665	28%	0.279	S	S	*	.	H	α-helix	trans	-67.7	-49.8	177.6	-66	-179.9	179.9	177.3	0	109.7	D217 V221 K222 E223	D217-K219 VanDerWaalsContact C-N 3.26Å; D217-K219 PolarHBondContact O-N 3.47Å; D217-K219 WeakPolarHBondContact OD1-CB 3.49Å; D217-K219 PolarHBondContact OD1-N 3.13Å; K219-V221 VanDerWaalsContact C-N 3.33Å; K219-V221 PolarHBondContact O-N 3.32Å; K219-K222 WeakPolarHBondContact O-CB 3.48Å; K219-K222 PolarHBondContact O-N 3.23Å; K219-K222 VanDerWaalsContact O-N 3.1Å; K219-E223 WeakPolarHBondContact O-CG 2.99Å; K219-E223 PolarHBondContact O-N 2.69Å
220	K	88.4	Confident	87.8	Confident	87 Å²	87	67.5 Å²	67.5	38%	0.378	31%	0.31	S	S	.	.	H	α-helix	trans	-58.7	-42.6	177.3	-173.5	173.7	168	-160.4	0	112.3	E215 D217 K222 E223 D224	E215-K220 HydrophobicContact CG-CD 4.38Å; E215-K220 VanDerWaalsContact OE2-CD 3.31Å; E215-K220 WeakPolarHBondContact OE2-CD 3.31Å; E215-K220 VanDerWaalsContact OE2-CE 3.27Å; E215-K220 WeakPolarHBondContact OE2-CE 3.41Å; E215-K220 IonicContact OE2-NZ 3.14Å; E215-K220 PolarHBondContact OE2-NZ 3.3Å; D217-K220 HydrophobicContact CB-CB 3.96Å; D217-K220 PolarHBondContact O-N 3.37Å; D217-K220 PolarHBondContact OD1-N 3.38Å; K220-K222 PolarHBondContact O-N 2.83Å; K220-E223 PolarHBondContact O-N 2.73Å; K220-D224 WeakPolarHBondContact O-CB 3.49Å; K220-D224 PolarHBondContact O-N 2.89Å
221	V	87.3	Confident	86.7	Confident	19 Å²	19	72.9 Å²	72.9	12%	0.115	34%	0.338	C	S	.	.	H	α-helix	trans	-62.8	-41.6	175.9	178.5	0	0	0	0	111.7	E215 D217 K219 K225 I301 F302 L309	E215-V221 HydrophobicContact CB-CG2 3.8Å; E215-V221 HydrophobicContact CG-CG2 3.55Å; D217-V221 WeakPolarHBondContact O-CG2 3.43Å; D217-V221 PolarHBondContact O-N 3.32Å; K219-V221 VanDerWaalsContact C-N 3.33Å; K219-V221 PolarHBondContact O-N 3.32Å; V221-K225 VanDerWaalsContact O-CB 3.3Å; V221-K225 WeakPolarHBondContact O-CB 3.34Å; V221-K225 PolarHBondContact O-N 3.16Å; V221-K225 VanDerWaalsContact O-N 3.12Å; V221-I301 HydrophobicContact CB-CG2 3.98Å; V221-I301 HydrophobicContact CG1-CG2 3.74Å; V221-F302 HydrophobicContact CG1-CE2 4.33Å; V221-L309 HydrophobicContact CG1-CD1 3.81Å; V221-L309 HydrophobicContact CG1-CD2 4.38Å
222	K	87.9	Confident	85.2	Confident	83 Å²	83	75.5 Å²	75.5	36%	0.361	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-44.9	177.2	-73.8	171.7	-176.8	-178.8	0	111.4	A218 K219 K220 K225 E226 I301 F302	A218-K222 WeakPolarHBondContact O-CB 3.36Å; A218-K222 WeakPolarHBondContact O-CG 3.39Å; A218-K222 PolarHBondContact O-N 3.27Å; K219-K222 WeakPolarHBondContact O-CB 3.48Å; K219-K222 PolarHBondContact O-N 3.23Å; K219-K222 VanDerWaalsContact O-N 3.1Å; K220-K222 PolarHBondContact O-N 2.83Å; K222-K225 WeakPolarHBondContact O-CB 3.46Å; K222-K225 PolarHBondContact O-N 3.48Å; K222-E226 WeakPolarHBondContact O-CG 3.36Å; K222-E226 PolarHBondContact O-N 3.43Å; K222-I301 WeakPolarHBondContact CE-O 3.45Å; K222-I301 HydrophobicContact CG-CG2 4.47Å; K222-F302 HydrophobicContact CG-CE1 3.75Å; K222-F302 HydrophobicContact CG-CZ 3.9Å
223	E	88.3	Confident	83.5	Confident	125 Å²	125	83 Å²	83	58%	0.584	39%	0.385	S	S	*	.	H	α-helix	trans	-62.8	-49	178	-72.5	173.2	-171.8	0	0	112.6	K219 K220 K225 E226 K227	K219-E223 WeakPolarHBondContact O-CG 2.99Å; K219-E223 PolarHBondContact O-N 2.69Å; K220-E223 PolarHBondContact O-N 2.73Å; E223-K225 PolarHBondContact O-N 3.45Å; E223-E226 PolarHBondContact O-N 3.47Å; E223-K227 WeakPolarHBondContact O-CB 3.35Å; E223-K227 PolarHBondContact O-N 3.21Å
224	D	84.8	Confident	81.1	Confident	59 Å²	59	88.4 Å²	88.4	32%	0.316	41%	0.41	S	S	.	.	H	α-helix	trans	-59.4	-36.2	177.7	-89.9	-20.6	0	0	0	110.7	K220 A228 K272	K220-D224 WeakPolarHBondContact O-CB 3.49Å; K220-D224 PolarHBondContact O-N 2.89Å; D224-A228 WeakPolarHBondContact O-CB 3.38Å; D224-A228 PolarHBondContact O-N 2.99Å; D224-K272 IonicContact OD1-NZ 3.71Å; D224-K272 PolarHBondContact OD1-NZ 3.31Å; D224-K272 IonicContact OD2-NZ 2.76Å; D224-K272 PolarHBondContact OD2-NZ 3.31Å
225	K	83.8	Confident	78.7	Confident	37 Å²	37	93.9 Å²	93.9	16%	0.161	45%	0.446	C	S	.	.	H	α-helix	trans	-71.2	-43	176.5	-170.5	176.2	-159.5	138.6	0	113.4	V221 K222 E223 K227 A228 K229 F302 T307 F308	V221-K225 VanDerWaalsContact O-CB 3.3Å; V221-K225 WeakPolarHBondContact O-CB 3.34Å; V221-K225 PolarHBondContact O-N 3.16Å; V221-K225 VanDerWaalsContact O-N 3.12Å; K222-K225 WeakPolarHBondContact O-CB 3.46Å; K222-K225 PolarHBondContact O-N 3.48Å; E223-K225 PolarHBondContact O-N 3.45Å; K225-K227 VanDerWaalsContact C-N 3.27Å; K225-K227 PolarHBondContact O-N 3.09Å; K225-A228 PolarHBondContact O-N 3.37Å; K225-K229 WeakPolarHBondContact O-CG 3.31Å; K225-K229 PolarHBondContact O-N 2.66Å; K225-F302 HydrophobicContact CD-CE1 4.25Å; K225-F302 HydrophobicContact CD-CE2 3.87Å; K225-F302 HydrophobicContact CD-CZ 3.46Å; K225-F302 VanDerWaalsContact CD-CZ 3.46Å; K225-T307 HydrophobicContact CD-CG2 3.92Å; K225-F308 VanDerWaalsContact NZ-C 3.3Å; K225-F308 PolarHBondContact NZ-O 3.24Å
226	E	85.4	Confident	76.2	Confident	109 Å²	109	95.4 Å²	95.4	51%	0.509	47%	0.472	S	S	.	.	H	α-helix	trans	-60.9	-41.6	174.1	-75.3	-172.1	173.3	0	0	111	K222 E223 K229 R230	K222-E226 WeakPolarHBondContact O-CG 3.36Å; K222-E226 PolarHBondContact O-N 3.43Å; E223-E226 PolarHBondContact O-N 3.47Å; E226-K229 PolarHBondContact O-N 3.48Å; E226-R230 WeakPolarHBondContact O-CG 3.44Å; E226-R230 PolarHBondContact O-N 3.44Å; E226-R230 IonicContact OE2-NH2 3.48Å
227	K	83.6	Confident	73.4	Confident	129 Å²	129	95 Å²	95	56%	0.561	48%	0.48	S	S	*	.	H	α-helix	trans	-59.2	-47.1	173.8	-173.8	179	-179.2	178.3	0	111.4	E223 K225 K229 R230 L231	E223-K227 WeakPolarHBondContact O-CB 3.35Å; E223-K227 PolarHBondContact O-N 3.21Å; K225-K227 VanDerWaalsContact C-N 3.27Å; K225-K227 PolarHBondContact O-N 3.09Å; K227-K229 PolarHBondContact O-N 2.97Å; K227-R230 PolarHBondContact O-N 3.39Å; K227-L231 WeakPolarHBondContact O-CG 3.25Å; K227-L231 PolarHBondContact O-N 3.17Å; K227-L231 VanDerWaalsContact O-N 3.11Å
228	A	80.2	Confident	70.7	Confident	17 Å²	17	97.2 Å²	97.2	14%	0.14	50%	0.501	C	S	.	.	H	α-helix	trans	-60.1	-44.2	176.1	0	0	0	0	0	112.2	D224 K225 R230 L231 L232	D224-A228 WeakPolarHBondContact O-CB 3.38Å; D224-A228 PolarHBondContact O-N 2.99Å; K225-A228 PolarHBondContact O-N 3.37Å; A228-R230 VanDerWaalsContact C-N 3.32Å; A228-R230 PolarHBondContact O-N 2.96Å; A228-L231 PolarHBondContact O-N 3.34Å; A228-L232 WeakPolarHBondContact O-CG 3.47Å; A228-L232 PolarHBondContact O-N 3.28Å; A228-L232 VanDerWaalsContact O-N 3.16Å
229	K	79	Confident	67.9	Low	104 Å²	104	105.4 Å²	105.4	45%	0.452	53%	0.532	S	S	.	.	H	α-helix	trans	-61.3	-37.2	175.6	-75.9	-174.6	176.3	-171.9	0	112.9	K225 E226 K227 L232 K233	K225-K229 WeakPolarHBondContact O-CG 3.31Å; K225-K229 PolarHBondContact O-N 2.66Å; E226-K229 PolarHBondContact O-N 3.48Å; K227-K229 PolarHBondContact O-N 2.97Å; K229-L232 PolarHBondContact O-N 2.92Å; K229-K233 WeakPolarHBondContact O-CG 3.41Å; K229-K233 PolarHBondContact O-N 3.4Å
230	R	78.4	Confident	64.9	Low	175 Å²	175	106.5 Å²	106.5	66%	0.66	54%	0.539	S	S	*	.	H	α-helix	trans	-65.7	-38.9	175.8	-71.2	175.7	-166.8	-174.2	7.2	111.7	E226 K227 A228 L232 K233	E226-R230 WeakPolarHBondContact O-CG 3.44Å; E226-R230 PolarHBondContact O-N 3.44Å; E226-R230 IonicContact OE2-NH2 3.48Å; K227-R230 PolarHBondContact O-N 3.39Å; A228-R230 VanDerWaalsContact C-N 3.32Å; A228-R230 PolarHBondContact O-N 2.96Å; R230-L232 VanDerWaalsContact C-N 3.32Å; R230-L232 PolarHBondContact O-N 3.32Å; R230-K233 PolarHBondContact O-N 3.17Å
231	L	72.4	Confident	62	Low	112 Å²	112	113.8 Å²	113.8	59%	0.586	56%	0.564	S	S	*	*	H	α-helix	trans	-66.8	-32.3	178	-67.8	171.2	0	0	0	112.7	K227 A228	K227-L231 WeakPolarHBondContact O-CG 3.25Å; K227-L231 PolarHBondContact O-N 3.17Å; K227-L231 VanDerWaalsContact O-N 3.11Å; A228-L231 PolarHBondContact O-N 3.34Å
232	L	65.3	Low	59.2	Low	62 Å²	62	119.5 Å²	119.5	33%	0.325	59%	0.594	S	S	.	*	H	α-helix	trans	-74.4	-23.3	177.2	-65.9	166.2	0	0	0	113.6	A228 K229 R230 H234 T442	A228-L232 WeakPolarHBondContact O-CG 3.47Å; A228-L232 PolarHBondContact O-N 3.28Å; A228-L232 VanDerWaalsContact O-N 3.16Å; K229-L232 PolarHBondContact O-N 2.92Å; R230-L232 VanDerWaalsContact C-N 3.32Å; R230-L232 PolarHBondContact O-N 3.32Å; L232-H234 PolarHBondContact O-N 3.49Å; L232-T442 HydrophobicContact CD2-CG2 3.51Å
233	K	59.7	Low	56.3	Low	162 Å²	162	123.6 Å²	123.6	70%	0.704	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	2.9	-173.1	-78.7	-177.2	178.5	-172.6	0	115.7	K229 R230	K229-K233 WeakPolarHBondContact O-CG 3.41Å; K229-K233 PolarHBondContact O-N 3.4Å; R230-K233 PolarHBondContact O-N 3.17Å
234	H	43.6	Very low	53.3	Low	147 Å²	147	125.8 Å²	125.8	68%	0.681	63%	0.63	S	S	*	*			trans	-117.8	105.6	173.6	-76.9	-63.9	0	0	0	110.7	L232	L232-H234 PolarHBondContact O-N 3.49Å
235	P	39.3	Very low	50.5	Low	124 Å²	124	131.1 Å²	131.1	81%	0.805	65%	0.651	S	S	*	*	S	Bend		-134.2	119.7	94.6	26.6	-9.2	0	0	0	112.5
236	G	38.3	Very low	47.7	Very low	70 Å²	70	140.6 Å²	140.6	72%	0.722	69%	0.686	S	S	*	*	S	Bend	trans	87.6	66.5	162	0	0	0	0	0	117.9
237	T	29.3	Very low	44.7	Very low	115 Å²	115	143.1 Å²	143.1	71%	0.706	70%	0.702	S	S	*	*			trans	-151.4	84	149.9	43.1	0	0	0	0	109.1	K239	T237-K239 PolarHBondContact O-N 3.06Å
238	S	29.8	Very low	42.2	Very low	123 Å²	123	143 Å²	143	86%	0.86	71%	0.714	S	S	*	*			trans	-75.4	107.3	157.4	49	0	0	0	0	107.3	Q240	S238-Q240 PolarHBondContact O-N 3.14Å
239	K	31	Very low	39.5	Very low	201 Å²	201	147.3 Å²	147.3	87%	0.874	73%	0.734	S	S	*	*			trans	-62.6	125.1	159.4	-87.2	-176.2	172.4	-176.8	0	107.5	T237 R241	T237-K239 PolarHBondContact O-N 3.06Å; K239-R241 PolarHBondContact O-N 3.01Å
240	Q	27.2	Very low	37	Very low	176 Å²	176	149.9 Å²	149.9	82%	0.822	75%	0.753	S	S	*	*			trans	-45.1	125.5	164.1	-77.7	164.1	-43.1	0	0	109.7	S238	S238-Q240 PolarHBondContact O-N 3.14Å
241	R	28.2	Very low	34.4	Very low	241 Å²	241	150.6 Å²	150.6	91%	0.909	76%	0.756	S	S	*	*			trans	-127	113.2	143.9	-75.9	-171.6	-172.7	-176.6	1.3	105.4	K239 D243	K239-R241 PolarHBondContact O-N 3.01Å; R241-D243 PolarHBondContact O-N 3.4Å
242	D	27.1	Very low	32.2	Very low	139 Å²	139	152 Å²	152	74%	0.743	76%	0.764	S	S	*	*			trans	-54.3	128.6	164.7	-60.9	-50.8	0	0	0	108.3
243	D	28.5	Very low	30.3	Very low	168 Å²	168	158.9 Å²	158.9	90%	0.898	79%	0.791	S	S	*	*			trans	-164.3	116.8	138.7	-89.6	-30.6	0	0	0	109.2	R241	R241-D243 PolarHBondContact O-N 3.4Å
244	E	24.3	Very low	28.7	Very low	172 Å²	172	157 Å²	157	80%	0.804	80%	0.796	S	S	*	*			trans	-57.9	127.2	175.2	-91.4	-175.3	156.9	0	0	113.6
245	K	26.3	Very low	28.1	Very low	170 Å²	170	154.2 Å²	154.2	74%	0.739	81%	0.806	S	S	*	*				163.1	129.2	113.8	-95.3	155	-169.7	172.3	0	115
246	R	24.3	Very low	27.3	Very low	237 Å²	237	151.8 Å²	151.8	89%	0.894	80%	0.804	S	S	*	*			trans	78.6	105.8	145.5	-66.6	180	-177.7	-160.7	0.4	120.3
247	L	23.1	Very low	26.7	Very low	162 Å²	162	154.2 Å²	154.2	85%	0.848	80%	0.8	S	S	*	*			trans	-76.6	159.1	149.4	-78	159.6	0	0	0	110.1
248	P	31.6	Very low	26.6	Very low	126 Å²	126	157.7 Å²	157.7	82%	0.818	81%	0.809	S	S	*	*				-131.8	134.8	71.3	21.4	1.1	0	0	0	114
249	D	23	Very low	26.6	Very low	107 Å²	107	156.4 Å²	156.4	57%	0.572	80%	0.796	S	S	*	*				76.4	106.1	96.1	-158.2	16.8	0	0	0	114.5
250	N	26.4	Very low	26.4	Very low	159 Å²	159	150 Å²	150	85%	0.85	78%	0.776	S	S	*	*			trans	-163.1	144.1	136.3	-109.6	-27	0	0	0	112.2
251	R	24.1	Very low	26.4	Very low	190 Å²	190	150 Å²	150	72%	0.717	77%	0.773	S	S	*	*			trans	-86.6	167.5	-160.7	-55.2	174.4	-164.3	171.2	3.9	114.5
252	D	24.9	Very low	26.5	Very low	142 Å²	142	140.8 Å²	140.8	76%	0.759	75%	0.754	S	S	*	*			trans	77.1	105.2	149.3	-57.8	-34	0	0	0	120.1
253	K	27	Very low	26.8	Very low	205 Å²	205	141.2 Å²	141.2	89%	0.891	75%	0.749	S	S	*	*				-174.7	151.6	117.2	-99.8	169.6	-173.5	-179.8	0	113.8
254	P	26.6	Very low	26.8	Very low	124 Å²	124	139.5 Å²	139.5	81%	0.805	74%	0.736	S	S	*	*			trans	-84.9	159.3	-163.8	33.8	-31.8	0	0	0	114
255	G	30.3	Very low	27.3	Very low	87 Å²	87	133.7 Å²	133.7	90%	0.897	71%	0.714	S	S	*	*			trans	-59.7	136.6	-164.3	0	0	0	0	0	117
256	G	22.9	Very low	28.3	Very low	73 Å²	73	126.9 Å²	126.9	75%	0.753	69%	0.687	S	S	*	*			trans	-110.8	119.4	169.4	0	0	0	0	0	111.5
257	D	25.3	Very low	29.3	Very low	121 Å²	121	121.5 Å²	121.5	65%	0.647	67%	0.672	S	S	*	*			trans	-6.6	120.2	161.3	-141.1	-25.8	0	0	0	118.8	T259	D257-T259 VanDerWaalsContact C-N 3.32Å; D257-T259 PolarHBondContact O-N 2.87Å; D257-T259 WeakPolarHBondContact OD1-CG2 3.43Å; D257-T259 PolarHBondContact OD1-N 2.91Å; D257-T259 PolarHBondContact OD1-OG1 3.24Å; D257-T259 PolarHBondContact OD2-OG1 3.39Å
258	Q	26.5	Very low	30.3	Very low	188 Å²	188	116.2 Å²	116.2	88%	0.879	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	10	174.9	-73.6	-168.8	0.7	0	0	114
259	T	29.4	Very low	31.1	Very low	97 Å²	97	114.8 Å²	114.8	60%	0.595	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-5.3	-175.3	52.9	0	0	0	0	115.6	D257	D257-T259 VanDerWaalsContact C-N 3.32Å; D257-T259 PolarHBondContact O-N 2.87Å; D257-T259 WeakPolarHBondContact OD1-CG2 3.43Å; D257-T259 PolarHBondContact OD1-N 2.91Å; D257-T259 PolarHBondContact OD1-OG1 3.24Å; D257-T259 PolarHBondContact OD2-OG1 3.39Å
260	S	27.9	Very low	32.6	Very low	66 Å²	66	112.3 Å²	112.3	46%	0.462	62%	0.617	S	S	.	*	S	Bend	trans	-84.9	-36.5	-175.6	57.4	0	0	0	0	114.9	G262 K263 E264	S260-G262 PolarHBondContact O-N 3.48Å; S260-K263 PolarHBondContact O-N 3.44Å; S260-E264 PolarHBondContact O-N 3.19Å
261	K	28	Very low	34	Very low	175 Å²	175	111.6 Å²	111.6	76%	0.761	61%	0.606	S	S	*	*	H	α-helix	trans	-68.8	-29	-170.3	-75.8	-175.9	176.1	177.8	0	115.3
262	G	29.4	Very low	35.7	Very low	48 Å²	48	106.5 Å²	106.5	50%	0.495	59%	0.589	S	S	.	*	H	α-helix	trans	-79	-26.8	178.8	0	0	0	0	0	114.3	S260 S265 T266	S260-G262 PolarHBondContact O-N 3.48Å; G262-S265 PolarHBondContact O-OG 3.35Å; G262-T266 PolarHBondContact O-OG1 3.37Å
263	K	33.4	Very low	37.6	Very low	149 Å²	149	101.6 Å²	101.6	65%	0.648	56%	0.562	S	S	*	*	H	α-helix	trans	-74.5	-42.6	176	-76.2	-178.3	175.9	-179.5	0	111.3	S260 T266 Q267	S260-K263 PolarHBondContact O-N 3.44Å; K263-T266 PolarHBondContact O-N 3.04Å; K263-Q267 WeakPolarHBondContact O-CB 3.43Å; K263-Q267 PolarHBondContact O-N 2.97Å
264	E	28.9	Very low	39.9	Very low	131 Å²	131	92.6 Å²	92.6	61%	0.612	52%	0.522	S	S	*	.	H	α-helix	trans	-63.6	-41.4	179.7	-78.9	-177.3	153.9	0	0	112.9	S260 Q267 A268	S260-E264 PolarHBondContact O-N 3.19Å; E264-Q267 PolarHBondContact O-N 3.31Å; E264-A268 WeakPolarHBondContact O-CB 3.34Å; E264-A268 PolarHBondContact O-N 2.74Å
265	S	34.7	Very low	42.4	Very low	51 Å²	51	93.1 Å²	93.1	36%	0.357	51%	0.514	S	S	.	.	H	α-helix	trans	-65	-41.8	179.7	61.3	0	0	0	0	112.3	G262 A268 Q269	G262-S265 PolarHBondContact O-OG 3.35Å; S265-A268 PolarHBondContact O-N 3.16Å; S265-Q269 WeakPolarHBondContact O-CB 2.81Å; S265-Q269 PolarHBondContact O-N 3.37Å
266	T	46	Very low	44.8	Very low	26 Å²	26	91 Å²	91	16%	0.16	48%	0.481	C	S	.	.	H	α-helix	trans	-69.9	-39.9	179.4	-53.3	0	0	0	0	111.5	G262 K263 R270 W440	G262-T266 PolarHBondContact O-OG1 3.37Å; K263-T266 PolarHBondContact O-N 3.04Å; T266-R270 VanDerWaalsContact O-CG 3.29Å; T266-R270 WeakPolarHBondContact O-CG 3.23Å; T266-R270 PolarHBondContact O-N 3.42Å; T266-R270 VanDerWaalsContact O-N 3.12Å; T266-W440 HydrophobicContact CG2-CB 3.91Å
267	Q	45.8	Very low	47.7	Very low	124 Å²	124	95.9 Å²	95.9	58%	0.579	48%	0.484	S	S	*	.	H	α-helix	trans	-69	-38.4	175.8	-166.7	173.5	8.9	0	0	111.7	K263 E264 R270 K271	K263-Q267 WeakPolarHBondContact O-CB 3.43Å; K263-Q267 PolarHBondContact O-N 2.97Å; E264-Q267 PolarHBondContact O-N 3.31Å; Q267-R270 PolarHBondContact O-N 2.79Å; Q267-K271 WeakPolarHBondContact O-CB 3.31Å; Q267-K271 PolarHBondContact O-N 2.93Å
268	A	44.5	Very low	50.7	Low	52 Å²	52	91 Å²	91	43%	0.43	46%	0.457	S	S	.	.	H	α-helix	trans	-65.5	-40.2	174.7	0	0	0	0	0	112.5	E264 S265 K271 K272	E264-A268 WeakPolarHBondContact O-CB 3.34Å; E264-A268 PolarHBondContact O-N 2.74Å; S265-A268 PolarHBondContact O-N 3.16Å; A268-K271 PolarHBondContact O-N 3.3Å; A268-K272 WeakPolarHBondContact O-CG 3.37Å; A268-K272 PolarHBondContact O-N 3.17Å; A268-K272 VanDerWaalsContact O-N 3.13Å
269	Q	48.8	Very low	53.5	Low	95 Å²	95	82.2 Å²	82.2	44%	0.444	42%	0.416	S	S	.	.	H	α-helix	trans	-67	-38.9	177.4	-167.4	169.9	-0.2	0	0	112	S265 K272 E273	S265-Q269 WeakPolarHBondContact O-CB 2.81Å; S265-Q269 PolarHBondContact O-N 3.37Å; Q269-K272 PolarHBondContact O-N 3.33Å; Q269-E273 PolarHBondContact O-N 3.11Å
270	R	53.1	Low	56.4	Low	56 Å²	56	80.7 Å²	80.7	21%	0.211	40%	0.4	C	S	.	.	H	α-helix	trans	-65.6	-40.4	173.1	-69.9	170.6	-171.9	-152.7	-0.5	112.1	T266 Q267 K272 E273 F274 V515	T266-R270 VanDerWaalsContact O-CG 3.29Å; T266-R270 WeakPolarHBondContact O-CG 3.23Å; T266-R270 PolarHBondContact O-N 3.42Å; T266-R270 VanDerWaalsContact O-N 3.12Å; Q267-R270 PolarHBondContact O-N 2.79Å; R270-K272 VanDerWaalsContact C-N 3.3Å; R270-K272 PolarHBondContact O-N 3.47Å; R270-E273 WeakPolarHBondContact O-CB 3.48Å; R270-E273 PolarHBondContact O-N 3.44Å; R270-E273 VanDerWaalsContact O-N 3.14Å; R270-F274 WeakPolarHBondContact O-CD2 3.31Å; R270-F274 WeakPolarHBondContact O-CE2 3.42Å; R270-V515 PolarHBondContact NH1-O 2.83Å
271	K	56.6	Low	59.5	Low	144 Å²	144	78.6 Å²	78.6	63%	0.626	38%	0.383	S	S	*	.	H	α-helix	trans	-61.1	-39.2	177.5	-167.3	175.6	179.8	-179	0	111.9	Q267 A268 E273 F274	Q267-K271 WeakPolarHBondContact O-CB 3.31Å; Q267-K271 PolarHBondContact O-N 2.93Å; A268-K271 PolarHBondContact O-N 3.3Å; K271-E273 VanDerWaalsContact C-N 3.33Å; K271-E273 PolarHBondContact O-N 2.96Å; K271-F274 PolarHBondContact O-N 3.24Å
272	K	59.9	Low	62.6	Low	82 Å²	82	76.7 Å²	76.7	36%	0.357	38%	0.375	S	S	.	.	H	α-helix	trans	-63	-34.1	174.2	-72.4	179	172.3	-169.2	0	113.3	D224 A268 Q269 R270 F274 E275 H276	D224-K272 IonicContact OD1-NZ 3.71Å; D224-K272 PolarHBondContact OD1-NZ 3.31Å; D224-K272 IonicContact OD2-NZ 2.76Å; D224-K272 PolarHBondContact OD2-NZ 3.31Å; A268-K272 WeakPolarHBondContact O-CG 3.37Å; A268-K272 PolarHBondContact O-N 3.17Å; A268-K272 VanDerWaalsContact O-N 3.13Å; Q269-K272 PolarHBondContact O-N 3.33Å; R270-K272 VanDerWaalsContact C-N 3.3Å; R270-K272 PolarHBondContact O-N 3.47Å; K272-F274 VanDerWaalsContact C-N 3.28Å; K272-F274 PolarHBondContact O-N 3.01Å; K272-E275 WeakPolarHBondContact O-CB 3.38Å; K272-E275 PolarHBondContact O-N 2.91Å; K272-E275 VanDerWaalsContact O-N 3.1Å; K272-H276 PolarHBondContact O-CD2 3.42Å
273	E	64.5	Low	65.7	Low	40 Å²	40	79.7 Å²	79.7	19%	0.187	38%	0.38	C	S	.	.	H	α-helix	trans	-59.3	-40.3	179.8	-168.9	-176.1	168.8	0	0	111.9	H213 Y214 Q269 R270 K271 E275 H276 Y279	H213-E273 IonicContact NE2-OE1 2.67Å; Y214-E273 HydrophobicContact CD2-CG 4Å; Y214-E273 HydrophobicContact CE2-CG 4.07Å; Q269-E273 PolarHBondContact O-N 3.11Å; R270-E273 WeakPolarHBondContact O-CB 3.48Å; R270-E273 PolarHBondContact O-N 3.44Å; R270-E273 VanDerWaalsContact O-N 3.14Å; K271-E273 VanDerWaalsContact C-N 3.33Å; K271-E273 PolarHBondContact O-N 2.96Å; E273-E275 PolarHBondContact O-N 2.72Å; E273-H276 PolarHBondContact O-CD2 3.07Å; E273-H276 PolarHBondContact O-N 3.12Å; E273-Y279 HydrophobicContact CG-CD2 4.25Å; E273-Y279 HydrophobicContact CG-CE2 3.9Å; E273-Y279 VanDerWaalsContact OE1-CE2 3.26Å; E273-Y279 WeakPolarHBondContact OE1-CE2 3.48Å
274	F	75.3	Confident	68.5	Low	15 Å²	15	77.7 Å²	77.7	7%	0.066	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	8.6	179.5	-59.7	-79.4	0	0	0	114	R270 K271 K272 Y279 Y280 A475 Q513 S514	R270-F274 WeakPolarHBondContact O-CD2 3.31Å; R270-F274 WeakPolarHBondContact O-CE2 3.42Å; K271-F274 PolarHBondContact O-N 3.24Å; K272-F274 VanDerWaalsContact C-N 3.28Å; K272-F274 PolarHBondContact O-N 3.01Å; F274-Y279 AromaticContact CD1-CD1 3.82Å; F274-Y279 HydrophobicContact CD1-CD1 3.82Å; F274-Y279 AromaticContact CD1-CE1 3.42Å; F274-Y279 HydrophobicContact CD1-CE1 3.42Å; F274-Y279 VanDerWaalsContact CD1-CE1 3.42Å; F274-Y279 AromaticContact CD1-CZ 3.98Å; F274-Y279 HydrophobicContact CE1-CD1 4.19Å; F274-Y279 AromaticContact CE1-CE1 3.32Å; F274-Y279 HydrophobicContact CE1-CE1 3.32Å; F274-Y279 AromaticContact CE1-CZ 3.62Å; F274-Y279 WeakPolarHBondContact CE1-OH 3.5Å; F274-Y279 HydrophobicContact CZ-CE1 4.42Å; F274-Y280 WeakPolarHBondContact O-CE2 3.5Å; F274-Y280 PolarHBondContact O-OH 3.06Å; F274-A475 WeakPolarHBondContact CE1-O 3.42Å; F274-Q513 HydrophobicContact CE1-CB 4.22Å; F274-Q513 HydrophobicContact CZ-CB 4.2Å; F274-S514 VanDerWaalsContact CD2-OG 3.26Å; F274-S514 WeakPolarHBondContact CD2-OG 3.42Å; F274-S514 WeakPolarHBondContact CE2-OG 3.34Å
275	E	78.9	Confident	71.6	Confident	136 Å²	136	73.3 Å²	73.3	64%	0.636	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-10.9	174.3	-64.6	173.4	175.5	0	0	112.1	K272 E273	K272-E275 WeakPolarHBondContact O-CB 3.38Å; K272-E275 PolarHBondContact O-N 2.91Å; K272-E275 VanDerWaalsContact O-N 3.1Å; E273-E275 PolarHBondContact O-N 2.72Å
276	H	81.5	Confident	74.3	Confident	42 Å²	42	79.1 Å²	79.1	19%	0.194	38%	0.376	C	S	.	.			trans	-84.2	132.2	-179.4	-63.1	-71.5	0	0	0	112.4	E215 K272 E273 E278 Y279 Y280	E215-H276 IonicContact OE2-CE1 3.91Å; E215-H276 PolarHBondContact OE2-CE1 3.21Å; K272-H276 PolarHBondContact O-CD2 3.42Å; E273-H276 PolarHBondContact O-CD2 3.07Å; E273-H276 PolarHBondContact O-N 3.12Å; H276-E278 VanDerWaalsContact C-N 3.29Å; H276-E278 PolarHBondContact O-N 3.2Å; H276-Y279 WeakPolarHBondContact O-CB 3.48Å; H276-Y279 PolarHBondContact O-N 2.86Å; H276-Y280 WeakPolarHBondContact O-CD2 3.43Å
277	E	83.1	Confident	76.6	Confident	176 Å²	176	79.6 Å²	79.6	82%	0.822	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-60.5	-35.2	-179.7	-64.3	-177.6	169.7	0	0	113.1	Y279 Y280	E277-Y279 PolarHBondContact O-N 3.02Å; E277-Y280 PolarHBondContact O-N 3.46Å
278	E	88.1	Confident	79	Confident	17 Å²	17	73.8 Å²	73.8	8%	0.079	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-59.9	-20.4	176.8	-70.6	-169.9	176	0	0	113.2	R212 Y214 K216 H276 Y280 I281 H313 Y380	R212-E278 IonicContact CZ-OE1 2.78Å; R212-E278 IonicContact CZ-OE2 3.37Å; R212-E278 IonicContact NH1-OE1 2.76Å; R212-E278 PolarHBondContact NH1-OE1 3.28Å; R212-E278 IonicContact NH1-OE2 3.29Å; R212-E278 PolarHBondContact NH1-OE2 2.94Å; R212-E278 IonicContact NH2-OE1 3.91Å; R212-E278 PolarHBondContact NH2-OE1 3.16Å; R212-E278 IonicContact NH2-OE2 3.28Å; Y214-E278 HydrophobicContact CD1-CB 3.96Å; K216-E278 WeakPolarHBondContact CE-OE1 3.34Å; K216-E278 IonicContact NZ-OE1 3.74Å; K216-E278 PolarHBondContact NZ-OE1 3.35Å; K216-E278 VanDerWaalsContact NZ-OE1 3.12Å; H276-E278 VanDerWaalsContact C-N 3.29Å; H276-E278 PolarHBondContact O-N 3.2Å; E278-Y280 PolarHBondContact O-N 2.89Å; E278-I281 HydrophobicContact CB-CD1 4.21Å; E278-I281 WeakPolarHBondContact O-CD1 3.24Å; E278-I281 WeakPolarHBondContact O-CG1 3.44Å; E278-H313 IonicContact OE2-CD2 3.65Å; E278-H313 IonicContact OE2-CE1 2.81Å; E278-H313 IonicContact OE2-NE2 3.31Å; E278-H313 PolarHBondContact OE2-NE2 3.05Å; E278-Y380 PolarHBondContact O-OH 2.85Å
279	Y	84.9	Confident	81.4	Confident	4 Å²	4	72.6 Å²	72.6	2%	0.016	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-73.4	-20.3	175.9	-147	-91.7	0	0	0	112.9	Y214 E273 F274 H276 E277 G474 A475 V476	Y214-Y279 AromaticContact CD2-CD2 3.8Å; Y214-Y279 HydrophobicContact CD2-CD2 3.8Å; Y214-Y279 HydrophobicContact CD2-CE2 4.24Å; Y214-Y279 HydrophobicContact CE1-CD2 4.13Å; Y214-Y279 AromaticContact CE2-CD2 3.28Å; Y214-Y279 HydrophobicContact CE2-CD2 3.28Å; Y214-Y279 AromaticContact CE2-CE2 3.39Å; Y214-Y279 HydrophobicContact CE2-CE2 3.39Å; Y214-Y279 HydrophobicContact CG-CD2 4.4Å; Y214-Y279 AromaticContact CZ-CD2 3.46Å; Y214-Y279 VanDerWaalsContact CZ-CD2 3.46Å; Y214-Y279 AromaticContact CZ-CE2 3.66Å; E273-Y279 HydrophobicContact CG-CD2 4.25Å; E273-Y279 HydrophobicContact CG-CE2 3.9Å; E273-Y279 VanDerWaalsContact OE1-CE2 3.26Å; E273-Y279 WeakPolarHBondContact OE1-CE2 3.48Å; F274-Y279 AromaticContact CD1-CD1 3.82Å; F274-Y279 HydrophobicContact CD1-CD1 3.82Å; F274-Y279 AromaticContact CD1-CE1 3.42Å; F274-Y279 HydrophobicContact CD1-CE1 3.42Å; F274-Y279 VanDerWaalsContact CD1-CE1 3.42Å; F274-Y279 AromaticContact CD1-CZ 3.98Å; F274-Y279 HydrophobicContact CE1-CD1 4.19Å; F274-Y279 AromaticContact CE1-CE1 3.32Å; F274-Y279 HydrophobicContact CE1-CE1 3.32Å; F274-Y279 AromaticContact CE1-CZ 3.62Å; F274-Y279 WeakPolarHBondContact CE1-OH 3.5Å; F274-Y279 HydrophobicContact CZ-CE1 4.42Å; H276-Y279 WeakPolarHBondContact O-CB 3.48Å; H276-Y279 PolarHBondContact O-N 2.86Å; E277-Y279 PolarHBondContact O-N 3.02Å; Y279-G474 VanDerWaalsContact OH-C 3.26Å; Y279-G474 PolarHBondContact OH-O 2.78Å; Y279-A475 WeakPolarHBondContact OH-CA 3.49Å; Y279-A475 PolarHBondContact OH-N 3.36Å; Y279-V476 HydrophobicContact CD1-CG2 3.28Å; Y279-V476 HydrophobicContact CE1-CB 4.38Å; Y279-V476 HydrophobicContact CE1-CG2 3.37Å
280	Y	90.9	Very high	83.7	Confident	66 Å²	66	73.3 Å²	73.3	26%	0.259	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-115.6	24.1	-176.2	-56.7	-84.5	0	0	0	113.6	F274 H276 E277 E278 K282 P374 V376 V476	F274-Y280 WeakPolarHBondContact O-CE2 3.5Å; F274-Y280 PolarHBondContact O-OH 3.06Å; H276-Y280 WeakPolarHBondContact O-CD2 3.43Å; E277-Y280 PolarHBondContact O-N 3.46Å; E278-Y280 PolarHBondContact O-N 2.89Å; Y280-K282 PolarHBondContact O-N 3.31Å; Y280-P374 HydrophobicContact CD1-CG 3.68Å; Y280-P374 HydrophobicContact CE1-CG 3.88Å; Y280-V376 HydrophobicContact CD1-CG1 3.94Å; Y280-V476 HydrophobicContact CD1-CG2 4.09Å; Y280-V476 HydrophobicContact CE1-CG1 4.29Å; Y280-V476 HydrophobicContact CE1-CG2 3.91Å
281	I	93.1	Very high	85.7	Confident	21 Å²	21	70.6 Å²	70.6	11%	0.108	33%	0.332	C	S	.	.			trans	-53.6	137.9	172.3	-68.9	168.1	0	0	0	109.5	E278 D283 Y285 L294 V376 D377 Y380	E278-I281 HydrophobicContact CB-CD1 4.21Å; E278-I281 WeakPolarHBondContact O-CD1 3.24Å; E278-I281 WeakPolarHBondContact O-CG1 3.44Å; I281-D283 HydrophobicContact CG2-CB 4.2Å; I281-Y285 HydrophobicContact CG2-CE2 3.95Å; I281-L294 HydrophobicContact CD1-CD1 4.07Å; I281-L294 HydrophobicContact CD1-CD2 4.03Å; I281-V376 CarbonylContact O-C 3.56Å; I281-V376 WeakPolarHBondContact O-CA 3.43Å; I281-D377 PolarHBondContact O-N 2.92Å; I281-Y380 HydrophobicContact CB-CD1 4.48Å; I281-Y380 HydrophobicContact CB-CE1 4.13Å; I281-Y380 HydrophobicContact CD1-CD1 4.19Å; I281-Y380 HydrophobicContact CD1-CE1 3.92Å; I281-Y380 HydrophobicContact CG2-CD1 4.48Å
282	K	93.6	Very high	87.6	Confident	135 Å²	135	63.9 Å²	63.9	59%	0.587	30%	0.303	S	S	*	.			trans	-113.6	-13.6	178.1	-60.1	179	-175.9	173.3	0	112.6	Y280 Y375	Y280-K282 PolarHBondContact O-N 3.31Å; K282-Y375 HydrophobicContact CB-CD1 4.34Å; K282-Y375 HydrophobicContact CB-CE1 4.43Å; K282-Y375 HydrophobicContact CG-CD1 4.26Å
283	D	92.9	Very high	89.4	Confident	111 Å²	111	63.9 Å²	63.9	59%	0.594	31%	0.307	S	S	*	.			trans	-72.3	134.3	-179.5	-56.4	-47.8	0	0	0	110	I281 Y285 D377	I281-D283 HydrophobicContact CG2-CB 4.2Å; D283-Y285 HydrophobicContact CB-CE2 4.41Å; D283-Y285 WeakPolarHBondContact O-CD2 3.35Å; D283-Y285 WeakPolarHBondContact O-CE2 3.33Å; D283-D377 WeakPolarHBondContact O-CB 3.43Å
284	N	93.5	Very high	90.8	Very high	108 Å²	108	63.7 Å²	63.7	58%	0.578	31%	0.307	S	S	*	.			trans	-83	137.9	174.2	-173.1	-99.9	0	0	0	110.2	D377	N284-D377 WeakPolarHBondContact CA-OD2 3.39Å; N284-D377 WeakPolarHBondContact CB-OD2 3.31Å; N284-D377 PolarHBondContact ND2-OD2 2.87Å
285	Y	93.6	Very high	91.8	Very high	38 Å²	38	63.2 Å²	63.2	15%	0.149	31%	0.305	C	S	.	.			trans	-105.3	119.9	176.5	-68.8	-101	0	0	0	109.6	I281 D283 S287 S291 L294 S379 Y380	I281-Y285 HydrophobicContact CG2-CE2 3.95Å; D283-Y285 HydrophobicContact CB-CE2 4.41Å; D283-Y285 WeakPolarHBondContact O-CD2 3.35Å; D283-Y285 WeakPolarHBondContact O-CE2 3.33Å; Y285-S287 PolarHBondContact O-N 2.97Å; Y285-S291 WeakPolarHBondContact CB-OG 3.38Å; Y285-S291 VanDerWaalsContact CD1-CA 3.45Å; Y285-L294 HydrophobicContact CE1-CD1 4.05Å; Y285-L294 HydrophobicContact CE1-CG 3.98Å; Y285-L294 HydrophobicContact CE2-CD1 4.36Å; Y285-L294 WeakPolarHBondContact OH-CD2 3.39Å; Y285-L294 WeakPolarHBondContact OH-CG 3.5Å; Y285-S379 PolarHBondContact N-OG 3.03Å; Y285-Y380 HydrophobicContact CE2-CD1 4.44Å; Y285-Y380 HydrophobicContact CE2-CG 4.48Å
286	E	91.1	Very high	92.6	Very high	173 Å²	173	58.9 Å²	58.9	81%	0.808	28%	0.284	S	S	*	.	S	Bend	trans	-62.6	-25.1	-176.6	-58.5	177.1	170.5	0	0	113.6
287	S	94.5	Very high	93.3	Very high	36 Å²	36	62.5 Å²	62.5	25%	0.252	30%	0.304	S	S	.	.	S	Bend	trans	-156.2	159.3	-179.9	62.4	0	0	0	0	111.7	Y285 T289 K290 S291	Y285-S287 PolarHBondContact O-N 2.97Å; S287-T289 PolarHBondContact O-N 3.12Å; S287-K290 PolarHBondContact O-N 3.3Å; S287-K290 VanDerWaalsContact O-N 3.13Å; S287-K290 WeakPolarHBondContact OG-CG 3.38Å; S287-K290 PolarHBondContact OG-N 3.21Å; S287-S291 PolarHBondContact O-N 3.45Å; S287-S291 PolarHBondContact O-OG 2.67Å; S287-S291 VanDerWaalsContact O-OG 3.06Å
288	V	95.8	Very high	93.9	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.018	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-29.9	175.2	-63.1	0	0	0	0	112.5	S291 A320 E323 F330 W382	V288-S291 WeakPolarHBondContact O-CB 3.42Å; V288-S291 PolarHBondContact O-N 3.4Å; V288-A320 HydrophobicContact CG2-CB 4.13Å; V288-E323 HydrophobicContact CG2-CB 4.22Å; V288-E323 HydrophobicContact CG2-CG 4.46Å; V288-E323 WeakPolarHBondContact CG2-OE2 3.26Å; V288-F330 HydrophobicContact CG1-CB 3.93Å; V288-F330 HydrophobicContact CG1-CD1 4.13Å; V288-F330 HydrophobicContact CG1-CG 4.25Å; V288-F330 HydrophobicContact CG2-CB 4.39Å; V288-W382 HydrophobicContact CG1-CE3 3.97Å; V288-W382 HydrophobicContact CG1-CZ3 4.26Å
289	T	95.6	Very high	94.3	Very high	26 Å²	26	60 Å²	60	16%	0.16	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-43.6	173.4	-68.7	0	0	0	0	111.7	E186 S287 S291 L292	E186-T289 HydrophobicContact CG-CG2 3.94Å; E186-T289 WeakPolarHBondContact OE1-CG2 3.45Å; E186-T289 PolarHBondContact OE1-OG1 3.05Å; S287-T289 PolarHBondContact O-N 3.12Å; T289-S291 PolarHBondContact O-N 2.95Å; T289-L292 VanDerWaalsContact O-CB 3.24Å; T289-L292 WeakPolarHBondContact O-CB 3.43Å; T289-L292 VanDerWaalsContact O-CG 3.28Å; T289-L292 WeakPolarHBondContact O-CG 3.41Å; T289-L292 PolarHBondContact O-N 3.23Å
290	K	96.2	Very high	94.8	Very high	110 Å²	110	60.5 Å²	60.5	48%	0.478	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-62.8	-33.1	176.9	-76.1	-72.6	-177.5	179.6	0	112	S287 L292 D293	S287-K290 PolarHBondContact O-N 3.3Å; S287-K290 VanDerWaalsContact O-N 3.13Å; S287-K290 WeakPolarHBondContact OG-CG 3.38Å; S287-K290 PolarHBondContact OG-N 3.21Å; K290-L292 PolarHBondContact O-N 3.3Å; K290-L292 VanDerWaalsContact O-N 3.15Å; K290-D293 WeakPolarHBondContact O-CB 3.3Å; K290-D293 PolarHBondContact O-N 3.49Å; K290-D293 VanDerWaalsContact O-N 3.11Å
291	S	96	Very high	95.1	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-62.1	-19.1	174.9	-47.6	0	0	0	0	114	Y285 S287 V288 T289 D293 L294 Y380	Y285-S291 WeakPolarHBondContact CB-OG 3.38Å; Y285-S291 VanDerWaalsContact CD1-CA 3.45Å; S287-S291 PolarHBondContact O-N 3.45Å; S287-S291 PolarHBondContact O-OG 2.67Å; S287-S291 VanDerWaalsContact O-OG 3.06Å; V288-S291 WeakPolarHBondContact O-CB 3.42Å; V288-S291 PolarHBondContact O-N 3.4Å; T289-S291 PolarHBondContact O-N 2.95Å; S291-D293 VanDerWaalsContact C-N 3.25Å; S291-D293 PolarHBondContact O-N 3.27Å; S291-L294 WeakPolarHBondContact O-CB 2.99Å; S291-L294 PolarHBondContact O-N 2.95Å; S291-Y380 WeakPolarHBondContact OG-CA 3.4Å
292	L	97.2	Very high	95.2	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-68.1	-26.5	175.9	-53.5	179.8	0	0	0	112	V184 T289 K290 L294 F295 K296 T316 L317 A320	V184-L292 HydrophobicContact CG1-CD1 3.66Å; T289-L292 VanDerWaalsContact O-CB 3.24Å; T289-L292 WeakPolarHBondContact O-CB 3.43Å; T289-L292 VanDerWaalsContact O-CG 3.28Å; T289-L292 WeakPolarHBondContact O-CG 3.41Å; T289-L292 PolarHBondContact O-N 3.23Å; K290-L292 PolarHBondContact O-N 3.3Å; K290-L292 VanDerWaalsContact O-N 3.15Å; L292-L294 PolarHBondContact O-N 3.48Å; L292-F295 HydrophobicContact CD2-CE1 4.03Å; L292-F295 HydrophobicContact CD2-CZ 3.81Å; L292-F295 PolarHBondContact O-N 3.34Å; L292-K296 HydrophobicContact CB-CB 4.21Å; L292-K296 HydrophobicContact CB-CD 4.42Å; L292-K296 WeakPolarHBondContact O-CB 3.49Å; L292-K296 WeakPolarHBondContact O-CG 3.26Å; L292-K296 PolarHBondContact O-N 3.05Å; L292-T316 HydrophobicContact CD2-CG2 4.1Å; L292-L317 HydrophobicContact CD1-CD1 4.22Å; L292-L317 HydrophobicContact CD2-CB 4.19Å; L292-L317 HydrophobicContact CD2-CD1 4.15Å; L292-A320 HydrophobicContact CD1-CB 4.03Å; L292-A320 HydrophobicContact CD2-CB 4.5Å
293	D	95.9	Very high	95.3	Very high	82 Å²	82	56.4 Å²	56.4	44%	0.439	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-59.2	-19.2	179.3	-65.6	-22.5	0	0	0	112.5	K290 S291 F295 K296	K290-D293 WeakPolarHBondContact O-CB 3.3Å; K290-D293 PolarHBondContact O-N 3.49Å; K290-D293 VanDerWaalsContact O-N 3.11Å; S291-D293 VanDerWaalsContact C-N 3.25Å; S291-D293 PolarHBondContact O-N 3.27Å; D293-F295 VanDerWaalsContact C-N 3.31Å; D293-F295 PolarHBondContact O-N 3.46Å; D293-K296 WeakPolarHBondContact OD1-CE 3.45Å; D293-K296 IonicContact OD1-NZ 3.69Å; D293-K296 PolarHBondContact OD1-NZ 3.02Å
294	L	94.9	Very high	95.5	Very high	36 Å²	36	51.8 Å²	51.8	19%	0.188	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-64.2	-30.6	173.9	-79.9	173.4	0	0	0	114.4	R212 I281 Y285 S291 L292 Y380	R212-L294 PolarHBondContact NH2-O 2.84Å; I281-L294 HydrophobicContact CD1-CD1 4.07Å; I281-L294 HydrophobicContact CD1-CD2 4.03Å; Y285-L294 HydrophobicContact CE1-CD1 4.05Å; Y285-L294 HydrophobicContact CE1-CG 3.98Å; Y285-L294 HydrophobicContact CE2-CD1 4.36Å; Y285-L294 WeakPolarHBondContact OH-CD2 3.39Å; Y285-L294 WeakPolarHBondContact OH-CG 3.5Å; S291-L294 WeakPolarHBondContact O-CB 2.99Å; S291-L294 PolarHBondContact O-N 2.95Å; L292-L294 PolarHBondContact O-N 3.48Å; L294-Y380 HydrophobicContact CD1-CD2 3.64Å; L294-Y380 HydrophobicContact CD1-CE2 4.43Å; L294-Y380 HydrophobicContact CD1-CG 3.72Å
295	F	96	Very high	95.6	Very high	5 Å²	5	47.7 Å²	47.7	2%	0.022	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-148.4	-7.6	-169.7	73.2	-87.5	0	0	0	115.5	F187 I211 L292 D293 D297 D298 H313 T316 L317	F187-F295 HydrophobicContact CE2-CD2 4.42Å; F187-F295 AromaticContact CE2-CE2 3.76Å; F187-F295 HydrophobicContact CE2-CE2 3.76Å; F187-F295 HydrophobicContact CE2-CZ 4.39Å; F187-F295 HydrophobicContact CZ-CE2 4.26Å; I211-F295 HydrophobicContact CD1-CE2 4.39Å; I211-F295 HydrophobicContact CG2-CD2 3.7Å; I211-F295 HydrophobicContact CG2-CE2 3.8Å; L292-F295 HydrophobicContact CD2-CE1 4.03Å; L292-F295 HydrophobicContact CD2-CZ 3.81Å; L292-F295 PolarHBondContact O-N 3.34Å; D293-F295 VanDerWaalsContact C-N 3.31Å; D293-F295 PolarHBondContact O-N 3.46Å; F295-D297 PolarHBondContact O-N 3.25Å; F295-D297 VanDerWaalsContact O-N 3.09Å; F295-D298 VanDerWaalsContact CA-OD2 3.28Å; F295-D298 WeakPolarHBondContact CA-OD2 3.33Å; F295-D298 WeakPolarHBondContact O-CB 3.28Å; F295-D298 PolarHBondContact O-N 3.23Å; F295-H313 HydrophobicContact CB-CB 4.44Å; F295-H313 HydrophobicContact CD1-CB 3.65Å; F295-H313 AromaticContact CD1-CG 3.67Å; F295-H313 AromaticContact CD1-ND1 3.66Å; F295-H313 HydrophobicContact CD2-CB 3.95Å; F295-H313 HydrophobicContact CE1-CB 3.81Å; F295-H313 HydrophobicContact CE2-CB 4.1Å; F295-H313 HydrophobicContact CG-CB 3.73Å; F295-H313 AromaticContact CG-CG 3.9Å; F295-H313 HydrophobicContact CZ-CB 4.04Å; F295-H313 WeakPolarHBondContact CZ-O 3.39Å; F295-T316 HydrophobicContact CE1-CG2 4.07Å; F295-L317 HydrophobicContact CE2-CB 4.48Å; F295-L317 HydrophobicContact CZ-CB 4.06Å
296	K	96.6	Very high	95.6	Very high	46 Å²	46	48.5 Å²	48.5	20%	0.2	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.4	-173.4	71.9	-176.9	-170.6	-173.2	0	112.8	F187 P188 K190 L292 D293	F187-K296 HydrophobicContact CD2-CB 3.84Å; F187-K296 HydrophobicContact CE2-CB 3.83Å; P188-K296 WeakPolarHBondContact CD-O 3.49Å; P188-K296 WeakPolarHBondContact CG-O 3.47Å; K190-K296 VanDerWaalsContact CE-O 3.32Å; K190-K296 WeakPolarHBondContact CE-O 3.31Å; K190-K296 PolarHBondContact NZ-O 3.11Å; L292-K296 HydrophobicContact CB-CB 4.21Å; L292-K296 HydrophobicContact CB-CD 4.42Å; L292-K296 WeakPolarHBondContact O-CB 3.49Å; L292-K296 WeakPolarHBondContact O-CG 3.26Å; L292-K296 PolarHBondContact O-N 3.05Å; D293-K296 WeakPolarHBondContact OD1-CE 3.45Å; D293-K296 IonicContact OD1-NZ 3.69Å; D293-K296 PolarHBondContact OD1-NZ 3.02Å
297	D	96.2	Very high	95.6	Very high	117 Å²	117	41.4 Å²	41.4	63%	0.626	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-5	-179.2	-60.3	-47.9	0	0	0	113	F295	F295-D297 PolarHBondContact O-N 3.25Å; F295-D297 VanDerWaalsContact O-N 3.09Å
298	D	95.7	Very high	95.5	Very high	46 Å²	46	40.4 Å²	40.4	25%	0.246	22%	0.216	C	C	.	.	S	Bend	trans	-72	146.2	-179.9	-66.3	-35.9	0	0	0	112.1	K190 R212 F295	K190-D298 PolarHBondContact NZ-O 3.4Å; R212-D298 IonicContact CZ-OD2 3.51Å; R212-D298 IonicContact NE-OD2 2.8Å; R212-D298 PolarHBondContact NE-OD2 3.44Å; R212-D298 IonicContact NH2-OD2 3.36Å; R212-D298 PolarHBondContact NH2-OD2 2.98Å; F295-D298 VanDerWaalsContact CA-OD2 3.28Å; F295-D298 WeakPolarHBondContact CA-OD2 3.33Å; F295-D298 WeakPolarHBondContact O-CB 3.28Å; F295-D298 PolarHBondContact O-N 3.23Å
299	P	95.1	Very high	95.4	Very high	96 Å²	96	41.2 Å²	41.2	62%	0.623	22%	0.22	S	C	*	.	P	Polyproline II helix	trans	-65.7	152.9	175.1	28.7	-35	0	0	0	111.4
300	L	96.7	Very high	95.3	Very high	13 Å²	13	41.8 Å²	41.8	7%	0.068	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-72.5	139.5	172.4	-60.7	-179.9	0	0	0	110.5	K190 F192 V197 I199 I211 P304	K190-L300 HydrophobicContact CB-CD1 3.79Å; K190-L300 HydrophobicContact CB-CG 4.19Å; K190-L300 HydrophobicContact CD-CD2 4.34Å; K190-L300 HydrophobicContact CD-CG 4.34Å; K190-L300 HydrophobicContact CG-CD1 4.26Å; K190-L300 HydrophobicContact CG-CD2 4.25Å; K190-L300 HydrophobicContact CG-CG 4.27Å; F192-L300 HydrophobicContact CD2-CB 4.13Å; V197-L300 HydrophobicContact CG2-CD1 3.7Å; I199-L300 HydrophobicContact CD1-CD1 4.23Å; I199-L300 HydrophobicContact CD1-CD2 3.9Å; I211-L300 HydrophobicContact CG1-CD2 3.94Å; L300-P304 HydrophobicContact CD1-CG 3.77Å
301	I	96.1	Very high	95.3	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	20%	0.197	C	C	.	.	S	Bend	trans	-76.2	-38.4	177.9	-51.6	-61.1	0	0	0	110.7	G210 R212 A218 V221 K222 L309	G210-I301 PolarHBondContact O-N 3.3Å; R212-I301 HydrophobicContact CB-CD1 3.9Å; R212-I301 HydrophobicContact CB-CG1 3.71Å; A218-I301 HydrophobicContact CB-CD1 3.6Å; A218-I301 HydrophobicContact CB-CG2 4.46Å; V221-I301 HydrophobicContact CB-CG2 3.98Å; V221-I301 HydrophobicContact CG1-CG2 3.74Å; K222-I301 WeakPolarHBondContact CE-O 3.45Å; K222-I301 HydrophobicContact CG-CG2 4.47Å; I301-L309 HydrophobicContact CB-CD2 3.81Å; I301-L309 HydrophobicContact CG1-CD2 3.88Å; I301-L309 HydrophobicContact CG2-CD2 4.15Å
302	F	95.3	Very high	95.3	Very high	24 Å²	24	36.7 Å²	36.7	11%	0.105	20%	0.198	C	C	.	.	S	Bend	trans	-133.9	157.4	179.1	-60.1	-72.1	0	0	0	110.4	G210 V221 K222 K225 T307 L309	G210-F302 WeakPolarHBondContact CA-O 3.24Å; V221-F302 HydrophobicContact CG1-CE2 4.33Å; K222-F302 HydrophobicContact CG-CE1 3.75Å; K222-F302 HydrophobicContact CG-CZ 3.9Å; K225-F302 HydrophobicContact CD-CE1 4.25Å; K225-F302 HydrophobicContact CD-CE2 3.87Å; K225-F302 HydrophobicContact CD-CZ 3.46Å; K225-F302 VanDerWaalsContact CD-CZ 3.46Å; F302-T307 HydrophobicContact CB-CG2 4.25Å; F302-T307 HydrophobicContact CD1-CG2 3.6Å; F302-T307 HydrophobicContact CD2-CG2 3.66Å; F302-T307 HydrophobicContact CE1-CG2 3.76Å; F302-T307 HydrophobicContact CE2-CG2 3.84Å; F302-T307 HydrophobicContact CG-CG2 3.55Å; F302-T307 HydrophobicContact CZ-CG2 3.9Å; F302-L309 HydrophobicContact CD2-CB 4.11Å; F302-L309 HydrophobicContact CD2-CD2 3.99Å; F302-L309 HydrophobicContact CE2-CB 4.28Å; F302-L309 HydrophobicContact CE2-CD1 4.4Å; F302-L309 HydrophobicContact CE2-CD2 4.08Å
303	K	96.5	Very high	95.3	Very high	111 Å²	111	36.6 Å²	36.6	48%	0.483	20%	0.198	S	C	.	.			trans	-60.6	134.5	170.4	-174.6	177.3	178.3	-179.8	0	109.7	F192 G305 T306	F192-K303 HydrophobicContact CD1-CB 3.75Å; F192-K303 HydrophobicContact CD1-CG 4.34Å; F192-K303 HydrophobicContact CE1-CB 3.91Å; F192-K303 HydrophobicContact CG-CB 4.1Å; F192-K303 HydrophobicContact CZ-CB 4.4Å; K303-G305 PolarHBondContact O-N 3.11Å; K303-T306 HydrophobicContact CB-CG2 3.77Å; K303-T306 HydrophobicContact CD-CG2 3.99Å; K303-T306 HydrophobicContact CG-CG2 3.96Å; K303-T306 PolarHBondContact O-N 3.46Å; K303-T306 PolarHBondContact O-OG1 3.35Å
304	P	97.1	Very high	95.4	Very high	13 Å²	13	32.7 Å²	32.7	8%	0.084	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	139.3	175.3	-25.9	34.2	0	0	0	112.2	V197 T198 I199 M203 L208 L300 T306	V197-P304 HydrophobicContact CB-CG 4.1Å; V197-P304 HydrophobicContact CG2-CG 3.91Å; T198-P304 WeakPolarHBondContact O-CB 3.44Å; I199-P304 HydrophobicContact CG1-CB 4.34Å; I199-P304 HydrophobicContact CG1-CG 3.84Å; M203-P304 HydrophobicContact SD-CB 3.66Å; L208-P304 CarbonylContact O-C 3.57Å; L208-P304 WeakPolarHBondContact O-CA 3.26Å; L300-P304 HydrophobicContact CD1-CG 3.77Å; P304-T306 VanDerWaalsContact C-N 3.31Å; P304-T306 PolarHBondContact O-N 2.97Å
305	G	95.1	Very high	95.6	Very high	22 Å²	22	31 Å²	31	23%	0.227	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	-0.1	179.4	0	0	0	0	0	115.9	L208 K303	L208-G305 PolarHBondContact O-N 3.48Å; K303-G305 PolarHBondContact O-N 3.11Å
306	T	93.5	Very high	95.7	Very high	55 Å²	55	30.8 Å²	30.8	34%	0.337	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-32.5	-174.7	72.8	0	0	0	0	114.7	K303 P304	K303-T306 HydrophobicContact CB-CG2 3.77Å; K303-T306 HydrophobicContact CD-CG2 3.99Å; K303-T306 HydrophobicContact CG-CG2 3.96Å; K303-T306 PolarHBondContact O-N 3.46Å; K303-T306 PolarHBondContact O-OG1 3.35Å; P304-T306 VanDerWaalsContact C-N 3.31Å; P304-T306 PolarHBondContact O-N 2.97Å
307	T	92.2	Very high	95.8	Very high	24 Å²	24	28.6 Å²	28.6	15%	0.147	16%	0.157	C	C	.	.	S	Bend	trans	-149.5	114.9	-160.2	-60	0	0	0	0	111.6	K225 F302 L309	K225-T307 HydrophobicContact CD-CG2 3.92Å; F302-T307 HydrophobicContact CB-CG2 4.25Å; F302-T307 HydrophobicContact CD1-CG2 3.6Å; F302-T307 HydrophobicContact CD2-CG2 3.66Å; F302-T307 HydrophobicContact CE1-CG2 3.76Å; F302-T307 HydrophobicContact CE2-CG2 3.84Å; F302-T307 HydrophobicContact CG-CG2 3.55Å; F302-T307 HydrophobicContact CZ-CG2 3.9Å; T307-L309 PolarHBondContact O-N 3.09Å
308	F	92.6	Very high	95.9	Very high	15 Å²	15	23 Å²	23	7%	0.066	13%	0.127	C	C	.	.			trans	-64.4	109.6	-179	172.3	-98	0	0	0	114.5	S206 H207 L208 K225 K435 T436 W440 Y446	S206-F308 WeakPolarHBondContact O-CD2 3.47Å; H207-F308 HydrophobicContact CB-CD2 3.74Å; H207-F308 HydrophobicContact CB-CE2 3.56Å; H207-F308 HydrophobicContact CB-CZ 4.38Å; H207-F308 CarbonylContact O-C 3.53Å; H207-F308 WeakPolarHBondContact O-CA 3.5Å; L208-F308 HydrophobicContact CD2-CB 4.2Å; K225-F308 VanDerWaalsContact NZ-C 3.3Å; K225-F308 PolarHBondContact NZ-O 3.24Å; F308-K435 VanDerWaalsContact CB-O 3.23Å; F308-K435 WeakPolarHBondContact CB-O 3.19Å; F308-T436 HydrophobicContact CB-CG2 4.43Å; F308-T436 HydrophobicContact CD2-CG2 3.88Å; F308-W440 AromaticContact CE1-CH2 3.75Å; F308-W440 HydrophobicContact CE1-CH2 3.75Å; F308-W440 HydrophobicContact CE1-CZ3 4.11Å; F308-W440 AromaticContact CZ-CH2 3.84Å; F308-W440 HydrophobicContact CZ-CH2 3.84Å; F308-Y446 AromaticContact CE2-CD1 3.72Å; F308-Y446 HydrophobicContact CE2-CD1 3.72Å; F308-Y446 HydrophobicContact CE2-CD2 4.07Å; F308-Y446 HydrophobicContact CE2-CE1 4.45Å; F308-Y446 AromaticContact CE2-CG 3.5Å; F308-Y446 HydrophobicContact CE2-CG 3.5Å; F308-Y446 HydrophobicContact CZ-CD1 4.41Å; F308-Y446 AromaticContact CZ-CD2 3.97Å; F308-Y446 HydrophobicContact CZ-CD2 3.97Å; F308-Y446 AromaticContact CZ-CG 3.89Å; F308-Y446 HydrophobicContact CZ-CG 3.89Å
309	L	93.4	Very high	96	Very high	21 Å²	21	20.9 Å²	20.9	11%	0.11	12%	0.116	C	C	.	.			trans	-126	105.4	177.8	177.4	63.8	0	0	0	109.2	H207 V221 I301 F302 T307 S311	H207-L309 WeakPolarHBondContact CB-O 3.28Å; H207-L309 PolarHBondContact O-N 2.87Å; V221-L309 HydrophobicContact CG1-CD1 3.81Å; V221-L309 HydrophobicContact CG1-CD2 4.38Å; I301-L309 HydrophobicContact CB-CD2 3.81Å; I301-L309 HydrophobicContact CG1-CD2 3.88Å; I301-L309 HydrophobicContact CG2-CD2 4.15Å; F302-L309 HydrophobicContact CD2-CB 4.11Å; F302-L309 HydrophobicContact CD2-CD2 3.99Å; F302-L309 HydrophobicContact CE2-CB 4.28Å; F302-L309 HydrophobicContact CE2-CD1 4.4Å; F302-L309 HydrophobicContact CE2-CD2 4.08Å; T307-L309 PolarHBondContact O-N 3.09Å; L309-S311 PolarHBondContact O-N 3.06Å
310	Y	93.5	Very high	96.2	Very high	38 Å²	38	16.3 Å²	16.3	15%	0.149	9%	0.086	C	C	.	.			trans	-54.5	124.1	175.4	-168	-89.5	0	0	0	110.5	S155 K158 H207 H213 W440	S155-Y310 WeakPolarHBondContact CB-OH 3.37Å; S155-Y310 PolarHBondContact OG-OH 3.43Å; S155-Y310 VanDerWaalsContact OG-OH 3.09Å; K158-Y310 HydrophobicContact CD-CE2 4.27Å; K158-Y310 WeakPolarHBondContact CD-OH 3.34Å; K158-Y310 VanDerWaalsContact CE-OH 3.31Å; K158-Y310 WeakPolarHBondContact CE-OH 3.45Å; K158-Y310 PolarHBondContact NZ-OH 3.18Å; H207-Y310 AromaticContact CD2-CD2 3.51Å; H207-Y310 AromaticContact CD2-CE2 3.92Å; H207-Y310 AromaticContact CE1-CD2 3.93Å; H207-Y310 AromaticContact NE2-CD2 3.26Å; H207-Y310 VanDerWaalsContact NE2-CD2 3.26Å; H207-Y310 WeakPolarHBondContact NE2-CD2 3.47Å; H207-Y310 AromaticContact NE2-CE2 3.25Å; H207-Y310 WeakPolarHBondContact NE2-CE2 3.43Å; H213-Y310 WeakPolarHBondContact CB-O 3.43Å; Y310-W440 HydrophobicContact CD2-CH2 4.01Å; Y310-W440 HydrophobicContact CG-CH2 4.38Å
311	S	95.6	Very high	96.3	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.083	C	C	.	.			trans	-145.2	118.3	-175.5	174.3	0	0	0	0	111.7	H207 I211 R212 L309 H313 A314	H207-S311 PolarHBondContact CE1-N 3.28Å; H207-S311 PolarHBondContact CE1-O 3.02Å; H207-S311 VanDerWaalsContact CE1-O 3.28Å; H207-S311 PolarHBondContact ND1-N 3.21Å; H207-S311 VanDerWaalsContact ND1-N 3.18Å; I211-S311 WeakPolarHBondContact O-CB 3.48Å; I211-S311 PolarHBondContact O-OG 3.26Å; R212-S311 WeakPolarHBondContact O-CB 3.31Å; R212-S311 PolarHBondContact O-OG 3.45Å; L309-S311 PolarHBondContact O-N 3.06Å; S311-H313 PolarHBondContact OG-N 3.41Å; S311-A314 PolarHBondContact OG-N 2.99Å
312	T	96.1	Very high	96.4	Very high	3 Å²	3	15.6 Å²	15.6	2%	0.018	8%	0.083	C	C	.	.	H	α-helix	trans	-67.8	-38.6	167.7	-72.5	0	0	0	0	111.9	K158 H213 A314 F315 T316 K381	K158-T312 PolarHBondContact NZ-OG1 3.2Å; H213-T312 PolarHBondContact CE1-OG1 2.92Å; H213-T312 PolarHBondContact ND1-N 3.34Å; T312-A314 VanDerWaalsContact C-N 3.29Å; T312-A314 PolarHBondContact O-N 3.19Å; T312-F315 CarbonylContact O-C 3.25Å; T312-F315 WeakPolarHBondContact O-CA 3.42Å; T312-F315 WeakPolarHBondContact O-CB 3.11Å; T312-F315 PolarHBondContact O-N 2.84Å; T312-T316 PolarHBondContact O-N 2.98Å; T312-T316 PolarHBondContact O-OG1 3Å; T312-K381 HydrophobicContact CG2-CB 3.55Å; T312-K381 HydrophobicContact CG2-CD 3.93Å; T312-K381 HydrophobicContact CG2-CG 4.39Å
313	H	97	Very high	96.6	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62.6	-35.6	177.7	-71.6	-39.1	0	0	0	112.4	I211 R212 H213 E278 F295 S311 F315 T316 L317 Y380	I211-H313 HydrophobicContact CG2-CB 4.11Å; R212-H313 PolarHBondContact NH1-CD2 3.14Å; R212-H313 PolarHBondContact NH1-NE2 2.71Å; H213-H313 PolarHBondContact O-CD2 3.45Å; H213-H313 VanDerWaalsContact O-CD2 3.32Å; E278-H313 IonicContact OE2-CD2 3.65Å; E278-H313 IonicContact OE2-CE1 2.81Å; E278-H313 IonicContact OE2-NE2 3.31Å; E278-H313 PolarHBondContact OE2-NE2 3.05Å; F295-H313 HydrophobicContact CB-CB 4.44Å; F295-H313 HydrophobicContact CD1-CB 3.65Å; F295-H313 AromaticContact CD1-CG 3.67Å; F295-H313 AromaticContact CD1-ND1 3.66Å; F295-H313 HydrophobicContact CD2-CB 3.95Å; F295-H313 HydrophobicContact CE1-CB 3.81Å; F295-H313 HydrophobicContact CE2-CB 4.1Å; F295-H313 HydrophobicContact CG-CB 3.73Å; F295-H313 AromaticContact CG-CG 3.9Å; F295-H313 HydrophobicContact CZ-CB 4.04Å; F295-H313 WeakPolarHBondContact CZ-O 3.39Å; S311-H313 PolarHBondContact OG-N 3.41Å; H313-F315 VanDerWaalsContact C-N 3.27Å; H313-F315 PolarHBondContact O-N 2.89Å; H313-T316 WeakPolarHBondContact O-CA 3.44Å; H313-T316 WeakPolarHBondContact O-CB 3.4Å; H313-T316 PolarHBondContact O-N 2.81Å; H313-T316 VanDerWaalsContact O-N 3.08Å; H313-L317 PolarHBondContact O-N 2.53Å; H313-Y380 AromaticContact CE1-CE2 3.98Å
314	A	98.2	Very high	96.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-58.5	-40.6	171.4	0	0	0	0	0	111.7	I204 I211 S311 T312 L317 L318	I204-A314 HydrophobicContact CG2-CB 4.02Å; I204-A314 WeakPolarHBondContact CG2-O 3.31Å; I211-A314 HydrophobicContact CB-CB 4.26Å; I211-A314 HydrophobicContact CD1-CB 4.26Å; S311-A314 PolarHBondContact OG-N 2.99Å; T312-A314 VanDerWaalsContact C-N 3.29Å; T312-A314 PolarHBondContact O-N 3.19Å; A314-L317 WeakPolarHBondContact O-CB 3.43Å; A314-L317 PolarHBondContact O-N 2.86Å; A314-L318 PolarHBondContact O-N 2.74Å
315	F	98.6	Very high	96.8	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-71.6	-28.8	174.5	-87.9	-105.6	0	0	0	113.1	K158 T161 I204 H207 T312 H313 L317 L318 S319 A383	K158-F315 HydrophobicContact CB-CD1 3.83Å; K158-F315 HydrophobicContact CB-CE1 3.47Å; K158-F315 VanDerWaalsContact CB-CE1 3.47Å; K158-F315 HydrophobicContact CB-CE2 4.49Å; K158-F315 HydrophobicContact CB-CG 4.48Å; K158-F315 HydrophobicContact CB-CZ 3.83Å; K158-F315 HydrophobicContact CD-CD1 4.11Å; K158-F315 HydrophobicContact CD-CD2 3.73Å; K158-F315 HydrophobicContact CD-CE1 4.14Å; K158-F315 HydrophobicContact CD-CE2 3.76Å; K158-F315 HydrophobicContact CD-CG 3.9Å; K158-F315 HydrophobicContact CD-CZ 3.96Å; K158-F315 HydrophobicContact CG-CD1 3.6Å; K158-F315 HydrophobicContact CG-CD2 4.16Å; K158-F315 HydrophobicContact CG-CE1 3.73Å; K158-F315 HydrophobicContact CG-CE2 4.28Å; K158-F315 HydrophobicContact CG-CG 3.82Å; K158-F315 HydrophobicContact CG-CZ 4.07Å; T161-F315 HydrophobicContact CG2-CD1 4.38Å; I204-F315 HydrophobicContact CG2-CD2 4.4Å; H207-F315 AromaticContact CE1-CD2 3.55Å; H207-F315 AromaticContact CE1-CE2 3.3Å; H207-F315 WeakPolarHBondContact CE1-CE2 3.25Å; H207-F315 AromaticContact ND1-CE2 3.95Å; H207-F315 AromaticContact NE2-CE2 3.7Å; T312-F315 CarbonylContact O-C 3.25Å; T312-F315 WeakPolarHBondContact O-CA 3.42Å; T312-F315 WeakPolarHBondContact O-CB 3.11Å; T312-F315 PolarHBondContact O-N 2.84Å; H313-F315 VanDerWaalsContact C-N 3.27Å; H313-F315 PolarHBondContact O-N 2.89Å; F315-L317 VanDerWaalsContact C-N 3.34Å; F315-L318 HydrophobicContact CD1-CD2 4Å; F315-L318 HydrophobicContact CE1-CD2 4Å; F315-L318 WeakPolarHBondContact O-CB 3.36Å; F315-L318 PolarHBondContact O-N 3.33Å; F315-S319 PolarHBondContact O-N 2.96Å; F315-A383 HydrophobicContact CB-CB 4.29Å; F315-A383 WeakPolarHBondContact O-CB 3.34Å
316	T	98.1	Very high	96.9	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.6	-44.3	167.9	-58.1	0	0	0	0	111	L292 F295 T312 H313 L318 S319 A320 Y380	L292-T316 HydrophobicContact CD2-CG2 4.1Å; F295-T316 HydrophobicContact CE1-CG2 4.07Å; T312-T316 PolarHBondContact O-N 2.98Å; T312-T316 PolarHBondContact O-OG1 3Å; H313-T316 WeakPolarHBondContact O-CA 3.44Å; H313-T316 WeakPolarHBondContact O-CB 3.4Å; H313-T316 PolarHBondContact O-N 2.81Å; H313-T316 VanDerWaalsContact O-N 3.08Å; T316-L318 VanDerWaalsContact C-N 3.31Å; T316-L318 PolarHBondContact O-N 3.24Å; T316-S319 PolarHBondContact O-N 2.94Å; T316-S319 PolarHBondContact O-OG 3.46Å; T316-A320 PolarHBondContact O-N 2.58Å; T316-Y380 WeakPolarHBondContact CB-O 3.48Å; T316-Y380 WeakPolarHBondContact CG2-O 3.41Å; T316-Y380 PolarHBondContact OG1-O 3.07Å
317	L	98.7	Very high	97.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.9	-41.5	171.1	178.3	59	0	0	0	112	V180 V184 F187 I204 I211 L292 F295 H313 A314 F315 S319 A320 V321	V180-L317 HydrophobicContact CB-CD2 4.43Å; V180-L317 HydrophobicContact CG1-CD2 4.32Å; V180-L317 HydrophobicContact CG2-CD2 4.2Å; V184-L317 HydrophobicContact CB-CD1 4.47Å; V184-L317 HydrophobicContact CG1-CD1 4.38Å; V184-L317 HydrophobicContact CG2-CD1 4.44Å; F187-L317 HydrophobicContact CB-CD1 4.17Å; F187-L317 HydrophobicContact CD1-CD2 4.11Å; F187-L317 HydrophobicContact CD2-CD1 3.65Å; F187-L317 HydrophobicContact CD2-CD2 4.08Å; F187-L317 HydrophobicContact CD2-CG 4.45Å; F187-L317 HydrophobicContact CE1-CD2 3.88Å; F187-L317 HydrophobicContact CE2-CD1 4.14Å; F187-L317 HydrophobicContact CE2-CD2 3.85Å; F187-L317 HydrophobicContact CE2-CG 4.49Å; F187-L317 HydrophobicContact CG-CD1 3.85Å; F187-L317 HydrophobicContact CG-CD2 4.2Å; F187-L317 HydrophobicContact CZ-CD2 3.74Å; I204-L317 HydrophobicContact CD1-CB 4.38Å; I204-L317 HydrophobicContact CD1-CD2 3.79Å; I204-L317 HydrophobicContact CD1-CG 3.99Å; I211-L317 HydrophobicContact CD1-CD2 3.81Å; L292-L317 HydrophobicContact CD1-CD1 4.22Å; L292-L317 HydrophobicContact CD2-CB 4.19Å; L292-L317 HydrophobicContact CD2-CD1 4.15Å; F295-L317 HydrophobicContact CE2-CB 4.48Å; F295-L317 HydrophobicContact CZ-CB 4.06Å; H313-L317 PolarHBondContact O-N 2.53Å; A314-L317 WeakPolarHBondContact O-CB 3.43Å; A314-L317 PolarHBondContact O-N 2.86Å; F315-L317 VanDerWaalsContact C-N 3.34Å; L317-S319 VanDerWaalsContact C-N 3.31Å; L317-S319 PolarHBondContact O-N 2.92Å; L317-A320 PolarHBondContact O-N 3.41Å; L317-V321 WeakPolarHBondContact O-CG2 3.2Å; L317-V321 PolarHBondContact O-N 3.3Å
318	L	98.8	Very high	97.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58.1	-42.4	175.9	-171.6	61.7	0	0	0	111.8	T161 I204 L205 A314 F315 T316 A320 V321 L322	T161-L318 HydrophobicContact CG2-CD2 3.88Å; T161-L318 HydrophobicContact CG2-CG 4.35Å; I204-L318 HydrophobicContact CG2-CB 3.86Å; I204-L318 HydrophobicContact CG2-CD2 4.36Å; I204-L318 HydrophobicContact CG2-CG 4.5Å; L205-L318 HydrophobicContact CD2-CD2 3.53Å; L205-L318 HydrophobicContact CG-CD2 4.21Å; A314-L318 PolarHBondContact O-N 2.74Å; F315-L318 HydrophobicContact CD1-CD2 4Å; F315-L318 HydrophobicContact CE1-CD2 4Å; F315-L318 WeakPolarHBondContact O-CB 3.36Å; F315-L318 PolarHBondContact O-N 3.33Å; T316-L318 VanDerWaalsContact C-N 3.31Å; T316-L318 PolarHBondContact O-N 3.24Å; L318-A320 VanDerWaalsContact C-N 3.31Å; L318-A320 PolarHBondContact O-N 3.48Å; L318-V321 WeakPolarHBondContact O-CB 3.3Å; L318-V321 PolarHBondContact O-N 3.35Å; L318-V321 VanDerWaalsContact O-N 3.1Å; L318-L322 HydrophobicContact CD1-CD2 4.07Å; L318-L322 HydrophobicContact CD1-CG 4.4Å; L318-L322 HydrophobicContact CG-CD2 4.41Å; L318-L322 HydrophobicContact CG-CG 4.23Å; L318-L322 WeakPolarHBondContact O-CG 3.39Å; L318-L322 PolarHBondContact O-N 3.48Å
319	S	98.6	Very high	97.7	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.007	14%	0.141	C	C	.	.	H	α-helix	trans	-58.5	-41.2	177.2	41.4	0	0	0	0	113.2	F315 T316 L317 L322 E323	F315-S319 PolarHBondContact O-N 2.96Å; T316-S319 PolarHBondContact O-N 2.94Å; T316-S319 PolarHBondContact O-OG 3.46Å; L317-S319 VanDerWaalsContact C-N 3.31Å; L317-S319 PolarHBondContact O-N 2.92Å; S319-L322 PolarHBondContact O-N 2.83Å; S319-E323 WeakPolarHBondContact O-CB 3.34Å; S319-E323 PolarHBondContact O-N 2.87Å
320	A	98.7	Very high	97.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66	-39	174.8	0	0	0	0	0	111.9	V184 V288 L292 T316 L317 L318 E323 R324	V184-A320 HydrophobicContact CG1-CB 4.47Å; V184-A320 HydrophobicContact CG2-CB 3.88Å; V288-A320 HydrophobicContact CG2-CB 4.13Å; L292-A320 HydrophobicContact CD1-CB 4.03Å; L292-A320 HydrophobicContact CD2-CB 4.5Å; T316-A320 PolarHBondContact O-N 2.58Å; L317-A320 PolarHBondContact O-N 3.41Å; L318-A320 VanDerWaalsContact C-N 3.31Å; L318-A320 PolarHBondContact O-N 3.48Å; A320-E323 PolarHBondContact O-N 2.76Å; A320-R324 WeakPolarHBondContact O-CB 3.46Å; A320-R324 WeakPolarHBondContact O-CG 3.41Å; A320-R324 PolarHBondContact O-N 3.49Å
321	V	98.9	Very high	98.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.7	-46.9	173.7	170.6	0	0	0	0	111.3	L174 V180 Y183 V184 L317 L318 R324 A325	L174-V321 HydrophobicContact CD1-CG1 3.63Å; V180-V321 HydrophobicContact CB-CG2 4.18Å; V180-V321 HydrophobicContact CG1-CG2 4.18Å; Y183-V321 HydrophobicContact CD2-CG1 3.63Å; Y183-V321 HydrophobicContact CE2-CG1 4.25Å; Y183-V321 HydrophobicContact CG-CG1 3.93Å; V184-V321 HydrophobicContact CG2-CB 4.44Å; V184-V321 HydrophobicContact CG2-CG2 3.75Å; L317-V321 WeakPolarHBondContact O-CG2 3.2Å; L317-V321 PolarHBondContact O-N 3.3Å; L318-V321 WeakPolarHBondContact O-CB 3.3Å; L318-V321 PolarHBondContact O-N 3.35Å; L318-V321 VanDerWaalsContact O-N 3.1Å; V321-R324 PolarHBondContact O-N 2.88Å; V321-A325 WeakPolarHBondContact O-CB 3.44Å; V321-A325 PolarHBondContact O-N 3.07Å
322	L	98.8	Very high	98.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.3	-42.9	179.8	-59.9	-164	0	0	0	111.6	T161 A164 A165 L168 L174 L318 S319 R324 A325 A326 F330 I333	T161-L322 HydrophobicContact CG2-CD1 3.92Å; A164-L322 HydrophobicContact CB-CD1 4.37Å; A165-L322 HydrophobicContact CB-CD1 4.07Å; A165-L322 HydrophobicContact CB-CD2 3.78Å; L168-L322 HydrophobicContact CD1-CB 3.96Å; L168-L322 HydrophobicContact CD1-CD2 4.04Å; L168-L322 HydrophobicContact CD1-CG 4.37Å; L174-L322 HydrophobicContact CD2-CD2 3.59Å; L318-L322 HydrophobicContact CD1-CD2 4.07Å; L318-L322 HydrophobicContact CD1-CG 4.4Å; L318-L322 HydrophobicContact CG-CD2 4.41Å; L318-L322 HydrophobicContact CG-CG 4.23Å; L318-L322 WeakPolarHBondContact O-CG 3.39Å; L318-L322 PolarHBondContact O-N 3.48Å; S319-L322 PolarHBondContact O-N 2.83Å; L322-R324 VanDerWaalsContact C-N 3.33Å; L322-R324 PolarHBondContact O-N 3.35Å; L322-A325 PolarHBondContact O-N 2.94Å; L322-A326 VanDerWaalsContact O-CB 3.3Å; L322-A326 WeakPolarHBondContact O-CB 3.45Å; L322-A326 PolarHBondContact O-N 3.39Å; L322-F330 HydrophobicContact CB-CD2 4.43Å; L322-F330 HydrophobicContact CD1-CE2 4.29Å; L322-I333 HydrophobicContact CB-CD1 4.4Å
323	E	98.8	Very high	98.4	Very high	37 Å²	37	31.2 Å²	31.2	17%	0.173	15%	0.146	C	C	.	.	H	α-helix	trans	-57	-46.4	177	173.5	162.5	117.2	0	0	111.7	V288 S319 A320 N327 Q328 R329 F330	V288-E323 HydrophobicContact CG2-CB 4.22Å; V288-E323 HydrophobicContact CG2-CG 4.46Å; V288-E323 WeakPolarHBondContact CG2-OE2 3.26Å; S319-E323 WeakPolarHBondContact O-CB 3.34Å; S319-E323 PolarHBondContact O-N 2.87Å; A320-E323 PolarHBondContact O-N 2.76Å; E323-N327 WeakPolarHBondContact O-CA 3.34Å; E323-N327 PolarHBondContact O-N 3.37Å; E323-Q328 VanDerWaalsContact CA-O 3.26Å; E323-Q328 WeakPolarHBondContact CA-O 3.38Å; E323-Q328 WeakPolarHBondContact CG-O 3.23Å; E323-Q328 PolarHBondContact O-N 3.38Å; E323-R329 WeakPolarHBondContact OE2-CA 3.13Å; E323-F330 HydrophobicContact CB-CB 4.22Å; E323-F330 PolarHBondContact OE2-N 2.91Å
324	R	98.4	Very high	98.5	Very high	130 Å²	130	31.2 Å²	31.2	49%	0.491	15%	0.146	S	C	.	.	H	α-helix	trans	-72.9	-39.5	179.6	-65.7	-70.3	-164.6	-173.5	4.5	112.7	Y183 V184 E186 A320 V321 L322 A326 N327	Y183-R324 VanDerWaalsContact O-CB 3.27Å; Y183-R324 WeakPolarHBondContact O-CB 3.01Å; Y183-R324 VanDerWaalsContact O-CG 3.24Å; Y183-R324 WeakPolarHBondContact O-CG 3.47Å; V184-R324 HydrophobicContact CG2-CG 4.5Å; E186-R324 IonicContact OE1-NE 3.96Å; E186-R324 IonicContact OE1-NH2 3.24Å; E186-R324 PolarHBondContact OE1-NH2 2.91Å; A320-R324 WeakPolarHBondContact O-CB 3.46Å; A320-R324 WeakPolarHBondContact O-CG 3.41Å; A320-R324 PolarHBondContact O-N 3.49Å; V321-R324 PolarHBondContact O-N 2.88Å; L322-R324 VanDerWaalsContact C-N 3.33Å; L322-R324 PolarHBondContact O-N 3.35Å; R324-A326 VanDerWaalsContact C-N 3.34Å; R324-N327 PolarHBondContact O-N 3.33Å
325	A	98.6	Very high	98.5	Very high	17 Å²	17	34.8 Å²	34.8	14%	0.14	16%	0.162	C	C	.	.	H	α-helix	trans	-64.3	-38.5	176.7	0	0	0	0	0	112.2	L174 Y183 V321 L322	L174-A325 HydrophobicContact CB-CB 4.42Å; L174-A325 HydrophobicContact CD1-CB 4.17Å; Y183-A325 HydrophobicContact CD1-CB 3.81Å; Y183-A325 HydrophobicContact CE1-CB 3.87Å; V321-A325 WeakPolarHBondContact O-CB 3.44Å; V321-A325 PolarHBondContact O-N 3.07Å; L322-A325 PolarHBondContact O-N 2.94Å
326	A	98.3	Very high	98.5	Very high	15 Å²	15	37.6 Å²	37.6	12%	0.124	18%	0.177	C	C	.	.	H	α-helix	trans	-84.2	-15.6	178.9	0	0	0	0	0	113.8	L168 L322 R324 Q328 I333	L168-A326 HydrophobicContact CD1-CB 4.14Å; L168-A326 HydrophobicContact CD2-CB 3.81Å; L322-A326 VanDerWaalsContact O-CB 3.3Å; L322-A326 WeakPolarHBondContact O-CB 3.45Å; L322-A326 PolarHBondContact O-N 3.39Å; R324-A326 VanDerWaalsContact C-N 3.34Å; A326-Q328 HydrophobicContact CB-CB 4.11Å; A326-Q328 PolarHBondContact O-N 3Å; A326-I333 HydrophobicContact CB-CD1 3.48Å; A326-I333 VanDerWaalsContact CB-CD1 3.48Å; A326-I333 HydrophobicContact CB-CG1 4.04Å
327	N	97.7	Very high	98.5	Very high	155 Å²	155	38 Å²	38	83%	0.829	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	41.6	-167.1	-168.4	44.3	0	0	0	112.1	E323 R324	E323-N327 WeakPolarHBondContact O-CA 3.34Å; E323-N327 PolarHBondContact O-N 3.37Å; R324-N327 PolarHBondContact O-N 3.33Å
328	Q	98.1	Very high	98.5	Very high	68 Å²	68	38.2 Å²	38.2	32%	0.318	18%	0.18	S	C	.	.	S	Bend	trans	-148.2	142	-175.3	179	178.3	-1.9	0	0	108.4	E323 A326 F330 D332 I333 D336	E323-Q328 VanDerWaalsContact CA-O 3.26Å; E323-Q328 WeakPolarHBondContact CA-O 3.38Å; E323-Q328 WeakPolarHBondContact CG-O 3.23Å; E323-Q328 PolarHBondContact O-N 3.38Å; A326-Q328 HydrophobicContact CB-CB 4.11Å; A326-Q328 PolarHBondContact O-N 3Å; Q328-F330 PolarHBondContact O-N 3.08Å; Q328-D332 HydrophobicContact CG-CB 3.96Å; Q328-I333 HydrophobicContact CB-CG1 4.03Å; Q328-I333 HydrophobicContact CG-CG1 3.95Å; Q328-D336 PolarHBondContact NE2-OD2 2.82Å
329	R	98.2	Very high	98.5	Very high	158 Å²	158	46 Å²	46	60%	0.596	21%	0.209	S	C	*	.			trans	-56	139	179.5	-59.9	-172.8	-58.7	170.1	5.2	110.9	E323 L331 D332 I333	E323-R329 WeakPolarHBondContact OE2-CA 3.13Å; R329-L331 VanDerWaalsContact C-N 3.3Å; R329-L331 PolarHBondContact O-N 3.49Å; R329-D332 HydrophobicContact CB-CB 4.43Å; R329-D332 WeakPolarHBondContact CB-OD2 3.4Å; R329-D332 IonicContact CZ-OD1 3.77Å; R329-D332 IonicContact CZ-OD2 3.8Å; R329-D332 VanDerWaalsContact CZ-OD2 3.3Å; R329-D332 IonicContact NE-OD1 3.47Å; R329-D332 IonicContact NE-OD2 3.9Å; R329-D332 PolarHBondContact NE-OD2 3.15Å; R329-D332 IonicContact NH2-OD1 3.18Å; R329-D332 PolarHBondContact NH2-OD1 3.34Å; R329-D332 IonicContact NH2-OD2 2.93Å; R329-D332 PolarHBondContact NH2-OD2 2.99Å; R329-D332 WeakPolarHBondContact O-CB 3.35Å; R329-D332 PolarHBondContact O-N 2.93Å; R329-I333 PolarHBondContact O-N 3.05Å; R329-I333 VanDerWaalsContact O-N 3.12Å
330	F	98.6	Very high	98.4	Very high	1 Å²	1	51.6 Å²	51.6	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-52.4	-47	-177.2	173.3	-106.3	0	0	0	112.7	T161 V288 L322 E323 Q328 D332 I333 M334 W382 A383 F387	T161-F330 HydrophobicContact CG2-CE2 4.06Å; T161-F330 HydrophobicContact CG2-CZ 4.24Å; V288-F330 HydrophobicContact CG1-CB 3.93Å; V288-F330 HydrophobicContact CG1-CD1 4.13Å; V288-F330 HydrophobicContact CG1-CG 4.25Å; V288-F330 HydrophobicContact CG2-CB 4.39Å; L322-F330 HydrophobicContact CB-CD2 4.43Å; L322-F330 HydrophobicContact CD1-CE2 4.29Å; E323-F330 HydrophobicContact CB-CB 4.22Å; E323-F330 PolarHBondContact OE2-N 2.91Å; Q328-F330 PolarHBondContact O-N 3.08Å; F330-D332 VanDerWaalsContact C-N 3.26Å; F330-D332 PolarHBondContact O-N 2.86Å; F330-I333 WeakPolarHBondContact O-CB 3.06Å; F330-I333 PolarHBondContact O-N 3.49Å; F330-M334 HydrophobicContact CD1-CG 4.43Å; F330-M334 HydrophobicContact CD2-CG 4.32Å; F330-M334 HydrophobicContact CE1-CG 3.88Å; F330-M334 HydrophobicContact CE2-CG 3.76Å; F330-M334 HydrophobicContact CE2-SD 3.89Å; F330-M334 HydrophobicContact CZ-CG 3.5Å; F330-M334 HydrophobicContact CZ-SD 3.86Å; F330-M334 WeakPolarHBondContact O-CG 3.12Å; F330-M334 PolarHBondContact O-N 3.46Å; F330-M334 VanDerWaalsContact O-N 3.1Å; F330-W382 HydrophobicContact CD1-CB 4.18Å; F330-W382 HydrophobicContact CE1-CB 3.71Å; F330-A383 HydrophobicContact CE1-CB 4.11Å; F330-A383 HydrophobicContact CE2-CB 4.21Å; F330-A383 HydrophobicContact CZ-CB 3.61Å; F330-F387 HydrophobicContact CE1-CE2 4.38Å; F330-F387 HydrophobicContact CE1-CZ 4.03Å; F330-F387 HydrophobicContact CZ-CE2 4.49Å; F330-F387 HydrophobicContact CZ-CZ 4.42Å
331	L	98	Very high	98.4	Very high	19 Å²	19	52.7 Å²	52.7	10%	0.099	24%	0.241	C	C	.	.	H	α-helix	trans	-64.3	-29.6	179.2	-70.6	-174.4	0	0	0	113.3	R329 K335 P348 W382 F387	R329-L331 VanDerWaalsContact C-N 3.3Å; R329-L331 PolarHBondContact O-N 3.49Å; L331-K335 WeakPolarHBondContact O-CB 3.46Å; L331-K335 WeakPolarHBondContact O-CD 3.35Å; L331-K335 WeakPolarHBondContact O-CG 3.33Å; L331-K335 PolarHBondContact O-N 3.26Å; L331-P348 HydrophobicContact CD1-CB 4.28Å; L331-P348 HydrophobicContact CD1-CG 4.27Å; L331-P348 HydrophobicContact CD2-CB 3.9Å; L331-P348 HydrophobicContact CD2-CG 4.36Å; L331-W382 HydrophobicContact CD1-CD2 4.05Å; L331-W382 HydrophobicContact CD1-CE3 4.03Å; L331-W382 HydrophobicContact CD1-CH2 3.68Å; L331-W382 HydrophobicContact CD1-CZ2 3.67Å; L331-W382 HydrophobicContact CD1-CZ3 3.85Å; L331-W382 HydrophobicContact CD2-CB 4.12Å; L331-W382 HydrophobicContact CD2-CD2 3.67Å; L331-W382 HydrophobicContact CD2-CE3 3.92Å; L331-W382 HydrophobicContact CD2-CG 3.79Å; L331-W382 HydrophobicContact CG-CD2 4.04Å; L331-W382 HydrophobicContact CG-CE3 3.86Å; L331-W382 HydrophobicContact CG-CH2 4.38Å; L331-W382 HydrophobicContact CG-CZ3 4.04Å; L331-F387 HydrophobicContact CD2-CE1 4.02Å; L331-F387 HydrophobicContact CD2-CZ 4.13Å
332	D	98.6	Very high	98.3	Very high	40 Å²	40	53.8 Å²	53.8	21%	0.214	25%	0.252	C	S	.	.	H	α-helix	trans	-73.5	-40.3	177.1	-62.1	-29.1	0	0	0	110.3	Q328 R329 F330 M334 K335 D336	Q328-D332 HydrophobicContact CG-CB 3.96Å; R329-D332 HydrophobicContact CB-CB 4.43Å; R329-D332 WeakPolarHBondContact CB-OD2 3.4Å; R329-D332 IonicContact CZ-OD1 3.77Å; R329-D332 IonicContact CZ-OD2 3.8Å; R329-D332 VanDerWaalsContact CZ-OD2 3.3Å; R329-D332 IonicContact NE-OD1 3.47Å; R329-D332 IonicContact NE-OD2 3.9Å; R329-D332 PolarHBondContact NE-OD2 3.15Å; R329-D332 IonicContact NH2-OD1 3.18Å; R329-D332 PolarHBondContact NH2-OD1 3.34Å; R329-D332 IonicContact NH2-OD2 2.93Å; R329-D332 PolarHBondContact NH2-OD2 2.99Å; R329-D332 WeakPolarHBondContact O-CB 3.35Å; R329-D332 PolarHBondContact O-N 2.93Å; F330-D332 VanDerWaalsContact C-N 3.26Å; F330-D332 PolarHBondContact O-N 2.86Å; D332-M334 VanDerWaalsContact C-N 3.28Å; D332-M334 PolarHBondContact O-N 3.44Å; D332-K335 PolarHBondContact O-N 3.1Å; D332-D336 WeakPolarHBondContact O-CB 3.49Å; D332-D336 PolarHBondContact O-N 3.41Å
333	I	98.7	Very high	98.3	Very high	14 Å²	14	53.9 Å²	53.9	7%	0.072	25%	0.253	C	S	.	.	H	α-helix	trans	-55.3	-46.9	172.4	-58.1	167.7	0	0	0	110.4	A164 L168 L322 A326 Q328 R329 F330 D336 M337	A164-I333 HydrophobicContact CB-CG2 4.32Å; L168-I333 HydrophobicContact CD1-CD1 4.47Å; L322-I333 HydrophobicContact CB-CD1 4.4Å; A326-I333 HydrophobicContact CB-CD1 3.48Å; A326-I333 VanDerWaalsContact CB-CD1 3.48Å; A326-I333 HydrophobicContact CB-CG1 4.04Å; Q328-I333 HydrophobicContact CB-CG1 4.03Å; Q328-I333 HydrophobicContact CG-CG1 3.95Å; R329-I333 PolarHBondContact O-N 3.05Å; R329-I333 VanDerWaalsContact O-N 3.12Å; F330-I333 WeakPolarHBondContact O-CB 3.06Å; F330-I333 PolarHBondContact O-N 3.49Å; I333-D336 PolarHBondContact O-N 3.15Å; I333-M337 PolarHBondContact O-N 2.91Å; I333-M337 VanDerWaalsContact O-N 3.12Å
334	M	98.8	Very high	98.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.5	-43.1	-179.6	-62.8	-58.9	-63	0	0	111.8	L160 A164 F330 D332 D336 M337 F338 F387	L160-M334 HydrophobicContact CB-CE 3.76Å; A164-M334 HydrophobicContact CB-SD 3.73Å; F330-M334 HydrophobicContact CD1-CG 4.43Å; F330-M334 HydrophobicContact CD2-CG 4.32Å; F330-M334 HydrophobicContact CE1-CG 3.88Å; F330-M334 HydrophobicContact CE2-CG 3.76Å; F330-M334 HydrophobicContact CE2-SD 3.89Å; F330-M334 HydrophobicContact CZ-CG 3.5Å; F330-M334 HydrophobicContact CZ-SD 3.86Å; F330-M334 WeakPolarHBondContact O-CG 3.12Å; F330-M334 PolarHBondContact O-N 3.46Å; F330-M334 VanDerWaalsContact O-N 3.1Å; D332-M334 VanDerWaalsContact C-N 3.28Å; D332-M334 PolarHBondContact O-N 3.44Å; M334-D336 VanDerWaalsContact C-N 3.32Å; M334-D336 PolarHBondContact O-N 2.88Å; M334-M337 HydrophobicContact CE-CE 3.6Å; M334-M337 PolarHBondContact O-N 3.34Å; M334-M337 HydrophobicContact SD-CE 4.33Å; M334-F338 HydrophobicContact CB-CE2 4.03Å; M334-F338 HydrophobicContact CB-CZ 4.01Å; M334-F338 HydrophobicContact CE-CE1 3.94Å; M334-F338 HydrophobicContact CE-CZ 3.76Å; M334-F338 WeakPolarHBondContact O-CD1 3.46Å; M334-F338 VanDerWaalsContact O-CD2 3.25Å; M334-F338 WeakPolarHBondContact O-CD2 3.47Å; M334-F338 WeakPolarHBondContact O-CG 3.36Å; M334-F338 PolarHBondContact O-N 3.14Å; M334-F387 HydrophobicContact CB-CE1 4.3Å; M334-F387 HydrophobicContact CB-CZ 3.9Å; M334-F387 HydrophobicContact CE-CE2 3.94Å; M334-F387 HydrophobicContact CE-CZ 4.16Å; M334-F387 HydrophobicContact CG-CE2 4.41Å; M334-F387 HydrophobicContact CG-CZ 3.81Å
335	K	98.4	Very high	98.2	Very high	75 Å²	75	55.9 Å²	55.9	33%	0.326	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-35.9	176.2	-75.8	169.7	-176.4	175.9	0	112.3	L331 D332 R339	L331-K335 WeakPolarHBondContact O-CB 3.46Å; L331-K335 WeakPolarHBondContact O-CD 3.35Å; L331-K335 WeakPolarHBondContact O-CG 3.33Å; L331-K335 PolarHBondContact O-N 3.26Å; D332-K335 PolarHBondContact O-N 3.1Å; K335-R339 VanDerWaalsContact O-CG 3.29Å; K335-R339 WeakPolarHBondContact O-CG 3.4Å; K335-R339 PolarHBondContact O-N 3.45Å; K335-R339 PolarHBondContact O-NE 2.88Å
336	D	98.5	Very high	98.2	Very high	59 Å²	59	55.4 Å²	55.4	32%	0.316	27%	0.265	S	S	.	.	H	α-helix	trans	-63.5	-48.6	175.1	-69.2	-5.4	0	0	0	110.4	Q328 D332 I333 M334 F338 R339 E340	Q328-D336 PolarHBondContact NE2-OD2 2.82Å; D332-D336 WeakPolarHBondContact O-CB 3.49Å; D332-D336 PolarHBondContact O-N 3.41Å; I333-D336 PolarHBondContact O-N 3.15Å; M334-D336 VanDerWaalsContact C-N 3.32Å; M334-D336 PolarHBondContact O-N 2.88Å; D336-F338 PolarHBondContact O-N 2.86Å; D336-R339 PolarHBondContact O-N 3.45Å; D336-R339 IonicContact OD1-CZ 2.94Å; D336-R339 IonicContact OD1-NE 3.12Å; D336-R339 IonicContact OD1-NH2 3.3Å; D336-R339 PolarHBondContact OD1-NH2 2.92Å; D336-E340 PolarHBondContact O-N 3.03Å
337	M	98.6	Very high	98.2	Very high	9 Å²	9	56.7 Å²	56.7	4%	0.044	27%	0.271	C	S	.	.	H	α-helix	trans	-59.3	-45.2	175.4	-179.6	-178.1	75.6	0	0	112.3	L160 A163 A164 I333 M334 R339 E340 L341 F420	L160-M337 HydrophobicContact CB-CE 4.08Å; L160-M337 HydrophobicContact CD2-CE 4.42Å; L160-M337 WeakPolarHBondContact O-CE 3.24Å; A163-M337 HydrophobicContact CB-SD 4.18Å; A164-M337 HydrophobicContact CB-SD 3.97Å; I333-M337 PolarHBondContact O-N 2.91Å; I333-M337 VanDerWaalsContact O-N 3.12Å; M334-M337 HydrophobicContact CE-CE 3.6Å; M334-M337 PolarHBondContact O-N 3.34Å; M334-M337 HydrophobicContact SD-CE 4.33Å; M337-R339 VanDerWaalsContact C-N 3.3Å; M337-R339 PolarHBondContact O-N 2.7Å; M337-E340 PolarHBondContact O-N 3.09Å; M337-L341 HydrophobicContact CG-CD1 3.94Å; M337-L341 WeakPolarHBondContact O-CG 3.19Å; M337-L341 PolarHBondContact O-N 2.83Å; M337-F420 HydrophobicContact CG-CE1 4.4Å; M337-F420 HydrophobicContact CG-CE2 3.98Å; M337-F420 HydrophobicContact CG-CZ 3.5Å; M337-F420 HydrophobicContact SD-CE1 4.21Å; M337-F420 HydrophobicContact SD-CZ 3.75Å
338	F	98.7	Very high	98.2	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.018	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-40.9	178.5	-60.1	-25.3	0	0	0	111.5	L160 M334 D336 L341 G342 M343 T346 F387	L160-F338 HydrophobicContact CB-CE1 4.33Å; L160-F338 HydrophobicContact CD1-CE1 3.91Å; L160-F338 HydrophobicContact CD1-CZ 4.13Å; L160-F338 HydrophobicContact CD2-CE1 4.23Å; L160-F338 HydrophobicContact CG-CE1 4.39Å; M334-F338 HydrophobicContact CB-CE2 4.03Å; M334-F338 HydrophobicContact CB-CZ 4.01Å; M334-F338 HydrophobicContact CE-CE1 3.94Å; M334-F338 HydrophobicContact CE-CZ 3.76Å; M334-F338 WeakPolarHBondContact O-CD1 3.46Å; M334-F338 VanDerWaalsContact O-CD2 3.25Å; M334-F338 WeakPolarHBondContact O-CD2 3.47Å; M334-F338 WeakPolarHBondContact O-CG 3.36Å; M334-F338 PolarHBondContact O-N 3.14Å; D336-F338 PolarHBondContact O-N 2.86Å; F338-L341 PolarHBondContact O-N 3.37Å; F338-G342 PolarHBondContact O-N 3.47Å; F338-G342 VanDerWaalsContact O-N 3.11Å; F338-M343 HydrophobicContact CB-CB 4.04Å; F338-M343 HydrophobicContact CD1-CE 4.35Å; F338-M343 HydrophobicContact CD1-SD 4.16Å; F338-M343 PolarHBondContact O-N 3.36Å; F338-T346 HydrophobicContact CD1-CG2 4.08Å; F338-T346 HydrophobicContact CD2-CG2 3.84Å; F338-T346 WeakPolarHBondContact CD2-O 3.5Å; F338-T346 HydrophobicContact CE1-CG2 3.88Å; F338-T346 HydrophobicContact CE2-CG2 3.63Å; F338-T346 HydrophobicContact CG-CG2 4.09Å; F338-T346 HydrophobicContact CZ-CG2 3.65Å; F338-F387 AromaticContact CE2-CD1 3.9Å; F338-F387 HydrophobicContact CE2-CD1 3.9Å; F338-F387 AromaticContact CE2-CE1 3.86Å; F338-F387 HydrophobicContact CE2-CE1 3.86Å; F338-F387 HydrophobicContact CE2-CZ 4.49Å; F338-F387 HydrophobicContact CZ-CD1 4.04Å; F338-F387 HydrophobicContact CZ-CD2 4.49Å; F338-F387 HydrophobicContact CZ-CE1 4.06Å; F338-F387 HydrophobicContact CZ-CE2 4.5Å; F338-F387 HydrophobicContact CZ-CG 4.3Å; F338-F387 HydrophobicContact CZ-CZ 4.3Å
339	R	98.4	Very high	98.1	Very high	164 Å²	164	46.8 Å²	46.8	62%	0.619	22%	0.221	S	C	*	.	H	α-helix	trans	-65.2	-41.6	176.1	-73.6	-175.1	-68.4	165.1	-7.4	112.5	K335 D336 M337 L341 G342	K335-R339 VanDerWaalsContact O-CG 3.29Å; K335-R339 WeakPolarHBondContact O-CG 3.4Å; K335-R339 PolarHBondContact O-N 3.45Å; K335-R339 PolarHBondContact O-NE 2.88Å; D336-R339 PolarHBondContact O-N 3.45Å; D336-R339 IonicContact OD1-CZ 2.94Å; D336-R339 IonicContact OD1-NE 3.12Å; D336-R339 IonicContact OD1-NH2 3.3Å; D336-R339 PolarHBondContact OD1-NH2 2.92Å; M337-R339 VanDerWaalsContact C-N 3.3Å; M337-R339 PolarHBondContact O-N 2.7Å; R339-L341 VanDerWaalsContact C-N 3.31Å; R339-L341 PolarHBondContact O-N 3.38Å; R339-G342 PolarHBondContact O-N 2.93Å
340	E	97.3	Very high	97.9	Very high	119 Å²	119	42 Å²	42	56%	0.556	21%	0.205	S	C	*	.	H	α-helix	trans	-62	-39.2	176.9	-173.2	177.9	178.3	0	0	111.8	R167 D336 M337 G342	R167-E340 IonicContact NH2-OE1 3.75Å; D336-E340 PolarHBondContact O-N 3.03Å; M337-E340 PolarHBondContact O-N 3.09Å; E340-G342 VanDerWaalsContact C-N 3.32Å; E340-G342 PolarHBondContact O-N 2.89Å
341	L	97.8	Very high	97.5	Very high	23 Å²	23	46.9 Å²	46.9	12%	0.12	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-4.1	178.3	-70.7	172.2	0	0	0	114.4	M337 F338 R339 M343 F397 A400 F420	M337-L341 HydrophobicContact CG-CD1 3.94Å; M337-L341 WeakPolarHBondContact O-CG 3.19Å; M337-L341 PolarHBondContact O-N 2.83Å; F338-L341 PolarHBondContact O-N 3.37Å; R339-L341 VanDerWaalsContact C-N 3.31Å; R339-L341 PolarHBondContact O-N 3.38Å; L341-M343 VanDerWaalsContact C-N 3.29Å; L341-M343 HydrophobicContact CB-CG 3.93Å; L341-M343 HydrophobicContact CB-SD 4.04Å; L341-M343 HydrophobicContact CD1-SD 3.92Å; L341-M343 PolarHBondContact O-N 3.1Å; L341-F397 HydrophobicContact CD1-CD2 3.91Å; L341-A400 HydrophobicContact CD2-CB 3.73Å; L341-F420 HydrophobicContact CD1-CE1 4.38Å; L341-F420 HydrophobicContact CD1-CE2 4.41Å; L341-F420 HydrophobicContact CD1-CZ 4.34Å; L341-F420 HydrophobicContact CD2-CB 3.9Å; L341-F420 HydrophobicContact CD2-CD1 4.15Å; L341-F420 HydrophobicContact CD2-CD2 3.7Å; L341-F420 HydrophobicContact CD2-CE2 4.32Å; L341-F420 HydrophobicContact CD2-CG 3.62Å; L341-F420 HydrophobicContact CG-CD2 4.05Å; L341-F420 HydrophobicContact CG-CE2 4.19Å; L341-F420 HydrophobicContact CG-CG 4.34Å
342	G	98.1	Very high	97.2	Very high	23 Å²	23	53.4 Å²	53.4	24%	0.237	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	14.8	-175.7	0	0	0	0	0	114.7	F338 R339 E340 H344 L396	F338-G342 PolarHBondContact O-N 3.47Å; F338-G342 VanDerWaalsContact O-N 3.11Å; R339-G342 PolarHBondContact O-N 2.93Å; E340-G342 VanDerWaalsContact C-N 3.32Å; E340-G342 PolarHBondContact O-N 2.89Å; G342-H344 PolarHBondContact O-CD2 2.93Å; G342-H344 VanDerWaalsContact O-CD2 3.31Å; G342-H344 PolarHBondContact O-N 3.16Å; G342-L396 WeakPolarHBondContact O-CD1 3.43Å
343	M	98.6	Very high	96.9	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.01	27%	0.273	C	S	.	.			trans	-80.6	65.7	178.9	-61.2	175	68.3	0	0	111.2	L160 F338 L341 N345 T346 D393 L394 L396 F397	L160-M343 HydrophobicContact CD2-CE 3.91Å; L160-M343 HydrophobicContact CD2-SD 4.41Å; F338-M343 HydrophobicContact CB-CB 4.04Å; F338-M343 HydrophobicContact CD1-CE 4.35Å; F338-M343 HydrophobicContact CD1-SD 4.16Å; F338-M343 PolarHBondContact O-N 3.36Å; L341-M343 VanDerWaalsContact C-N 3.29Å; L341-M343 HydrophobicContact CB-CG 3.93Å; L341-M343 HydrophobicContact CB-SD 4.04Å; L341-M343 HydrophobicContact CD1-SD 3.92Å; L341-M343 PolarHBondContact O-N 3.1Å; M343-N345 VanDerWaalsContact C-N 3.26Å; M343-N345 PolarHBondContact O-N 2.85Å; M343-T346 HydrophobicContact CE-CG2 4.05Å; M343-T346 WeakPolarHBondContact CE-OG1 3.29Å; M343-T346 PolarHBondContact O-N 3.29Å; M343-D393 VanDerWaalsContact CA-CG 3.43Å; M343-D393 VanDerWaalsContact CA-OD2 3.23Å; M343-D393 WeakPolarHBondContact CA-OD2 3.44Å; M343-D393 HydrophobicContact CB-CB 3.93Å; M343-D393 HydrophobicContact CE-CB 4.11Å; M343-D393 HydrophobicContact CG-CB 4.04Å; M343-D393 WeakPolarHBondContact CG-O 3.24Å; M343-L394 HydrophobicContact CE-CD2 4.39Å; M343-L396 HydrophobicContact CG-CB 4.47Å; M343-F397 HydrophobicContact CE-CB 4.06Å; M343-F397 HydrophobicContact SD-CB 3.78Å; M343-F397 HydrophobicContact SD-CG 4.45Å
344	H	97.3	Very high	96.8	Very high	136 Å²	136	60.3 Å²	60.3	63%	0.63	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-11	-170.2	-60.2	-52	0	0	0	115.1	G342 D393	G342-H344 PolarHBondContact O-CD2 2.93Å; G342-H344 VanDerWaalsContact O-CD2 3.31Å; G342-H344 PolarHBondContact O-N 3.16Å; H344-D393 PolarHBondContact N-OD2 3.22Å
345	N	97.9	Very high	96.7	Very high	73 Å²	73	61.8 Å²	61.8	39%	0.39	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	5.5	179.5	-54.2	-72.9	0	0	0	112.4	V150 M343 T390 D393	V150-N345 HydrophobicContact CG2-CB 4.43Å; M343-N345 VanDerWaalsContact C-N 3.26Å; M343-N345 PolarHBondContact O-N 2.85Å; N345-T390 HydrophobicContact CB-CG2 3.6Å; N345-D393 VanDerWaalsContact C-OD2 3.25Å; N345-D393 VanDerWaalsContact CA-OD2 3.31Å; N345-D393 WeakPolarHBondContact CA-OD2 3.26Å; N345-D393 PolarHBondContact N-OD2 3.33Å; N345-D393 PolarHBondContact ND2-OD1 3.15Å
346	T	98.7	Very high	96.6	Very high	6 Å²	6	66.7 Å²	66.7	4%	0.037	33%	0.33	C	S	.	.			trans	-91.5	116.4	176.7	-56.5	0	0	0	0	109.5	L160 F338 M343 L388 S389 D393	L160-T346 HydrophobicContact CD1-CG2 4.42Å; F338-T346 HydrophobicContact CD1-CG2 4.08Å; F338-T346 HydrophobicContact CD2-CG2 3.84Å; F338-T346 WeakPolarHBondContact CD2-O 3.5Å; F338-T346 HydrophobicContact CE1-CG2 3.88Å; F338-T346 HydrophobicContact CE2-CG2 3.63Å; F338-T346 HydrophobicContact CG-CG2 4.09Å; F338-T346 HydrophobicContact CZ-CG2 3.65Å; M343-T346 HydrophobicContact CE-CG2 4.05Å; M343-T346 WeakPolarHBondContact CE-OG1 3.29Å; M343-T346 PolarHBondContact O-N 3.29Å; T346-L388 VanDerWaalsContact CA-O 3.31Å; T346-L388 WeakPolarHBondContact CA-O 3.18Å; T346-L388 WeakPolarHBondContact CG2-O 3.24Å; T346-S389 PolarHBondContact OG1-OG 2.99Å; T346-D393 PolarHBondContact N-OD2 3.46Å; T346-D393 VanDerWaalsContact OG1-CB 3.31Å; T346-D393 WeakPolarHBondContact OG1-CB 3.3Å; T346-D393 PolarHBondContact OG1-OD2 2.91Å
347	V	98	Very high	96.5	Very high	43 Å²	43	69.7 Å²	69.7	26%	0.261	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	153.8	-170.9	-64.2	0	0	0	0	110.8	I355 F387 L388	V347-I355 HydrophobicContact CG2-CD1 4.29Å; V347-I355 HydrophobicContact CG2-CG1 4.24Å; V347-I355 HydrophobicContact CG2-CG2 4.18Å; V347-F387 WeakPolarHBondContact O-CA 3.2Å; V347-L388 HydrophobicContact CG2-CB 4.16Å; V347-L388 HydrophobicContact CG2-CD1 4.14Å; V347-L388 PolarHBondContact N-O 2.88Å; V347-L388 VanDerWaalsContact N-O 3.09Å; V347-L388 PolarHBondContact O-N 2.84Å
348	P	97.4	Very high	96.5	Very high	4 Å²	4	72.9 Å²	72.9	3%	0.026	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	144	169.7	28.7	-36.8	0	0	0	110.7	L331 E350 F387	L331-P348 HydrophobicContact CD1-CB 4.28Å; L331-P348 HydrophobicContact CD1-CG 4.27Å; L331-P348 HydrophobicContact CD2-CB 3.9Å; L331-P348 HydrophobicContact CD2-CG 4.36Å; P348-E350 HydrophobicContact CB-CG 4.05Å; P348-E350 HydrophobicContact CG-CG 4.11Å; P348-E350 VanDerWaalsContact CG-OE2 3.27Å; P348-E350 WeakPolarHBondContact CG-OE2 3.24Å; P348-E350 PolarHBondContact O-N 2.84Å; P348-F387 HydrophobicContact CB-CD1 4.27Å; P348-F387 HydrophobicContact CB-CE1 4.15Å
349	D	96.2	Very high	96.4	Very high	11 Å²	11	72.9 Å²	72.9	6%	0.059	35%	0.354	C	S	.	.			trans	-77.2	76.3	176	-173.3	30	0	0	0	109.9	R152 R358 V378 G386 L388	R152-D349 IonicContact CZ-OD2 3.39Å; R152-D349 VanDerWaalsContact CZ-OD2 3.24Å; R152-D349 IonicContact NE-OD2 3.95Å; R152-D349 PolarHBondContact NE-OD2 2.88Å; R152-D349 IonicContact NH2-OD2 3.3Å; R152-D349 PolarHBondContact NH2-OD2 2.82Å; D349-R358 IonicContact OD1-CZ 3.59Å; D349-R358 IonicContact OD1-NE 2.84Å; D349-R358 IonicContact OD1-NH2 3.93Å; D349-R358 PolarHBondContact OD1-NH2 3.3Å; D349-V378 HydrophobicContact CB-CG2 3.65Å; D349-G386 WeakPolarHBondContact CB-O 3.46Å; D349-G386 PolarHBondContact N-O 2.94Å; D349-L388 HydrophobicContact CB-CD1 4.14Å; D349-L388 HydrophobicContact CB-CD2 4.3Å; D349-L388 HydrophobicContact CB-CG 3.86Å
350	E	94.1	Very high	96.4	Very high	58 Å²	58	71.6 Å²	71.6	27%	0.271	35%	0.349	S	S	.	.			trans	-98.5	151.2	177.2	-64.6	-179.6	110.1	0	0	110.6	P348 P353 R358 W382	P348-E350 HydrophobicContact CB-CG 4.05Å; P348-E350 HydrophobicContact CG-CG 4.11Å; P348-E350 VanDerWaalsContact CG-OE2 3.27Å; P348-E350 WeakPolarHBondContact CG-OE2 3.24Å; P348-E350 PolarHBondContact O-N 2.84Å; E350-P353 VanDerWaalsContact CB-CD 3.49Å; E350-P353 HydrophobicContact CB-CG 3.94Å; E350-R358 PolarHBondContact O-NH1 3.27Å; E350-W382 HydrophobicContact CG-CZ2 4.49Å
351	N	89.6	Confident	96.4	Very high	103 Å²	103	66.9 Å²	66.9	55%	0.551	33%	0.327	S	S	*	.	S	Bend	trans	-85.5	-36.6	-180	-172.3	61.9	0	0	0	113	Y375	N351-Y375 HydrophobicContact CB-CE2 3.84Å; N351-Y375 WeakPolarHBondContact CB-OH 3.42Å; N351-Y375 WeakPolarHBondContact OD1-CE2 3.36Å
352	D	90.9	Very high	96.4	Very high	155 Å²	155	66 Å²	66	83%	0.829	32%	0.322	S	S	*	.	S	Bend	trans	-71.7	-45.8	-173.7	-175.6	63.9	0	0	0	113.7
353	P	93.5	Very high	96.2	Very high	55 Å²	55	67 Å²	67	36%	0.357	32%	0.32	S	S	.	.	S	Bend	trans	-69.9	142	-179.3	-19.2	34	0	0	0	113.4	E350 I355	E350-P353 VanDerWaalsContact CB-CD 3.49Å; E350-P353 HydrophobicContact CB-CG 3.94Å; P353-I355 PolarHBondContact O-N 2.86Å
354	I	96	Very high	96	Very high	145 Å²	145	70.4 Å²	70.4	74%	0.744	34%	0.338	S	S	*	.			trans	-71.8	117.8	169.5	-59.7	175.6	0	0	0	109
355	I	96.4	Very high	95.8	Very high	30 Å²	30	66.2 Å²	66.2	15%	0.154	32%	0.32	C	S	.	.			trans	-109.3	111.8	175.5	-62	154.8	0	0	0	107.9	V150 V347 P353 R358 L388	V150-I355 HydrophobicContact CB-CG2 4.27Å; V150-I355 HydrophobicContact CG1-CG2 3.78Å; V347-I355 HydrophobicContact CG2-CD1 4.29Å; V347-I355 HydrophobicContact CG2-CG1 4.24Å; V347-I355 HydrophobicContact CG2-CG2 4.18Å; P353-I355 PolarHBondContact O-N 2.86Å; I355-R358 HydrophobicContact CB-CB 4.13Å; I355-R358 HydrophobicContact CG2-CB 3.98Å; I355-R358 HydrophobicContact CG2-CG 4.48Å; I355-R358 WeakPolarHBondContact O-CB 3.22Å; I355-R358 PolarHBondContact O-N 2.76Å; I355-L388 HydrophobicContact CD1-CD1 3.55Å; I355-L388 HydrophobicContact CG2-CD1 4.36Å
356	Y	96.2	Very high	95.4	Very high	178 Å²	178	73.4 Å²	73.4	70%	0.698	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	145.2	177.7	-66.5	-83.5	0	0	0	110.8	R358	Y356-R358 PolarHBondContact O-N 3.12Å
357	H	97.2	Very high	95.2	Very high	122 Å²	122	82.8 Å²	82.8	57%	0.565	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	19.7	-179.5	-51.8	-72.6	0	0	0	115	D148 V150 S359	D148-H357 WeakPolarHBondContact O-CB 3.45Å; V150-H357 PolarHBondContact N-O 2.81Å; H357-S359 PolarHBondContact O-N 3.23Å
358	R	97.6	Very high	94.8	Very high	77 Å²	77	83.2 Å²	83.2	29%	0.291	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-63.9	125.4	175.3	-171.9	176.7	-176.2	175.4	1.1	110.7	V150 D349 E350 I355 Y356	V150-R358 WeakPolarHBondContact O-CA 3.4Å; D349-R358 IonicContact OD1-CZ 3.59Å; D349-R358 IonicContact OD1-NE 2.84Å; D349-R358 IonicContact OD1-NH2 3.93Å; D349-R358 PolarHBondContact OD1-NH2 3.3Å; E350-R358 PolarHBondContact O-NH1 3.27Å; I355-R358 HydrophobicContact CB-CB 4.13Å; I355-R358 HydrophobicContact CG2-CB 3.98Å; I355-R358 HydrophobicContact CG2-CG 4.48Å; I355-R358 WeakPolarHBondContact O-CB 3.22Å; I355-R358 PolarHBondContact O-N 2.76Å; Y356-R358 PolarHBondContact O-N 3.12Å
359	S	97.8	Very high	94.7	Very high	4 Å²	4	90.7 Å²	90.7	3%	0.028	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-71.5	152.7	174.1	-175.7	0	0	0	0	112	A137 V150 H357 N511	A137-S359 PolarHBondContact O-OG 2.91Å; V150-S359 PolarHBondContact O-N 2.91Å; H357-S359 PolarHBondContact O-N 3.23Å; S359-N511 WeakPolarHBondContact OG-CB 3.25Å; S359-N511 PolarHBondContact OG-ND2 2.87Å
360	R	97.5	Very high	94.7	Very high	136 Å²	136	92.7 Å²	92.7	51%	0.513	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-74.7	163.8	157.5	-66.3	-63.2	-176.6	-173.9	-0.3	110.1	A137 D138 Y362 N511	A137-R360 PolarHBondContact O-N 2.8Å; D138-R360 HydrophobicContact CB-CG 4.03Å; D138-R360 IonicContact OD2-NE 3.87Å; R360-Y362 HydrophobicContact CB-CE2 3.77Å; R360-Y362 WeakPolarHBondContact CB-OH 3.32Å; R360-N511 VanDerWaalsContact O-CB 3.24Å; R360-N511 WeakPolarHBondContact O-CB 3.27Å
361	F	97.1	Very high	94.8	Very high	21 Å²	21	92.1 Å²	92.1	9%	0.092	44%	0.437	C	S	.	.			trans	-128.3	135.3	-173	-58.9	-60.5	0	0	0	111	R152 C373 L388 G477 A478 N511	R152-F361 HydrophobicContact CB-CE1 4.02Å; R152-F361 HydrophobicContact CB-CZ 4.27Å; R152-F361 HydrophobicContact CG-CE1 3.78Å; R152-F361 HydrophobicContact CG-CE2 4.14Å; R152-F361 HydrophobicContact CG-CZ 3.56Å; F361-C373 HydrophobicContact CB-CB 4.36Å; F361-C373 PolarHBondContact O-N 2.97Å; F361-L388 HydrophobicContact CZ-CD2 3.96Å; F361-G477 WeakPolarHBondContact CB-O 3.42Å; F361-G477 WeakPolarHBondContact CD1-O 3.45Å; F361-A478 HydrophobicContact CD1-CB 4.17Å; F361-A478 HydrophobicContact CE1-CB 4.39Å; F361-N511 HydrophobicContact CD1-CB 4.49Å
362	Y	97.6	Very high	95.1	Very high	4 Å²	4	90.5 Å²	90.5	2%	0.016	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	155.5	-167.6	-56.1	-84.8	0	0	0	113.8	P116 L139 R360 V370 V371 N372 G477 N511 Q513	P116-Y362 HydrophobicContact CB-CD2 4.04Å; P116-Y362 HydrophobicContact CB-CE2 4.14Å; P116-Y362 HydrophobicContact CG-CD1 4.37Å; P116-Y362 HydrophobicContact CG-CD2 3.61Å; P116-Y362 HydrophobicContact CG-CE2 4.13Å; P116-Y362 HydrophobicContact CG-CG 3.75Å; L139-Y362 HydrophobicContact CB-CE1 4.02Å; L139-Y362 HydrophobicContact CB-CE2 4.36Å; L139-Y362 WeakPolarHBondContact CB-OH 3.28Å; L139-Y362 PolarHBondContact N-OH 2.92Å; R360-Y362 HydrophobicContact CB-CE2 3.77Å; R360-Y362 WeakPolarHBondContact CB-OH 3.32Å; Y362-V370 HydrophobicContact CD1-CG1 3.87Å; Y362-V370 HydrophobicContact CG-CG1 4.06Å; Y362-V371 WeakPolarHBondContact CA-O 3.47Å; Y362-N372 WeakPolarHBondContact CE1-OD1 3.3Å; Y362-G477 VanDerWaalsContact O-CA 3.24Å; Y362-G477 WeakPolarHBondContact O-CA 3.36Å; Y362-N511 WeakPolarHBondContact CB-O 3.49Å; Y362-N511 HydrophobicContact CD2-CB 4.31Å; Y362-N511 WeakPolarHBondContact CD2-O 3.39Å; Y362-N511 PolarHBondContact N-O 2.66Å; Y362-Q513 PolarHBondContact O-N 2.84Å
363	H	95.6	Very high	95.3	Very high	43 Å²	43	84 Å²	84	20%	0.199	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	164.9	167.2	77.6	102	0	0	0	113.1	V370 V371 Q513	H363-V370 WeakPolarHBondContact O-CA 3.41Å; H363-V371 PolarHBondContact N-O 3.23Å; H363-V371 VanDerWaalsContact NE2-CG2 3.32Å; H363-V371 WeakPolarHBondContact NE2-CG2 3.44Å; H363-V371 WeakPolarHBondContact O-CG2 3.22Å; H363-V371 PolarHBondContact O-N 2.8Å; H363-Q513 HydrophobicContact CB-CG 3.55Å
364	L	94.3	Very high	95.3	Very high	74 Å²	74	84.2 Å²	84.2	39%	0.387	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	127	166.8	-60.6	179.6	0	0	0	109.7	R369 V370 M512	L364-R369 WeakPolarHBondContact CA-O 3.31Å; L364-V370 HydrophobicContact CD2-CG2 3.82Å; L364-M512 HydrophobicContact CD2-CE 4.31Å; L364-M512 HydrophobicContact CG-CE 4.44Å; L364-M512 HydrophobicContact CG-SD 4.39Å
365	N	92.6	Very high	95.1	Very high	49 Å²	49	82 Å²	82	26%	0.262	38%	0.378	S	S	.	.			trans	-76.5	178.1	170.6	71.7	17.7	0	0	0	111.4	R367 G368 R369 V371	N365-R367 PolarHBondContact O-N 3.34Å; N365-R367 WeakPolarHBondContact OD1-CA 3.35Å; N365-R367 WeakPolarHBondContact OD1-CB 3.27Å; N365-R367 PolarHBondContact OD1-N 2.8Å; N365-G368 PolarHBondContact O-N 3.03Å; N365-G368 PolarHBondContact OD1-N 3.34Å; N365-R369 PolarHBondContact N-O 3.36Å; N365-R369 PolarHBondContact OD1-N 3.02Å; N365-V371 HydrophobicContact CB-CG1 4.26Å; N365-V371 HydrophobicContact CB-CG2 3.98Å
366	K	90.1	Very high	95.1	Very high	223 Å²	223	80.8 Å²	80.8	97%	0.97	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.3	179.7	-64.1	-175.6	-179.6	-179.6	0	114.4
367	R	92.8	Very high	95	Very high	204 Å²	204	73 Å²	73	77%	0.77	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	9	177.5	-60.1	-178.3	179.2	175.8	-0.4	112.7	N365 R369	N365-R367 PolarHBondContact O-N 3.34Å; N365-R367 WeakPolarHBondContact OD1-CA 3.35Å; N365-R367 WeakPolarHBondContact OD1-CB 3.27Å; N365-R367 PolarHBondContact OD1-N 2.8Å; R367-R369 VanDerWaalsContact C-N 3.27Å; R367-R369 HydrophobicContact CB-CG 4.5Å; R367-R369 PolarHBondContact O-N 2.92Å
368	G	90.9	Very high	95	Very high	52 Å²	52	67.5 Å²	67.5	54%	0.536	32%	0.318	S	S	.	.	S	Bend	trans	71.2	16.8	-178.5	0	0	0	0	0	114.4	N365	N365-G368 PolarHBondContact O-N 3.03Å; N365-G368 PolarHBondContact OD1-N 3.34Å
369	R	94.1	Very high	94.9	Very high	161 Å²	161	64 Å²	64	61%	0.608	31%	0.305	S	S	*	.			trans	-93.6	139	177.1	-58.9	-177.9	179.9	-179.2	-3.4	110.5	L364 N365 R367 V371	L364-R369 WeakPolarHBondContact CA-O 3.31Å; N365-R369 PolarHBondContact N-O 3.36Å; N365-R369 PolarHBondContact OD1-N 3.02Å; R367-R369 VanDerWaalsContact C-N 3.27Å; R367-R369 HydrophobicContact CB-CG 4.5Å; R367-R369 PolarHBondContact O-N 2.92Å; R369-V371 PolarHBondContact O-N 2.78Å
370	V	96.2	Very high	94.7	Very high	52 Å²	52	63.9 Å²	63.9	32%	0.315	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	127.1	169.6	-178	0	0	0	0	109.1	G114 P116 L139 Y362 H363 L364 M512	G114-V370 WeakPolarHBondContact O-CG2 3.46Å; P116-V370 HydrophobicContact CG-CG1 3.66Å; L139-V370 HydrophobicContact CD2-CG1 3.96Å; Y362-V370 HydrophobicContact CD1-CG1 3.87Å; Y362-V370 HydrophobicContact CG-CG1 4.06Å; H363-V370 WeakPolarHBondContact O-CA 3.41Å; L364-V370 HydrophobicContact CD2-CG2 3.82Å; V370-M512 HydrophobicContact CG1-CE 4.32Å; V370-M512 HydrophobicContact CG2-CE 4.25Å
371	V	96.7	Very high	94.6	Very high	47 Å²	47	57.8 Å²	57.8	29%	0.285	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	159.3	176	-63.1	0	0	0	0	109.9	Y362 H363 N365 R369	Y362-V371 WeakPolarHBondContact CA-O 3.47Å; H363-V371 PolarHBondContact N-O 3.23Å; H363-V371 VanDerWaalsContact NE2-CG2 3.32Å; H363-V371 WeakPolarHBondContact NE2-CG2 3.44Å; H363-V371 WeakPolarHBondContact O-CG2 3.22Å; H363-V371 PolarHBondContact O-N 2.8Å; N365-V371 HydrophobicContact CB-CG1 4.26Å; N365-V371 HydrophobicContact CB-CG2 3.98Å; R369-V371 PolarHBondContact O-N 2.78Å
372	N	96.9	Very high	94.6	Very high	68 Å²	68	57.8 Å²	57.8	36%	0.364	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	144.1	172	-69.5	-55.1	0	0	0	111.5	E140 Y362	E140-N372 PolarHBondContact OE1-ND2 3.17Å; Y362-N372 WeakPolarHBondContact CE1-OD1 3.3Å
373	C	94.6	Very high	94.6	Very high	20 Å²	20	57.6 Å²	57.6	14%	0.135	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-73.6	150.4	167	-75.4	0	0	0	0	112.2	F361 V476 G477	F361-C373 HydrophobicContact CB-CB 4.36Å; F361-C373 PolarHBondContact O-N 2.97Å; C373-V476 HydrophobicContact CB-CG1 3.58Å; C373-G477 WeakPolarHBondContact SG-CA 3.38Å; C373-G477 PolarHBondContact SG-N 2.92Å; C373-G477 VanDerWaalsContact SG-N 3.38Å
374	P	92.9	Very high	94.6	Very high	58 Å²	58	55.6 Å²	55.6	38%	0.377	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-63.8	155.8	170.1	30	-36.1	0	0	0	110.9	Y280	Y280-P374 HydrophobicContact CD1-CG 3.68Å; Y280-P374 HydrophobicContact CE1-CG 3.88Å
375	Y	93	Very high	94.7	Very high	98 Å²	98	52.6 Å²	52.6	38%	0.384	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-60.2	137.2	167.7	176.1	-100.5	0	0	0	110.4	K282 N351 D377	K282-Y375 HydrophobicContact CB-CD1 4.34Å; K282-Y375 HydrophobicContact CB-CE1 4.43Å; K282-Y375 HydrophobicContact CG-CD1 4.26Å; N351-Y375 HydrophobicContact CB-CE2 3.84Å; N351-Y375 WeakPolarHBondContact CB-OH 3.42Å; N351-Y375 WeakPolarHBondContact OD1-CE2 3.36Å; Y375-D377 HydrophobicContact CE1-CB 4.25Å; Y375-D377 PolarHBondContact OH-OD2 3.48Å
376	V	94.9	Very high	94.8	Very high	6 Å²	6	50.2 Å²	50.2	4%	0.036	25%	0.245	C	C	.	.			trans	-137.7	141.3	172.3	-60.4	0	0	0	0	109	Y280 I281 V378 V476	Y280-V376 HydrophobicContact CD1-CG1 3.94Å; I281-V376 CarbonylContact O-C 3.56Å; I281-V376 WeakPolarHBondContact O-CA 3.43Å; V376-V378 HydrophobicContact CG2-CG1 4.14Å; V376-V476 HydrophobicContact CG1-CB 4.29Å; V376-V476 HydrophobicContact CG1-CG1 4.19Å; V376-V476 HydrophobicContact CG1-CG2 3.92Å; V376-V476 HydrophobicContact CG2-CB 4Å; V376-V476 HydrophobicContact CG2-CG1 4.38Å; V376-V476 HydrophobicContact CG2-CG2 4.2Å
377	D	95.6	Very high	95.2	Very high	14 Å²	14	39.7 Å²	39.7	8%	0.075	20%	0.2	C	C	.	.			trans	-97.8	127.8	170.1	-167.5	-56.9	0	0	0	108.5	I281 D283 N284 Y375 S379	I281-D377 PolarHBondContact O-N 2.92Å; D283-D377 WeakPolarHBondContact O-CB 3.43Å; N284-D377 WeakPolarHBondContact CA-OD2 3.39Å; N284-D377 WeakPolarHBondContact CB-OD2 3.31Å; N284-D377 PolarHBondContact ND2-OD2 2.87Å; Y375-D377 HydrophobicContact CE1-CB 4.25Å; Y375-D377 PolarHBondContact OH-OD2 3.48Å; D377-S379 WeakPolarHBondContact OD1-CB 3.44Å; D377-S379 PolarHBondContact OD1-N 2.94Å; D377-S379 PolarHBondContact OD1-OG 3.29Å
378	V	95.3	Very high	95.5	Very high	6 Å²	6	30 Å²	30	4%	0.036	16%	0.163	C	C	.	.			trans	-112.1	11.6	-176.7	-56.8	0	0	0	0	112.9	D349 V376 Y380 K381 W382	D349-V378 HydrophobicContact CB-CG2 3.65Å; V376-V378 HydrophobicContact CG2-CG1 4.14Å; V378-Y380 PolarHBondContact O-N 3.14Å; V378-Y380 VanDerWaalsContact O-N 3.17Å; V378-K381 HydrophobicContact CB-CG 4.05Å; V378-K381 CarbonylContact O-C 3.59Å; V378-K381 WeakPolarHBondContact O-CG 3.1Å; V378-K381 PolarHBondContact O-N 2.74Å; V378-W382 PolarHBondContact O-N 3.34Å
379	S	95.4	Very high	95.9	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.021	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-54.9	-33.4	178.4	54.9	0	0	0	0	112.5	Y285 D377 K381	Y285-S379 PolarHBondContact N-OG 3.03Å; D377-S379 WeakPolarHBondContact OD1-CB 3.44Å; D377-S379 PolarHBondContact OD1-N 2.94Å; D377-S379 PolarHBondContact OD1-OG 3.29Å; S379-K381 PolarHBondContact O-N 3.49Å; S379-K381 VanDerWaalsContact O-N 3.15Å
380	Y	95.4	Very high	96.1	Very high	2 Å²	2	20 Å²	20	1%	0.008	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-66.8	-14	176.5	79.3	-89.7	0	0	0	115.3	Y214 E278 I281 Y285 S291 L294 H313 T316 V378	Y214-Y380 HydrophobicContact CE1-CE2 4.42Å; E278-Y380 PolarHBondContact O-OH 2.85Å; I281-Y380 HydrophobicContact CB-CD1 4.48Å; I281-Y380 HydrophobicContact CB-CE1 4.13Å; I281-Y380 HydrophobicContact CD1-CD1 4.19Å; I281-Y380 HydrophobicContact CD1-CE1 3.92Å; I281-Y380 HydrophobicContact CG2-CD1 4.48Å; Y285-Y380 HydrophobicContact CE2-CD1 4.44Å; Y285-Y380 HydrophobicContact CE2-CG 4.48Å; S291-Y380 WeakPolarHBondContact OG-CA 3.4Å; L294-Y380 HydrophobicContact CD1-CD2 3.64Å; L294-Y380 HydrophobicContact CD1-CE2 4.43Å; L294-Y380 HydrophobicContact CD1-CG 3.72Å; H313-Y380 AromaticContact CE1-CE2 3.98Å; T316-Y380 WeakPolarHBondContact CB-O 3.48Å; T316-Y380 WeakPolarHBondContact CG2-O 3.41Å; T316-Y380 PolarHBondContact OG1-O 3.07Å; V378-Y380 PolarHBondContact O-N 3.14Å; V378-Y380 VanDerWaalsContact O-N 3.17Å
381	K	95.1	Very high	96.2	Very high	9 Å²	9	17.6 Å²	17.6	4%	0.039	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-137.2	29.3	-171.1	63.7	172.1	171.5	-156.8	0	114	T312 V378 S379 A383 G384 G385 G386	T312-K381 HydrophobicContact CG2-CB 3.55Å; T312-K381 HydrophobicContact CG2-CD 3.93Å; T312-K381 HydrophobicContact CG2-CG 4.39Å; V378-K381 HydrophobicContact CB-CG 4.05Å; V378-K381 CarbonylContact O-C 3.59Å; V378-K381 WeakPolarHBondContact O-CG 3.1Å; V378-K381 PolarHBondContact O-N 2.74Å; S379-K381 PolarHBondContact O-N 3.49Å; S379-K381 VanDerWaalsContact O-N 3.15Å; K381-A383 VanDerWaalsContact C-N 3.32Å; K381-A383 PolarHBondContact O-N 2.97Å; K381-G384 CarbonylContact O-C 3.59Å; K381-G384 WeakPolarHBondContact O-CA 3.49Å; K381-G384 PolarHBondContact O-N 2.98Å; K381-G385 PolarHBondContact O-N 3.28Å; K381-G386 PolarHBondContact O-N 2.87Å
382	W	96.7	Very high	96.3	Very high	21 Å²	21	16.1 Å²	16.1	8%	0.08	9%	0.089	C	C	.	.	H	α-helix	trans	-48.4	-52.3	178.5	-72.2	-49.6	0	0	0	112.8	V288 F330 L331 E350 V378 G384 G385 G386 F387	V288-W382 HydrophobicContact CG1-CE3 3.97Å; V288-W382 HydrophobicContact CG1-CZ3 4.26Å; F330-W382 HydrophobicContact CD1-CB 4.18Å; F330-W382 HydrophobicContact CE1-CB 3.71Å; L331-W382 HydrophobicContact CD1-CD2 4.05Å; L331-W382 HydrophobicContact CD1-CE3 4.03Å; L331-W382 HydrophobicContact CD1-CH2 3.68Å; L331-W382 HydrophobicContact CD1-CZ2 3.67Å; L331-W382 HydrophobicContact CD1-CZ3 3.85Å; L331-W382 HydrophobicContact CD2-CB 4.12Å; L331-W382 HydrophobicContact CD2-CD2 3.67Å; L331-W382 HydrophobicContact CD2-CE3 3.92Å; L331-W382 HydrophobicContact CD2-CG 3.79Å; L331-W382 HydrophobicContact CG-CD2 4.04Å; L331-W382 HydrophobicContact CG-CE3 3.86Å; L331-W382 HydrophobicContact CG-CH2 4.38Å; L331-W382 HydrophobicContact CG-CZ3 4.04Å; E350-W382 HydrophobicContact CG-CZ2 4.49Å; V378-W382 PolarHBondContact O-N 3.34Å; W382-G384 PolarHBondContact O-N 2.94Å; W382-G385 PolarHBondContact O-N 3.26Å; W382-G386 PolarHBondContact O-N 2.85Å; W382-G386 VanDerWaalsContact O-N 3.13Å; W382-F387 HydrophobicContact CB-CZ 4.34Å; W382-F387 VanDerWaalsContact O-CE2 3.3Å; W382-F387 WeakPolarHBondContact O-CE2 3.15Å
383	A	97.8	Very high	96.4	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-59.9	-31	176.5	0	0	0	0	0	114.6	S157 K158 T161 F315 F330 K381	S157-A383 CarbonylContact C-O 3.59Å; K158-A383 WeakPolarHBondContact CA-O 3.41Å; K158-A383 PolarHBondContact N-O 3.43Å; T161-A383 HydrophobicContact CG2-CB 3.8Å; T161-A383 VanDerWaalsContact OG1-CA 3.28Å; T161-A383 WeakPolarHBondContact OG1-CA 3.31Å; T161-A383 PolarHBondContact OG1-O 3.03Å; T161-A383 VanDerWaalsContact OG1-O 3.1Å; F315-A383 HydrophobicContact CB-CB 4.29Å; F315-A383 WeakPolarHBondContact O-CB 3.34Å; F330-A383 HydrophobicContact CE1-CB 4.11Å; F330-A383 HydrophobicContact CE2-CB 4.21Å; F330-A383 HydrophobicContact CZ-CB 3.61Å; K381-A383 VanDerWaalsContact C-N 3.32Å; K381-A383 PolarHBondContact O-N 2.97Å
384	G	95.4	Very high	96.6	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-92.1	-23.7	-174.6	0	0	0	0	0	114.6	S155 K158 K381 W382	S155-G384 WeakPolarHBondContact CA-O 3.19Å; K158-G384 PolarHBondContact NZ-O 2.65Å; K381-G384 CarbonylContact O-C 3.59Å; K381-G384 WeakPolarHBondContact O-CA 3.49Å; K381-G384 PolarHBondContact O-N 2.98Å; W382-G384 PolarHBondContact O-N 2.94Å
385	G	95.4	Very high	96.9	Very high	11 Å²	11	9.8 Å²	9.8	11%	0.113	5%	0.051	C	C	.	.	H	α-helix	trans	175.6	21.2	-174.2	0	0	0	0	0	116.6	A154 S157 K381 W382	A154-G385 WeakPolarHBondContact O-CA 3.39Å; S157-G385 WeakPolarHBondContact OG-CA 3.43Å; K381-G385 PolarHBondContact O-N 3.28Å; W382-G385 PolarHBondContact O-N 3.26Å
386	G	96	Very high	97.2	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.052	C	C	.	.			trans	-106.9	20.3	-169.1	0	0	0	0	0	115.7	S157 D349 K381 W382	S157-G386 PolarHBondContact OG-N 2.82Å; D349-G386 WeakPolarHBondContact CB-O 3.46Å; D349-G386 PolarHBondContact N-O 2.94Å; K381-G386 PolarHBondContact O-N 2.87Å; W382-G386 PolarHBondContact O-N 2.85Å; W382-G386 VanDerWaalsContact O-N 3.13Å
387	F	98.5	Very high	97.3	Very high	2 Å²	2	8.6 Å²	8.6	1%	0.009	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	152.9	175.1	-64.7	-71.9	0	0	0	112.9	I153 S157 F330 L331 M334 F338 V347 P348 W382	I153-F387 HydrophobicContact CD1-CB 3.98Å; I153-F387 HydrophobicContact CG1-CB 4.04Å; I153-F387 VanDerWaalsContact CG1-O 3.24Å; I153-F387 WeakPolarHBondContact CG1-O 3.31Å; I153-F387 PolarHBondContact N-O 3.34Å; I153-F387 VanDerWaalsContact N-O 3.12Å; S157-F387 PolarHBondContact OG-N 2.88Å; F330-F387 HydrophobicContact CE1-CE2 4.38Å; F330-F387 HydrophobicContact CE1-CZ 4.03Å; F330-F387 HydrophobicContact CZ-CE2 4.49Å; F330-F387 HydrophobicContact CZ-CZ 4.42Å; L331-F387 HydrophobicContact CD2-CE1 4.02Å; L331-F387 HydrophobicContact CD2-CZ 4.13Å; M334-F387 HydrophobicContact CB-CE1 4.3Å; M334-F387 HydrophobicContact CB-CZ 3.9Å; M334-F387 HydrophobicContact CE-CE2 3.94Å; M334-F387 HydrophobicContact CE-CZ 4.16Å; M334-F387 HydrophobicContact CG-CE2 4.41Å; M334-F387 HydrophobicContact CG-CZ 3.81Å; F338-F387 AromaticContact CE2-CD1 3.9Å; F338-F387 HydrophobicContact CE2-CD1 3.9Å; F338-F387 AromaticContact CE2-CE1 3.86Å; F338-F387 HydrophobicContact CE2-CE1 3.86Å; F338-F387 HydrophobicContact CE2-CZ 4.49Å; F338-F387 HydrophobicContact CZ-CD1 4.04Å; F338-F387 HydrophobicContact CZ-CD2 4.49Å; F338-F387 HydrophobicContact CZ-CE1 4.06Å; F338-F387 HydrophobicContact CZ-CE2 4.5Å; F338-F387 HydrophobicContact CZ-CG 4.3Å; F338-F387 HydrophobicContact CZ-CZ 4.3Å; V347-F387 WeakPolarHBondContact O-CA 3.2Å; P348-F387 HydrophobicContact CB-CD1 4.27Å; P348-F387 HydrophobicContact CB-CE1 4.15Å; W382-F387 HydrophobicContact CB-CZ 4.34Å; W382-F387 VanDerWaalsContact O-CE2 3.3Å; W382-F387 WeakPolarHBondContact O-CE2 3.15Å
388	L	98.7	Very high	97.5	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	153.6	165.9	-57.3	159.6	0	0	0	109	V150 M151 R152 T346 V347 D349 I355 F361	V150-L388 HydrophobicContact CG1-CB 3.51Å; V150-L388 HydrophobicContact CG1-CD1 4.2Å; V150-L388 HydrophobicContact CG1-CG 4.33Å; M151-L388 CarbonylContact O-C 3.45Å; M151-L388 VanDerWaalsContact O-CA 3.25Å; M151-L388 WeakPolarHBondContact O-CA 3.26Å; R152-L388 HydrophobicContact CB-CD2 4.25Å; R152-L388 HydrophobicContact CG-CD2 3.61Å; T346-L388 VanDerWaalsContact CA-O 3.31Å; T346-L388 WeakPolarHBondContact CA-O 3.18Å; T346-L388 WeakPolarHBondContact CG2-O 3.24Å; V347-L388 HydrophobicContact CG2-CB 4.16Å; V347-L388 HydrophobicContact CG2-CD1 4.14Å; V347-L388 PolarHBondContact N-O 2.88Å; V347-L388 VanDerWaalsContact N-O 3.09Å; V347-L388 PolarHBondContact O-N 2.84Å; D349-L388 HydrophobicContact CB-CD1 4.14Å; D349-L388 HydrophobicContact CB-CD2 4.3Å; D349-L388 HydrophobicContact CB-CG 3.86Å; I355-L388 HydrophobicContact CD1-CD1 3.55Å; I355-L388 HydrophobicContact CG2-CD1 4.36Å; F361-L388 HydrophobicContact CZ-CD2 3.96Å
389	S	98.8	Very high	97.6	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	171.2	175.2	-167.7	0	0	0	0	111.3	M151 T346 D393	M151-S389 PolarHBondContact N-O 2.91Å; M151-S389 PolarHBondContact O-N 3.44Å; T346-S389 PolarHBondContact OG1-OG 2.99Å; S389-D393 WeakPolarHBondContact OG-CB 3.47Å
390	T	98.8	Very high	97.8	Very high	4 Å²	4	9.2 Å²	9.2	3%	0.025	6%	0.057	C	C	.	.			trans	-96.1	170.4	159.5	64.5	0	0	0	0	110.6	V150 N345 D393 L394	V150-T390 HydrophobicContact CG2-CG2 3.88Å; N345-T390 HydrophobicContact CB-CG2 3.6Å; T390-D393 PolarHBondContact OG1-N 2.88Å; T390-D393 PolarHBondContact OG1-OD1 2.76Å; T390-L394 PolarHBondContact O-N 2.94Å
391	V	98.6	Very high	97.9	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-69.9	-34.6	172	-70.3	0	0	0	0	112.4	I119 S131 D393 L394 L395 T507 I509	I119-V391 HydrophobicContact CB-CG1 4.02Å; I119-V391 HydrophobicContact CD1-CG1 3.88Å; I119-V391 HydrophobicContact CG1-CG1 3.68Å; S131-V391 VanDerWaalsContact OG-CG2 3.25Å; S131-V391 WeakPolarHBondContact OG-CG2 3.37Å; V391-D393 PolarHBondContact O-N 3.24Å; V391-L394 PolarHBondContact O-N 2.97Å; V391-L395 VanDerWaalsContact O-CG 3.31Å; V391-L395 WeakPolarHBondContact O-CG 3.47Å; V391-L395 PolarHBondContact O-N 3.26Å; V391-T507 HydrophobicContact CB-CG2 3.59Å; V391-T507 HydrophobicContact CG1-CG2 3.7Å; V391-I509 HydrophobicContact CG1-CD1 4.12Å; V391-I509 HydrophobicContact CG1-CG1 4.35Å
392	G	98.7	Very high	98	Very high	17 Å²	17	9 Å²	9	18%	0.175	6%	0.056	C	C	.	.	H	α-helix	trans	-59.9	-47.1	177.8	0	0	0	0	0	112.4	L394 L395 L396	G392-L394 PolarHBondContact O-N 2.83Å; G392-L395 WeakPolarHBondContact O-CB 3.39Å; G392-L395 PolarHBondContact O-N 2.8Å; G392-L396 PolarHBondContact O-N 3.36Å; G392-L396 VanDerWaalsContact O-N 3.11Å
393	D	98.9	Very high	98	Very high	8 Å²	8	9.3 Å²	9.3	4%	0.043	6%	0.057	C	C	.	.	H	α-helix	trans	-61.4	-42.4	177	-76	25	0	0	0	112.2	M343 H344 N345 T346 S389 T390 V391 L395 L396 F397	M343-D393 VanDerWaalsContact CA-CG 3.43Å; M343-D393 VanDerWaalsContact CA-OD2 3.23Å; M343-D393 WeakPolarHBondContact CA-OD2 3.44Å; M343-D393 HydrophobicContact CB-CB 3.93Å; M343-D393 HydrophobicContact CE-CB 4.11Å; M343-D393 HydrophobicContact CG-CB 4.04Å; M343-D393 WeakPolarHBondContact CG-O 3.24Å; H344-D393 PolarHBondContact N-OD2 3.22Å; N345-D393 VanDerWaalsContact C-OD2 3.25Å; N345-D393 VanDerWaalsContact CA-OD2 3.31Å; N345-D393 WeakPolarHBondContact CA-OD2 3.26Å; N345-D393 PolarHBondContact N-OD2 3.33Å; N345-D393 PolarHBondContact ND2-OD1 3.15Å; T346-D393 PolarHBondContact N-OD2 3.46Å; T346-D393 VanDerWaalsContact OG1-CB 3.31Å; T346-D393 WeakPolarHBondContact OG1-CB 3.3Å; T346-D393 PolarHBondContact OG1-OD2 2.91Å; S389-D393 WeakPolarHBondContact OG-CB 3.47Å; T390-D393 PolarHBondContact OG1-N 2.88Å; T390-D393 PolarHBondContact OG1-OD1 2.76Å; V391-D393 PolarHBondContact O-N 3.24Å; D393-L395 VanDerWaalsContact C-N 3.33Å; D393-L395 PolarHBondContact O-N 3.19Å; D393-L396 WeakPolarHBondContact O-CB 3.43Å; D393-L396 PolarHBondContact O-N 3.41Å; D393-F397 PolarHBondContact O-N 2.77Å; D393-F397 VanDerWaalsContact O-N 3.11Å
394	L	98.9	Very high	97.8	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-68.5	-31.1	178.1	-69.8	-172.1	0	0	0	112.9	I153 I156 M343 T390 V391 G392 F397 G398 L482 T507 I509	I153-L394 HydrophobicContact CD1-CD2 4.13Å; I153-L394 HydrophobicContact CG2-CD1 3.82Å; I153-L394 HydrophobicContact CG2-CD2 4.48Å; I153-L394 HydrophobicContact CG2-CG 4.41Å; I156-L394 HydrophobicContact CD1-CD1 3.98Å; I156-L394 HydrophobicContact CG2-CD2 3.98Å; M343-L394 HydrophobicContact CE-CD2 4.39Å; T390-L394 PolarHBondContact O-N 2.94Å; V391-L394 PolarHBondContact O-N 2.97Å; G392-L394 PolarHBondContact O-N 2.83Å; L394-F397 PolarHBondContact O-N 3Å; L394-G398 PolarHBondContact O-N 2.92Å; L394-L482 HydrophobicContact CB-CD1 4.44Å; L394-T507 HydrophobicContact CB-CG2 4.11Å; L394-T507 VanDerWaalsContact CD1-OG1 3.31Å; L394-T507 WeakPolarHBondContact CD1-OG1 3.1Å; L394-I509 HydrophobicContact CD1-CD1 3.94Å; L394-I509 HydrophobicContact CD1-CG1 4.36Å
395	L	98.9	Very high	97.8	Very high	4 Å²	4	11.3 Å²	11.3	2%	0.021	7%	0.066	C	C	.	.	H	α-helix	trans	-65.1	-41.7	171.9	-69.8	178.8	0	0	0	111.3	A123 Q128 V391 G392 D393 F397 G398 N399 V505 T507	A123-L395 HydrophobicContact CB-CB 4.42Å; A123-L395 HydrophobicContact CB-CD1 4.28Å; A123-L395 HydrophobicContact CB-CD2 4.05Å; A123-L395 HydrophobicContact CB-CG 4.48Å; Q128-L395 HydrophobicContact CB-CD1 4.2Å; Q128-L395 HydrophobicContact CG-CD1 3.76Å; V391-L395 VanDerWaalsContact O-CG 3.31Å; V391-L395 WeakPolarHBondContact O-CG 3.47Å; V391-L395 PolarHBondContact O-N 3.26Å; G392-L395 WeakPolarHBondContact O-CB 3.39Å; G392-L395 PolarHBondContact O-N 2.8Å; D393-L395 VanDerWaalsContact C-N 3.33Å; D393-L395 PolarHBondContact O-N 3.19Å; L395-F397 PolarHBondContact O-N 3.43Å; L395-G398 PolarHBondContact O-N 2.94Å; L395-N399 VanDerWaalsContact O-CB 3.3Å; L395-N399 WeakPolarHBondContact O-CB 3.24Å; L395-N399 VanDerWaalsContact O-CG 3.3Å; L395-N399 PolarHBondContact O-N 2.98Å; L395-N399 PolarHBondContact O-ND2 3.33Å; L395-V505 HydrophobicContact CD2-CB 4.06Å; L395-V505 HydrophobicContact CD2-CG1 3.77Å; L395-V505 WeakPolarHBondContact CD2-O 3.42Å; L395-T507 HydrophobicContact CD2-CG2 4.06Å; L395-T507 HydrophobicContact CG-CG2 4.13Å
396	L	98.8	Very high	97.7	Very high	79 Å²	79	11.1 Å²	11.1	41%	0.414	6%	0.062	S	C	.	.	H	α-helix	trans	-58.1	-48.2	174.5	-67.3	171.9	0	0	0	111	G342 M343 G392 D393 N399 A400	G342-L396 WeakPolarHBondContact O-CD1 3.43Å; M343-L396 HydrophobicContact CG-CB 4.47Å; G392-L396 PolarHBondContact O-N 3.36Å; G392-L396 VanDerWaalsContact O-N 3.11Å; D393-L396 WeakPolarHBondContact O-CB 3.43Å; D393-L396 PolarHBondContact O-N 3.41Å; L396-N399 PolarHBondContact O-N 3.47Å; L396-A400 WeakPolarHBondContact O-CB 3.36Å; L396-A400 PolarHBondContact O-N 3.12Å
397	F	98.8	Very high	97.6	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-60.2	-49.2	177.6	179	-119	0	0	0	112.7	L160 A163 L341 M343 D393 L394 L395 N399 A400 L401 W450 L482	L160-F397 HydrophobicContact CD2-CB 4.37Å; L160-F397 HydrophobicContact CD2-CD1 3.57Å; L160-F397 HydrophobicContact CD2-CD2 3.71Å; L160-F397 HydrophobicContact CD2-CE1 3.64Å; L160-F397 HydrophobicContact CD2-CE2 3.78Å; L160-F397 HydrophobicContact CD2-CG 3.61Å; L160-F397 HydrophobicContact CD2-CZ 3.75Å; L160-F397 HydrophobicContact CG-CE1 4.32Å; L160-F397 HydrophobicContact CG-CZ 4.48Å; A163-F397 HydrophobicContact CB-CE2 3.71Å; A163-F397 HydrophobicContact CB-CZ 3.97Å; L341-F397 HydrophobicContact CD1-CD2 3.91Å; M343-F397 HydrophobicContact CE-CB 4.06Å; M343-F397 HydrophobicContact SD-CB 3.78Å; M343-F397 HydrophobicContact SD-CG 4.45Å; D393-F397 PolarHBondContact O-N 2.77Å; D393-F397 VanDerWaalsContact O-N 3.11Å; L394-F397 PolarHBondContact O-N 3Å; L395-F397 PolarHBondContact O-N 3.43Å; F397-N399 VanDerWaalsContact C-N 3.34Å; F397-N399 PolarHBondContact O-N 3.13Å; F397-A400 PolarHBondContact O-N 3.39Å; F397-L401 HydrophobicContact CD2-CD1 4.49Å; F397-L401 HydrophobicContact CE1-CD1 3.86Å; F397-L401 HydrophobicContact CE2-CD1 3.84Å; F397-L401 HydrophobicContact CE2-CD2 4.45Å; F397-L401 HydrophobicContact CE2-CG 4.11Å; F397-L401 HydrophobicContact CZ-CD1 3.48Å; F397-L401 VanDerWaalsContact CZ-CD1 3.48Å; F397-L401 HydrophobicContact CZ-CG 4.27Å; F397-L401 PolarHBondContact O-N 3.3Å; F397-W450 HydrophobicContact CE1-CH2 4.17Å; F397-W450 AromaticContact CE1-CZ2 3.72Å; F397-W450 HydrophobicContact CE1-CZ2 3.72Å; F397-W450 HydrophobicContact CZ-CZ2 4.2Å; F397-L482 HydrophobicContact CD1-CD2 3.68Å; F397-L482 HydrophobicContact CE1-CD2 4.16Å
398	G	98.5	Very high	97.2	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.2	-41.9	178.9	0	0	0	0	0	112.7	L394 L395 L401 L402	L394-G398 PolarHBondContact O-N 2.92Å; L395-G398 PolarHBondContact O-N 2.94Å; G398-L401 PolarHBondContact O-N 2.94Å; G398-L402 WeakPolarHBondContact O-CB 3.43Å; G398-L402 PolarHBondContact O-N 2.84Å
399	N	98.4	Very high	96.7	Very high	15 Å²	15	18.1 Å²	18.1	8%	0.08	10%	0.1	C	C	.	.	H	α-helix	trans	-66.3	-40.7	177	-78	-32.7	0	0	0	112.4	A123 G126 L395 L396 F397 L401 L402 Y403 P501 V505	A123-N399 WeakPolarHBondContact CB-ND2 3.23Å; G126-N399 PolarHBondContact O-ND2 3.12Å; L395-N399 VanDerWaalsContact O-CB 3.3Å; L395-N399 WeakPolarHBondContact O-CB 3.24Å; L395-N399 VanDerWaalsContact O-CG 3.3Å; L395-N399 PolarHBondContact O-N 2.98Å; L395-N399 PolarHBondContact O-ND2 3.33Å; L396-N399 PolarHBondContact O-N 3.47Å; F397-N399 VanDerWaalsContact C-N 3.34Å; F397-N399 PolarHBondContact O-N 3.13Å; N399-L401 VanDerWaalsContact C-N 3.32Å; N399-L401 PolarHBondContact O-N 2.9Å; N399-L402 PolarHBondContact O-N 3.21Å; N399-Y403 WeakPolarHBondContact O-CB 3.48Å; N399-Y403 PolarHBondContact O-N 3.36Å; N399-P501 HydrophobicContact CB-CG 4.19Å; N399-V505 WeakPolarHBondContact OD1-CG2 3.16Å
400	A	97.9	Very high	96.2	Very high	22 Å²	22	19.6 Å²	19.6	18%	0.182	11%	0.108	C	C	.	.	H	α-helix	trans	-61.7	-40.7	178.2	0	0	0	0	0	112	L341 L396 F397 G404 F420	L341-A400 HydrophobicContact CD2-CB 3.73Å; L396-A400 WeakPolarHBondContact O-CB 3.36Å; L396-A400 PolarHBondContact O-N 3.12Å; F397-A400 PolarHBondContact O-N 3.39Å; A400-G404 PolarHBondContact O-N 2.81Å; A400-F420 HydrophobicContact CB-CB 4.33Å
401	L	97.9	Very high	95.4	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-71.3	-41.4	175.5	-65.9	-177.5	0	0	0	112.5	F397 G398 N399 Y403 G404 Y405 L421 L429 W430 W450	F397-L401 HydrophobicContact CD2-CD1 4.49Å; F397-L401 HydrophobicContact CE1-CD1 3.86Å; F397-L401 HydrophobicContact CE2-CD1 3.84Å; F397-L401 HydrophobicContact CE2-CD2 4.45Å; F397-L401 HydrophobicContact CE2-CG 4.11Å; F397-L401 HydrophobicContact CZ-CD1 3.48Å; F397-L401 VanDerWaalsContact CZ-CD1 3.48Å; F397-L401 HydrophobicContact CZ-CG 4.27Å; F397-L401 PolarHBondContact O-N 3.3Å; G398-L401 PolarHBondContact O-N 2.94Å; N399-L401 VanDerWaalsContact C-N 3.32Å; N399-L401 PolarHBondContact O-N 2.9Å; L401-Y403 VanDerWaalsContact C-N 3.27Å; L401-Y403 PolarHBondContact O-N 3.24Å; L401-G404 PolarHBondContact O-N 3.46Å; L401-Y405 WeakPolarHBondContact O-CB 3.25Å; L401-Y405 PolarHBondContact O-N 2.97Å; L401-L421 HydrophobicContact CD2-CD1 3.68Å; L401-L421 HydrophobicContact CD2-CG 4.37Å; L401-L429 HydrophobicContact CD2-CD1 4.35Å; L401-W430 HydrophobicContact CB-CH2 4.22Å; L401-W430 HydrophobicContact CB-CZ2 3.6Å; L401-W430 HydrophobicContact CD1-CZ2 4.45Å; L401-W450 HydrophobicContact CD1-CH2 4.23Å; L401-W450 HydrophobicContact CD1-CZ2 3.38Å
402	L	97.4	Very high	94.6	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-58.3	-42.5	175.2	-178.9	56.8	0	0	0	111.6	G398 N399 Y405 Q406 W430 V484 P486 P501 V505	G398-L402 WeakPolarHBondContact O-CB 3.43Å; G398-L402 PolarHBondContact O-N 2.84Å; N399-L402 PolarHBondContact O-N 3.21Å; L402-Y405 PolarHBondContact O-N 2.94Å; L402-Q406 HydrophobicContact CD1-CG 4.15Å; L402-Q406 WeakPolarHBondContact O-CB 3.23Å; L402-Q406 WeakPolarHBondContact O-CG 3.27Å; L402-Q406 PolarHBondContact O-N 3.47Å; L402-W430 HydrophobicContact CB-CH2 4.17Å; L402-W430 HydrophobicContact CD1-CH2 4.31Å; L402-W430 HydrophobicContact CD1-CZ3 4.24Å; L402-V484 HydrophobicContact CB-CG1 3.97Å; L402-V484 HydrophobicContact CD1-CG1 3.92Å; L402-V484 HydrophobicContact CD2-CG1 4Å; L402-V484 HydrophobicContact CG-CG1 4.18Å; L402-P486 HydrophobicContact CD1-CB 3.87Å; L402-P486 HydrophobicContact CD1-CG 3.79Å; L402-P501 HydrophobicContact CB-CB 4.06Å; L402-P501 HydrophobicContact CD2-CB 3.85Å; L402-P501 HydrophobicContact CG-CB 3.7Å; L402-V505 HydrophobicContact CD2-CG2 4.37Å
403	Y	96.2	Very high	93.9	Very high	28 Å²	28	38 Å²	38	11%	0.11	19%	0.194	C	C	.	.	H	α-helix	trans	-58.2	-54.2	174.9	178.3	-89.5	0	0	0	111.2	N399 L401 Y405 Q406 V407 L416 L417 L500	N399-Y403 WeakPolarHBondContact O-CB 3.48Å; N399-Y403 PolarHBondContact O-N 3.36Å; L401-Y403 VanDerWaalsContact C-N 3.27Å; L401-Y403 PolarHBondContact O-N 3.24Å; Y403-Y405 VanDerWaalsContact C-N 3.3Å; Y403-Y405 PolarHBondContact O-N 2.97Å; Y403-Q406 PolarHBondContact O-N 3.31Å; Y403-V407 HydrophobicContact CD1-CG2 4.07Å; Y403-V407 HydrophobicContact CE1-CG2 3.68Å; Y403-V407 HydrophobicContact CE2-CG2 4.23Å; Y403-V407 HydrophobicContact CG-CG2 4.49Å; Y403-V407 VanDerWaalsContact O-CG2 3.31Å; Y403-V407 WeakPolarHBondContact O-CG2 3.46Å; Y403-V407 PolarHBondContact O-N 3.36Å; Y403-L416 WeakPolarHBondContact OH-CB 3.47Å; Y403-L417 WeakPolarHBondContact CE1-O 3.47Å; Y403-L417 WeakPolarHBondContact OH-CA 3.47Å; Y403-L417 PolarHBondContact OH-N 3.45Å; Y403-L417 PolarHBondContact OH-O 3.4Å; Y403-L500 HydrophobicContact CD2-CB 3.57Å; Y403-L500 HydrophobicContact CD2-CD1 4.39Å; Y403-L500 HydrophobicContact CE2-CB 3.65Å; Y403-L500 HydrophobicContact CE2-CD1 4.13Å
404	G	95.2	Very high	93.3	Very high	2 Å²	2	45.7 Å²	45.7	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-58.7	-40.8	179.7	0	0	0	0	0	113	A400 L401 A408	A400-G404 PolarHBondContact O-N 2.81Å; L401-G404 PolarHBondContact O-N 3.46Å; G404-A408 PolarHBondContact O-N 3.04Å
405	Y	94.9	Very high	92.5	Very high	41 Å²	41	49.6 Å²	49.6	16%	0.161	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-45.2	175.8	175.6	-98.9	0	0	0	112.1	L401 L402 Y403 A408 H409 I427 W430 H467 P486	L401-Y405 WeakPolarHBondContact O-CB 3.25Å; L401-Y405 PolarHBondContact O-N 2.97Å; L402-Y405 PolarHBondContact O-N 2.94Å; Y403-Y405 VanDerWaalsContact C-N 3.3Å; Y403-Y405 PolarHBondContact O-N 2.97Å; Y405-A408 VanDerWaalsContact O-CB 3.28Å; Y405-A408 WeakPolarHBondContact O-CB 3.36Å; Y405-A408 PolarHBondContact O-N 3.15Å; Y405-H409 AromaticContact CE1-CD2 3.92Å; Y405-H409 AromaticContact CE1-NE2 3.72Å; Y405-H409 AromaticContact CE2-NE2 3.53Å; Y405-H409 AromaticContact CZ-CD2 3.99Å; Y405-H409 AromaticContact CZ-NE2 3.29Å; Y405-H409 VanDerWaalsContact CZ-NE2 3.29Å; Y405-H409 PolarHBondContact O-CD2 3.27Å; Y405-H409 PolarHBondContact OH-NE2 3.16Å; Y405-I427 HydrophobicContact CD2-CG1 4.17Å; Y405-I427 HydrophobicContact CE2-CG1 4.41Å; Y405-W430 VanDerWaalsContact CB-CZ3 3.44Å; Y405-W430 AromaticContact CD1-CE3 3.89Å; Y405-W430 HydrophobicContact CD1-CE3 3.89Å; Y405-W430 AromaticContact CD1-CZ3 3.66Å; Y405-W430 HydrophobicContact CD1-CZ3 3.66Å; Y405-W430 HydrophobicContact CD2-CD2 4.24Å; Y405-W430 AromaticContact CD2-CE3 3.37Å; Y405-W430 HydrophobicContact CD2-CE3 3.37Å; Y405-W430 AromaticContact CD2-CZ3 3.94Å; Y405-W430 HydrophobicContact CD2-CZ3 3.94Å; Y405-W430 HydrophobicContact CE1-CE3 4.37Å; Y405-W430 HydrophobicContact CE1-CZ3 4.4Å; Y405-W430 AromaticContact CE2-CE3 3.9Å; Y405-W430 HydrophobicContact CE2-CE3 3.9Å; Y405-W430 HydrophobicContact CG-CD2 4.48Å; Y405-W430 AromaticContact CG-CE3 3.36Å; Y405-W430 HydrophobicContact CG-CE3 3.36Å; Y405-W430 AromaticContact CG-CZ3 3.4Å; Y405-W430 HydrophobicContact CG-CZ3 3.4Å; Y405-H467 AromaticContact CZ-NE2 3.87Å; Y405-H467 PolarHBondContact OH-NE2 3.22Å; Y405-P486 HydrophobicContact CE1-CG 4.37Å
406	Q	93.6	Very high	92	Very high	6 Å²	6	51.8 Å²	51.8	3%	0.028	28%	0.282	C	S	.	.	H	α-helix	trans	-71.1	-39.2	-178.8	-73.7	179.2	-45	0	0	113.1	L402 Y403 A408 H409 M490 L500 Q502	L402-Q406 HydrophobicContact CD1-CG 4.15Å; L402-Q406 WeakPolarHBondContact O-CB 3.23Å; L402-Q406 WeakPolarHBondContact O-CG 3.27Å; L402-Q406 PolarHBondContact O-N 3.47Å; Y403-Q406 PolarHBondContact O-N 3.31Å; Q406-A408 PolarHBondContact O-N 2.89Å; Q406-H409 PolarHBondContact O-N 3.21Å; Q406-M490 HydrophobicContact CB-CE 4.25Å; Q406-L500 HydrophobicContact CB-CD2 4.01Å; Q406-Q502 PolarHBondContact NE2-O 3.23Å
407	V	92.6	Very high	91.5	Very high	15 Å²	15	54.5 Å²	54.5	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-56.7	-33.5	174	173.4	0	0	0	0	110.8	Y403 H409 L410 T413 L416 P423 L500	Y403-V407 HydrophobicContact CD1-CG2 4.07Å; Y403-V407 HydrophobicContact CE1-CG2 3.68Å; Y403-V407 HydrophobicContact CE2-CG2 4.23Å; Y403-V407 HydrophobicContact CG-CG2 4.49Å; Y403-V407 VanDerWaalsContact O-CG2 3.31Å; Y403-V407 WeakPolarHBondContact O-CG2 3.46Å; Y403-V407 PolarHBondContact O-N 3.36Å; V407-H409 PolarHBondContact O-N 2.98Å; V407-L410 PolarHBondContact O-N 3.19Å; V407-L410 VanDerWaalsContact O-N 3.12Å; V407-T413 HydrophobicContact CG1-CG2 3.73Å; V407-L416 HydrophobicContact CG2-CD1 4.15Å; V407-P423 HydrophobicContact CB-CG 4.39Å; V407-P423 HydrophobicContact CG1-CB 4.42Å; V407-P423 HydrophobicContact CG1-CG 3.75Å; V407-L500 HydrophobicContact CG2-CD1 3.71Å
408	A	90.7	Very high	91	Very high	30 Å²	30	60.5 Å²	60.5	25%	0.248	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-18.6	179.5	0	0	0	0	0	114.3	G404 Y405 Q406 P423 I427	G404-A408 PolarHBondContact O-N 3.04Å; Y405-A408 VanDerWaalsContact O-CB 3.28Å; Y405-A408 WeakPolarHBondContact O-CB 3.36Å; Y405-A408 PolarHBondContact O-N 3.15Å; Q406-A408 PolarHBondContact O-N 2.89Å; A408-P423 VanDerWaalsContact CA-CB 3.45Å; A408-P423 HydrophobicContact CB-CB 3.4Å; A408-P423 VanDerWaalsContact CB-CB 3.4Å; A408-P423 WeakPolarHBondContact CB-O 3.26Å; A408-I427 HydrophobicContact CB-CD1 3.27Å; A408-I427 HydrophobicContact CB-CG1 3.51Å
409	H	88.8	Confident	90.7	Very high	104 Å²	104	61.8 Å²	61.8	48%	0.481	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-1.2	177.6	-64.6	-63	0	0	0	113.3	Y405 Q406 V407	Y405-H409 AromaticContact CE1-CD2 3.92Å; Y405-H409 AromaticContact CE1-NE2 3.72Å; Y405-H409 AromaticContact CE2-NE2 3.53Å; Y405-H409 AromaticContact CZ-CD2 3.99Å; Y405-H409 AromaticContact CZ-NE2 3.29Å; Y405-H409 VanDerWaalsContact CZ-NE2 3.29Å; Y405-H409 PolarHBondContact O-CD2 3.27Å; Y405-H409 PolarHBondContact OH-NE2 3.16Å; Q406-H409 PolarHBondContact O-N 3.21Å; V407-H409 PolarHBondContact O-N 2.98Å
410	L	87.5	Confident	90.5	Very high	31 Å²	31	62 Å²	62	16%	0.162	35%	0.348	C	S	.	.			trans	-89.9	142.6	177.4	-63	-179.8	0	0	0	111.6	V407 T413 L416 M490 L498 L500	V407-L410 PolarHBondContact O-N 3.19Å; V407-L410 VanDerWaalsContact O-N 3.12Å; L410-T413 HydrophobicContact CB-CG2 4.3Å; L410-L416 HydrophobicContact CD1-CD1 3.66Å; L410-M490 HydrophobicContact CD2-CE 3.79Å; L410-M490 HydrophobicContact CD2-SD 4.23Å; L410-M490 HydrophobicContact CG-CE 4.4Å; L410-L498 HydrophobicContact CD1-CD2 3.5Å; L410-L498 HydrophobicContact CD2-CD2 4Å; L410-L498 HydrophobicContact CG-CD2 4.42Å; L410-L500 HydrophobicContact CD1-CD1 3.9Å
411	K	82	Confident	90.5	Very high	225 Å²	225	61.1 Å²	61.1	98%	0.978	34%	0.341	S	S	*	.	S	Bend	trans	-81.2	-32.9	173.8	-66.6	-177	179.6	179.6	0	112.4
412	D	82.1	Confident	90.3	Very high	111 Å²	111	66.6 Å²	66.6	59%	0.594	36%	0.364	S	S	*	.			trans	-120.4	130.7	178.6	-175.6	9.1	0	0	0	109	E414	D412-E414 WeakPolarHBondContact OD1-CB 3.32Å; D412-E414 PolarHBondContact OD1-N 3.16Å
413	T	85.1	Confident	90.2	Very high	72 Å²	72	69 Å²	69	44%	0.442	38%	0.38	S	S	.	.			trans	-124.8	10.6	-178.3	57.7	0	0	0	0	111.6	V407 L410 G415 L416	V407-T413 HydrophobicContact CG1-CG2 3.73Å; L410-T413 HydrophobicContact CB-CG2 4.3Å; T413-G415 PolarHBondContact O-N 3.38Å; T413-L416 HydrophobicContact CG2-CD1 4.39Å; T413-L416 WeakPolarHBondContact O-CB 3.32Å; T413-L416 PolarHBondContact O-N 2.96Å
414	E	84.6	Confident	90.1	Very high	170 Å²	170	74.9 Å²	74.9	79%	0.794	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	131.5	177.7	-167.4	174.5	-175.8	0	0	110.7	D412 L416	D412-E414 WeakPolarHBondContact OD1-CB 3.32Å; D412-E414 PolarHBondContact OD1-N 3.16Å; E414-L416 VanDerWaalsContact C-N 3.27Å; E414-L416 PolarHBondContact O-N 3.18Å
415	G	83.8	Confident	90.1	Very high	82 Å²	82	75.8 Å²	75.8	85%	0.845	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	-1.4	-179	0	0	0	0	0	115.8	T413	T413-G415 PolarHBondContact O-N 3.38Å
416	L	87.9	Confident	90.1	Very high	50 Å²	50	74 Å²	74	26%	0.262	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-82.4	148.5	173.4	-63.6	-177.1	0	0	0	111.7	Y403 V407 L410 T413 E414 L500	Y403-L416 WeakPolarHBondContact OH-CB 3.47Å; V407-L416 HydrophobicContact CG2-CD1 4.15Å; L410-L416 HydrophobicContact CD1-CD1 3.66Å; T413-L416 HydrophobicContact CG2-CD1 4.39Å; T413-L416 WeakPolarHBondContact O-CB 3.32Å; T413-L416 PolarHBondContact O-N 2.96Å; E414-L416 VanDerWaalsContact C-N 3.27Å; E414-L416 PolarHBondContact O-N 3.18Å; L416-L500 HydrophobicContact CD1-CD1 4.09Å
417	L	88.7	Confident	90.2	Very high	136 Å²	136	76.1 Å²	76.1	71%	0.712	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-66.9	148.7	174.3	-66.2	175.2	0	0	0	110.7	Y403 G419	Y403-L417 WeakPolarHBondContact CE1-O 3.47Å; Y403-L417 WeakPolarHBondContact OH-CA 3.47Å; Y403-L417 PolarHBondContact OH-N 3.45Å; Y403-L417 PolarHBondContact OH-O 3.4Å; L417-G419 PolarHBondContact O-N 3.29Å
418	P	87.6	Confident	90.3	Very high	126 Å²	126	78.4 Å²	78.4	82%	0.818	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-60.6	124.8	166.8	26.9	-32.5	0	0	0	108.8
419	G	91.6	Very high	90.5	Very high	27 Å²	27	77.1 Å²	77.1	28%	0.278	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-67.7	159.2	172.8	0	0	0	0	0	111.1	L417 L421	L417-G419 PolarHBondContact O-N 3.29Å; G419-L421 VanDerWaalsContact C-N 3.29Å; G419-L421 PolarHBondContact O-N 2.91Å
420	F	95.6	Very high	90.9	Very high	19 Å²	19	72.5 Å²	72.5	8%	0.083	39%	0.394	C	S	.	.	S	Bend	trans	-58.2	-43	175.6	170.9	-109	0	0	0	112	A163 R167 M337 L341 A400	A163-F420 HydrophobicContact CB-CE1 4.13Å; R167-F420 WeakPolarHBondContact CD-O 3.46Å; R167-F420 HydrophobicContact CG-CE1 4.04Å; R167-F420 HydrophobicContact CG-CE2 4.12Å; R167-F420 HydrophobicContact CG-CZ 3.54Å; R167-F420 PolarHBondContact NH1-O 2.98Å; M337-F420 HydrophobicContact CG-CE1 4.4Å; M337-F420 HydrophobicContact CG-CE2 3.98Å; M337-F420 HydrophobicContact CG-CZ 3.5Å; M337-F420 HydrophobicContact SD-CE1 4.21Å; M337-F420 HydrophobicContact SD-CZ 3.75Å; L341-F420 HydrophobicContact CD1-CE1 4.38Å; L341-F420 HydrophobicContact CD1-CE2 4.41Å; L341-F420 HydrophobicContact CD1-CZ 4.34Å; L341-F420 HydrophobicContact CD2-CB 3.9Å; L341-F420 HydrophobicContact CD2-CD1 4.15Å; L341-F420 HydrophobicContact CD2-CD2 3.7Å; L341-F420 HydrophobicContact CD2-CE2 4.32Å; L341-F420 HydrophobicContact CD2-CG 3.62Å; L341-F420 HydrophobicContact CG-CD2 4.05Å; L341-F420 HydrophobicContact CG-CE2 4.19Å; L341-F420 HydrophobicContact CG-CG 4.34Å; A400-F420 HydrophobicContact CB-CB 4.33Å
421	L	96.3	Very high	91.2	Very high	4 Å²	4	74.2 Å²	74.2	2%	0.021	41%	0.406	C	S	.	.	S	Bend	trans	-106.2	151.5	168.4	-64.5	178.6	0	0	0	110	A166 R167 L401 G419 L429	A166-L421 HydrophobicContact CB-CD1 4.16Å; A166-L421 HydrophobicContact CB-CD2 3.89Å; R167-L421 HydrophobicContact CG-CD2 3.68Å; L401-L421 HydrophobicContact CD2-CD1 3.68Å; L401-L421 HydrophobicContact CD2-CG 4.37Å; G419-L421 VanDerWaalsContact C-N 3.29Å; G419-L421 PolarHBondContact O-N 2.91Å; L421-L429 HydrophobicContact CD1-CD1 3.52Å; L421-L429 HydrophobicContact CD1-CG 4.38Å
422	K	95.2	Very high	91.7	Very high	118 Å²	118	64.7 Å²	64.7	51%	0.513	37%	0.367	S	S	.	.			trans	-58.7	146.6	166.1	-66	175.5	-172	168	0	109.3	E170 K424 S425 A426	E170-K422 HydrophobicContact CB-CD 4.4Å; E170-K422 HydrophobicContact CG-CD 3.97Å; E170-K422 HydrophobicContact CG-CG 4.26Å; E170-K422 PolarHBondContact O-NZ 3.27Å; E170-K422 WeakPolarHBondContact OE1-CA 3.4Å; E170-K422 VanDerWaalsContact OE1-CB 3.25Å; E170-K422 WeakPolarHBondContact OE1-CB 3.48Å; E170-K422 PolarHBondContact OE1-N 3.05Å; K422-K424 VanDerWaalsContact C-N 3.28Å; K422-K424 PolarHBondContact O-N 3.15Å; K422-S425 WeakPolarHBondContact O-CB 3.37Å; K422-S425 PolarHBondContact O-N 2.84Å; K422-A426 PolarHBondContact O-N 2.81Å; K422-A426 VanDerWaalsContact O-N 3.1Å
423	P	93.8	Very high	92.1	Very high	52 Å²	52	61.5 Å²	61.5	34%	0.338	35%	0.351	S	S	.	.	H	α-helix	trans	-56.5	-39.6	-174.5	-25.5	33.1	0	0	0	114.1	V407 A408 S425 A426 I427	V407-P423 HydrophobicContact CB-CG 4.39Å; V407-P423 HydrophobicContact CG1-CB 4.42Å; V407-P423 HydrophobicContact CG1-CG 3.75Å; A408-P423 VanDerWaalsContact CA-CB 3.45Å; A408-P423 HydrophobicContact CB-CB 3.4Å; A408-P423 VanDerWaalsContact CB-CB 3.4Å; A408-P423 WeakPolarHBondContact CB-O 3.26Å; P423-S425 PolarHBondContact O-N 2.96Å; P423-A426 PolarHBondContact O-N 3.5Å; P423-I427 PolarHBondContact O-N 2.79Å; P423-I427 VanDerWaalsContact O-N 3.11Å
424	K	94.6	Very high	92.2	Very high	152 Å²	152	64.6 Å²	64.6	66%	0.661	37%	0.365	S	S	*	.	H	α-helix	trans	-59.2	-46.8	175.7	-178.2	176.9	172.7	-178.3	0	112.1	K422 A426 I427 E428	K422-K424 VanDerWaalsContact C-N 3.28Å; K422-K424 PolarHBondContact O-N 3.15Å; K424-A426 VanDerWaalsContact C-N 3.32Å; K424-A426 PolarHBondContact O-N 2.78Å; K424-I427 PolarHBondContact O-N 3.26Å; K424-E428 WeakPolarHBondContact CE-OE1 3.49Å; K424-E428 IonicContact NZ-OE1 2.58Å; K424-E428 WeakPolarHBondContact O-CG 3.43Å; K424-E428 PolarHBondContact O-N 3.46Å
425	S	96.3	Very high	92.1	Very high	20 Å²	20	62.2 Å²	62.2	14%	0.14	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-39.9	-180	-43.1	0	0	0	0	111.1	E170 K422 P423 I427 E428 L429	E170-S425 WeakPolarHBondContact OE1-CB 3.5Å; E170-S425 PolarHBondContact OE1-OG 3.33Å; K422-S425 WeakPolarHBondContact O-CB 3.37Å; K422-S425 PolarHBondContact O-N 2.84Å; P423-S425 PolarHBondContact O-N 2.96Å; S425-I427 PolarHBondContact O-N 3.37Å; S425-E428 PolarHBondContact O-N 3.28Å; S425-L429 WeakPolarHBondContact O-CG 3.23Å; S425-L429 PolarHBondContact O-N 2.76Å
426	A	95.1	Very high	92	Very high	3 Å²	3	58.3 Å²	58.3	3%	0.025	31%	0.312	C	S	.	.	H	α-helix	trans	-61.6	-42.4	176.6	0	0	0	0	0	112.5	K422 P423 K424 L429	K422-A426 PolarHBondContact O-N 2.81Å; K422-A426 VanDerWaalsContact O-N 3.1Å; P423-A426 PolarHBondContact O-N 3.5Å; K424-A426 VanDerWaalsContact C-N 3.32Å; K424-A426 PolarHBondContact O-N 2.78Å; A426-L429 PolarHBondContact O-N 3.02Å
427	I	94.5	Very high	91.6	Very high	51 Å²	51	61.4 Å²	61.4	26%	0.262	33%	0.325	S	S	.	.	H	α-helix	trans	-60.9	-47	171.9	-72.6	-179.5	0	0	0	110.9	Y405 A408 P423 K424 S425 L429 W430 T431	Y405-I427 HydrophobicContact CD2-CG1 4.17Å; Y405-I427 HydrophobicContact CE2-CG1 4.41Å; A408-I427 HydrophobicContact CB-CD1 3.27Å; A408-I427 HydrophobicContact CB-CG1 3.51Å; P423-I427 PolarHBondContact O-N 2.79Å; P423-I427 VanDerWaalsContact O-N 3.11Å; K424-I427 PolarHBondContact O-N 3.26Å; S425-I427 PolarHBondContact O-N 3.37Å; I427-L429 PolarHBondContact O-N 2.88Å; I427-W430 CarbonylContact O-C 3.54Å; I427-W430 PolarHBondContact O-N 2.92Å; I427-T431 PolarHBondContact O-N 3.2Å; I427-T431 PolarHBondContact O-OG1 2.91Å
428	E	95.2	Very high	90.6	Very high	64 Å²	64	55 Å²	55	30%	0.299	29%	0.292	S	S	.	.	H	α-helix	trans	-61.6	-29.6	-177.4	-75.1	-179.7	-168.8	0	0	113.1	K424 S425 W430 Q448	K424-E428 WeakPolarHBondContact CE-OE1 3.49Å; K424-E428 IonicContact NZ-OE1 2.58Å; K424-E428 WeakPolarHBondContact O-CG 3.43Å; K424-E428 PolarHBondContact O-N 3.46Å; S425-E428 PolarHBondContact O-N 3.28Å; E428-W430 VanDerWaalsContact C-N 3.35Å; E428-Q448 PolarHBondContact O-NE2 2.82Å; E428-Q448 VanDerWaalsContact O-NE2 3.08Å
429	L	95.6	Very high	89.4	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.016	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-38.1	174.6	-67.5	-166.3	0	0	0	112.7	T162 A166 L401 L421 S425 A426 I427 Q448	T162-L429 HydrophobicContact CG2-CD1 4.3Å; T162-L429 HydrophobicContact CG2-CD2 3.26Å; T162-L429 HydrophobicContact CG2-CG 4.35Å; A166-L429 HydrophobicContact CB-CD2 4.33Å; L401-L429 HydrophobicContact CD2-CD1 4.35Å; L421-L429 HydrophobicContact CD1-CD1 3.52Å; L421-L429 HydrophobicContact CD1-CG 4.38Å; S425-L429 WeakPolarHBondContact O-CG 3.23Å; S425-L429 PolarHBondContact O-N 2.76Å; A426-L429 PolarHBondContact O-N 3.02Å; I427-L429 PolarHBondContact O-N 2.88Å; L429-Q448 HydrophobicContact CD2-CB 3.92Å; L429-Q448 PolarHBondContact O-N 3.44Å
430	W	95.3	Very high	88.1	Confident	7 Å²	7	53.2 Å²	53.2	3%	0.027	27%	0.266	C	S	.	.	H	α-helix	trans	-100.8	4.7	-175.3	-65.3	-6.1	0	0	0	113.5	L401 L402 Y405 I427 E428 P432 W450 V452 V469 V484 P486	L401-W430 HydrophobicContact CB-CH2 4.22Å; L401-W430 HydrophobicContact CB-CZ2 3.6Å; L401-W430 HydrophobicContact CD1-CZ2 4.45Å; L402-W430 HydrophobicContact CB-CH2 4.17Å; L402-W430 HydrophobicContact CD1-CH2 4.31Å; L402-W430 HydrophobicContact CD1-CZ3 4.24Å; Y405-W430 VanDerWaalsContact CB-CZ3 3.44Å; Y405-W430 AromaticContact CD1-CE3 3.89Å; Y405-W430 HydrophobicContact CD1-CE3 3.89Å; Y405-W430 AromaticContact CD1-CZ3 3.66Å; Y405-W430 HydrophobicContact CD1-CZ3 3.66Å; Y405-W430 HydrophobicContact CD2-CD2 4.24Å; Y405-W430 AromaticContact CD2-CE3 3.37Å; Y405-W430 HydrophobicContact CD2-CE3 3.37Å; Y405-W430 AromaticContact CD2-CZ3 3.94Å; Y405-W430 HydrophobicContact CD2-CZ3 3.94Å; Y405-W430 HydrophobicContact CE1-CE3 4.37Å; Y405-W430 HydrophobicContact CE1-CZ3 4.4Å; Y405-W430 AromaticContact CE2-CE3 3.9Å; Y405-W430 HydrophobicContact CE2-CE3 3.9Å; Y405-W430 HydrophobicContact CG-CD2 4.48Å; Y405-W430 AromaticContact CG-CE3 3.36Å; Y405-W430 HydrophobicContact CG-CE3 3.36Å; Y405-W430 AromaticContact CG-CZ3 3.4Å; Y405-W430 HydrophobicContact CG-CZ3 3.4Å; I427-W430 CarbonylContact O-C 3.54Å; I427-W430 PolarHBondContact O-N 2.92Å; E428-W430 VanDerWaalsContact C-N 3.35Å; W430-P432 WeakPolarHBondContact O-CD 3.47Å; W430-W450 AromaticContact CD1-CD1 3.71Å; W430-W450 AromaticContact CD1-CG 3.79Å; W430-W450 AromaticContact NE1-CD1 3.78Å; W430-W450 AromaticContact NE1-CD2 3.73Å; W430-W450 AromaticContact NE1-CE2 3.66Å; W430-W450 AromaticContact NE1-CG 3.87Å; W430-W450 AromaticContact NE1-NE1 3.69Å; W430-V452 WeakPolarHBondContact O-CG1 3.42Å; W430-V452 WeakPolarHBondContact O-CG2 3.48Å; W430-V469 HydrophobicContact CB-CG1 3.99Å; W430-V469 HydrophobicContact CD2-CB 4.44Å; W430-V469 HydrophobicContact CD2-CG1 3.9Å; W430-V469 HydrophobicContact CD2-CG2 3.85Å; W430-V469 HydrophobicContact CE3-CG1 4.27Å; W430-V469 HydrophobicContact CE3-CG2 4.23Å; W430-V469 HydrophobicContact CG-CB 4.48Å; W430-V469 HydrophobicContact CG-CG1 3.75Å; W430-V469 HydrophobicContact CG-CG2 4.34Å; W430-V469 HydrophobicContact CH2-CG2 4.12Å; W430-V469 HydrophobicContact CZ2-CG2 3.71Å; W430-V469 HydrophobicContact CZ3-CG2 4.37Å; W430-V484 HydrophobicContact CH2-CB 4.32Å; W430-V484 HydrophobicContact CH2-CG1 3.83Å; W430-V484 HydrophobicContact CZ2-CG1 4.48Å; W430-V484 HydrophobicContact CZ2-CG2 4.48Å; W430-P486 HydrophobicContact CZ3-CG 4.43Å
431	T	94.4	Very high	86.8	Confident	67 Å²	67	53.6 Å²	53.6	41%	0.411	27%	0.269	S	S	.	.	S	Bend	trans	-80.8	122.8	172.6	-60.5	0	0	0	0	109	I427 V433 G447	I427-T431 PolarHBondContact O-N 3.2Å; I427-T431 PolarHBondContact O-OG1 2.91Å; T431-V433 PolarHBondContact O-N 3.29Å; T431-G447 WeakPolarHBondContact O-CA 3.37Å
432	P	92.5	Very high	85.4	Confident	25 Å²	25	58.6 Å²	58.6	16%	0.162	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-55.2	136.9	172.6	-27.8	37.4	0	0	0	112.3	W430 L445 V452 E454	W430-P432 WeakPolarHBondContact O-CD 3.47Å; P432-L445 HydrophobicContact CB-CB 3.69Å; P432-L445 HydrophobicContact CB-CD1 3.53Å; P432-L445 HydrophobicContact CB-CG 4.26Å; P432-L445 HydrophobicContact CG-CB 4.21Å; P432-L445 HydrophobicContact CG-CD1 4.01Å; P432-V452 HydrophobicContact CG-CB 4.1Å; P432-V452 HydrophobicContact CG-CG1 3.78Å; P432-E454 HydrophobicContact CG-CG 3.81Å
433	V	91.8	Very high	84.4	Confident	43 Å²	43	56.2 Å²	56.2	26%	0.261	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-95.7	138.3	173.8	-179	0	0	0	0	109	L208 T431 T436 Y446	L208-V433 HydrophobicContact CD1-CG1 3.79Å; T431-V433 PolarHBondContact O-N 3.29Å; V433-T436 HydrophobicContact CB-CG2 3.85Å; V433-T436 HydrophobicContact CG1-CG2 4.13Å; V433-T436 WeakPolarHBondContact O-CB 3.07Å; V433-T436 WeakPolarHBondContact O-CG2 3.26Å; V433-T436 PolarHBondContact O-N 2.91Å; V433-T436 PolarHBondContact O-OG1 2.88Å; V433-Y446 PolarHBondContact N-O 3.48Å
434	D	86.1	Confident	83.8	Confident	137 Å²	137	53.9 Å²	53.9	73%	0.733	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	145.5	177.8	-71.5	-24.1	0	0	0	112.3	T436	D434-T436 VanDerWaalsContact C-N 3.28Å; D434-T436 PolarHBondContact O-N 3.02Å
435	K	82.6	Confident	83.5	Confident	121 Å²	121	49.1 Å²	49.1	53%	0.526	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	26.1	177.1	-47.3	168.7	-171.4	166.3	0	114.2	F308	F308-K435 VanDerWaalsContact CB-O 3.23Å; F308-K435 WeakPolarHBondContact CB-O 3.19Å
436	T	82.6	Confident	83.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.254	C	S	.	.			trans	-110.4	35.4	179.3	68.6	0	0	0	0	114.7	L208 F308 V433 D434 A438 Y446	L208-T436 HydrophobicContact CD1-CG2 4.22Å; L208-T436 HydrophobicContact CD2-CG2 4.16Å; L208-T436 HydrophobicContact CG-CG2 4.21Å; F308-T436 HydrophobicContact CB-CG2 4.43Å; F308-T436 HydrophobicContact CD2-CG2 3.88Å; V433-T436 HydrophobicContact CB-CG2 3.85Å; V433-T436 HydrophobicContact CG1-CG2 4.13Å; V433-T436 WeakPolarHBondContact O-CB 3.07Å; V433-T436 WeakPolarHBondContact O-CG2 3.26Å; V433-T436 PolarHBondContact O-N 2.91Å; V433-T436 PolarHBondContact O-OG1 2.88Å; D434-T436 VanDerWaalsContact C-N 3.28Å; D434-T436 PolarHBondContact O-N 3.02Å; T436-A438 PolarHBondContact O-N 2.93Å; T436-Y446 PolarHBondContact O-N 3.39Å; T436-Y446 PolarHBondContact OG1-N 2.88Å; T436-Y446 PolarHBondContact OG1-O 3.01Å
437	E	77.7	Confident	83.2	Confident	115 Å²	115	48.1 Å²	48.1	54%	0.537	25%	0.252	S	S	.	.			trans	-60.2	115.9	177.7	-52.8	93.7	157.9	0	0	110.5	S439 L445	E437-S439 PolarHBondContact O-N 3.39Å; E437-L445 HydrophobicContact CG-CD2 4.25Å
438	A	68.1	Low	83.3	Confident	2 Å²	2	46.4 Å²	46.4	2%	0.017	24%	0.243	C	C	.	.			trans	-74.3	118.2	179.5	0	0	0	0	0	109.2	T436 W440 D441 G444 L451	T436-A438 PolarHBondContact O-N 2.93Å; A438-W440 HydrophobicContact CB-CD2 4.28Å; A438-W440 HydrophobicContact CB-CH2 4.47Å; A438-W440 HydrophobicContact CB-CZ2 3.96Å; A438-W440 PolarHBondContact O-N 2.76Å; A438-D441 CarbonylContact O-C 3.53Å; A438-D441 PolarHBondContact O-N 2.79Å; A438-D441 VanDerWaalsContact O-N 3.16Å; A438-G444 PolarHBondContact N-O 3.25Å; A438-L451 HydrophobicContact CB-CD1 3.64Å
439	S	63.5	Low	83.3	Confident	39 Å²	39	43.3 Å²	43.3	27%	0.273	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.7	-173.7	62.6	0	0	0	0	114.7	E437	E437-S439 PolarHBondContact O-N 3.39Å
440	W	64.1	Low	83.3	Confident	75 Å²	75	43.2 Å²	43.2	28%	0.284	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-5.6	-178.4	57.9	80.1	0	0	0	113.8	T266 F308 Y310 A438	T266-W440 HydrophobicContact CG2-CB 3.91Å; F308-W440 AromaticContact CE1-CH2 3.75Å; F308-W440 HydrophobicContact CE1-CH2 3.75Å; F308-W440 HydrophobicContact CE1-CZ3 4.11Å; F308-W440 AromaticContact CZ-CH2 3.84Å; F308-W440 HydrophobicContact CZ-CH2 3.84Å; Y310-W440 HydrophobicContact CD2-CH2 4.01Å; Y310-W440 HydrophobicContact CG-CH2 4.38Å; A438-W440 HydrophobicContact CB-CD2 4.28Å; A438-W440 HydrophobicContact CB-CH2 4.47Å; A438-W440 HydrophobicContact CB-CZ2 3.96Å; A438-W440 PolarHBondContact O-N 2.76Å
441	D	66.9	Low	83.3	Confident	27 Å²	27	43.3 Å²	43.3	14%	0.144	23%	0.229	C	C	.	.			trans	-137.9	106.6	174.8	-166.5	-31	0	0	0	109.2	A438 D443 G444 L451	A438-D441 CarbonylContact O-C 3.53Å; A438-D441 PolarHBondContact O-N 2.79Å; A438-D441 VanDerWaalsContact O-N 3.16Å; D441-D443 PolarHBondContact O-N 3.09Å; D441-D443 VanDerWaalsContact O-N 3.15Å; D441-D443 PolarHBondContact OD1-N 2.87Å; D441-G444 PolarHBondContact O-N 2.83Å; D441-G444 PolarHBondContact OD1-N 3.47Å; D441-L451 HydrophobicContact CB-CD1 4.32Å; D441-L451 HydrophobicContact CB-CD2 4.21Å
442	T	68.1	Low	83.2	Confident	110 Å²	110	40.1 Å²	40.1	68%	0.675	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-22.6	-178	46.5	0	0	0	0	113.5	L232	L232-T442 HydrophobicContact CD2-CG2 3.51Å
443	D	74	Confident	83.1	Confident	67 Å²	67	39 Å²	39	36%	0.358	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-11.2	-177.3	-73.8	-58	0	0	0	112.7	D441 V453 R465	D441-D443 PolarHBondContact O-N 3.09Å; D441-D443 VanDerWaalsContact O-N 3.15Å; D441-D443 PolarHBondContact OD1-N 2.87Å; D443-V453 HydrophobicContact CB-CG1 4.41Å; D443-R465 PolarHBondContact O-NH1 3.15Å; D443-R465 IonicContact OD1-CZ 3.95Å; D443-R465 IonicContact OD1-NH1 2.75Å; D443-R465 PolarHBondContact OD1-NH1 3.04Å
444	G	80.3	Confident	82.8	Confident	3 Å²	3	41.4 Å²	41.4	3%	0.031	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.4	-174.3	0	0	0	0	0	113.9	A438 D441 V452	A438-G444 PolarHBondContact N-O 3.25Å; D441-G444 PolarHBondContact O-N 2.83Å; D441-G444 PolarHBondContact OD1-N 3.47Å; G444-V452 WeakPolarHBondContact CA-O 3.46Å
445	L	88.9	Confident	82.6	Confident	53 Å²	53	40.6 Å²	40.6	28%	0.277	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	170.4	165.2	-61.4	175.1	0	0	0	109.3	P432 E437 V452	P432-L445 HydrophobicContact CB-CB 3.69Å; P432-L445 HydrophobicContact CB-CD1 3.53Å; P432-L445 HydrophobicContact CB-CG 4.26Å; P432-L445 HydrophobicContact CG-CB 4.21Å; P432-L445 HydrophobicContact CG-CD1 4.01Å; E437-L445 HydrophobicContact CG-CD2 4.25Å; L445-V452 PolarHBondContact N-O 2.68Å; L445-V452 PolarHBondContact O-N 3.4Å
446	Y	91.5	Very high	82.1	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.008	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125	176	-149.1	-101.7	0	0	0	110.7	H207 F308 V433 T436 G449 W450 H471	H207-Y446 AromaticContact CD2-CD1 3.99Å; H207-Y446 AromaticContact CD2-CE1 3.34Å; H207-Y446 WeakPolarHBondContact CD2-CE1 3.07Å; H207-Y446 AromaticContact CD2-CZ 3.62Å; H207-Y446 AromaticContact NE2-CE1 3.93Å; H207-Y446 AromaticContact NE2-CZ 3.89Å; F308-Y446 AromaticContact CE2-CD1 3.72Å; F308-Y446 HydrophobicContact CE2-CD1 3.72Å; F308-Y446 HydrophobicContact CE2-CD2 4.07Å; F308-Y446 HydrophobicContact CE2-CE1 4.45Å; F308-Y446 AromaticContact CE2-CG 3.5Å; F308-Y446 HydrophobicContact CE2-CG 3.5Å; F308-Y446 HydrophobicContact CZ-CD1 4.41Å; F308-Y446 AromaticContact CZ-CD2 3.97Å; F308-Y446 HydrophobicContact CZ-CD2 3.97Å; F308-Y446 AromaticContact CZ-CG 3.89Å; F308-Y446 HydrophobicContact CZ-CG 3.89Å; V433-Y446 PolarHBondContact N-O 3.48Å; T436-Y446 PolarHBondContact O-N 3.39Å; T436-Y446 PolarHBondContact OG1-N 2.88Å; T436-Y446 PolarHBondContact OG1-O 3.01Å; Y446-G449 WeakPolarHBondContact OH-CA 3.34Å; Y446-W450 CarbonylContact C-O 3.6Å; Y446-W450 WeakPolarHBondContact CA-O 3.29Å; Y446-W450 WeakPolarHBondContact CD2-O 3.46Å; Y446-H471 PolarHBondContact OH-CD2 3.4Å; Y446-H471 PolarHBondContact OH-NE2 3.08Å
447	G	94.3	Very high	80.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.217	C	C	.	.			trans	-85.4	-147.4	166.7	0	0	0	0	0	110.9	T431 G449 W450	T431-G447 WeakPolarHBondContact O-CA 3.37Å; G447-G449 PolarHBondContact O-N 2.89Å; G447-W450 PolarHBondContact N-O 3.2Å
448	Q	95.6	Very high	79.6	Confident	14 Å²	14	44 Å²	44	7%	0.065	22%	0.219	C	C	.	.	S	Bend	trans	-90.3	98.5	174.1	-61	-178.2	52.8	0	0	109	T162 L205 E428 L429 W450	T162-Q448 HydrophobicContact CG2-CB 3.86Å; T162-Q448 VanDerWaalsContact CG2-O 3.26Å; T162-Q448 WeakPolarHBondContact CG2-O 3.36Å; L205-Q448 HydrophobicContact CB-CB 4.13Å; L205-Q448 HydrophobicContact CB-CG 4.25Å; L205-Q448 CarbonylContact O-C 3.58Å; L205-Q448 WeakPolarHBondContact O-CA 3.25Å; E428-Q448 PolarHBondContact O-NE2 2.82Å; E428-Q448 VanDerWaalsContact O-NE2 3.08Å; L429-Q448 HydrophobicContact CD2-CB 3.92Å; L429-Q448 PolarHBondContact O-N 3.44Å; Q448-W450 VanDerWaalsContact C-N 3.27Å; Q448-W450 PolarHBondContact O-N 3.46Å
449	G	95	Very high	78.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	67.3	22.1	-178.4	0	0	0	0	0	114.9	S159 L205 Y446 G447 H471	S159-G449 PolarHBondContact OG-O 2.87Å; L205-G449 PolarHBondContact O-N 3.3Å; Y446-G449 WeakPolarHBondContact OH-CA 3.34Å; G447-G449 PolarHBondContact O-N 2.89Å; G449-H471 PolarHBondContact O-CD2 3.45Å
450	W	96.6	Very high	77.9	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	-140.2	138.7	179.1	-70.5	94.4	0	0	0	110.9	F397 L401 W430 Y446 G447 Q448 V452 V469 H471 L482	F397-W450 HydrophobicContact CE1-CH2 4.17Å; F397-W450 AromaticContact CE1-CZ2 3.72Å; F397-W450 HydrophobicContact CE1-CZ2 3.72Å; F397-W450 HydrophobicContact CZ-CZ2 4.2Å; L401-W450 HydrophobicContact CD1-CH2 4.23Å; L401-W450 HydrophobicContact CD1-CZ2 3.38Å; W430-W450 AromaticContact CD1-CD1 3.71Å; W430-W450 AromaticContact CD1-CG 3.79Å; W430-W450 AromaticContact NE1-CD1 3.78Å; W430-W450 AromaticContact NE1-CD2 3.73Å; W430-W450 AromaticContact NE1-CE2 3.66Å; W430-W450 AromaticContact NE1-CG 3.87Å; W430-W450 AromaticContact NE1-NE1 3.69Å; Y446-W450 CarbonylContact C-O 3.6Å; Y446-W450 WeakPolarHBondContact CA-O 3.29Å; Y446-W450 WeakPolarHBondContact CD2-O 3.46Å; G447-W450 PolarHBondContact N-O 3.2Å; Q448-W450 VanDerWaalsContact C-N 3.27Å; Q448-W450 PolarHBondContact O-N 3.46Å; W450-V452 HydrophobicContact CB-CG2 4.34Å; W450-V469 HydrophobicContact CE3-CB 4.08Å; W450-V469 HydrophobicContact CE3-CG2 3.96Å; W450-V469 HydrophobicContact CZ3-CG2 4.19Å; W450-H471 HydrophobicContact CE3-CB 4.46Å; W450-L482 HydrophobicContact CH2-CD2 3.74Å; W450-L482 HydrophobicContact CH2-CG 4.19Å; W450-L482 HydrophobicContact CZ3-CD2 4.4Å; W450-L482 HydrophobicContact CZ3-CG 4.41Å
451	L	94.4	Very high	77.4	Confident	9 Å²	9	59.2 Å²	59.2	5%	0.047	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	132.5	158.4	-173.8	76	0	0	0	107.7	A438 D441 V469 S470	A438-L451 HydrophobicContact CB-CD1 3.64Å; D441-L451 HydrophobicContact CB-CD1 4.32Å; D441-L451 HydrophobicContact CB-CD2 4.21Å; L451-V469 CarbonylContact O-C 3.45Å; L451-V469 VanDerWaalsContact O-CA 3.24Å; L451-V469 WeakPolarHBondContact O-CA 3.47Å; L451-S470 WeakPolarHBondContact CA-O 3.3Å; L451-S470 VanDerWaalsContact CB-O 3.26Å; L451-S470 WeakPolarHBondContact CB-O 3.49Å; L451-S470 PolarHBondContact N-O 2.84Å; L451-S470 PolarHBondContact O-N 3.23Å
452	V	93.4	Very high	76.8	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.006	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	122.1	-178.3	-176.7	0	0	0	0	108.6	W430 P432 G444 L445 W450 E454 V469	W430-V452 WeakPolarHBondContact O-CG1 3.42Å; W430-V452 WeakPolarHBondContact O-CG2 3.48Å; P432-V452 HydrophobicContact CG-CB 4.1Å; P432-V452 HydrophobicContact CG-CG1 3.78Å; G444-V452 WeakPolarHBondContact CA-O 3.46Å; L445-V452 PolarHBondContact N-O 2.68Å; L445-V452 PolarHBondContact O-N 3.4Å; W450-V452 HydrophobicContact CB-CG2 4.34Å; V452-E454 HydrophobicContact CG1-CG 4.44Å; V452-V469 HydrophobicContact CB-CG1 4.42Å; V452-V469 HydrophobicContact CG1-CG1 4.2Å; V452-V469 HydrophobicContact CG2-CG1 4.04Å
453	V	89.8	Confident	76.2	Confident	2 Å²	2	69 Å²	69	1%	0.012	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.4	168.4	178.3	0	0	0	0	107.7	D443 R465 H467 Y468	D443-V453 HydrophobicContact CB-CG1 4.41Å; V453-R465 HydrophobicContact CG1-CG 3.8Å; V453-H467 VanDerWaalsContact O-CA 3.25Å; V453-H467 WeakPolarHBondContact O-CA 3.37Å; V453-H467 PolarHBondContact O-ND1 3.11Å; V453-Y468 HydrophobicContact CB-CD1 3.8Å; V453-Y468 HydrophobicContact CB-CE1 3.51Å; V453-Y468 HydrophobicContact CB-CG 4.42Å; V453-Y468 HydrophobicContact CG1-CD1 4.19Å; V453-Y468 HydrophobicContact CG1-CE1 3.8Å; V453-Y468 HydrophobicContact CG2-CD1 4.26Å; V453-Y468 HydrophobicContact CG2-CE1 3.54Å; V453-Y468 HydrophobicContact CG2-CE2 4.06Å; V453-Y468 VanDerWaalsContact CG2-CZ 3.43Å; V453-Y468 WeakPolarHBondContact CG2-OH 3.39Å; V453-Y468 PolarHBondContact N-O 3.5Å; V453-Y468 PolarHBondContact O-N 3.47Å
454	E	85.9	Confident	75.9	Confident	93 Å²	93	72.7 Å²	72.7	44%	0.435	36%	0.36	S	S	.	.			trans	-82.8	151.4	178	-67.5	-174.5	113.4	0	0	111.8	P432 V452 L456 R465	P432-E454 HydrophobicContact CG-CG 3.81Å; V452-E454 HydrophobicContact CG1-CG 4.44Å; E454-L456 PolarHBondContact O-N 2.97Å; E454-R465 VanDerWaalsContact O-CZ 3.27Å; E454-R465 PolarHBondContact O-NE 3.33Å; E454-R465 PolarHBondContact O-NH2 3.32Å
455	K	80.6	Confident	75.7	Confident	120 Å²	120	75.1 Å²	75.1	52%	0.522	37%	0.368	S	S	.	.			trans	-58.9	126.2	173.5	-173.7	175.5	-178.7	173.5	0	109.7	R465 H467	K455-R465 WeakPolarHBondContact CA-O 3.43Å; K455-H467 HydrophobicContact CB-CB 4.32Å
456	L	73.1	Confident	75.4	Confident	68 Å²	68	74.4 Å²	74.4	36%	0.356	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	129.2	174.7	-169.3	79.8	0	0	0	109.4	E454 K458 R465	E454-L456 PolarHBondContact O-N 2.97Å; L456-K458 HydrophobicContact CD2-CD 4.32Å; L456-K458 HydrophobicContact CD2-CG 4Å; L456-K458 HydrophobicContact CG-CG 4.33Å; L456-R465 HydrophobicContact CB-CB 3.97Å; L456-R465 PolarHBondContact N-O 3.21Å; L456-R465 PolarHBondContact O-N 3.12Å
457	Q	55.6	Low	75.4	Confident	108 Å²	108	75.8 Å²	75.8	51%	0.505	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	104.6	172.8	-173.1	165.9	-7.9	0	0	108	Y459	Q457-Y459 HydrophobicContact CG-CE2 4.3Å; Q457-Y459 PolarHBondContact NE2-OH 3.11Å
458	K	51.3	Low	75.4	Confident	132 Å²	132	76.7 Å²	76.7	57%	0.574	37%	0.372	S	S	*	.			trans	-91.1	123.4	169.7	-70.9	-170.2	179.6	-175.4	0	108.5	L456	L456-K458 HydrophobicContact CD2-CD 4.32Å; L456-K458 HydrophobicContact CD2-CG 4Å; L456-K458 HydrophobicContact CG-CG 4.33Å
459	Y	44.4	Very low	75.5	Confident	206 Å²	206	76 Å²	76	81%	0.808	37%	0.369	S	S	*	.	S	Bend	trans	-79.1	139.1	169.5	-75.4	-86.3	0	0	0	109.7	Q457	Q457-Y459 HydrophobicContact CG-CE2 4.3Å; Q457-Y459 PolarHBondContact NE2-OH 3.11Å
460	G	53.3	Low	75.6	Confident	87 Å²	87	76 Å²	76	90%	0.897	37%	0.369	S	S	*	.	S	Bend	trans	96.2	-13.5	177	0	0	0	0	0	116.2
461	Q	51.8	Low	75.6	Confident	141 Å²	141	76.4 Å²	76.4	66%	0.659	37%	0.37	S	S	*	.	S	Bend	trans	-137	125.4	165.9	-68.2	-175.7	-11.6	0	0	107.7	R463	Q461-R463 PolarHBondContact O-N 2.94Å
462	C	54.7	Low	75.7	Confident	146 Å²	146	77.7 Å²	77.7	99%	0.986	38%	0.379	S	S	*	.			trans	-64.3	39	-169.5	-55.2	0	0	0	0	116.3
463	R	56.7	Low	75.7	Confident	198 Å²	198	78 Å²	78	75%	0.747	38%	0.382	S	S	*	.			trans	-96.9	101.7	173.2	-79.1	-171.3	174.7	-172.5	0.9	110.1	Q461	Q461-R463 PolarHBondContact O-N 2.94Å
464	K	66.4	Low	75.9	Confident	144 Å²	144	78.9 Å²	78.9	63%	0.626	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	117.1	163.2	-170.6	-179	179.6	-169.4	0	108	D488	K464-D488 IonicContact NZ-OD2 3.63Å
465	R	76.1	Confident	76.2	Confident	54 Å²	54	74.9 Å²	74.9	20%	0.204	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	125.8	176.1	-168.1	173.5	74.3	180	10	109.2	D443 V453 E454 K455 L456	D443-R465 PolarHBondContact O-NH1 3.15Å; D443-R465 IonicContact OD1-CZ 3.95Å; D443-R465 IonicContact OD1-NH1 2.75Å; D443-R465 PolarHBondContact OD1-NH1 3.04Å; V453-R465 HydrophobicContact CG1-CG 3.8Å; E454-R465 VanDerWaalsContact O-CZ 3.27Å; E454-R465 PolarHBondContact O-NE 3.33Å; E454-R465 PolarHBondContact O-NH2 3.32Å; K455-R465 WeakPolarHBondContact CA-O 3.43Å; L456-R465 HydrophobicContact CB-CB 3.97Å; L456-R465 PolarHBondContact N-O 3.21Å; L456-R465 PolarHBondContact O-N 3.12Å
466	R	83.9	Confident	76.9	Confident	38 Å²	38	69.3 Å²	69.3	14%	0.143	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-88.2	150.4	176.7	-70.5	-166.9	64.8	177	-5.9	111.1	L485 P486 D488 E529	R466-L485 HydrophobicContact CB-CD1 4.31Å; R466-P486 PolarHBondContact NH2-O 2.95Å; R466-D488 IonicContact CZ-OD1 3.67Å; R466-D488 VanDerWaalsContact CZ-OD1 3.29Å; R466-D488 IonicContact CZ-OD2 3.33Å; R466-D488 IonicContact NE-OD1 3.1Å; R466-D488 PolarHBondContact NE-OD1 3.33Å; R466-D488 IonicContact NE-OD2 3.99Å; R466-D488 PolarHBondContact NE-OD2 3.01Å; R466-D488 IonicContact NH2-OD1 2.75Å; R466-D488 PolarHBondContact NH2-OD1 3.15Å; R466-E529 IonicContact CZ-OE1 3.7Å; R466-E529 VanDerWaalsContact CZ-OE1 3.31Å; R466-E529 VanDerWaalsContact NH1-CD 3.34Å; R466-E529 VanDerWaalsContact NH1-CG 3.25Å; R466-E529 IonicContact NH1-OE1 2.83Å; R466-E529 PolarHBondContact NH1-OE1 3.43Å; R466-E529 IonicContact NH2-OE1 3.88Å; R466-E529 PolarHBondContact NH2-OE1 3.19Å
467	H	91	Very high	77.9	Confident	31 Å²	31	66 Å²	66	14%	0.144	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-73.2	129.4	170.9	173.8	61	0	0	0	109.8	Y405 V453 K455	Y405-H467 AromaticContact CZ-NE2 3.87Å; Y405-H467 PolarHBondContact OH-NE2 3.22Å; V453-H467 VanDerWaalsContact O-CA 3.25Å; V453-H467 WeakPolarHBondContact O-CA 3.37Å; V453-H467 PolarHBondContact O-ND1 3.11Å; K455-H467 HydrophobicContact CB-CB 4.32Å
468	Y	94.6	Very high	79.8	Confident	19 Å²	19	60.9 Å²	60.9	8%	0.075	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	159.3	169.8	73.5	-90	0	0	0	109.3	V453 L483 V484 L522	V453-Y468 HydrophobicContact CB-CD1 3.8Å; V453-Y468 HydrophobicContact CB-CE1 3.51Å; V453-Y468 HydrophobicContact CB-CG 4.42Å; V453-Y468 HydrophobicContact CG1-CD1 4.19Å; V453-Y468 HydrophobicContact CG1-CE1 3.8Å; V453-Y468 HydrophobicContact CG2-CD1 4.26Å; V453-Y468 HydrophobicContact CG2-CE1 3.54Å; V453-Y468 HydrophobicContact CG2-CE2 4.06Å; V453-Y468 VanDerWaalsContact CG2-CZ 3.43Å; V453-Y468 WeakPolarHBondContact CG2-OH 3.39Å; V453-Y468 PolarHBondContact N-O 3.5Å; V453-Y468 PolarHBondContact O-N 3.47Å; Y468-L483 HydrophobicContact CD2-CD1 3.85Å; Y468-L483 HydrophobicContact CD2-CG 4.09Å; Y468-L483 HydrophobicContact CE2-CD1 3.97Å; Y468-V484 WeakPolarHBondContact CA-O 3.17Å; Y468-V484 WeakPolarHBondContact CB-O 3.31Å; Y468-L522 HydrophobicContact CD1-CD1 4.02Å; Y468-L522 HydrophobicContact CE1-CD1 4.13Å; Y468-L522 HydrophobicContact CE1-CD2 3.93Å; Y468-L522 HydrophobicContact CG-CD1 4.24Å
469	V	96.8	Very high	82.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	148.5	171.2	-59.7	0	0	0	0	109.8	W430 W450 L451 V452 L483 V484	W430-V469 HydrophobicContact CB-CG1 3.99Å; W430-V469 HydrophobicContact CD2-CB 4.44Å; W430-V469 HydrophobicContact CD2-CG1 3.9Å; W430-V469 HydrophobicContact CD2-CG2 3.85Å; W430-V469 HydrophobicContact CE3-CG1 4.27Å; W430-V469 HydrophobicContact CE3-CG2 4.23Å; W430-V469 HydrophobicContact CG-CB 4.48Å; W430-V469 HydrophobicContact CG-CG1 3.75Å; W430-V469 HydrophobicContact CG-CG2 4.34Å; W430-V469 HydrophobicContact CH2-CG2 4.12Å; W430-V469 HydrophobicContact CZ2-CG2 3.71Å; W430-V469 HydrophobicContact CZ3-CG2 4.37Å; W450-V469 HydrophobicContact CE3-CB 4.08Å; W450-V469 HydrophobicContact CE3-CG2 3.96Å; W450-V469 HydrophobicContact CZ3-CG2 4.19Å; L451-V469 CarbonylContact O-C 3.45Å; L451-V469 VanDerWaalsContact O-CA 3.24Å; L451-V469 WeakPolarHBondContact O-CA 3.47Å; V452-V469 HydrophobicContact CB-CG1 4.42Å; V452-V469 HydrophobicContact CG1-CG1 4.2Å; V452-V469 HydrophobicContact CG2-CG1 4.04Å; V469-L483 WeakPolarHBondContact O-CA 3.45Å; V469-V484 HydrophobicContact CG2-CB 3.76Å; V469-V484 HydrophobicContact CG2-CG2 4.32Å; V469-V484 PolarHBondContact N-O 2.79Å; V469-V484 PolarHBondContact O-N 3Å
470	S	97.4	Very high	84.6	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	165.8	173.9	71.8	0	0	0	0	112.5	L451 L482 N518	L451-S470 WeakPolarHBondContact CA-O 3.3Å; L451-S470 VanDerWaalsContact CB-O 3.26Å; L451-S470 WeakPolarHBondContact CB-O 3.49Å; L451-S470 PolarHBondContact N-O 2.84Å; L451-S470 PolarHBondContact O-N 3.23Å; S470-L482 CarbonylContact C-O 3.5Å; S470-L482 WeakPolarHBondContact CA-O 3.31Å; S470-L482 VanDerWaalsContact CB-O 3.31Å; S470-L482 WeakPolarHBondContact CB-O 3.38Å; S470-N518 WeakPolarHBondContact CB-OD1 3.4Å; S470-N518 PolarHBondContact OG-OD1 3.48Å
471	H	97.3	Very high	86.8	Confident	7 Å²	7	40.9 Å²	40.9	3%	0.032	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	127.1	164.4	-159.9	-64.4	0	0	0	109.4	S155 S159 Y446 G449 W450 V481 L482	S155-H471 VanDerWaalsContact CB-CE1 3.42Å; S155-H471 WeakPolarHBondContact CB-CE1 3.42Å; S155-H471 PolarHBondContact O-CE1 2.52Å; S155-H471 VanDerWaalsContact O-CE1 3.24Å; S155-H471 PolarHBondContact O-ND1 3.37Å; S159-H471 WeakPolarHBondContact OG-CB 3.49Å; Y446-H471 PolarHBondContact OH-CD2 3.4Å; Y446-H471 PolarHBondContact OH-NE2 3.08Å; G449-H471 PolarHBondContact O-CD2 3.45Å; W450-H471 HydrophobicContact CE3-CB 4.46Å; H471-V481 WeakPolarHBondContact O-CA 3.09Å; H471-L482 PolarHBondContact N-O 2.9Å; H471-L482 PolarHBondContact O-N 3.37Å
472	T	95.8	Very high	89	Confident	36 Å²	36	34.1 Å²	34.1	22%	0.221	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	148.6	173.1	59.5	0	0	0	0	110.8	S480 V481 N518	T472-S480 CarbonylContact C-O 3.54Å; T472-S480 WeakPolarHBondContact CA-O 3.37Å; T472-V481 HydrophobicContact CG2-CB 4.35Å; T472-V481 HydrophobicContact CG2-CG2 4.07Å; T472-N518 HydrophobicContact CG2-CB 3.73Å
473	G	93.6	Very high	91.1	Very high	7 Å²	7	27.2 Å²	27.2	7%	0.072	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	140	174.6	0	0	0	0	0	112.2	S479 S480	G473-S479 CarbonylContact O-C 3.15Å; G473-S479 VanDerWaalsContact O-CA 3.28Å; G473-S479 WeakPolarHBondContact O-CA 3.43Å; G473-S480 WeakPolarHBondContact CA-OG 3.42Å; G473-S480 PolarHBondContact N-O 2.92Å; G473-S480 PolarHBondContact N-OG 3.37Å; G473-S480 PolarHBondContact O-N 3.42Å
474	G	93.5	Very high	93.1	Very high	21 Å²	21	17.8 Å²	17.8	22%	0.216	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	132.9	164	0	0	0	0	0	109	A154 Y279	A154-G474 VanDerWaalsContact CB-C 3.45Å; A154-G474 WeakPolarHBondContact CB-O 3.19Å; Y279-G474 VanDerWaalsContact OH-C 3.26Å; Y279-G474 PolarHBondContact OH-O 2.78Å
475	A	93.1	Very high	94.6	Very high	9 Å²	9	10.9 Å²	10.9	7%	0.074	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	168.3	173.2	0	0	0	0	0	109.4	R152 A154 F274 Y279 G477 A478	R152-A475 HydrophobicContact CB-CB 4.33Å; A154-A475 HydrophobicContact CB-CB 3.58Å; F274-A475 WeakPolarHBondContact CE1-O 3.42Å; Y279-A475 WeakPolarHBondContact OH-CA 3.49Å; Y279-A475 PolarHBondContact OH-N 3.36Å; A475-G477 PolarHBondContact O-N 3.42Å; A475-A478 HydrophobicContact CB-CB 4.49Å; A475-A478 PolarHBondContact N-O 3.47Å; A475-A478 PolarHBondContact O-N 3.25Å; A475-A478 VanDerWaalsContact O-N 3.08Å
476	V	93.9	Very high	95.5	Very high	3 Å²	3	8.8 Å²	8.8	2%	0.018	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	116.7	173.4	174.9	0	0	0	0	108.5	R152 Y279 Y280 C373 V376 A478	R152-V476 PolarHBondContact NH1-O 2.58Å; Y279-V476 HydrophobicContact CD1-CG2 3.28Å; Y279-V476 HydrophobicContact CE1-CB 4.38Å; Y279-V476 HydrophobicContact CE1-CG2 3.37Å; Y280-V476 HydrophobicContact CD1-CG2 4.09Å; Y280-V476 HydrophobicContact CE1-CG1 4.29Å; Y280-V476 HydrophobicContact CE1-CG2 3.91Å; C373-V476 HydrophobicContact CB-CG1 3.58Å; V376-V476 HydrophobicContact CG1-CB 4.29Å; V376-V476 HydrophobicContact CG1-CG1 4.19Å; V376-V476 HydrophobicContact CG1-CG2 3.92Å; V376-V476 HydrophobicContact CG2-CB 4Å; V376-V476 HydrophobicContact CG2-CG1 4.38Å; V376-V476 HydrophobicContact CG2-CG2 4.2Å; V476-A478 VanDerWaalsContact C-N 3.28Å; V476-A478 PolarHBondContact O-N 2.99Å
477	G	94.3	Very high	95.8	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	61	24.6	-178.3	0	0	0	0	0	116.8	F361 Y362 C373 A475 N511 M512	F361-G477 WeakPolarHBondContact CB-O 3.42Å; F361-G477 WeakPolarHBondContact CD1-O 3.45Å; Y362-G477 VanDerWaalsContact O-CA 3.24Å; Y362-G477 WeakPolarHBondContact O-CA 3.36Å; C373-G477 WeakPolarHBondContact SG-CA 3.38Å; C373-G477 PolarHBondContact SG-N 2.92Å; C373-G477 VanDerWaalsContact SG-N 3.38Å; A475-G477 PolarHBondContact O-N 3.42Å; G477-N511 CarbonylContact O-C 3.57Å; G477-N511 WeakPolarHBondContact O-CA 3.46Å; G477-M512 PolarHBondContact O-N 3.01Å
478	A	96.6	Very high	95.1	Very high	0 Å²	0	9 Å²	9	0%	0	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	152.3	172.7	0	0	0	0	0	112.9	R152 F361 A475 V476 T510 M512	R152-A478 HydrophobicContact CB-CB 3.54Å; F361-A478 HydrophobicContact CD1-CB 4.17Å; F361-A478 HydrophobicContact CE1-CB 4.39Å; A475-A478 HydrophobicContact CB-CB 4.49Å; A475-A478 PolarHBondContact N-O 3.47Å; A475-A478 PolarHBondContact O-N 3.25Å; A475-A478 VanDerWaalsContact O-N 3.08Å; V476-A478 VanDerWaalsContact C-N 3.28Å; V476-A478 PolarHBondContact O-N 2.99Å; A478-T510 VanDerWaalsContact CA-O 3.24Å; A478-T510 WeakPolarHBondContact CA-O 3.43Å; A478-M512 CarbonylContact C-O 3.47Å; A478-M512 VanDerWaalsContact C-O 3.25Å
479	S	98.1	Very high	93.9	Very high	2 Å²	2	16 Å²	16	1%	0.014	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	148.7	171.3	-48.9	0	0	0	0	109.4	G473 T510 M512 S514 V515	G473-S479 CarbonylContact O-C 3.15Å; G473-S479 VanDerWaalsContact O-CA 3.28Å; G473-S479 WeakPolarHBondContact O-CA 3.43Å; S479-T510 PolarHBondContact N-O 3.33Å; S479-T510 PolarHBondContact O-N 3.35Å; S479-M512 PolarHBondContact N-O 3.35Å; S479-M512 VanDerWaalsContact N-O 3.15Å; S479-M512 PolarHBondContact OG-O 3.25Å; S479-S514 PolarHBondContact OG-N 3.33Å; S479-V515 PolarHBondContact OG-N 3.3Å
480	S	98.4	Very high	92.3	Very high	2 Å²	2	18.2 Å²	18.2	1%	0.014	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	161	-175.5	63.7	0	0	0	0	112.1	I153 I156 T472 G473 I508	I153-S480 PolarHBondContact O-OG 2.76Å; I156-S480 VanDerWaalsContact CD1-OG 3.3Å; I156-S480 WeakPolarHBondContact CD1-OG 3.37Å; T472-S480 CarbonylContact C-O 3.54Å; T472-S480 WeakPolarHBondContact CA-O 3.37Å; G473-S480 WeakPolarHBondContact CA-OG 3.42Å; G473-S480 PolarHBondContact N-O 2.92Å; G473-S480 PolarHBondContact N-OG 3.37Å; G473-S480 PolarHBondContact O-N 3.42Å; S480-I508 CarbonylContact C-O 3.54Å; S480-I508 VanDerWaalsContact CA-O 3.27Å; S480-I508 WeakPolarHBondContact CA-O 3.39Å
481	V	98.7	Very high	90.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	142.4	164.9	61.3	0	0	0	0	109.8	H471 T472 L483 T507 I508 L517 A521	H471-V481 WeakPolarHBondContact O-CA 3.09Å; T472-V481 HydrophobicContact CG2-CB 4.35Å; T472-V481 HydrophobicContact CG2-CG2 4.07Å; V481-L483 HydrophobicContact CG2-CB 4.48Å; V481-T507 WeakPolarHBondContact O-CA 3.38Å; V481-T507 WeakPolarHBondContact O-CB 2.96Å; V481-T507 PolarHBondContact O-OG1 2.84Å; V481-I508 HydrophobicContact CG1-CB 3.93Å; V481-I508 HydrophobicContact CG1-CD1 4.2Å; V481-I508 HydrophobicContact CG1-CG1 4.22Å; V481-I508 PolarHBondContact N-O 3.3Å; V481-I508 PolarHBondContact O-N 3.22Å; V481-I508 VanDerWaalsContact O-N 3.09Å; V481-L517 HydrophobicContact CB-CB 3.98Å; V481-L517 HydrophobicContact CG1-CB 3.51Å; V481-L517 HydrophobicContact CG1-CD1 4.41Å; V481-A521 HydrophobicContact CG1-CB 3.7Å; V481-A521 HydrophobicContact CG2-CB 4.2Å
482	L	98.8	Very high	88.4	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.1	161.6	174	60.8	0	0	0	107.3	I156 L394 F397 W450 S470 H471 V505	I156-L482 HydrophobicContact CD1-CB 3.95Å; I156-L482 HydrophobicContact CG1-CB 4.38Å; I156-L482 HydrophobicContact CG2-CB 4.34Å; I156-L482 HydrophobicContact CG2-CD2 4.26Å; L394-L482 HydrophobicContact CB-CD1 4.44Å; F397-L482 HydrophobicContact CD1-CD2 3.68Å; F397-L482 HydrophobicContact CE1-CD2 4.16Å; W450-L482 HydrophobicContact CH2-CD2 3.74Å; W450-L482 HydrophobicContact CH2-CG 4.19Å; W450-L482 HydrophobicContact CZ3-CD2 4.4Å; W450-L482 HydrophobicContact CZ3-CG 4.41Å; S470-L482 CarbonylContact C-O 3.5Å; S470-L482 WeakPolarHBondContact CA-O 3.31Å; S470-L482 VanDerWaalsContact CB-O 3.31Å; S470-L482 WeakPolarHBondContact CB-O 3.38Å; H471-L482 PolarHBondContact N-O 2.9Å; H471-L482 PolarHBondContact O-N 3.37Å; L482-V505 HydrophobicContact CD1-CG1 3.79Å
483	L	98.6	Very high	86.2	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	135.2	-179	-177.3	148.7	0	0	0	109.2	Y468 V469 V481 L485 V505 V506 A521 L522 A525	Y468-L483 HydrophobicContact CD2-CD1 3.85Å; Y468-L483 HydrophobicContact CD2-CG 4.09Å; Y468-L483 HydrophobicContact CE2-CD1 3.97Å; V469-L483 WeakPolarHBondContact O-CA 3.45Å; V481-L483 HydrophobicContact CG2-CB 4.48Å; L483-L485 HydrophobicContact CD2-CB 4.12Å; L483-V505 CarbonylContact O-C 3.59Å; L483-V505 WeakPolarHBondContact O-CA 3.47Å; L483-V506 PolarHBondContact N-O 3.06Å; L483-V506 PolarHBondContact O-N 3.15Å; L483-A521 HydrophobicContact CB-CB 4.13Å; L483-A521 HydrophobicContact CD1-CB 4.21Å; L483-L522 HydrophobicContact CD1-CB 3.9Å; L483-L522 HydrophobicContact CD1-CD1 4.25Å; L483-A525 HydrophobicContact CD2-CB 3.84Å
484	V	98.6	Very high	83.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	121.9	174.3	-177.2	0	0	0	0	108	L402 W430 Y468 V469 P486 V505	L402-V484 HydrophobicContact CB-CG1 3.97Å; L402-V484 HydrophobicContact CD1-CG1 3.92Å; L402-V484 HydrophobicContact CD2-CG1 4Å; L402-V484 HydrophobicContact CG-CG1 4.18Å; W430-V484 HydrophobicContact CH2-CB 4.32Å; W430-V484 HydrophobicContact CH2-CG1 3.83Å; W430-V484 HydrophobicContact CZ2-CG1 4.48Å; W430-V484 HydrophobicContact CZ2-CG2 4.48Å; Y468-V484 WeakPolarHBondContact CA-O 3.17Å; Y468-V484 WeakPolarHBondContact CB-O 3.31Å; V469-V484 HydrophobicContact CG2-CB 3.76Å; V469-V484 HydrophobicContact CG2-CG2 4.32Å; V469-V484 PolarHBondContact N-O 2.79Å; V469-V484 PolarHBondContact O-N 3Å; V484-P486 WeakPolarHBondContact O-CD 3.26Å; V484-V505 HydrophobicContact CG1-CG2 4.16Å; V484-V505 HydrophobicContact CG2-CG1 4.22Å; V484-V505 HydrophobicContact CG2-CG2 4.19Å
485	L	97.2	Very high	81.5	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	95.3	175.7	179.2	67.6	0	0	0	108.3	R466 L483 G503 V504 A525 E529	R466-L485 HydrophobicContact CB-CD1 4.31Å; L483-L485 HydrophobicContact CD2-CB 4.12Å; L485-G503 CarbonylContact O-C 3.48Å; L485-G503 WeakPolarHBondContact O-CA 3.24Å; L485-V504 HydrophobicContact CB-CB 4.47Å; L485-V504 PolarHBondContact N-O 2.93Å; L485-V504 PolarHBondContact O-N 3.36Å; L485-A525 HydrophobicContact CB-CB 4.2Å; L485-A525 HydrophobicContact CD2-CB 3.84Å; L485-E529 HydrophobicContact CD2-CB 4.38Å
486	P	95.5	Very high	79.7	Confident	10 Å²	10	56.2 Å²	56.2	7%	0.065	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	145.4	172.4	-22.3	33.4	0	0	0	111.6	L402 Y405 W430 R466 V484	L402-P486 HydrophobicContact CD1-CB 3.87Å; L402-P486 HydrophobicContact CD1-CG 3.79Å; Y405-P486 HydrophobicContact CE1-CG 4.37Å; W430-P486 HydrophobicContact CZ3-CG 4.43Å; R466-P486 PolarHBondContact NH2-O 2.95Å; V484-P486 WeakPolarHBondContact O-CD 3.26Å
487	S	90.7	Very high	78.1	Confident	18 Å²	18	61 Å²	61	13%	0.126	31%	0.308	C	S	.	.			trans	-61.3	144.5	174.7	-165.3	0	0	0	0	111.6	E489 Q502 R532	S487-E489 VanDerWaalsContact C-N 3.34Å; S487-E489 PolarHBondContact OG-O 3.38Å; S487-Q502 PolarHBondContact N-O 3.48Å; S487-R532 PolarHBondContact OG-NH1 3.43Å; S487-R532 VanDerWaalsContact OG-NH1 3.15Å
488	D	75.4	Confident	77	Confident	56 Å²	56	63.5 Å²	63.5	30%	0.299	32%	0.321	S	S	.	.	S	Bend	trans	-70.1	-32.5	-177.4	-99	0.3	0	0	0	111.8	K464 R466	K464-D488 IonicContact NZ-OD2 3.63Å; R466-D488 IonicContact CZ-OD1 3.67Å; R466-D488 VanDerWaalsContact CZ-OD1 3.29Å; R466-D488 IonicContact CZ-OD2 3.33Å; R466-D488 IonicContact NE-OD1 3.1Å; R466-D488 PolarHBondContact NE-OD1 3.33Å; R466-D488 IonicContact NE-OD2 3.99Å; R466-D488 PolarHBondContact NE-OD2 3.01Å; R466-D488 IonicContact NH2-OD1 2.75Å; R466-D488 PolarHBondContact NH2-OD1 3.15Å
489	E	70.4	Confident	76.2	Confident	166 Å²	166	71.3 Å²	71.3	78%	0.776	35%	0.351	S	S	*	.	S	Bend	trans	-132.7	121.2	177.6	-68.4	179.5	-173.7	0	0	107.4	S487 D491	S487-E489 VanDerWaalsContact C-N 3.34Å; S487-E489 PolarHBondContact OG-O 3.38Å; E489-D491 PolarHBondContact O-N 3.34Å
490	M	63.4	Low	75.9	Confident	45 Å²	45	72.6 Å²	72.6	22%	0.222	36%	0.358	C	S	.	.			trans	-67.2	124.3	169.8	-65	-176.6	70.1	0	0	107.3	Q406 L410 Q492 L500	Q406-M490 HydrophobicContact CB-CE 4.25Å; L410-M490 HydrophobicContact CD2-CE 3.79Å; L410-M490 HydrophobicContact CD2-SD 4.23Å; L410-M490 HydrophobicContact CG-CE 4.4Å; M490-Q492 PolarHBondContact O-N 3.39Å; M490-L500 HydrophobicContact CE-CD2 3.5Å; M490-L500 VanDerWaalsContact CE-CD2 3.5Å
491	D	60	Low	75.7	Confident	73 Å²	73	73.1 Å²	73.1	39%	0.39	36%	0.361	S	S	.	.			trans	-69.3	85	-175.5	-137.9	-6.6	0	0	0	108.3	E489 R493	E489-D491 PolarHBondContact O-N 3.34Å; D491-R493 PolarHBondContact O-N 3.08Å; D491-R493 WeakPolarHBondContact OD1-CG 3.45Å; D491-R493 IonicContact OD1-CZ 2.65Å; D491-R493 IonicContact OD1-NE 2.87Å; D491-R493 PolarHBondContact OD1-NE 3.24Å; D491-R493 IonicContact OD1-NH2 2.61Å; D491-R493 IonicContact OD2-NE 3.24Å; D491-R493 IonicContact OD2-NH2 3.43Å
492	Q	52.6	Low	75.5	Confident	147 Å²	147	73.5 Å²	73.5	69%	0.687	36%	0.363	S	S	*	.			trans	-89.7	38.4	177.4	-66.6	-173.4	3	0	0	110.7	M490 Q494	M490-Q492 PolarHBondContact O-N 3.39Å; Q492-Q494 PolarHBondContact O-N 3.39Å
493	R	48.6	Very low	75.3	Confident	163 Å²	163	73.5 Å²	73.5	62%	0.615	36%	0.363	S	S	*	.			trans	-59	109.6	179.3	-67.1	-172	-156.6	-165.7	7.1	108.8	D491 G495 R496	D491-R493 PolarHBondContact O-N 3.08Å; D491-R493 WeakPolarHBondContact OD1-CG 3.45Å; D491-R493 IonicContact OD1-CZ 2.65Å; D491-R493 IonicContact OD1-NE 2.87Å; D491-R493 PolarHBondContact OD1-NE 3.24Å; D491-R493 IonicContact OD1-NH2 2.61Å; D491-R493 IonicContact OD2-NE 3.24Å; D491-R493 IonicContact OD2-NH2 3.43Å; R493-G495 PolarHBondContact O-N 2.98Å; R493-R496 PolarHBondContact O-N 3.25Å; R493-R496 VanDerWaalsContact O-N 3.14Å
494	Q	40.2	Very low	75.3	Confident	205 Å²	205	73.5 Å²	73.5	96%	0.958	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.2	112.2	-175.9	-71.1	172.9	-17.1	0	0	110.3	Q492	Q492-Q494 PolarHBondContact O-N 3.39Å
495	G	49.3	Very low	75.3	Confident	87 Å²	87	73.5 Å²	73.5	90%	0.897	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.4	-3.1	174.3	0	0	0	0	0	117.2	R493	R493-G495 PolarHBondContact O-N 2.98Å
496	R	55.3	Low	75.4	Confident	204 Å²	204	73.5 Å²	73.5	77%	0.77	36%	0.363	S	S	*	.	S	Bend	trans	-98.7	141.8	169.2	-78.2	-176.4	176.1	178.1	-0.7	111.6	R493 L498	R493-R496 PolarHBondContact O-N 3.25Å; R493-R496 VanDerWaalsContact O-N 3.14Å; R496-L498 PolarHBondContact O-N 2.84Å
497	T	60	Low	75.6	Confident	102 Å²	102	73 Å²	73	63%	0.626	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-48.7	128.1	168.3	-50.7	0	0	0	0	109.6	Y499	T497-Y499 WeakPolarHBondContact O-CD2 3.35Å; T497-Y499 WeakPolarHBondContact O-CE2 3.18Å; T497-Y499 PolarHBondContact O-N 3.08Å
498	L	71.5	Confident	75.9	Confident	54 Å²	54	72.2 Å²	72.2	28%	0.283	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-69	118.7	176.8	-175	70.7	0	0	0	109.1	L410 R496 L500	L410-L498 HydrophobicContact CD1-CD2 3.5Å; L410-L498 HydrophobicContact CD2-CD2 4Å; L410-L498 HydrophobicContact CG-CD2 4.42Å; R496-L498 PolarHBondContact O-N 2.84Å; L498-L500 HydrophobicContact CD2-CD1 4.41Å; L498-L500 HydrophobicContact CD2-CG 4.3Å; L498-L500 HydrophobicContact CG-CG 4.32Å
499	Y	79.6	Confident	77	Confident	163 Å²	163	69.5 Å²	69.5	64%	0.639	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-98.2	125.6	173.9	-62.4	-82	0	0	0	109	T497 Q502	T497-Y499 WeakPolarHBondContact O-CD2 3.35Å; T497-Y499 WeakPolarHBondContact O-CE2 3.18Å; T497-Y499 PolarHBondContact O-N 3.08Å; Y499-Q502 WeakPolarHBondContact O-CG 3.39Å; Y499-Q502 PolarHBondContact O-NE2 3.04Å
500	L	90.4	Very high	78.4	Confident	30 Å²	30	61.7 Å²	61.7	16%	0.157	30%	0.304	C	S	.	.	S	Bend	trans	-125.7	152.9	175.1	-69.4	-178.3	0	0	0	110	Y403 Q406 V407 L410 L416 M490 L498 Q502	Y403-L500 HydrophobicContact CD2-CB 3.57Å; Y403-L500 HydrophobicContact CD2-CD1 4.39Å; Y403-L500 HydrophobicContact CE2-CB 3.65Å; Y403-L500 HydrophobicContact CE2-CD1 4.13Å; Q406-L500 HydrophobicContact CB-CD2 4.01Å; V407-L500 HydrophobicContact CG2-CD1 3.71Å; L410-L500 HydrophobicContact CD1-CD1 3.9Å; L416-L500 HydrophobicContact CD1-CD1 4.09Å; M490-L500 HydrophobicContact CE-CD2 3.5Å; M490-L500 VanDerWaalsContact CE-CD2 3.5Å; L498-L500 HydrophobicContact CD2-CD1 4.41Å; L498-L500 HydrophobicContact CD2-CG 4.3Å; L498-L500 HydrophobicContact CG-CG 4.32Å; L500-Q502 HydrophobicContact CD2-CG 4.4Å
501	P	94.1	Very high	80	Confident	12 Å²	12	59.6 Å²	59.6	8%	0.078	29%	0.293	C	S	.	.			cis	-73.1	163.2	-6.4	29.4	-33.4	0	0	0	113.2	D125 N399 L402	D125-P501 CarbonylContact C-O 3.56Å; D125-P501 WeakPolarHBondContact CA-O 3.37Å; N399-P501 HydrophobicContact CB-CG 4.19Å; L402-P501 HydrophobicContact CB-CB 4.06Å; L402-P501 HydrophobicContact CD2-CB 3.85Å; L402-P501 HydrophobicContact CG-CB 3.7Å
502	Q	94.5	Very high	81.8	Confident	9 Å²	9	56.2 Å²	56.2	4%	0.042	28%	0.275	C	S	.	.			trans	-122.6	126.5	174.1	-62.8	-175.7	14.1	0	0	112.1	D125 Q406 S487 Y499 L500	D125-Q502 VanDerWaalsContact OD1-CA 3.23Å; D125-Q502 WeakPolarHBondContact OD1-CA 3.41Å; Q406-Q502 PolarHBondContact NE2-O 3.23Å; S487-Q502 PolarHBondContact N-O 3.48Å; Y499-Q502 WeakPolarHBondContact O-CG 3.39Å; Y499-Q502 PolarHBondContact O-NE2 3.04Å; L500-Q502 HydrophobicContact CD2-CG 4.4Å
503	G	95.9	Very high	83.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	135.8	-166.1	-177	0	0	0	0	0	111.9	V124 D125 L485	V124-G503 WeakPolarHBondContact CA-O 3.5Å; D125-G503 PolarHBondContact N-O 3.06Å; D125-G503 PolarHBondContact OD1-N 3Å; L485-G503 CarbonylContact O-C 3.48Å; L485-G503 WeakPolarHBondContact O-CA 3.24Å
504	V	98.2	Very high	85.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.6	-174.9	-169.8	0	0	0	0	110.6	V122 A123 V124 L485 V506 A525 F528 E529	V122-V504 HydrophobicContact CG1-CG1 3.76Å; A123-V504 CarbonylContact O-C 3.59Å; A123-V504 WeakPolarHBondContact O-CA 3.49Å; V124-V504 HydrophobicContact CG2-CG1 4.29Å; V124-V504 HydrophobicContact CG2-CG2 4.23Å; L485-V504 HydrophobicContact CB-CB 4.47Å; L485-V504 PolarHBondContact N-O 2.93Å; L485-V504 PolarHBondContact O-N 3.36Å; V504-V506 HydrophobicContact CG1-CG2 3.87Å; V504-A525 HydrophobicContact CB-CB 4.45Å; V504-A525 HydrophobicContact CG1-CB 4.26Å; V504-F528 HydrophobicContact CG1-CB 3.94Å; V504-F528 HydrophobicContact CG2-CB 4.31Å; V504-E529 HydrophobicContact CG2-CB 4.03Å
505	V	98.8	Very high	88.2	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	127.7	169.7	-176.2	0	0	0	0	108.2	V122 A123 L395 N399 L402 L482 L483 V484	V122-V505 CarbonylContact C-O 3.58Å; V122-V505 VanDerWaalsContact CA-O 3.31Å; V122-V505 WeakPolarHBondContact CA-O 3.48Å; A123-V505 HydrophobicContact CB-CB 4.36Å; A123-V505 PolarHBondContact N-O 3.4Å; A123-V505 PolarHBondContact O-N 2.63Å; L395-V505 HydrophobicContact CD2-CB 4.06Å; L395-V505 HydrophobicContact CD2-CG1 3.77Å; L395-V505 WeakPolarHBondContact CD2-O 3.42Å; N399-V505 WeakPolarHBondContact OD1-CG2 3.16Å; L402-V505 HydrophobicContact CD2-CG2 4.37Å; L482-V505 HydrophobicContact CD1-CG1 3.79Å; L483-V505 CarbonylContact O-C 3.59Å; L483-V505 WeakPolarHBondContact O-CA 3.47Å; V484-V505 HydrophobicContact CG1-CG2 4.16Å; V484-V505 HydrophobicContact CG2-CG1 4.22Å; V484-V505 HydrophobicContact CG2-CG2 4.19Å
506	V	98.9	Very high	90.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	132.9	178.9	-177.5	0	0	0	0	109.3	G121 V122 L483 V504 I508 A521 I524 A525	G121-V506 WeakPolarHBondContact O-CA 3.38Å; V122-V506 HydrophobicContact CG1-CG2 4.26Å; V122-V506 HydrophobicContact CG2-CG1 4.24Å; V122-V506 HydrophobicContact CG2-CG2 4.14Å; L483-V506 PolarHBondContact N-O 3.06Å; L483-V506 PolarHBondContact O-N 3.15Å; V504-V506 HydrophobicContact CG1-CG2 3.87Å; V506-I508 HydrophobicContact CG1-CG1 4.39Å; V506-A521 HydrophobicContact CB-CB 4.37Å; V506-A521 HydrophobicContact CG1-CB 3.93Å; V506-I524 HydrophobicContact CG1-CB 4.25Å; V506-I524 HydrophobicContact CG1-CG2 3.98Å; V506-I524 HydrophobicContact CG2-CG2 4.09Å; V506-A525 HydrophobicContact CG2-CB 3.72Å
507	T	98.8	Very high	92.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	141.6	168.4	-176.5	0	0	0	0	111	V120 G121 V391 L394 L395 V481	V120-T507 WeakPolarHBondContact CA-O 3.2Å; G121-T507 PolarHBondContact N-O 3.1Å; G121-T507 PolarHBondContact O-N 3.4Å; V391-T507 HydrophobicContact CB-CG2 3.59Å; V391-T507 HydrophobicContact CG1-CG2 3.7Å; L394-T507 HydrophobicContact CB-CG2 4.11Å; L394-T507 VanDerWaalsContact CD1-OG1 3.31Å; L394-T507 WeakPolarHBondContact CD1-OG1 3.1Å; L395-T507 HydrophobicContact CD2-CG2 4.06Å; L395-T507 HydrophobicContact CG-CG2 4.13Å; V481-T507 WeakPolarHBondContact O-CA 3.38Å; V481-T507 WeakPolarHBondContact O-CB 2.96Å; V481-T507 PolarHBondContact O-OG1 2.84Å
508	I	98.8	Very high	93.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	130.7	174.2	-50.6	162.9	0	0	0	106.8	L106 I119 V120 S480 V481 V506 L517 T520 A521 I524	L106-I508 HydrophobicContact CD2-CD1 3.92Å; L106-I508 HydrophobicContact CD2-CG1 4.32Å; L106-I508 HydrophobicContact CD2-CG2 4.11Å; I119-I508 WeakPolarHBondContact O-CA 3.49Å; V120-I508 HydrophobicContact CG2-CG1 4.13Å; S480-I508 CarbonylContact C-O 3.54Å; S480-I508 VanDerWaalsContact CA-O 3.27Å; S480-I508 WeakPolarHBondContact CA-O 3.39Å; V481-I508 HydrophobicContact CG1-CB 3.93Å; V481-I508 HydrophobicContact CG1-CD1 4.2Å; V481-I508 HydrophobicContact CG1-CG1 4.22Å; V481-I508 PolarHBondContact N-O 3.3Å; V481-I508 PolarHBondContact O-N 3.22Å; V481-I508 VanDerWaalsContact O-N 3.09Å; V506-I508 HydrophobicContact CG1-CG1 4.39Å; I508-L517 HydrophobicContact CB-CD1 4.23Å; I508-L517 HydrophobicContact CG2-CD1 4.09Å; I508-L517 HydrophobicContact CG2-CD2 4.09Å; I508-T520 HydrophobicContact CD1-CG2 3.81Å; I508-A521 HydrophobicContact CD1-CB 4.06Å; I508-I524 HydrophobicContact CD1-CD1 4.05Å
509	I	98.6	Very high	94.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135.3	173.3	-46.3	163	0	0	0	108.1	L118 I119 M151 I153 V391 L394	L118-I509 CarbonylContact C-O 3.56Å; L118-I509 VanDerWaalsContact CA-O 3.23Å; L118-I509 WeakPolarHBondContact CA-O 3.47Å; I119-I509 HydrophobicContact CD1-CB 4.08Å; I119-I509 HydrophobicContact CD1-CD1 3.91Å; I119-I509 HydrophobicContact CD1-CG1 4.45Å; I119-I509 HydrophobicContact CG1-CB 3.74Å; I119-I509 HydrophobicContact CG1-CD1 4.34Å; I119-I509 HydrophobicContact CG1-CG1 4.36Å; I119-I509 PolarHBondContact N-O 3.36Å; I119-I509 PolarHBondContact O-N 3.32Å; M151-I509 HydrophobicContact CB-CB 4.33Å; M151-I509 HydrophobicContact CB-CG2 3.43Å; M151-I509 VanDerWaalsContact CB-CG2 3.43Å; M151-I509 HydrophobicContact CG-CG2 4.28Å; M151-I509 HydrophobicContact SD-CB 4.36Å; M151-I509 HydrophobicContact SD-CG2 4Å; I153-I509 HydrophobicContact CG2-CD1 3.78Å; I153-I509 HydrophobicContact CG2-CG1 4.45Å; V391-I509 HydrophobicContact CG1-CD1 4.12Å; V391-I509 HydrophobicContact CG1-CG1 4.35Å; L394-I509 HydrophobicContact CD1-CD1 3.94Å; L394-I509 HydrophobicContact CD1-CG1 4.36Å
510	T	98.4	Very high	95.7	Very high	2 Å²	2	13 Å²	13	1%	0.012	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145.1	177	-178.1	0	0	0	0	110.6	A115 G117 A478 S479 M512 V515 L517	A115-T510 WeakPolarHBondContact CB-OG1 3.47Å; G117-T510 WeakPolarHBondContact O-CA 3.45Å; G117-T510 PolarHBondContact O-OG1 2.78Å; A478-T510 VanDerWaalsContact CA-O 3.24Å; A478-T510 WeakPolarHBondContact CA-O 3.43Å; S479-T510 PolarHBondContact N-O 3.33Å; S479-T510 PolarHBondContact O-N 3.35Å; T510-M512 PolarHBondContact O-N 3.13Å; T510-M512 VanDerWaalsContact O-N 3.15Å; T510-V515 HydrophobicContact CG2-CB 3.97Å; T510-V515 HydrophobicContact CG2-CG1 4.27Å; T510-V515 HydrophobicContact CG2-CG2 3.96Å; T510-L517 HydrophobicContact CG2-CD1 4.14Å
511	N	97.9	Very high	96	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	8%	0.08	C	C	.	.	S	Bend	trans	-84.7	33.4	176.5	63.4	5.8	0	0	0	113.3	G117 Y136 M151 S359 R360 F361 Y362 G477	G117-N511 PolarHBondContact N-OD1 3.28Å; G117-N511 PolarHBondContact O-N 2.77Å; G117-N511 PolarHBondContact O-OD1 3.01Å; Y136-N511 PolarHBondContact O-ND2 3.04Å; M151-N511 HydrophobicContact CE-CB 4.32Å; M151-N511 HydrophobicContact SD-CB 4.18Å; S359-N511 WeakPolarHBondContact OG-CB 3.25Å; S359-N511 PolarHBondContact OG-ND2 2.87Å; R360-N511 VanDerWaalsContact O-CB 3.24Å; R360-N511 WeakPolarHBondContact O-CB 3.27Å; F361-N511 HydrophobicContact CD1-CB 4.49Å; Y362-N511 WeakPolarHBondContact CB-O 3.49Å; Y362-N511 HydrophobicContact CD2-CB 4.31Å; Y362-N511 WeakPolarHBondContact CD2-O 3.39Å; Y362-N511 PolarHBondContact N-O 2.66Å; G477-N511 CarbonylContact O-C 3.57Å; G477-N511 WeakPolarHBondContact O-CA 3.46Å
512	M	97.1	Very high	96.1	Very high	3 Å²	3	12.6 Å²	12.6	2%	0.015	9%	0.085	C	C	.	.	B	Isolated β-bridge	trans	-126.8	133.7	175.3	177.5	57.9	68.7	0	0	110	G114 A115 L364 V370 G477 A478 S479 T510 V515	G114-M512 VanDerWaalsContact O-CE 3.31Å; G114-M512 WeakPolarHBondContact O-CE 3.3Å; A115-M512 HydrophobicContact CB-CB 3.74Å; A115-M512 HydrophobicContact CB-CG 4.3Å; L364-M512 HydrophobicContact CD2-CE 4.31Å; L364-M512 HydrophobicContact CG-CE 4.44Å; L364-M512 HydrophobicContact CG-SD 4.39Å; V370-M512 HydrophobicContact CG1-CE 4.32Å; V370-M512 HydrophobicContact CG2-CE 4.25Å; G477-M512 PolarHBondContact O-N 3.01Å; A478-M512 CarbonylContact C-O 3.47Å; A478-M512 VanDerWaalsContact C-O 3.25Å; S479-M512 PolarHBondContact N-O 3.35Å; S479-M512 VanDerWaalsContact N-O 3.15Å; S479-M512 PolarHBondContact OG-O 3.25Å; T510-M512 PolarHBondContact O-N 3.13Å; T510-M512 VanDerWaalsContact O-N 3.15Å; M512-V515 HydrophobicContact CB-CG2 3.9Å; M512-V515 HydrophobicContact CG-CG2 3.66Å
513	Q	92.4	Very high	96.2	Very high	29 Å²	29	17.7 Å²	17.7	14%	0.136	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	157.8	176.3	69.2	-176.5	26.1	0	0	113	F274 Y362 H363 V515	F274-Q513 HydrophobicContact CE1-CB 4.22Å; F274-Q513 HydrophobicContact CZ-CB 4.2Å; Y362-Q513 PolarHBondContact O-N 2.84Å; H363-Q513 HydrophobicContact CB-CG 3.55Å; Q513-V515 VanDerWaalsContact C-N 3.33Å; Q513-V515 PolarHBondContact O-N 3.45Å
514	S	89.6	Confident	96.3	Very high	38 Å²	38	17.7 Å²	17.7	27%	0.266	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	28.1	171.9	-48.1	0	0	0	0	115.8	F274 S479	F274-S514 VanDerWaalsContact CD2-OG 3.26Å; F274-S514 WeakPolarHBondContact CD2-OG 3.42Å; F274-S514 WeakPolarHBondContact CE2-OG 3.34Å; S479-S514 PolarHBondContact OG-N 3.33Å
515	V	94	Very high	96.3	Very high	7 Å²	7	17.7 Å²	17.7	4%	0.042	11%	0.107	C	C	.	.			trans	-91	132	178.9	-176.6	0	0	0	0	111.3	I109 V113 R270 S479 T510 M512 Q513 L517	I109-V515 HydrophobicContact CG2-CG1 4.34Å; V113-V515 HydrophobicContact CB-CG2 4.12Å; V113-V515 HydrophobicContact CG1-CG1 4.15Å; V113-V515 HydrophobicContact CG2-CG1 4.06Å; V113-V515 HydrophobicContact CG2-CG2 3.7Å; R270-V515 PolarHBondContact NH1-O 2.83Å; S479-V515 PolarHBondContact OG-N 3.3Å; T510-V515 HydrophobicContact CG2-CB 3.97Å; T510-V515 HydrophobicContact CG2-CG1 4.27Å; T510-V515 HydrophobicContact CG2-CG2 3.96Å; M512-V515 HydrophobicContact CB-CG2 3.9Å; M512-V515 HydrophobicContact CG-CG2 3.66Å; Q513-V515 VanDerWaalsContact C-N 3.33Å; Q513-V515 PolarHBondContact O-N 3.45Å; V515-L517 HydrophobicContact CG1-CD2 3.65Å; V515-L517 HydrophobicContact CG1-CG 3.96Å
516	G	93.1	Very high	96.2	Very high	42 Å²	42	21.3 Å²	21.3	43%	0.433	12%	0.123	S	C	.	.			trans	-86.6	106.7	175.1	0	0	0	0	0	112.7
517	L	95.6	Very high	96.1	Very high	3 Å²	3	24.3 Å²	24.3	2%	0.016	14%	0.138	C	C	.	.			trans	-110.9	-14.1	-173.9	-62.2	173.1	0	0	0	115.4	I109 V481 I508 T510 V515 S519 T520 A521	I109-L517 HydrophobicContact CG2-CD2 4.48Å; V481-L517 HydrophobicContact CB-CB 3.98Å; V481-L517 HydrophobicContact CG1-CB 3.51Å; V481-L517 HydrophobicContact CG1-CD1 4.41Å; I508-L517 HydrophobicContact CB-CD1 4.23Å; I508-L517 HydrophobicContact CG2-CD1 4.09Å; I508-L517 HydrophobicContact CG2-CD2 4.09Å; T510-L517 HydrophobicContact CG2-CD1 4.14Å; V515-L517 HydrophobicContact CG1-CD2 3.65Å; V515-L517 HydrophobicContact CG1-CG 3.96Å; L517-S519 PolarHBondContact O-N 3.43Å; L517-T520 WeakPolarHBondContact O-CB 3.35Å; L517-T520 PolarHBondContact O-N 3.32Å; L517-A521 PolarHBondContact O-N 3.04Å
518	N	94.3	Very high	96	Very high	23 Å²	23	24.3 Å²	24.3	12%	0.123	14%	0.138	C	C	.	.	H	α-helix	trans	-61.2	-48.6	-172.6	-163.6	51.5	0	0	0	113.3	S470 T472 T520 A521 L522	S470-N518 WeakPolarHBondContact CB-OD1 3.4Å; S470-N518 PolarHBondContact OG-OD1 3.48Å; T472-N518 HydrophobicContact CG2-CB 3.73Å; N518-T520 VanDerWaalsContact C-N 3.26Å; N518-T520 PolarHBondContact O-N 3.03Å; N518-A521 PolarHBondContact O-N 3.4Å; N518-L522 PolarHBondContact O-N 3.16Å
519	S	93.1	Very high	95.7	Very high	67 Å²	67	24.6 Å²	24.6	47%	0.469	14%	0.139	S	C	.	.	H	α-helix	trans	-64.6	-33.4	179.5	58	0	0	0	0	112.2	L517 K523	L517-S519 PolarHBondContact O-N 3.43Å; S519-K523 VanDerWaalsContact O-CG 3.3Å; S519-K523 WeakPolarHBondContact O-CG 3.36Å; S519-K523 PolarHBondContact O-N 2.74Å
520	T	96.6	Very high	95.5	Very high	8 Å²	8	31 Å²	31	5%	0.049	17%	0.166	C	C	.	.	H	α-helix	trans	-66.1	-51.3	174.1	-54.4	0	0	0	0	111.3	L105 L106 I109 I508 L517 N518 L522 K523 I524	L105-T520 HydrophobicContact CD2-CG2 3.85Å; L105-T520 HydrophobicContact CG-CG2 4.03Å; L106-T520 HydrophobicContact CD2-CG2 4.08Å; I109-T520 HydrophobicContact CD1-CG2 3.16Å; I109-T520 WeakPolarHBondContact CD1-OG1 3.42Å; I508-T520 HydrophobicContact CD1-CG2 3.81Å; L517-T520 WeakPolarHBondContact O-CB 3.35Å; L517-T520 PolarHBondContact O-N 3.32Å; N518-T520 VanDerWaalsContact C-N 3.26Å; N518-T520 PolarHBondContact O-N 3.03Å; T520-L522 VanDerWaalsContact C-N 3.25Å; T520-L522 PolarHBondContact O-N 3.35Å; T520-K523 WeakPolarHBondContact O-CB 3.46Å; T520-K523 PolarHBondContact O-N 2.69Å; T520-K523 VanDerWaalsContact O-N 3.15Å; T520-I524 HydrophobicContact CG2-CD1 4.16Å; T520-I524 WeakPolarHBondContact O-CG1 3.31Å; T520-I524 PolarHBondContact O-N 3.25Å
521	A	98	Very high	95.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.6	-39.7	177.6	0	0	0	0	0	111.6	V481 L483 V506 I508 L517 N518 I524 A525	V481-A521 HydrophobicContact CG1-CB 3.7Å; V481-A521 HydrophobicContact CG2-CB 4.2Å; L483-A521 HydrophobicContact CB-CB 4.13Å; L483-A521 HydrophobicContact CD1-CB 4.21Å; V506-A521 HydrophobicContact CB-CB 4.37Å; V506-A521 HydrophobicContact CG1-CB 3.93Å; I508-A521 HydrophobicContact CD1-CB 4.06Å; L517-A521 PolarHBondContact O-N 3.04Å; N518-A521 PolarHBondContact O-N 3.4Å; A521-I524 PolarHBondContact O-N 3.4Å; A521-A525 WeakPolarHBondContact O-CB 3.31Å; A521-A525 PolarHBondContact O-N 3.37Å
522	L	96	Very high	94.8	Very high	33 Å²	33	33.3 Å²	33.3	17%	0.173	18%	0.179	C	C	.	.	H	α-helix	trans	-65.3	-42	176.4	-176.4	61.5	0	0	0	112.3	Y468 L483 N518 T520 A525 H526	Y468-L522 HydrophobicContact CD1-CD1 4.02Å; Y468-L522 HydrophobicContact CE1-CD1 4.13Å; Y468-L522 HydrophobicContact CE1-CD2 3.93Å; Y468-L522 HydrophobicContact CG-CD1 4.24Å; L483-L522 HydrophobicContact CD1-CB 3.9Å; L483-L522 HydrophobicContact CD1-CD1 4.25Å; N518-L522 PolarHBondContact O-N 3.16Å; T520-L522 VanDerWaalsContact C-N 3.25Å; T520-L522 PolarHBondContact O-N 3.35Å; L522-A525 PolarHBondContact O-N 3.42Å; L522-H526 PolarHBondContact O-CD2 2.81Å; L522-H526 VanDerWaalsContact O-CD2 3.25Å; L522-H526 PolarHBondContact O-N 3.3Å
523	K	96.8	Very high	93.9	Very high	117 Å²	117	38.3 Å²	38.3	51%	0.509	21%	0.206	S	C	.	.	H	α-helix	trans	-61	-44.6	174.3	-75.6	172.6	-179.9	-175.6	0	111.6	L105 S519 T520 H526 Q527	L105-K523 HydrophobicContact CD2-CB 3.87Å; L105-K523 HydrophobicContact CD2-CD 4.03Å; S519-K523 VanDerWaalsContact O-CG 3.3Å; S519-K523 WeakPolarHBondContact O-CG 3.36Å; S519-K523 PolarHBondContact O-N 2.74Å; T520-K523 WeakPolarHBondContact O-CB 3.46Å; T520-K523 PolarHBondContact O-N 2.69Å; T520-K523 VanDerWaalsContact O-N 3.15Å; K523-H526 PolarHBondContact O-N 3.39Å; K523-Q527 WeakPolarHBondContact O-CG 3.31Å; K523-Q527 PolarHBondContact O-N 3.41Å; K523-Q527 VanDerWaalsContact O-N 3.12Å
524	I	98.4	Very high	92.7	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.7	-48.7	175.5	-66.7	177.7	0	0	0	109.6	L105 L106 V122 W130 V506 I508 T520 A521 H526 Q527 F528	L105-I524 HydrophobicContact CD2-CG1 4.25Å; L106-I524 HydrophobicContact CD1-CD1 4.24Å; L106-I524 HydrophobicContact CD2-CD1 4.08Å; L106-I524 HydrophobicContact CG-CD1 4.08Å; V122-I524 HydrophobicContact CG2-CG2 3.71Å; W130-I524 HydrophobicContact CZ3-CD1 4.48Å; W130-I524 HydrophobicContact CZ3-CG2 4.22Å; V506-I524 HydrophobicContact CG1-CB 4.25Å; V506-I524 HydrophobicContact CG1-CG2 3.98Å; V506-I524 HydrophobicContact CG2-CG2 4.09Å; I508-I524 HydrophobicContact CD1-CD1 4.05Å; T520-I524 HydrophobicContact CG2-CD1 4.16Å; T520-I524 WeakPolarHBondContact O-CG1 3.31Å; T520-I524 PolarHBondContact O-N 3.25Å; A521-I524 PolarHBondContact O-N 3.4Å; I524-H526 PolarHBondContact O-N 3.25Å; I524-Q527 WeakPolarHBondContact O-CB 3.35Å; I524-Q527 PolarHBondContact O-N 3.45Å; I524-F528 HydrophobicContact CG2-CD2 3.86Å; I524-F528 HydrophobicContact CG2-CE2 3.85Å; I524-F528 WeakPolarHBondContact O-CD2 3.46Å; I524-F528 PolarHBondContact O-N 3.49Å; I524-F528 VanDerWaalsContact O-N 3.11Å
525	A	97.8	Very high	92.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-55.3	-41.2	178.9	0	0	0	0	0	111.9	L483 L485 V504 V506 A521 L522 F528 E529	L483-A525 HydrophobicContact CD2-CB 3.84Å; L485-A525 HydrophobicContact CB-CB 4.2Å; L485-A525 HydrophobicContact CD2-CB 3.84Å; V504-A525 HydrophobicContact CB-CB 4.45Å; V504-A525 HydrophobicContact CG1-CB 4.26Å; V506-A525 HydrophobicContact CG2-CB 3.72Å; A521-A525 WeakPolarHBondContact O-CB 3.31Å; A521-A525 PolarHBondContact O-N 3.37Å; L522-A525 PolarHBondContact O-N 3.42Å; A525-F528 PolarHBondContact O-N 3.35Å; A525-E529 WeakPolarHBondContact O-CB 3.41Å; A525-E529 PolarHBondContact O-N 3.39Å
526	H	95.8	Very high	92.8	Very high	75 Å²	75	47.4 Å²	47.4	35%	0.347	26%	0.259	S	S	.	.	H	α-helix	trans	-66.8	-34.1	175.3	-71.7	-39.3	0	0	0	114.3	L522 K523 I524 K530	L522-H526 PolarHBondContact O-CD2 2.81Å; L522-H526 VanDerWaalsContact O-CD2 3.25Å; L522-H526 PolarHBondContact O-N 3.3Å; K523-H526 PolarHBondContact O-N 3.39Å; I524-H526 PolarHBondContact O-N 3.25Å; H526-K530 WeakPolarHBondContact O-CB 3.35Å; H526-K530 PolarHBondContact O-N 3.18Å
527	Q	96.6	Very high	92.8	Very high	64 Å²	64	47.7 Å²	47.7	30%	0.299	25%	0.249	S	C	.	.	H	α-helix	trans	-64.2	-45.4	174.4	-66.2	-56.1	-32.3	0	0	111.2	A98 V101 K523 I524 K530 A531	A98-Q527 HydrophobicContact CB-CB 4.09Å; V101-Q527 HydrophobicContact CG1-CG 4.09Å; K523-Q527 WeakPolarHBondContact O-CG 3.31Å; K523-Q527 PolarHBondContact O-N 3.41Å; K523-Q527 VanDerWaalsContact O-N 3.12Å; I524-Q527 WeakPolarHBondContact O-CB 3.35Å; I524-Q527 PolarHBondContact O-N 3.45Å; Q527-K530 PolarHBondContact O-N 3.32Å; Q527-A531 PolarHBondContact O-N 2.83Å; Q527-A531 VanDerWaalsContact O-N 3.08Å
528	F	96.9	Very high	92.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-71.4	-36.2	-179.6	-80.6	-97.2	0	0	0	112.7	Y95 A98 I99 V122 V124 V129 W130 V504 I524 A525 A531 R532	Y95-F528 AromaticContact CD1-CD1 3.67Å; Y95-F528 HydrophobicContact CD1-CD1 3.67Å; Y95-F528 HydrophobicContact CD1-CE1 4.27Å; Y95-F528 HydrophobicContact CE1-CD1 4.41Å; Y95-F528 AromaticContact CG-CD1 3.97Å; Y95-F528 HydrophobicContact CG-CD1 3.97Å; Y95-F528 HydrophobicContact CG-CE1 4.13Å; A98-F528 HydrophobicContact CB-CD1 4.44Å; A98-F528 HydrophobicContact CB-CD2 4.14Å; A98-F528 HydrophobicContact CB-CE2 4.21Å; A98-F528 HydrophobicContact CB-CG 4.27Å; A98-F528 HydrophobicContact CB-CZ 4.4Å; I99-F528 HydrophobicContact CG1-CE1 4.02Å; I99-F528 HydrophobicContact CG1-CZ 3.61Å; V122-F528 HydrophobicContact CB-CD1 4.42Å; V122-F528 HydrophobicContact CB-CE1 4.2Å; V122-F528 HydrophobicContact CB-CE2 4.34Å; V122-F528 HydrophobicContact CB-CZ 4.15Å; V122-F528 HydrophobicContact CG1-CB 4.16Å; V122-F528 HydrophobicContact CG1-CD1 3.66Å; V122-F528 HydrophobicContact CG1-CD2 3.92Å; V122-F528 HydrophobicContact CG1-CE1 3.94Å; V122-F528 HydrophobicContact CG1-CE2 4.19Å; V122-F528 HydrophobicContact CG1-CG 3.63Å; V122-F528 HydrophobicContact CG1-CZ 4.2Å; V122-F528 HydrophobicContact CG2-CD2 4.32Å; V122-F528 HydrophobicContact CG2-CE2 3.98Å; V122-F528 HydrophobicContact CG2-CZ 4.17Å; V124-F528 HydrophobicContact CG2-CB 3.99Å; V124-F528 HydrophobicContact CG2-CD1 3.98Å; V124-F528 HydrophobicContact CG2-CG 4.43Å; V129-F528 HydrophobicContact CG2-CD1 3.76Å; V129-F528 HydrophobicContact CG2-CE1 3.68Å; W130-F528 HydrophobicContact CB-CE1 4.11Å; W130-F528 HydrophobicContact CB-CZ 3.9Å; W130-F528 HydrophobicContact CD2-CZ 4.09Å; W130-F528 AromaticContact CE3-CE2 3.73Å; W130-F528 HydrophobicContact CE3-CE2 3.73Å; W130-F528 AromaticContact CE3-CZ 3.52Å; W130-F528 HydrophobicContact CE3-CZ 3.52Å; W130-F528 HydrophobicContact CG-CZ 4.29Å; W130-F528 HydrophobicContact CZ3-CE2 4.12Å; W130-F528 HydrophobicContact CZ3-CZ 4.32Å; V504-F528 HydrophobicContact CG1-CB 3.94Å; V504-F528 HydrophobicContact CG2-CB 4.31Å; I524-F528 HydrophobicContact CG2-CD2 3.86Å; I524-F528 HydrophobicContact CG2-CE2 3.85Å; I524-F528 WeakPolarHBondContact O-CD2 3.46Å; I524-F528 PolarHBondContact O-N 3.49Å; I524-F528 VanDerWaalsContact O-N 3.11Å; A525-F528 PolarHBondContact O-N 3.35Å; F528-A531 PolarHBondContact O-N 2.75Å; F528-R532 WeakPolarHBondContact O-CB 3.41Å; F528-R532 PolarHBondContact O-N 3.44Å
529	E	93.9	Very high	92.5	Very high	6 Å²	6	52.1 Å²	52.1	3%	0.028	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-41.5	172	-179.2	87.5	161.9	0	0	111.6	R466 L485 V504 A525 A531 R532 N533	R466-E529 IonicContact CZ-OE1 3.7Å; R466-E529 VanDerWaalsContact CZ-OE1 3.31Å; R466-E529 VanDerWaalsContact NH1-CD 3.34Å; R466-E529 VanDerWaalsContact NH1-CG 3.25Å; R466-E529 IonicContact NH1-OE1 2.83Å; R466-E529 PolarHBondContact NH1-OE1 3.43Å; R466-E529 IonicContact NH2-OE1 3.88Å; R466-E529 PolarHBondContact NH2-OE1 3.19Å; L485-E529 HydrophobicContact CD2-CB 4.38Å; V504-E529 HydrophobicContact CG2-CB 4.03Å; A525-E529 WeakPolarHBondContact O-CB 3.41Å; A525-E529 PolarHBondContact O-N 3.39Å; E529-A531 VanDerWaalsContact C-N 3.31Å; E529-A531 PolarHBondContact O-N 2.92Å; E529-R532 WeakPolarHBondContact O-CB 3.47Å; E529-R532 PolarHBondContact O-N 2.71Å; E529-N533 PolarHBondContact O-N 3.32Å; E529-N533 PolarHBondContact O-ND2 3.47Å
530	K	92.6	Very high	92.5	Very high	133 Å²	133	51.1 Å²	51.1	58%	0.578	26%	0.258	S	S	*	.	H	α-helix	trans	-59.3	-46.5	176	-176.5	-171.5	173	-160.6	0	110.3	H526 Q527 R532 N533	H526-K530 WeakPolarHBondContact O-CB 3.35Å; H526-K530 PolarHBondContact O-N 3.18Å; Q527-K530 PolarHBondContact O-N 3.32Å; K530-R532 VanDerWaalsContact C-N 3.33Å; K530-R532 PolarHBondContact O-N 3.48Å; K530-N533 PolarHBondContact O-N 3.37Å
531	A	92.9	Very high	92.2	Very high	19 Å²	19	54.1 Å²	54.1	16%	0.157	27%	0.273	C	S	.	.	H	α-helix	trans	-68.5	-28.4	177.7	0	0	0	0	0	113.5	Y95 A98 Q527 F528 E529 N533 V534	Y95-A531 HydrophobicContact CD1-CB 3.67Å; Y95-A531 HydrophobicContact CE1-CB 4.08Å; A98-A531 HydrophobicContact CB-CB 4.09Å; Q527-A531 PolarHBondContact O-N 2.83Å; Q527-A531 VanDerWaalsContact O-N 3.08Å; F528-A531 PolarHBondContact O-N 2.75Å; E529-A531 VanDerWaalsContact C-N 3.31Å; E529-A531 PolarHBondContact O-N 2.92Å; A531-N533 VanDerWaalsContact C-N 3.26Å; A531-N533 PolarHBondContact O-N 2.73Å; A531-V534 PolarHBondContact O-N 2.99Å
532	R	89.3	Confident	91.8	Very high	32 Å²	32	58.3 Å²	58.3	12%	0.121	29%	0.294	C	S	.	.	H	α-helix	trans	-63.2	-31	174.6	179.2	-169.6	175.4	-88.5	-4.1	112.7	Y95 V124 D125 S487 F528 E529 K530	Y95-R532 HydrophobicContact CE1-CB 4.33Å; V124-R532 HydrophobicContact CG1-CB 4.1Å; V124-R532 HydrophobicContact CG1-CG 3.86Å; D125-R532 IonicContact OD1-CZ 3.69Å; D125-R532 IonicContact OD1-NE 3.35Å; D125-R532 PolarHBondContact OD1-NE 2.78Å; D125-R532 IonicContact OD1-NH2 3.09Å; D125-R532 PolarHBondContact OD1-NH2 3.09Å; D125-R532 IonicContact OD2-CZ 3.66Å; D125-R532 IonicContact OD2-NE 2.76Å; D125-R532 PolarHBondContact OD2-NE 3.27Å; D125-R532 IonicContact OD2-NH2 3.02Å; D125-R532 PolarHBondContact OD2-NH2 2.97Å; S487-R532 PolarHBondContact OG-NH1 3.43Å; S487-R532 VanDerWaalsContact OG-NH1 3.15Å; F528-R532 WeakPolarHBondContact O-CB 3.41Å; F528-R532 PolarHBondContact O-N 3.44Å; E529-R532 WeakPolarHBondContact O-CB 3.47Å; E529-R532 PolarHBondContact O-N 2.71Å; K530-R532 VanDerWaalsContact C-N 3.33Å; K530-R532 PolarHBondContact O-N 3.48Å
533	N	77.6	Confident	91.4	Very high	108 Å²	108	60.4 Å²	60.4	58%	0.578	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	1.1	-174.6	-64.3	-28.6	0	0	0	113.9	E529 K530 A531	E529-N533 PolarHBondContact O-N 3.32Å; E529-N533 PolarHBondContact O-ND2 3.47Å; K530-N533 PolarHBondContact O-N 3.37Å; A531-N533 VanDerWaalsContact C-N 3.26Å; A531-N533 PolarHBondContact O-N 2.73Å
534	V	68.5	Low	90.9	Very high	171 Å²	171	55.3 Å²	55.3	100%	1.036	29%	0.286	S	S	*	.			trans	-99.8	0	175.6	-179.7	0	0	0	0	108.5	A531	A531-V534 PolarHBondContact O-N 2.99Å

Retrieved 534 of 534 residues in 1392.4 ms (Link to these results)

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