A0A3Q0KKQ3_SCHMA Loading...

Putative leucine-rich repeat-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KKQ3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 575 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	31.7	Very low	23.1	Very low	234 Å²	234	159.8 Å²	159.8	100%	1.153	81%	0.807	S	S	*	*				0	100.7	0	-69.5	-170.1	173.3	0	0	108.4	D3	M1-D3 PolarHBondContact O-N 2.86Å
2	M	23.6	Very low	23.1	Very low	199 Å²	199	166.2 Å²	166.2	98%	0.98	81%	0.814	S	S	*	*			trans	-79	101.8	169.6	-91.8	-77.3	-171	0	0	107.4
3	D	24.6	Very low	23.2	Very low	158 Å²	158	166.7 Å²	166.7	85%	0.845	81%	0.809	S	S	*	*			trans	-60.4	136.2	165.9	-79.2	-40.6	0	0	0	110.4	M1	M1-D3 PolarHBondContact O-N 2.86Å
4	G	23.1	Very low	23.2	Very low	67 Å²	67	166.1 Å²	166.1	69%	0.691	81%	0.809	S	S	*	*			trans	107.7	62.7	155	0	0	0	0	0	116.7	I6	G4-I6 PolarHBondContact O-N 3.49Å
5	L	21.4	Very low	23.3	Very low	156 Å²	156	163.3 Å²	163.3	82%	0.817	80%	0.799	S	S	*	*			trans	-81.4	99.2	156.9	-138.7	102.1	0	0	0	109.1	L7	L5-L7 HydrophobicContact CD2-CD1 4.41Å; L5-L7 HydrophobicContact CD2-CD2 4.24Å; L5-L7 HydrophobicContact CD2-CG 4.13Å; L5-L7 PolarHBondContact O-N 2.86Å
6	I	21.1	Very low	23.4	Very low	131 Å²	131	166.4 Å²	166.4	67%	0.672	81%	0.806	S	S	*	*			trans	-83.1	100.3	174.7	-60.5	175.1	0	0	0	108.6	G4 F8	G4-I6 PolarHBondContact O-N 3.49Å; I6-F8 HydrophobicContact CB-CE2 4.5Å; I6-F8 HydrophobicContact CG2-CD2 4.23Å; I6-F8 HydrophobicContact CG2-CE1 4.37Å; I6-F8 HydrophobicContact CG2-CE2 3.79Å; I6-F8 HydrophobicContact CG2-CZ 3.87Å; I6-F8 PolarHBondContact O-N 3.37Å
7	L	19.6	Very low	23.6	Very low	150 Å²	150	161.4 Å²	161.4	79%	0.785	79%	0.792	S	S	*	*			trans	-85.4	107.5	173.3	-75.4	164.9	0	0	0	110.4	L5 R9	L5-L7 HydrophobicContact CD2-CD1 4.41Å; L5-L7 HydrophobicContact CD2-CD2 4.24Å; L5-L7 HydrophobicContact CD2-CG 4.13Å; L5-L7 PolarHBondContact O-N 2.86Å; L7-R9 PolarHBondContact O-N 3.31Å
8	F	21.8	Very low	23.8	Very low	179 Å²	179	164.2 Å²	164.2	79%	0.785	80%	0.799	S	S	*	*			trans	-75	101.8	171.5	-67	-86.1	0	0	0	110.1	I6	I6-F8 HydrophobicContact CB-CE2 4.5Å; I6-F8 HydrophobicContact CG2-CD2 4.23Å; I6-F8 HydrophobicContact CG2-CE1 4.37Å; I6-F8 HydrophobicContact CG2-CE2 3.79Å; I6-F8 HydrophobicContact CG2-CZ 3.87Å; I6-F8 PolarHBondContact O-N 3.37Å
9	R	21.2	Very low	23.9	Very low	244 Å²	244	163.1 Å²	163.1	92%	0.921	80%	0.797	S	S	*	*			trans	-95.2	115.5	170.4	-151.6	176.8	-175.9	175.5	2.4	110.1	L7	L7-R9 PolarHBondContact O-N 3.31Å
10	R	24.1	Very low	24	Very low	123 Å²	123	159.3 Å²	159.3	46%	0.464	79%	0.787	S	S	.	*			trans	-52.9	127.2	177.8	-162.9	175.8	-177.2	163.2	-0.7	110.5	R12 Y372	R10-R12 PolarHBondContact O-N 3.23Å; R10-R12 VanDerWaalsContact O-N 3.14Å; R10-Y372 PolarHBondContact NH1-O 3.02Å; R10-Y372 PolarHBondContact NH2-O 2.94Å
11	P	22	Very low	24.3	Very low	117 Å²	117	160.9 Å²	160.9	76%	0.76	79%	0.793	S	S	*	*			trans	-70.5	111.3	171.3	26.8	-29	0	0	0	108.3	K13	P11-K13 PolarHBondContact O-N 2.86Å
12	R	22.9	Very low	24.1	Very low	236 Å²	236	156.5 Å²	156.5	89%	0.891	77%	0.774	S	S	*	*			trans	-57.9	121.3	165.1	-78.5	-177.3	174.8	173.8	-2.5	106.8	R10 I14	R10-R12 PolarHBondContact O-N 3.23Å; R10-R12 VanDerWaalsContact O-N 3.14Å; R12-I14 PolarHBondContact O-N 3.41Å
13	K	24.1	Very low	24.2	Very low	173 Å²	173	151.4 Å²	151.4	75%	0.752	75%	0.751	S	S	*	*			trans	-50.6	103.9	169	-88	176.9	175.6	168.8	0	107.8	P11 L15	P11-K13 PolarHBondContact O-N 2.86Å; K13-L15 PolarHBondContact O-N 3.35Å
14	I	23.4	Very low	24.2	Very low	158 Å²	158	151.4 Å²	151.4	81%	0.81	75%	0.751	S	S	*	*			trans	-70.9	109.3	161.3	-61.5	173.5	0	0	0	104.2	R12 K16	R12-I14 PolarHBondContact O-N 3.41Å; I14-K16 PolarHBondContact O-N 3.43Å; I14-K16 VanDerWaalsContact O-N 3.17Å
15	L	25	Very low	24.2	Very low	125 Å²	125	157.1 Å²	157.1	65%	0.654	75%	0.753	S	S	*	*			trans	-53.7	124.3	168.4	-90.9	109.1	0	0	0	107	K13 S17	K13-L15 PolarHBondContact O-N 3.35Å; L15-S17 PolarHBondContact O-N 3.15Å
16	K	24.8	Very low	24.3	Very low	212 Å²	212	156.2 Å²	156.2	92%	0.922	75%	0.754	S	S	*	*			trans	-63.1	73.7	165.2	-70.2	-175.3	176.7	-175.4	0	108.5	I14 K18	I14-K16 PolarHBondContact O-N 3.43Å; I14-K16 VanDerWaalsContact O-N 3.17Å; K16-K18 PolarHBondContact O-N 2.85Å
17	S	26.4	Very low	24.3	Very low	81 Å²	81	161 Å²	161	57%	0.566	77%	0.765	S	S	*	*			trans	-70.3	123.5	157.8	52.9	0	0	0	0	106	L15 L19	L15-S17 PolarHBondContact O-N 3.15Å; S17-L19 PolarHBondContact O-N 3.15Å
18	K	28	Very low	24.6	Very low	212 Å²	212	162.9 Å²	162.9	92%	0.922	77%	0.767	S	S	*	*			trans	-37.4	95.9	174.4	-66.4	174.3	177.3	179.5	0	110.7	K16	K16-K18 PolarHBondContact O-N 2.85Å
19	L	25.1	Very low	24.8	Very low	144 Å²	144	160 Å²	160	75%	0.754	77%	0.769	S	S	*	*			trans	-114.1	111.6	169.1	-78.6	162.1	0	0	0	104.4	S17	S17-L19 PolarHBondContact O-N 3.15Å
20	S	26.6	Very low	24.9	Very low	86 Å²	86	151.8 Å²	151.8	60%	0.601	76%	0.76	S	S	*	*			trans	-50.6	137.7	175.9	38	0	0	0	0	110.3	N22	S20-N22 PolarHBondContact O-N 2.81Å
21	E	30.7	Very low	25.1	Very low	193 Å²	193	155.6 Å²	155.6	90%	0.902	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	4.1	-172	-74.5	-178.4	146.5	0	0	116.4
22	N	27.2	Very low	25.2	Very low	143 Å²	143	160.4 Å²	160.4	77%	0.765	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-0.4	-171.2	-73.9	-15.4	0	0	0	116.3	S20	S20-N22 PolarHBondContact O-N 2.81Å
23	D	24.3	Very low	25.2	Very low	91 Å²	91	155 Å²	155	49%	0.487	78%	0.782	S	S	.	*			trans	-110.5	82.4	-174	-73	-27.4	0	0	0	113.1	Y25	D23-Y25 HydrophobicContact CB-CD2 3.97Å; D23-Y25 HydrophobicContact CB-CE2 3.56Å; D23-Y25 PolarHBondContact O-N 3.2Å; D23-Y25 VanDerWaalsContact O-N 3.16Å
24	N	24.8	Very low	25.2	Very low	159 Å²	159	157.1 Å²	157.1	85%	0.85	79%	0.792	S	S	*	*			trans	-75.8	91.3	169.9	-72	-44.2	0	0	0	110.6
25	Y	23.1	Very low	25.1	Very low	187 Å²	187	156.8 Å²	156.8	73%	0.733	79%	0.79	S	S	*	*			trans	-100.7	111.9	169.8	-64.9	-70.9	0	0	0	111.1	D23	D23-Y25 HydrophobicContact CB-CD2 3.97Å; D23-Y25 HydrophobicContact CB-CE2 3.56Å; D23-Y25 PolarHBondContact O-N 3.2Å; D23-Y25 VanDerWaalsContact O-N 3.16Å
26	V	24.9	Very low	25.1	Very low	137 Å²	137	155.8 Å²	155.8	83%	0.83	79%	0.793	S	S	*	*			trans	-94.5	108	169.8	179.6	0	0	0	0	108.6	K28	V26-K28 PolarHBondContact O-N 3.36Å
27	Y	20.4	Very low	24.9	Very low	230 Å²	230	152.1 Å²	152.1	90%	0.902	79%	0.788	S	S	*	*			trans	-75.3	114.9	170.2	-111.1	-97.8	0	0	0	109.4
28	K	26.5	Very low	24.7	Very low	191 Å²	191	153.7 Å²	153.7	83%	0.83	80%	0.795	S	S	*	*			trans	-144.1	130.5	157.6	-132.9	177.9	-177	-177.3	0	109.9	V26 G30	V26-K28 PolarHBondContact O-N 3.36Å; K28-G30 PolarHBondContact O-N 3.31Å
29	S	25	Very low	24.4	Very low	118 Å²	118	153 Å²	153	83%	0.825	79%	0.791	S	S	*	*	S	Bend	trans	-57	128	-172.5	57.2	0	0	0	0	112.2
30	G	24.8	Very low	24.3	Very low	72 Å²	72	155.4 Å²	155.4	74%	0.742	80%	0.796	S	S	*	*	S	Bend	trans	75.4	67.8	153.4	0	0	0	0	0	117	K28	K28-G30 PolarHBondContact O-N 3.31Å
31	K	26.6	Very low	24	Very low	203 Å²	203	158.2 Å²	158.2	88%	0.883	80%	0.804	S	S	*	*			trans	162.3	119.5	132.8	-89.5	170.8	-178.7	-179.4	0	108.9	T33	K31-T33 PolarHBondContact O-N 3.37Å
32	K	24.9	Very low	23.6	Very low	218 Å²	218	160 Å²	160	95%	0.948	80%	0.803	S	S	*	*			trans	-73.4	106.9	-176.2	-70.2	176.8	177	175.9	0	110.4
33	T	23.6	Very low	23.3	Very low	122 Å²	122	162.6 Å²	162.6	75%	0.748	81%	0.808	S	S	*	*			trans	-130.4	114	161	37.9	0	0	0	0	110	K31 I35	K31-T33 PolarHBondContact O-N 3.37Å; T33-I35 PolarHBondContact O-N 3.24Å
34	K	23.4	Very low	23.2	Very low	218 Å²	218	163.6 Å²	163.6	95%	0.948	82%	0.821	S	S	*	*			trans	-69.2	119.3	173.7	-82	178.8	172.5	177.8	0	108.5
35	I	21.4	Very low	23.1	Very low	150 Å²	150	162.7 Å²	162.7	77%	0.769	82%	0.817	S	S	*	*			trans	-117.7	113.3	166	-58.8	177.5	0	0	0	107.6	T33	T33-I35 PolarHBondContact O-N 3.24Å
36	S	23.9	Very low	23.2	Very low	104 Å²	104	161.3 Å²	161.3	73%	0.727	82%	0.822	S	S	*	*			trans	-80.3	115.7	175.5	41.3	0	0	0	0	109.9	T38	S36-T38 PolarHBondContact O-N 3.39Å
37	V	22.5	Very low	23	Very low	136 Å²	136	163.2 Å²	163.2	82%	0.824	82%	0.821	S	S	*	*			trans	-79.3	100.2	174.7	-179.4	0	0	0	0	108.5
38	T	22.1	Very low	23.1	Very low	114 Å²	114	160.5 Å²	160.5	70%	0.699	82%	0.822	S	S	*	*			trans	-85.9	117	168	39.3	0	0	0	0	109.2	S36 K40	S36-T38 PolarHBondContact O-N 3.39Å; T38-K40 PolarHBondContact O-N 3.37Å
39	K	21.4	Very low	23.3	Very low	196 Å²	196	156.2 Å²	156.2	85%	0.852	81%	0.813	S	S	*	*			trans	-61.8	99.5	170.9	-79.4	179.5	175.7	175.6	0	109.2
40	K	22.2	Very low	23	Very low	196 Å²	196	158.5 Å²	158.5	85%	0.852	82%	0.815	S	S	*	*			trans	-95.4	97.9	163.3	-83.7	-170.9	175.8	-179.2	0	109.6	T38	T38-K40 PolarHBondContact O-N 3.37Å
41	N	21.3	Very low	22.9	Very low	144 Å²	144	160.5 Å²	160.5	77%	0.77	82%	0.818	S	S	*	*			trans	-67.6	154.3	160.6	-81.9	-24.2	0	0	0	110.4
42	R	21.4	Very low	22.7	Very low	231 Å²	231	160.5 Å²	160.5	87%	0.872	82%	0.82	S	S	*	*			trans	97.1	96.6	160.9	-58.6	-173.8	177.6	173.4	-0.8	117.2
43	F	21.3	Very low	22.6	Very low	198 Å²	198	155 Å²	155	87%	0.868	81%	0.81	S	S	*	*				28.3	119.8	123	-71.1	-83.4	0	0	0	118
44	S	22.6	Very low	22.5	Very low	111 Å²	111	156.2 Å²	156.2	78%	0.776	81%	0.811	S	S	*	*			trans	-144.6	115.1	137.2	50.5	0	0	0	0	109.4
45	N	21.5	Very low	22.4	Very low	140 Å²	140	154 Å²	154	75%	0.749	81%	0.809	S	S	*	*			trans	-57	130.4	165.2	-73.1	-28.4	0	0	0	108.8
46	N	24.5	Very low	22.4	Very low	159 Å²	159	156 Å²	156	85%	0.85	81%	0.812	S	S	*	*			trans	-142.1	116.5	155.7	-92.3	-21	0	0	0	109.3
47	H	21.3	Very low	22.3	Very low	176 Å²	176	155.3 Å²	155.3	82%	0.815	81%	0.808	S	S	*	*			trans	-55.8	148.4	174.2	-74.1	-91.6	0	0	0	113
48	L	23.7	Very low	22.3	Very low	173 Å²	173	154.4 Å²	154.4	91%	0.906	81%	0.808	S	S	*	*			trans	-176.9	157	135.8	-92.8	145.6	0	0	0	109.1
49	P	29.6	Very low	22.3	Very low	101 Å²	101	156 Å²	156	66%	0.656	81%	0.81	S	S	*	*			trans	-116.6	151.6	-131.7	35.6	-21.2	0	0	0	115.4
50	I	19.8	Very low	22.3	Very low	166 Å²	166	149.6 Å²	149.6	85%	0.851	80%	0.8	S	S	*	*			trans	34.3	105.9	140.3	-48.9	170.1	0	0	0	116.8
51	S	21.8	Very low	22.3	Very low	115 Å²	115	146.2 Å²	146.2	80%	0.804	80%	0.796	S	S	*	*			trans	-141.1	132.8	139.9	62.6	0	0	0	0	110.6	S53	S51-S53 PolarHBondContact O-N 3.38Å
52	Q	22.8	Very low	22.3	Very low	202 Å²	202	150.5 Å²	150.5	94%	0.944	80%	0.801	S	S	*	*			trans	-28.3	106.5	-175	-68.4	159.3	-15.9	0	0	115.8
53	S	22.3	Very low	22.4	Very low	104 Å²	104	146.8 Å²	146.8	73%	0.727	80%	0.798	S	S	*	*			trans	-105.5	127.3	159.4	52.4	0	0	0	0	109.3	S51 L55	S51-S53 PolarHBondContact O-N 3.38Å; S53-L55 PolarHBondContact O-N 3.21Å; S53-L55 VanDerWaalsContact O-N 3.14Å
54	N	22.3	Very low	22.5	Very low	146 Å²	146	144 Å²	144	78%	0.781	79%	0.792	S	S	*	*			trans	-42.2	114.4	170.3	-70.3	-37.9	0	0	0	110.4	F56	N54-F56 VanDerWaalsContact C-N 3.25Å; N54-F56 PolarHBondContact O-N 3.38Å
55	L	21.2	Very low	22.5	Very low	171 Å²	171	147.6 Å²	147.6	90%	0.895	79%	0.794	S	S	*	*			trans	-62.1	86.6	168.9	-84	111.5	0	0	0	109.2	S53 S57	S53-L55 PolarHBondContact O-N 3.21Å; S53-L55 VanDerWaalsContact O-N 3.14Å; L55-S57 VanDerWaalsContact C-N 3.31Å; L55-S57 PolarHBondContact O-N 3.16Å; L55-S57 VanDerWaalsContact O-N 3.11Å
56	F	21.6	Very low	22.5	Very low	192 Å²	192	148.8 Å²	148.8	84%	0.842	80%	0.797	S	S	*	*			trans	-70.4	101	151	-84.6	-80.8	0	0	0	106.7	N54 S58	N54-F56 VanDerWaalsContact C-N 3.25Å; N54-F56 PolarHBondContact O-N 3.38Å; F56-S58 PolarHBondContact O-N 3.3Å; F56-S58 VanDerWaalsContact O-N 3.14Å
57	S	22	Very low	22.3	Very low	90 Å²	90	148.1 Å²	148.1	63%	0.629	79%	0.794	S	S	*	*			trans	-48.5	115.4	174.2	45.8	0	0	0	0	110.1	L55 I59	L55-S57 VanDerWaalsContact C-N 3.31Å; L55-S57 PolarHBondContact O-N 3.16Å; L55-S57 VanDerWaalsContact O-N 3.11Å; S57-I59 VanDerWaalsContact C-N 3.27Å; S57-I59 PolarHBondContact O-N 3.01Å
58	S	21.3	Very low	22.4	Very low	117 Å²	117	148 Å²	148	82%	0.818	79%	0.791	S	S	*	*			trans	-64.1	89.8	164.4	44	0	0	0	0	108.3	F56 G60	F56-S58 PolarHBondContact O-N 3.3Å; F56-S58 VanDerWaalsContact O-N 3.14Å; S58-G60 PolarHBondContact O-N 3.03Å
59	I	21.6	Very low	22.4	Very low	147 Å²	147	146 Å²	146	75%	0.754	79%	0.786	S	S	*	*			trans	-69.9	86.2	165.2	-63.5	172.5	0	0	0	106.2	S57 T61	S57-I59 VanDerWaalsContact C-N 3.27Å; S57-I59 PolarHBondContact O-N 3.01Å; I59-T61 PolarHBondContact O-N 2.72Å
60	G	21.6	Very low	22	Very low	62 Å²	62	150.2 Å²	150.2	64%	0.639	79%	0.794	S	S	*	*			trans	-62.6	112	172.6	0	0	0	0	0	109.3	S58 R62	S58-G60 PolarHBondContact O-N 3.03Å; G60-R62 PolarHBondContact O-N 3.34Å
61	T	22.8	Very low	22.2	Very low	126 Å²	126	149.9 Å²	149.9	77%	0.773	79%	0.794	S	S	*	*			trans	-68.7	77.9	165.1	41.8	0	0	0	0	108.9	I59 L63	I59-T61 PolarHBondContact O-N 2.72Å; T61-L63 PolarHBondContact O-N 3.45Å
62	R	21.3	Very low	22.2	Very low	233 Å²	233	153.7 Å²	153.7	88%	0.879	80%	0.796	S	S	*	*			trans	-66.6	89.2	160.1	-89	-174.6	172.1	-178	-1.3	107.7	G60 N64	G60-R62 PolarHBondContact O-N 3.34Å; R62-N64 VanDerWaalsContact C-N 3.35Å; R62-N64 PolarHBondContact O-N 3.24Å
63	L	23.7	Very low	22.2	Very low	153 Å²	153	156.1 Å²	156.1	80%	0.801	80%	0.797	S	S	*	*			trans	-65.3	98.2	162.6	-90.4	148	0	0	0	107.8	T61 F65	T61-L63 PolarHBondContact O-N 3.45Å; L63-F65 PolarHBondContact O-N 2.76Å; L63-F65 VanDerWaalsContact O-N 3.1Å
64	N	22.7	Very low	22.2	Very low	140 Å²	140	160.9 Å²	160.9	75%	0.749	81%	0.808	S	S	*	*			trans	-60	107.8	171.9	-77.7	-28.3	0	0	0	109.4	R62 M66	R62-N64 VanDerWaalsContact C-N 3.35Å; R62-N64 PolarHBondContact O-N 3.24Å; N64-M66 PolarHBondContact O-N 3.04Å
65	F	22.4	Very low	22.2	Very low	187 Å²	187	157.2 Å²	157.2	82%	0.82	80%	0.804	S	S	*	*			trans	-62.5	94	164.1	-89.4	-92.8	0	0	0	109.5	L63 N67	L63-F65 PolarHBondContact O-N 2.76Å; L63-F65 VanDerWaalsContact O-N 3.1Å; F65-N67 PolarHBondContact O-N 3.01Å
66	M	21.9	Very low	22.3	Very low	164 Å²	164	157.2 Å²	157.2	81%	0.808	81%	0.805	S	S	*	*			trans	-84	74.3	162	-84.3	-86.8	-92.8	0	0	108.7	N64	N64-M66 PolarHBondContact O-N 3.04Å
67	N	21.7	Very low	22.3	Very low	145 Å²	145	153.9 Å²	153.9	78%	0.775	80%	0.8	S	S	*	*			trans	-90.8	99.4	166.2	-113.7	-7.2	0	0	0	108.1	F65	F65-N67 PolarHBondContact O-N 3.01Å
68	K	22.4	Very low	22.3	Very low	173 Å²	173	155.5 Å²	155.5	75%	0.752	81%	0.806	S	S	*	*			trans	-102.9	139.7	160.4	-82.6	-175.1	177.4	177.4	0	108.6
69	T	23.3	Very low	22.5	Very low	132 Å²	132	157.3 Å²	157.3	81%	0.81	81%	0.807	S	S	*	*			trans	85.3	84	168.7	67	0	0	0	0	119.3
70	K	21.9	Very low	22.5	Very low	190 Å²	190	157.5 Å²	157.5	83%	0.826	81%	0.809	S	S	*	*				40.9	106.8	120.7	-66.7	-179	177	179.4	0	118.1
71	N	24.3	Very low	22.6	Very low	159 Å²	159	160.1 Å²	160.1	85%	0.85	81%	0.812	S	S	*	*				168.3	144.1	95.4	-94.2	-22.2	0	0	0	112
72	K	21.4	Very low	22.6	Very low	195 Å²	195	160.7 Å²	160.7	85%	0.848	81%	0.81	S	S	*	*			trans	-54	139.1	-172.9	-65.4	165.5	172.2	177.4	0	115
73	R	23	Very low	22.6	Very low	252 Å²	252	155.9 Å²	155.9	95%	0.951	80%	0.802	S	S	*	*				-175.3	140.9	110.4	-95.5	172.5	-173.5	-172.8	2.1	110.6
74	Q	21.4	Very low	22.6	Very low	205 Å²	205	153.6 Å²	153.6	96%	0.958	80%	0.799	S	S	*	*			trans	-66.4	147.3	-173	-70.4	157.2	-44	0	0	112.9
75	G	23.1	Very low	22.6	Very low	68 Å²	68	156.5 Å²	156.5	70%	0.701	81%	0.805	S	S	*	*			trans	170.6	95.6	167.6	0	0	0	0	0	112
76	D	22.3	Very low	22.4	Very low	171 Å²	171	150.9 Å²	150.9	91%	0.914	80%	0.8	S	S	*	*			trans	54.7	97.5	157.2	-57.3	-21.8	0	0	0	120.4
77	V	21.8	Very low	22.4	Very low	123 Å²	123	148.6 Å²	148.6	75%	0.745	80%	0.799	S	S	*	*			trans	-106.1	120.2	159	175.2	0	0	0	0	108
78	T	23.1	Very low	22.3	Very low	124 Å²	124	149.4 Å²	149.4	76%	0.761	80%	0.802	S	S	*	*			trans	-178.5	107.8	133.4	34.9	0	0	0	0	110.4
79	N	24.3	Very low	22.3	Very low	154 Å²	154	150.3 Å²	150.3	82%	0.824	81%	0.807	S	S	*	*			trans	179.5	70.9	137.3	-88.6	-20.7	0	0	0	108.6	V81	N79-V81 PolarHBondContact O-N 2.89Å
80	L	23	Very low	22.2	Very low	152 Å²	152	151.4 Å²	151.4	80%	0.796	81%	0.806	S	S	*	*			trans	-70.6	105	160.8	-90.5	107.3	0	0	0	107.9	N82	L80-N82 PolarHBondContact O-N 3.45Å; L80-N82 VanDerWaalsContact O-N 3.09Å
81	V	23.6	Very low	22.2	Very low	116 Å²	116	151.8 Å²	151.8	70%	0.703	81%	0.808	S	S	*	*			trans	-71.8	98.7	168.7	179.1	0	0	0	0	107.9	N79 N83	N79-V81 PolarHBondContact O-N 2.89Å; V81-N83 PolarHBondContact O-N 3.01Å
82	N	22.4	Very low	22.1	Very low	139 Å²	139	147.9 Å²	147.9	74%	0.743	80%	0.804	S	S	*	*			trans	-64.6	97.3	166.6	-85.4	-20.4	0	0	0	109.3	L80 S84	L80-N82 PolarHBondContact O-N 3.45Å; L80-N82 VanDerWaalsContact O-N 3.09Å; N82-S84 PolarHBondContact O-N 3.15Å
83	N	21.3	Very low	22.1	Very low	132 Å²	132	142.1 Å²	142.1	71%	0.706	80%	0.801	S	S	*	*			trans	-76.5	70.1	165.6	-78.1	-21.1	0	0	0	109.8	V81	V81-N83 PolarHBondContact O-N 3.01Å
84	S	22.5	Very low	22.3	Very low	105 Å²	105	138.7 Å²	138.7	73%	0.734	80%	0.798	S	S	*	*			trans	-87.8	104.8	166.2	55.1	0	0	0	0	109.1	N82 G86	N82-S84 PolarHBondContact O-N 3.15Å; S84-G86 PolarHBondContact O-N 2.82Å; S84-G86 VanDerWaalsContact O-N 3.15Å
85	F	22.7	Very low	22.3	Very low	200 Å²	200	133.2 Å²	133.2	88%	0.877	79%	0.788	S	S	*	*			trans	-64	104.5	171.9	-72.7	-95.1	0	0	0	109.9
86	G	20	Very low	22.5	Very low	70 Å²	70	137.3 Å²	137.3	72%	0.722	79%	0.794	S	S	*	*			trans	-94.9	105.5	171.6	0	0	0	0	0	110.8	S84 L88	S84-G86 PolarHBondContact O-N 2.82Å; S84-G86 VanDerWaalsContact O-N 3.15Å; G86-L88 PolarHBondContact O-N 3.3Å
87	C	21.3	Very low	22.5	Very low	115 Å²	115	137.7 Å²	137.7	78%	0.777	79%	0.79	S	S	*	*			trans	-69.1	108.8	167.7	-72.2	0	0	0	0	109.6	F89	C87-F89 PolarHBondContact O-N 3.16Å
88	L	20.2	Very low	22.7	Very low	163 Å²	163	137.9 Å²	137.9	85%	0.853	79%	0.792	S	S	*	*			trans	-85.2	101.1	170.9	-107.8	143.9	0	0	0	109.1	G86 I90	G86-L88 PolarHBondContact O-N 3.3Å; L88-I90 PolarHBondContact O-N 3.09Å
89	F	20.6	Very low	22.8	Very low	192 Å²	192	137.5 Å²	137.5	84%	0.842	79%	0.794	S	S	*	*			trans	-73.7	114.2	170.5	-89	-92.9	0	0	0	109.9	C87	C87-F89 PolarHBondContact O-N 3.16Å
90	I	21.4	Very low	22.7	Very low	154 Å²	154	136 Å²	136	79%	0.79	80%	0.796	S	S	*	*			trans	-99.1	102.4	168.5	-58.5	178.2	0	0	0	107.2	L88 G92	L88-I90 PolarHBondContact O-N 3.09Å; I90-G92 PolarHBondContact O-N 2.65Å
91	K	22.4	Very low	22.9	Very low	199 Å²	199	132.6 Å²	132.6	87%	0.865	80%	0.797	S	S	*	*			trans	-61.4	119.6	169.6	-92.9	-179.4	172	179.4	0	109	G93	K91-G93 PolarHBondContact O-N 3.21Å; K91-G93 VanDerWaalsContact O-N 3.12Å
92	G	22.4	Very low	22.9	Very low	76 Å²	76	137.6 Å²	137.6	78%	0.784	81%	0.809	S	S	*	*			trans	-65.5	105	168.8	0	0	0	0	0	109.9	I90 M94	I90-G92 PolarHBondContact O-N 2.65Å; G92-M94 PolarHBondContact O-N 3.26Å
93	G	22.2	Very low	22.9	Very low	75 Å²	75	134.4 Å²	134.4	77%	0.773	81%	0.809	S	S	*	*			trans	-78.3	105.5	164.1	0	0	0	0	0	108.2	K91 A95	K91-G93 PolarHBondContact O-N 3.21Å; K91-G93 VanDerWaalsContact O-N 3.12Å; G93-A95 PolarHBondContact O-N 3.1Å
94	M	25.8	Very low	23	Very low	179 Å²	179	138 Å²	138	88%	0.882	82%	0.819	S	S	*	*			trans	-69.8	107	164	-71.2	-147.1	-74.5	0	0	108.1	G92	G92-M94 PolarHBondContact O-N 3.26Å
95	A	22.9	Very low	23	Very low	91 Å²	91	137.3 Å²	137.3	75%	0.752	82%	0.819	S	S	*	*			trans	-77.5	113.1	157.2	0	0	0	0	0	106.4	G93	G93-A95 PolarHBondContact O-N 3.1Å
96	N	26.5	Very low	23	Very low	154 Å²	154	133 Å²	133	82%	0.824	81%	0.814	S	S	*	*			trans	-130.7	128.5	156.8	-91.4	-9.8	0	0	0	108.3
97	E	23	Very low	23.1	Very low	178 Å²	178	136.9 Å²	136.9	83%	0.832	82%	0.818	S	S	*	*			trans	-65.7	148.1	-175	-61.5	174.1	142.3	0	0	111.4
98	T	24.5	Very low	23.3	Very low	128 Å²	128	138.3 Å²	138.3	79%	0.785	82%	0.824	S	S	*	*			trans	43.3	105	140.7	60.3	0	0	0	0	118.7
99	S	25.5	Very low	23.4	Very low	116 Å²	116	139 Å²	139	81%	0.811	82%	0.822	S	S	*	*				-172	119.2	116.8	55.1	0	0	0	0	111.2
100	S	23.5	Very low	23.6	Very low	123 Å²	123	136.6 Å²	136.6	86%	0.86	82%	0.818	S	S	*	*			trans	-45.3	138.9	156.6	50.2	0	0	0	0	112.9
101	G	26	Very low	23.8	Very low	80 Å²	80	137.2 Å²	137.2	83%	0.825	82%	0.823	S	S	*	*			trans	157.3	102.7	162.8	0	0	0	0	0	114.4
102	K	23.1	Very low	24	Very low	221 Å²	221	134.1 Å²	134.1	96%	0.961	82%	0.816	S	S	*	*			trans	-58	147.2	174.5	-63.8	165.5	173.1	173.1	0	112
103	G	23	Very low	24.1	Very low	72 Å²	72	139.5 Å²	139.5	74%	0.742	82%	0.82	S	S	*	*			trans	145.5	94.6	147.8	0	0	0	0	0	117.9
104	K	23.2	Very low	24.1	Very low	207 Å²	207	145.3 Å²	145.3	90%	0.9	82%	0.821	S	S	*	*			trans	39.7	121.7	136.4	-66.8	-176.6	176.9	-179.7	0	121.3
105	A	21.9	Very low	23.9	Very low	90 Å²	90	145.9 Å²	145.9	74%	0.744	82%	0.821	S	S	*	*				84.3	137.3	124.4	0	0	0	0	0	121.5
106	S	23	Very low	23.9	Very low	110 Å²	110	151.2 Å²	151.2	77%	0.769	82%	0.823	S	S	*	*			trans	72.5	112.6	155.1	57.3	0	0	0	0	120.6
107	N	21.8	Very low	23.7	Very low	152 Å²	152	149.7 Å²	149.7	81%	0.813	82%	0.821	S	S	*	*			trans	20.1	123.3	134.6	-69.5	-7.1	0	0	0	118.2
108	T	25.7	Very low	23.6	Very low	145 Å²	145	148.3 Å²	148.3	89%	0.89	82%	0.818	S	S	*	*				-175.8	144.1	118.3	24.8	0	0	0	0	110.9
109	H	23.2	Very low	23.5	Very low	176 Å²	176	151.1 Å²	151.1	82%	0.815	82%	0.822	S	S	*	*			trans	-52	142.5	172.2	-80.9	-86.7	0	0	0	113.4
110	N	25.2	Very low	23.3	Very low	142 Å²	142	151.3 Å²	151.3	76%	0.759	81%	0.813	S	S	*	*				164.9	93.3	129.3	-83.7	-15.6	0	0	0	110.4
111	D	25.5	Very low	23.1	Very low	168 Å²	168	151.5 Å²	151.5	90%	0.898	81%	0.813	S	S	*	*			trans	-106.3	105.7	164.4	-79.8	-33.5	0	0	0	109.1	E113	D111-E113 PolarHBondContact O-N 3.26Å
112	N	25	Very low	22.9	Very low	134 Å²	134	153.8 Å²	153.8	72%	0.717	81%	0.807	S	S	*	*			trans	-70.1	106.4	172.3	-71	-40.3	0	0	0	109.4	Y114	N112-Y114 PolarHBondContact O-N 2.85Å
113	E	24.7	Very low	22.8	Very low	188 Å²	188	150.7 Å²	150.7	88%	0.879	80%	0.801	S	S	*	*			trans	-73.5	109.2	171.1	-77.5	-174.4	153.9	0	0	110.6	D111 Q115	D111-E113 PolarHBondContact O-N 3.26Å; E113-Q115 PolarHBondContact O-N 2.92Å
114	Y	22.9	Very low	22.7	Very low	198 Å²	198	156.9 Å²	156.9	78%	0.776	81%	0.807	S	S	*	*			trans	-69.9	112.2	168.7	-73	-91.7	0	0	0	110.2	N112	N112-Y114 PolarHBondContact O-N 2.85Å
115	Q	21.5	Very low	22.6	Very low	191 Å²	191	156.1 Å²	156.1	89%	0.893	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-75.6	119.4	173	-79.3	175.5	-28.3	0	0	111	E113	E113-Q115 PolarHBondContact O-N 2.92Å
116	Y	22.2	Very low	22.7	Very low	203 Å²	203	158.5 Å²	158.5	80%	0.796	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-91.5	131.3	163.9	-73.1	-86	0	0	0	109.7	I118	Y116-I118 PolarHBondContact O-N 3.18Å
117	P	22.3	Very low	22.6	Very low	121 Å²	121	157.7 Å²	157.7	79%	0.786	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-75.8	125.7	-177.3	30	-31.5	0	0	0	110.6	E119	P117-E119 PolarHBondContact O-N 3.03Å
118	I	22.8	Very low	22.7	Very low	150 Å²	150	157 Å²	157	77%	0.769	80%	0.796	S	S	*	*			trans	-84.8	104.2	173	-61	169.6	0	0	0	107	Y116 I120	Y116-I118 PolarHBondContact O-N 3.18Å; I118-I120 HydrophobicContact CG2-CG1 4.01Å; I118-I120 PolarHBondContact O-N 3.39Å; I118-I120 VanDerWaalsContact O-N 3.16Å
119	E	20.5	Very low	22.5	Very low	186 Å²	186	158.8 Å²	158.8	87%	0.869	79%	0.794	S	S	*	*			trans	-74.7	100.9	168.9	-77.2	-170.8	158.7	0	0	109.8	P117 C121	P117-E119 PolarHBondContact O-N 3.03Å; E119-C121 PolarHBondContact O-N 2.72Å
120	I	22.8	Very low	22.5	Very low	120 Å²	120	156 Å²	156	62%	0.615	79%	0.79	S	S	*	*			trans	-79	104.3	171.6	-55.6	174.2	0	0	0	107.3	I118 N122	I118-I120 HydrophobicContact CG2-CG1 4.01Å; I118-I120 PolarHBondContact O-N 3.39Å; I118-I120 VanDerWaalsContact O-N 3.16Å; I120-N122 VanDerWaalsContact CG2-OD1 3.32Å; I120-N122 WeakPolarHBondContact CG2-OD1 3.48Å; I120-N122 PolarHBondContact O-N 3.04Å
121	C	18.7	Very low	22.4	Very low	128 Å²	128	156.6 Å²	156.6	87%	0.865	79%	0.788	S	S	*	*			trans	-63.1	91.4	170.3	-91	0	0	0	0	110.8	E119	E119-C121 PolarHBondContact O-N 2.72Å
122	N	22.2	Very low	22.4	Very low	128 Å²	128	155.2 Å²	155.2	68%	0.684	78%	0.779	S	S	*	*			trans	-93.8	30.1	-179.1	-86.2	-22.7	0	0	0	114.3	I120 F124	I120-N122 VanDerWaalsContact CG2-OD1 3.32Å; I120-N122 WeakPolarHBondContact CG2-OD1 3.48Å; I120-N122 PolarHBondContact O-N 3.04Å; N122-F124 PolarHBondContact O-N 3.36Å
123	N	21.2	Very low	22.3	Very low	156 Å²	156	154.5 Å²	154.5	83%	0.834	78%	0.78	S	S	*	*			trans	-101.4	39	-174.5	-75.1	-4.1	0	0	0	115.2	Q125	N123-Q125 PolarHBondContact O-N 3.46Å
124	F	20.9	Very low	22.4	Very low	201 Å²	201	152.6 Å²	152.6	88%	0.882	77%	0.771	S	S	*	*			trans	-90.6	95	156.2	-92.1	-82.7	0	0	0	108.6	N122 I126	N122-F124 PolarHBondContact O-N 3.36Å; F124-I126 PolarHBondContact O-N 3.31Å
125	Q	21.4	Very low	22.5	Very low	192 Å²	192	147.5 Å²	147.5	90%	0.897	76%	0.757	S	S	*	*			trans	-58.9	101.1	169.3	-74.8	-177.8	-17.7	0	0	108.9	N123 S127	N123-Q125 PolarHBondContact O-N 3.46Å; Q125-S127 PolarHBondContact O-N 2.94Å; Q125-S127 VanDerWaalsContact O-N 3.17Å
126	I	23.4	Very low	22.7	Very low	139 Å²	139	147 Å²	147	71%	0.713	75%	0.748	S	S	*	*			trans	-64.3	111.9	168.2	-62.4	168.3	0	0	0	106	F124 N128	F124-I126 PolarHBondContact O-N 3.31Å; I126-N128 PolarHBondContact O-N 3.33Å
127	S	20.8	Very low	23	Very low	93 Å²	93	145.5 Å²	145.5	65%	0.65	75%	0.746	S	S	*	*			trans	-52.2	128	176.6	55.8	0	0	0	0	110.8	Q125 H129	Q125-S127 PolarHBondContact O-N 2.94Å; Q125-S127 VanDerWaalsContact O-N 3.17Å; S127-H129 PolarHBondContact O-N 3.04Å
128	N	24.1	Very low	23.4	Very low	137 Å²	137	146.4 Å²	146.4	73%	0.733	74%	0.739	S	S	*	*	S	Bend	trans	-63.3	28	-170.8	-76.4	-26.9	0	0	0	117.3	I126	I126-N128 PolarHBondContact O-N 3.33Å
129	H	21.8	Very low	23.6	Very low	184 Å²	184	144.3 Å²	144.3	85%	0.852	73%	0.729	S	S	*	*			trans	-98.7	12.9	-179.7	-79.3	-57.4	0	0	0	116.1	S127	S127-H129 PolarHBondContact O-N 3.04Å
130	T	23.4	Very low	23.8	Very low	118 Å²	118	143 Å²	143	72%	0.724	72%	0.721	S	S	*	*			trans	-127	45.7	171.5	52.5	0	0	0	0	112.7	I132	T130-I132 VanDerWaalsContact C-N 3.26Å; T130-I132 PolarHBondContact O-N 3.36Å
131	Q	23.2	Very low	24.1	Very low	153 Å²	153	141.6 Å²	141.6	72%	0.715	72%	0.721	S	S	*	*			trans	-87.7	68.8	157.1	-76.1	-174.3	-7.3	0	0	109.9	T133	Q131-T133 VanDerWaalsContact C-N 3.35Å
132	I	24.7	Very low	24.6	Very low	140 Å²	140	140.6 Å²	140.6	72%	0.718	71%	0.711	S	S	*	*			trans	-97.3	84.3	145.2	-58.6	176.5	0	0	0	104.4	T130 H134	T130-I132 VanDerWaalsContact C-N 3.26Å; T130-I132 PolarHBondContact O-N 3.36Å; I132-H134 PolarHBondContact O-N 3.23Å
133	T	23.2	Very low	24.7	Very low	119 Å²	119	140.8 Å²	140.8	73%	0.73	71%	0.711	S	S	*	*			trans	-66.2	90.2	169.9	46.6	0	0	0	0	107.2	Q131 D135	Q131-T133 VanDerWaalsContact C-N 3.35Å; T133-D135 PolarHBondContact O-N 2.82Å; T133-D135 VanDerWaalsContact O-N 3.15Å
134	H	25.7	Very low	25	Very low	147 Å²	147	139.2 Å²	139.2	68%	0.681	71%	0.707	S	S	*	*			trans	-55.7	119.5	159.6	-76.9	-70.6	0	0	0	107.1	I132 Y136	I132-H134 PolarHBondContact O-N 3.23Å; H134-Y136 PolarHBondContact O-N 2.81Å
135	D	24.7	Very low	25.2	Very low	92 Å²	92	141.7 Å²	141.7	49%	0.492	71%	0.711	S	S	.	*			trans	-57.9	97.8	-177.1	-168.8	-2	0	0	0	109.3	T133 K137 Q138	T133-D135 PolarHBondContact O-N 2.82Å; T133-D135 VanDerWaalsContact O-N 3.15Å; D135-K137 PolarHBondContact O-N 2.99Å; D135-K137 WeakPolarHBondContact OD1-CB 3.47Å; D135-K137 PolarHBondContact OD1-N 3.33Å; D135-Q138 HydrophobicContact CB-CG 4.32Å; D135-Q138 WeakPolarHBondContact O-CB 3.47Å; D135-Q138 PolarHBondContact O-N 3.32Å
136	Y	26	Very low	25.6	Very low	181 Å²	181	134.8 Å²	134.8	71%	0.71	69%	0.691	S	S	*	*	H	α-helix	trans	-60.7	-17.1	-175.5	-135.2	-87.8	0	0	0	111.5	H134 K140	H134-Y136 PolarHBondContact O-N 2.81Å; Y136-K140 PolarHBondContact O-N 3.04Å
137	K	28.8	Very low	25.8	Very low	171 Å²	171	133.9 Å²	133.9	74%	0.743	70%	0.697	S	S	*	*	H	α-helix	trans	-70.1	-31.6	171.7	-70.3	-176	176.7	178.4	0	112.5	D135 S141	D135-K137 PolarHBondContact O-N 2.99Å; D135-K137 WeakPolarHBondContact OD1-CB 3.47Å; D135-K137 PolarHBondContact OD1-N 3.33Å; K137-S141 PolarHBondContact O-N 3.06Å
138	Q	31.5	Very low	26.2	Very low	139 Å²	139	135 Å²	135	65%	0.65	69%	0.69	S	S	*	*	H	α-helix	trans	-67.8	-40.8	174.8	-72.4	-170.6	-7.3	0	0	111.5	D135 K140 S141	D135-Q138 HydrophobicContact CB-CG 4.32Å; D135-Q138 WeakPolarHBondContact O-CB 3.47Å; D135-Q138 PolarHBondContact O-N 3.32Å; Q138-K140 PolarHBondContact O-N 3.19Å; Q138-S141 PolarHBondContact O-N 2.77Å; Q138-S141 PolarHBondContact O-OG 2.78Å
139	L	26.3	Very low	26.6	Very low	107 Å²	107	132.1 Å²	132.1	56%	0.56	68%	0.681	S	S	*	*	H	α-helix	trans	-70.5	-31.1	179.8	-84.3	162	0	0	0	114.1	T142	L139-T142 PolarHBondContact O-OG1 3.33Å
140	K	25.5	Very low	27.2	Very low	159 Å²	159	127.8 Å²	127.8	69%	0.691	68%	0.677	S	S	*	*	H	α-helix	trans	-75.6	-25.3	175.3	-99	-176.1	177.1	177.9	0	113.7	Y136 Q138 T142 I143	Y136-K140 PolarHBondContact O-N 3.04Å; Q138-K140 PolarHBondContact O-N 3.19Å; K140-T142 PolarHBondContact O-N 2.77Å; K140-I143 PolarHBondContact O-N 3.11Å
141	S	29.1	Very low	27.7	Very low	89 Å²	89	128.8 Å²	128.8	62%	0.622	68%	0.678	S	S	*	*	H	α-helix	trans	-68.8	-20.2	-179.6	71.4	0	0	0	0	113.7	K137 Q138	K137-S141 PolarHBondContact O-N 3.06Å; Q138-S141 PolarHBondContact O-N 2.77Å; Q138-S141 PolarHBondContact O-OG 2.78Å
142	T	27.8	Very low	28.3	Very low	107 Å²	107	126.1 Å²	126.1	66%	0.656	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-3.4	179.9	32.8	0	0	0	0	115.4	L139 K140 T144	L139-T142 PolarHBondContact O-OG1 3.33Å; K140-T142 PolarHBondContact O-N 2.77Å; T142-T144 VanDerWaalsContact C-N 3.28Å; T142-T144 PolarHBondContact O-N 3.38Å
143	I	26.2	Very low	28.9	Very low	133 Å²	133	123.1 Å²	123.1	68%	0.682	65%	0.651	S	S	*	*			trans	-93.8	66.2	172.2	-48.9	176.9	0	0	0	108.2	K140 R145	K140-I143 PolarHBondContact O-N 3.11Å; I143-R145 PolarHBondContact O-N 3.13Å; I143-R145 VanDerWaalsContact O-N 3.16Å
144	T	27.2	Very low	29.7	Very low	123 Å²	123	122.3 Å²	122.3	76%	0.755	64%	0.642	S	S	*	*			trans	-61.1	116.9	164.9	36.6	0	0	0	0	108	T142 G146	T142-T144 VanDerWaalsContact C-N 3.28Å; T142-T144 PolarHBondContact O-N 3.38Å; T144-G146 PolarHBondContact O-N 3.25Å
145	R	25.4	Very low	30.6	Very low	252 Å²	252	118 Å²	118	95%	0.951	62%	0.624	S	S	*	*			trans	-58.7	81.1	171.8	-70.8	176	172.6	169.7	-4.1	109.6	I143 S147	I143-R145 PolarHBondContact O-N 3.13Å; I143-R145 VanDerWaalsContact O-N 3.16Å; R145-S147 PolarHBondContact O-N 3.46Å
146	G	28.9	Very low	31.4	Very low	47 Å²	47	114.1 Å²	114.1	49%	0.485	60%	0.603	S	S	.	*			trans	-80.8	109.1	169.4	0	0	0	0	0	108.8	T144 F148	T144-G146 PolarHBondContact O-N 3.25Å; G146-F148 PolarHBondContact O-N 2.89Å
147	S	26.7	Very low	32	Very low	120 Å²	120	107 Å²	107	84%	0.839	58%	0.577	S	S	*	*			trans	-58.3	105.9	161.4	52.8	0	0	0	0	107.8	R145 S149	R145-S147 PolarHBondContact O-N 3.46Å; S147-S149 PolarHBondContact O-N 3.35Å
148	F	29.5	Very low	32.7	Very low	116 Å²	116	107 Å²	107	51%	0.509	58%	0.58	S	S	.	*			trans	-64	109	177.5	-66.4	-78.4	0	0	0	108.4	G146 A150	G146-F148 PolarHBondContact O-N 2.89Å; F148-A150 PolarHBondContact O-N 2.86Å
149	S	32.5	Very low	33.3	Very low	77 Å²	77	104.2 Å²	104.2	54%	0.538	57%	0.572	S	S	.	*			trans	-62	129	168.1	77.1	0	0	0	0	107	S147 N151	S147-S149 PolarHBondContact O-N 3.35Å; S149-N151 PolarHBondContact O-N 3.34Å
150	A	34.6	Very low	34	Very low	93 Å²	93	99.7 Å²	99.7	77%	0.769	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	4.2	-161.2	0	0	0	0	0	116.6	F148	F148-A150 PolarHBondContact O-N 2.86Å
151	N	33.9	Very low	34.8	Very low	139 Å²	139	95.5 Å²	95.5	74%	0.743	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.1	-1.4	-167.9	-71.2	-33	0	0	0	117.6	S149	S149-N151 PolarHBondContact O-N 3.34Å
152	N	36.4	Very low	35.4	Very low	97 Å²	97	100.3 Å²	100.3	52%	0.519	55%	0.547	S	S	.	.			trans	-108.8	85	177.9	-91.6	-8	0	0	0	112.7	N154 D155	N152-N154 PolarHBondContact O-N 2.85Å; N152-D155 WeakPolarHBondContact O-CB 3.49Å; N152-D155 PolarHBondContact O-N 3.38Å
153	F	38.2	Very low	35.9	Very low	77 Å²	77	98.8 Å²	98.8	34%	0.338	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-21.3	170.9	-84.2	-99.3	0	0	0	113.7	D155 I156 L184 L240	F153-D155 PolarHBondContact O-N 3.37Å; F153-I156 HydrophobicContact CD1-CD1 3.72Å; F153-I156 HydrophobicContact CE1-CD1 4.25Å; F153-I156 HydrophobicContact CG-CD1 4.32Å; F153-I156 VanDerWaalsContact O-CB 3.25Å; F153-I156 WeakPolarHBondContact O-CB 3.32Å; F153-I156 PolarHBondContact O-N 3.35Å; F153-I156 VanDerWaalsContact O-N 3.16Å; F153-L184 HydrophobicContact CD1-CD2 4.24Å; F153-L184 HydrophobicContact CE1-CD2 3.48Å; F153-L184 VanDerWaalsContact CE1-CD2 3.48Å; F153-L184 HydrophobicContact CZ-CD2 4.26Å; F153-L240 HydrophobicContact CB-CD2 3.88Å; F153-L240 HydrophobicContact CD1-CD1 4.3Å; F153-L240 HydrophobicContact CD1-CD2 4.43Å; F153-L240 HydrophobicContact CG-CD2 4.13Å
154	N	39.8	Very low	36.7	Very low	102 Å²	102	96.9 Å²	96.9	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-62.5	-26.6	175.1	-73.6	-20.1	0	0	0	112.9	N152 I156 L157	N152-N154 PolarHBondContact O-N 2.85Å; N154-I156 PolarHBondContact O-N 3.48Å; N154-L157 WeakPolarHBondContact O-CB 3.26Å; N154-L157 PolarHBondContact O-N 2.79Å
155	D	42.9	Very low	37.2	Very low	58 Å²	58	101.5 Å²	101.5	31%	0.31	54%	0.539	S	S	.	.	H	α-helix	trans	-67.7	-29.4	177.6	-62	-19.5	0	0	0	111.3	N152 F153 L157 Q158	N152-D155 WeakPolarHBondContact O-CB 3.49Å; N152-D155 PolarHBondContact O-N 3.38Å; F153-D155 PolarHBondContact O-N 3.37Å; D155-L157 VanDerWaalsContact C-N 3.27Å; D155-L157 PolarHBondContact O-N 3.29Å; D155-Q158 PolarHBondContact O-N 2.79Å
156	I	42.1	Very low	38	Very low	9 Å²	9	99.8 Å²	99.8	5%	0.046	53%	0.532	C	S	.	.	H	α-helix	trans	-62.1	-37.5	176	-56.9	-178.2	0	0	0	110.4	F153 N154 Q158 V159 L180 I183 L184	F153-I156 HydrophobicContact CD1-CD1 3.72Å; F153-I156 HydrophobicContact CE1-CD1 4.25Å; F153-I156 HydrophobicContact CG-CD1 4.32Å; F153-I156 VanDerWaalsContact O-CB 3.25Å; F153-I156 WeakPolarHBondContact O-CB 3.32Å; F153-I156 PolarHBondContact O-N 3.35Å; F153-I156 VanDerWaalsContact O-N 3.16Å; N154-I156 PolarHBondContact O-N 3.48Å; I156-Q158 VanDerWaalsContact C-N 3.31Å; I156-Q158 PolarHBondContact O-N 3.26Å; I156-V159 PolarHBondContact O-N 3.21Å; I156-L180 HydrophobicContact CG2-CD2 3.79Å; I156-I183 HydrophobicContact CB-CG2 4.32Å; I156-I183 HydrophobicContact CD1-CG2 3.88Å; I156-I183 HydrophobicContact CG1-CG2 3.77Å; I156-I183 HydrophobicContact CG2-CB 4.2Å; I156-I183 HydrophobicContact CG2-CD1 3.72Å; I156-I183 HydrophobicContact CG2-CG2 3.85Å; I156-L184 HydrophobicContact CD1-CD2 3.94Å
157	L	38.6	Very low	38.7	Very low	33 Å²	33	98.5 Å²	98.5	17%	0.173	52%	0.515	C	S	.	.	H	α-helix	trans	-68	-29.4	-176.6	-64.2	-178.6	0	0	0	113.4	N154 D155 V159 I160 W229 M238	N154-L157 WeakPolarHBondContact O-CB 3.26Å; N154-L157 PolarHBondContact O-N 2.79Å; D155-L157 VanDerWaalsContact C-N 3.27Å; D155-L157 PolarHBondContact O-N 3.29Å; L157-V159 PolarHBondContact O-N 3.19Å; L157-I160 HydrophobicContact CD2-CD1 3.82Å; L157-I160 PolarHBondContact O-N 3.35Å; L157-W229 HydrophobicContact CD2-CH2 3.49Å; L157-W229 VanDerWaalsContact CD2-CH2 3.49Å; L157-W229 HydrophobicContact CD2-CZ3 3.32Å; L157-W229 HydrophobicContact CG-CH2 4.4Å; L157-M238 HydrophobicContact CD1-CB 4.01Å; L157-M238 VanDerWaalsContact CD1-O 3.26Å; L157-M238 WeakPolarHBondContact CD1-O 3.43Å; L157-M238 HydrophobicContact CD2-CB 3.47Å; L157-M238 VanDerWaalsContact CD2-CB 3.47Å; L157-M238 HydrophobicContact CD2-CG 4.23Å; L157-M238 HydrophobicContact CD2-SD 3.98Å; L157-M238 HydrophobicContact CG-CB 4.29Å
158	Q	44.1	Very low	39.6	Very low	171 Å²	171	95.6 Å²	95.6	80%	0.799	49%	0.494	S	S	*	.	H	α-helix	trans	-68.7	-24.1	178.5	-64.5	-169.4	5.4	0	0	112.3	D155 I156	D155-Q158 PolarHBondContact O-N 2.79Å; I156-Q158 VanDerWaalsContact C-N 3.31Å; I156-Q158 PolarHBondContact O-N 3.26Å
159	V	43.8	Very low	40.6	Very low	80 Å²	80	96.3 Å²	96.3	49%	0.485	50%	0.502	S	S	.	.	H	α-helix	trans	-80.8	-22.9	179.5	-174.1	0	0	0	0	111.6	I156 L157 P161 I183	I156-V159 PolarHBondContact O-N 3.21Å; L157-V159 PolarHBondContact O-N 3.19Å; V159-P161 VanDerWaalsContact O-CD 3.29Å; V159-P161 WeakPolarHBondContact O-CD 3.46Å; V159-I183 HydrophobicContact CB-CD1 4.16Å; V159-I183 HydrophobicContact CG1-CD1 4.16Å
160	I	41.7	Very low	41.5	Very low	12 Å²	12	96.2 Å²	96.2	6%	0.062	49%	0.49	C	S	.	.	S	Bend	trans	-74.8	116.7	-174.9	-54.2	170.5	0	0	0	109.2	L157 K162 I176 L180 W229 M238	L157-I160 HydrophobicContact CD2-CD1 3.82Å; L157-I160 PolarHBondContact O-N 3.35Å; I160-K162 PolarHBondContact O-N 3.08Å; I160-I176 HydrophobicContact CD1-CG2 4.46Å; I160-I176 HydrophobicContact CG2-CG1 3.93Å; I160-L180 HydrophobicContact CD1-CD2 3.88Å; I160-L180 HydrophobicContact CD1-CG 4.3Å; I160-W229 HydrophobicContact CD1-CZ3 4.37Å; I160-M238 HydrophobicContact CB-CE 3.84Å; I160-M238 HydrophobicContact CB-SD 4.4Å; I160-M238 HydrophobicContact CD1-CE 4.14Å; I160-M238 HydrophobicContact CD1-SD 3.56Å; I160-M238 VanDerWaalsContact CD1-SD 3.56Å; I160-M238 HydrophobicContact CG2-CE 3.33Å; I160-M238 HydrophobicContact CG2-SD 4.21Å
161	P	41.4	Very low	42.3	Very low	71 Å²	71	93 Å²	93	46%	0.461	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-62	133.9	-177.7	22.8	-31.2	0	0	0	110.3	V159	V159-P161 VanDerWaalsContact O-CD 3.29Å; V159-P161 WeakPolarHBondContact O-CD 3.46Å
162	K	42.8	Very low	43.3	Very low	189 Å²	189	86.9 Å²	86.9	82%	0.822	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-56.2	132.7	175.5	-68	-178.4	-179.9	178.8	0	109	I160 I164	I160-K162 PolarHBondContact O-N 3.08Å; K162-I164 PolarHBondContact O-N 2.91Å
163	P	37.8	Very low	44.1	Very low	76 Å²	76	83.4 Å²	83.4	49%	0.494	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-58.1	125.9	-178.8	21.3	-30.8	0	0	0	110.1
164	I	41.6	Very low	45	Very low	92 Å²	92	79.9 Å²	79.9	47%	0.472	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-66.9	134.2	175.3	-58.1	176	0	0	0	107.1	K162 R166 T167 Y270	K162-I164 PolarHBondContact O-N 2.91Å; I164-R166 PolarHBondContact O-N 3.43Å; I164-T167 PolarHBondContact O-N 3.05Å; I164-T167 PolarHBondContact O-OG1 2.79Å; I164-T167 VanDerWaalsContact O-OG1 3.04Å; I164-Y270 HydrophobicContact CD1-CD1 4.03Å; I164-Y270 HydrophobicContact CD1-CE1 3.43Å; I164-Y270 VanDerWaalsContact CD1-CE1 3.43Å; I164-Y270 HydrophobicContact CG1-CE1 4.23Å
165	K	39.6	Very low	45.8	Very low	220 Å²	220	75.7 Å²	75.7	96%	0.957	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-14.9	-174.7	-76.5	-173.9	176.3	-178.2	0	116.4
166	R	41.8	Very low	46.5	Very low	216 Å²	216	74.4 Å²	74.4	82%	0.815	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	2.4	-175.4	-69	-172.8	175.9	177.4	-0.5	115.2	I164 Y269	I164-R166 PolarHBondContact O-N 3.43Å; R166-Y269 PolarHBondContact O-OH 2.97Å
167	T	42.7	Very low	47.3	Very low	21 Å²	21	74 Å²	74	13%	0.129	36%	0.363	C	S	.	.	S	Bend	trans	-73.9	130.4	173.8	44.3	0	0	0	0	110.1	I164 L169 Y269	I164-T167 PolarHBondContact O-N 3.05Å; I164-T167 PolarHBondContact O-OG1 2.79Å; I164-T167 VanDerWaalsContact O-OG1 3.04Å; T167-L169 PolarHBondContact O-N 3.26Å; T167-Y269 HydrophobicContact CG2-CD1 4.12Å; T167-Y269 HydrophobicContact CG2-CE1 3.54Å
168	P	45.9	Very low	48.4	Very low	59 Å²	59	74.8 Å²	74.8	38%	0.383	36%	0.364	S	S	.	.			trans	-55.7	135.7	169.2	-20.6	30.5	0	0	0	109.2	Y170 H171 G172	P168-Y170 PolarHBondContact O-N 3.08Å; P168-H171 WeakPolarHBondContact O-CA 3.29Å; P168-H171 WeakPolarHBondContact O-CB 3.25Å; P168-H171 PolarHBondContact O-N 2.86Å; P168-G172 PolarHBondContact O-N 3.18Å
169	L	49.6	Very low	49.2	Very low	130 Å²	130	68.6 Å²	68.6	68%	0.681	34%	0.335	S	S	*	.	H	α-helix	trans	-51.2	-35.6	-170.4	-165.1	140.8	0	0	0	113.3	T167 G172 L173	T167-L169 PolarHBondContact O-N 3.26Å; L169-G172 PolarHBondContact O-N 3.44Å; L169-L173 HydrophobicContact CD2-CD1 3.91Å; L169-L173 HydrophobicContact CD2-CG 4.43Å; L169-L173 WeakPolarHBondContact O-CG 3.35Å; L169-L173 PolarHBondContact O-N 3.37Å
170	Y	52	Low	50	Low	76 Å²	76	64.8 Å²	64.8	30%	0.298	31%	0.312	S	S	.	.	H	α-helix	trans	-65.7	-38.4	175.5	-170.7	-106.1	0	0	0	113.9	P168 G172 L173 L174 I196 Q262	P168-Y170 PolarHBondContact O-N 3.08Å; Y170-G172 VanDerWaalsContact C-N 3.34Å; Y170-L173 PolarHBondContact O-N 2.85Å; Y170-L174 HydrophobicContact CD1-CD1 3.64Å; Y170-L174 HydrophobicContact CD1-CG 4.28Å; Y170-L174 HydrophobicContact CE1-CD1 3.47Å; Y170-L174 VanDerWaalsContact CE1-CD1 3.47Å; Y170-L174 HydrophobicContact CE1-CD2 4.37Å; Y170-L174 HydrophobicContact CE1-CG 4.03Å; Y170-L174 WeakPolarHBondContact O-CG 3.44Å; Y170-L174 PolarHBondContact O-N 3.43Å; Y170-I196 HydrophobicContact CE2-CD1 4.1Å; Y170-I196 HydrophobicContact CE2-CG2 4.38Å; Y170-Q262 PolarHBondContact OH-NE2 2.77Å
171	H	51.8	Low	50.9	Low	24 Å²	24	69.5 Å²	69.5	11%	0.111	33%	0.329	C	S	.	.	H	α-helix	trans	-65.7	-39.7	174.6	-74.7	83.9	0	0	0	110.9	P168 L174 L175 L266	P168-H171 WeakPolarHBondContact O-CA 3.29Å; P168-H171 WeakPolarHBondContact O-CB 3.25Å; P168-H171 PolarHBondContact O-N 2.86Å; H171-L174 PolarHBondContact O-N 2.98Å; H171-L175 WeakPolarHBondContact O-CG 3.14Å; H171-L175 PolarHBondContact O-N 3.42Å; H171-L175 VanDerWaalsContact O-N 3.13Å; H171-L266 HydrophobicContact CB-CD2 3.62Å; H171-L266 WeakPolarHBondContact O-CD2 3.4Å
172	G	54.3	Low	51.9	Low	11 Å²	11	68.5 Å²	68.5	11%	0.113	32%	0.322	C	S	.	.	H	α-helix	trans	-56.7	-49	171.7	0	0	0	0	0	112.4	P168 L169 Y170 L174 L175 I176	P168-G172 PolarHBondContact O-N 3.18Å; L169-G172 PolarHBondContact O-N 3.44Å; Y170-G172 VanDerWaalsContact C-N 3.34Å; G172-L174 PolarHBondContact O-N 2.86Å; G172-L175 WeakPolarHBondContact O-CB 3.03Å; G172-L175 PolarHBondContact O-N 2.89Å; G172-I176 WeakPolarHBondContact O-CG1 3.23Å; G172-I176 PolarHBondContact O-N 3.14Å; G172-I176 VanDerWaalsContact O-N 3.11Å
173	L	54.4	Low	52.7	Low	25 Å²	25	60.2 Å²	60.2	13%	0.131	29%	0.286	C	S	.	.	H	α-helix	trans	-61.5	-42.6	177.9	-71	171.1	0	0	0	112.5	L169 Y170 L175 I176 A177 I196 I216	L169-L173 HydrophobicContact CD2-CD1 3.91Å; L169-L173 HydrophobicContact CD2-CG 4.43Å; L169-L173 WeakPolarHBondContact O-CG 3.35Å; L169-L173 PolarHBondContact O-N 3.37Å; Y170-L173 PolarHBondContact O-N 2.85Å; L173-L175 VanDerWaalsContact C-N 3.29Å; L173-L175 PolarHBondContact O-N 3.33Å; L173-I176 PolarHBondContact O-N 3.13Å; L173-A177 WeakPolarHBondContact O-CB 3.4Å; L173-A177 PolarHBondContact O-N 3.14Å; L173-I196 HydrophobicContact CB-CD1 3.97Å; L173-I216 HydrophobicContact CD2-CD1 4.08Å; L173-I216 HydrophobicContact CD2-CG1 4.33Å; L173-I216 WeakPolarHBondContact O-CD1 3.17Å
174	L	56.8	Low	53.7	Low	3 Å²	3	56.7 Å²	56.7	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-61.1	-36.2	177.5	-73.9	164.3	0	0	0	112.6	Y170 H171 G172 R178 I196 I258 Q262 L266	Y170-L174 HydrophobicContact CD1-CD1 3.64Å; Y170-L174 HydrophobicContact CD1-CG 4.28Å; Y170-L174 HydrophobicContact CE1-CD1 3.47Å; Y170-L174 VanDerWaalsContact CE1-CD1 3.47Å; Y170-L174 HydrophobicContact CE1-CD2 4.37Å; Y170-L174 HydrophobicContact CE1-CG 4.03Å; Y170-L174 WeakPolarHBondContact O-CG 3.44Å; Y170-L174 PolarHBondContact O-N 3.43Å; H171-L174 PolarHBondContact O-N 2.98Å; G172-L174 PolarHBondContact O-N 2.86Å; L174-R178 WeakPolarHBondContact O-CB 3.33Å; L174-R178 PolarHBondContact O-N 3.41Å; L174-I196 HydrophobicContact CB-CD1 4.46Å; L174-I196 HydrophobicContact CD2-CD1 3.63Å; L174-I196 HydrophobicContact CG-CD1 3.78Å; L174-I258 HydrophobicContact CD2-CB 4.23Å; L174-I258 HydrophobicContact CD2-CG1 3.9Å; L174-I258 HydrophobicContact CD2-CG2 3.88Å; L174-Q262 HydrophobicContact CD1-CB 4.11Å; L174-Q262 HydrophobicContact CD1-CG 4.44Å; L174-Q262 HydrophobicContact CD2-CB 4.39Å; L174-L266 HydrophobicContact CB-CD1 3.47Å; L174-L266 VanDerWaalsContact CB-CD1 3.47Å; L174-L266 HydrophobicContact CD1-CD1 4.32Å
175	L	55.6	Low	54.7	Low	13 Å²	13	54.7 Å²	54.7	7%	0.068	26%	0.256	C	S	.	.	H	α-helix	trans	-67.1	-50.1	174.9	-67.9	158.3	0	0	0	111.9	H171 G172 L173 A177 R178 E179 L266 Y270	H171-L175 WeakPolarHBondContact O-CG 3.14Å; H171-L175 PolarHBondContact O-N 3.42Å; H171-L175 VanDerWaalsContact O-N 3.13Å; G172-L175 WeakPolarHBondContact O-CB 3.03Å; G172-L175 PolarHBondContact O-N 2.89Å; L173-L175 VanDerWaalsContact C-N 3.29Å; L173-L175 PolarHBondContact O-N 3.33Å; L175-A177 PolarHBondContact O-N 3.4Å; L175-R178 CarbonylContact O-C 3.57Å; L175-R178 WeakPolarHBondContact O-CB 2.98Å; L175-R178 PolarHBondContact O-N 3.02Å; L175-R178 VanDerWaalsContact O-N 3.08Å; L175-E179 WeakPolarHBondContact O-CG 3.33Å; L175-E179 PolarHBondContact O-N 2.65Å; L175-L266 HydrophobicContact CD1-CD2 4.17Å; L175-L266 HydrophobicContact CD2-CB 3.96Å; L175-L266 HydrophobicContact CD2-CD1 4.12Å; L175-L266 HydrophobicContact CD2-CD2 4.02Å; L175-L266 HydrophobicContact CD2-CG 4.26Å; L175-L266 HydrophobicContact CG-CD1 4.1Å; L175-L266 HydrophobicContact CG-CD2 3.78Å; L175-L266 HydrophobicContact CG-CG 4.39Å; L175-Y270 HydrophobicContact CD1-CE2 3.35Å; L175-Y270 VanDerWaalsContact CD1-CZ 3.49Å; L175-Y270 WeakPolarHBondContact CD1-OH 2.87Å; L175-Y270 HydrophobicContact CD2-CD2 4.21Å; L175-Y270 HydrophobicContact CD2-CE2 3.69Å; L175-Y270 HydrophobicContact CG-CE2 4.09Å
176	I	57.1	Low	55.7	Low	31 Å²	31	52.8 Å²	52.8	16%	0.159	25%	0.247	C	C	.	.	H	α-helix	trans	-56.4	-47.6	178.7	-64.4	171.2	0	0	0	108.1	I160 G172 L173 R178 E179 L180 I216 M238	I160-I176 HydrophobicContact CD1-CG2 4.46Å; I160-I176 HydrophobicContact CG2-CG1 3.93Å; G172-I176 WeakPolarHBondContact O-CG1 3.23Å; G172-I176 PolarHBondContact O-N 3.14Å; G172-I176 VanDerWaalsContact O-N 3.11Å; L173-I176 PolarHBondContact O-N 3.13Å; I176-R178 VanDerWaalsContact C-N 3.33Å; I176-R178 PolarHBondContact O-N 3.32Å; I176-E179 PolarHBondContact O-N 3.33Å; I176-L180 HydrophobicContact CG2-CD1 3.62Å; I176-L180 HydrophobicContact CG2-CG 4.14Å; I176-L180 WeakPolarHBondContact O-CB 3.48Å; I176-L180 WeakPolarHBondContact O-CG 3.41Å; I176-L180 PolarHBondContact O-N 2.86Å; I176-I216 HydrophobicContact CB-CD1 3.87Å; I176-I216 HydrophobicContact CG2-CD1 3.67Å; I176-M238 HydrophobicContact CD1-CE 3.79Å; I176-M238 HydrophobicContact CD1-SD 4.37Å; I176-M238 HydrophobicContact CG1-CE 4.02Å; I176-M238 HydrophobicContact CG2-SD 4.19Å
177	A	60.8	Low	56.2	Low	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-39.2	178.6	0	0	0	0	0	112.6	L173 L175 R181 C194 I216 I258	L173-A177 WeakPolarHBondContact O-CB 3.4Å; L173-A177 PolarHBondContact O-N 3.14Å; L175-A177 PolarHBondContact O-N 3.4Å; A177-R181 VanDerWaalsContact O-CB 3.27Å; A177-R181 WeakPolarHBondContact O-CB 3.28Å; A177-R181 PolarHBondContact O-N 3.25Å; A177-C194 VanDerWaalsContact CB-SG 3.53Å; A177-I216 HydrophobicContact CB-CB 4.49Å; A177-I216 HydrophobicContact CB-CD1 3.81Å; A177-I216 HydrophobicContact CB-CG1 3.98Å; A177-I216 HydrophobicContact CB-CG2 3.67Å; A177-I258 HydrophobicContact CB-CD1 3.39Å; A177-I258 HydrophobicContact CB-CG1 4.41Å
178	R	60.5	Low	56.9	Low	50 Å²	50	46.9 Å²	46.9	19%	0.189	23%	0.233	C	C	.	.	H	α-helix	trans	-67.8	-53.3	174	-174.2	-170.8	79.3	174.1	0.5	112.5	L174 L175 I176 L180 R181 T182 V263 D267	L174-R178 WeakPolarHBondContact O-CB 3.33Å; L174-R178 PolarHBondContact O-N 3.41Å; L175-R178 CarbonylContact O-C 3.57Å; L175-R178 WeakPolarHBondContact O-CB 2.98Å; L175-R178 PolarHBondContact O-N 3.02Å; L175-R178 VanDerWaalsContact O-N 3.08Å; I176-R178 VanDerWaalsContact C-N 3.33Å; I176-R178 PolarHBondContact O-N 3.32Å; R178-L180 VanDerWaalsContact C-N 3.3Å; R178-L180 PolarHBondContact O-N 3.33Å; R178-R181 WeakPolarHBondContact O-CB 3.34Å; R178-R181 PolarHBondContact O-N 3.07Å; R178-R181 VanDerWaalsContact O-N 3.14Å; R178-T182 HydrophobicContact CG-CG2 4.46Å; R178-T182 WeakPolarHBondContact O-CG2 3.46Å; R178-T182 PolarHBondContact O-N 3.48Å; R178-T182 PolarHBondContact O-OG1 3.12Å; R178-V263 VanDerWaalsContact CD-CG1 3.5Å; R178-D267 IonicContact CZ-OD1 2.79Å; R178-D267 IonicContact NH1-OD1 3.89Å; R178-D267 PolarHBondContact NH1-OD1 2.78Å; R178-D267 IonicContact NH1-OD2 3.56Å; R178-D267 PolarHBondContact NH1-OD2 2.85Å; R178-D267 VanDerWaalsContact NH1-OD2 3.14Å; R178-D267 IonicContact NH2-OD1 3.38Å
179	E	60.3	Low	57.4	Low	41 Å²	41	52.1 Å²	52.1	19%	0.192	26%	0.258	C	S	.	.	H	α-helix	trans	-59.9	-44.8	-178.7	-68.6	-52	134.9	0	0	110	L175 I176 R181 T182 I183	L175-E179 WeakPolarHBondContact O-CG 3.33Å; L175-E179 PolarHBondContact O-N 2.65Å; I176-E179 PolarHBondContact O-N 3.33Å; E179-R181 PolarHBondContact O-N 2.75Å; E179-T182 WeakPolarHBondContact CA-OG1 3.19Å; E179-T182 PolarHBondContact O-N 3.04Å; E179-T182 PolarHBondContact O-OG1 3.22Å; E179-I183 WeakPolarHBondContact O-CB 3.45Å; E179-I183 VanDerWaalsContact O-CG1 3.26Å; E179-I183 WeakPolarHBondContact O-CG1 3.12Å; E179-I183 PolarHBondContact O-N 2.78Å
180	L	60.7	Low	57.6	Low	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57.9	-47.9	172.8	-71.4	175.1	0	0	0	112.3	I156 I160 I176 R178 T182 I183 L184 W229	I156-L180 HydrophobicContact CG2-CD2 3.79Å; I160-L180 HydrophobicContact CD1-CD2 3.88Å; I160-L180 HydrophobicContact CD1-CG 4.3Å; I176-L180 HydrophobicContact CG2-CD1 3.62Å; I176-L180 HydrophobicContact CG2-CG 4.14Å; I176-L180 WeakPolarHBondContact O-CB 3.48Å; I176-L180 WeakPolarHBondContact O-CG 3.41Å; I176-L180 PolarHBondContact O-N 2.86Å; R178-L180 VanDerWaalsContact C-N 3.3Å; R178-L180 PolarHBondContact O-N 3.33Å; L180-T182 VanDerWaalsContact C-N 3.32Å; L180-T182 PolarHBondContact O-N 3.04Å; L180-I183 PolarHBondContact O-N 3.35Å; L180-L184 VanDerWaalsContact O-CB 3.22Å; L180-L184 WeakPolarHBondContact O-CB 3.21Å; L180-L184 WeakPolarHBondContact O-CG 3.39Å; L180-L184 PolarHBondContact O-N 3.01Å; L180-W229 HydrophobicContact CD1-CB 4.3Å; L180-W229 HydrophobicContact CD1-CD2 3.44Å; L180-W229 VanDerWaalsContact CD1-CD2 3.44Å; L180-W229 HydrophobicContact CD1-CE3 3.32Å; L180-W229 HydrophobicContact CD1-CG 3.9Å; L180-W229 HydrophobicContact CD1-CH2 4.28Å; L180-W229 HydrophobicContact CD1-CZ2 4.37Å; L180-W229 HydrophobicContact CD1-CZ3 3.76Å; L180-W229 HydrophobicContact CD2-CD2 4.13Å; L180-W229 HydrophobicContact CD2-CE3 3.9Å; L180-W229 HydrophobicContact CD2-CH2 3.22Å; L180-W229 HydrophobicContact CD2-CZ2 3.47Å; L180-W229 VanDerWaalsContact CD2-CZ2 3.47Å; L180-W229 HydrophobicContact CD2-CZ3 3.42Å; L180-W229 VanDerWaalsContact CD2-CZ3 3.42Å; L180-W229 HydrophobicContact CG-CD2 4.42Å; L180-W229 HydrophobicContact CG-CE3 4.22Å; L180-W229 HydrophobicContact CG-CH2 4.36Å; L180-W229 HydrophobicContact CG-CZ3 4.17Å
181	R	61.9	Low	57.9	Low	111 Å²	111	49 Å²	49	42%	0.419	25%	0.249	S	C	.	.	H	α-helix	trans	-57.2	-49	176.2	-175.4	-178.9	178	-151.2	-9.2	110.4	A177 R178 E179 I183 L184 T185 I192 C194	A177-R181 VanDerWaalsContact O-CB 3.27Å; A177-R181 WeakPolarHBondContact O-CB 3.28Å; A177-R181 PolarHBondContact O-N 3.25Å; R178-R181 WeakPolarHBondContact O-CB 3.34Å; R178-R181 PolarHBondContact O-N 3.07Å; R178-R181 VanDerWaalsContact O-N 3.14Å; E179-R181 PolarHBondContact O-N 2.75Å; R181-I183 PolarHBondContact O-N 3.15Å; R181-L184 PolarHBondContact O-N 2.87Å; R181-T185 HydrophobicContact CG-CG2 4.21Å; R181-T185 WeakPolarHBondContact O-CB 3.35Å; R181-T185 VanDerWaalsContact O-CG2 3.27Å; R181-T185 WeakPolarHBondContact O-CG2 3.46Å; R181-T185 PolarHBondContact O-N 2.91Å; R181-T185 PolarHBondContact O-OG1 2.94Å; R181-I192 PolarHBondContact NE-O 2.89Å; R181-C194 HydrophobicContact CB-CB 4.23Å; R181-C194 HydrophobicContact CG-CB 4.47Å
182	T	62.4	Low	58.4	Low	51 Å²	51	47.9 Å²	47.9	31%	0.313	24%	0.244	S	C	.	.	H	α-helix	trans	-64.7	-39.5	-177.6	58.9	0	0	0	0	113.5	R178 E179 L180 T185 K186	R178-T182 HydrophobicContact CG-CG2 4.46Å; R178-T182 WeakPolarHBondContact O-CG2 3.46Å; R178-T182 PolarHBondContact O-N 3.48Å; R178-T182 PolarHBondContact O-OG1 3.12Å; E179-T182 WeakPolarHBondContact CA-OG1 3.19Å; E179-T182 PolarHBondContact O-N 3.04Å; E179-T182 PolarHBondContact O-OG1 3.22Å; L180-T182 VanDerWaalsContact C-N 3.32Å; L180-T182 PolarHBondContact O-N 3.04Å; T182-T185 WeakPolarHBondContact CA-OG1 3.49Å; T182-T185 PolarHBondContact O-OG1 2.95Å; T182-T185 VanDerWaalsContact O-OG1 3.12Å; T182-K186 VanDerWaalsContact O-CG 3.27Å; T182-K186 WeakPolarHBondContact O-CG 3.42Å; T182-K186 PolarHBondContact O-N 3Å
183	I	58.2	Low	58.5	Low	15 Å²	15	49 Å²	49	8%	0.077	25%	0.248	C	C	.	.	H	α-helix	trans	-70.3	-45.5	178.4	-64.4	165.8	0	0	0	109.2	I156 V159 E179 L180 R181 K186 T187	I156-I183 HydrophobicContact CB-CG2 4.32Å; I156-I183 HydrophobicContact CD1-CG2 3.88Å; I156-I183 HydrophobicContact CG1-CG2 3.77Å; I156-I183 HydrophobicContact CG2-CB 4.2Å; I156-I183 HydrophobicContact CG2-CD1 3.72Å; I156-I183 HydrophobicContact CG2-CG2 3.85Å; V159-I183 HydrophobicContact CB-CD1 4.16Å; V159-I183 HydrophobicContact CG1-CD1 4.16Å; E179-I183 WeakPolarHBondContact O-CB 3.45Å; E179-I183 VanDerWaalsContact O-CG1 3.26Å; E179-I183 WeakPolarHBondContact O-CG1 3.12Å; E179-I183 PolarHBondContact O-N 2.78Å; L180-I183 PolarHBondContact O-N 3.35Å; R181-I183 PolarHBondContact O-N 3.15Å; I183-K186 WeakPolarHBondContact O-CB 3.5Å; I183-K186 PolarHBondContact O-N 2.81Å; I183-K186 VanDerWaalsContact O-N 3.13Å; I183-T187 PolarHBondContact O-N 3.11Å; I183-T187 PolarHBondContact O-OG1 3.38Å
184	L	58.8	Low	58.9	Low	2 Å²	2	48.1 Å²	48.1	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-69.3	-37.6	-178.2	-66.4	171.3	0	0	0	113.2	F153 I156 L180 R181 K186 T187 I188 I192 L218	F153-L184 HydrophobicContact CD1-CD2 4.24Å; F153-L184 HydrophobicContact CE1-CD2 3.48Å; F153-L184 VanDerWaalsContact CE1-CD2 3.48Å; F153-L184 HydrophobicContact CZ-CD2 4.26Å; I156-L184 HydrophobicContact CD1-CD2 3.94Å; L180-L184 VanDerWaalsContact O-CB 3.22Å; L180-L184 WeakPolarHBondContact O-CB 3.21Å; L180-L184 WeakPolarHBondContact O-CG 3.39Å; L180-L184 PolarHBondContact O-N 3.01Å; R181-L184 PolarHBondContact O-N 2.87Å; L184-K186 PolarHBondContact O-N 2.82Å; L184-T187 WeakPolarHBondContact CA-OG1 3.43Å; L184-T187 PolarHBondContact O-N 2.74Å; L184-T187 PolarHBondContact O-OG1 3.37Å; L184-I188 HydrophobicContact CD2-CD1 4.27Å; L184-I188 WeakPolarHBondContact O-CA 3.38Å; L184-I188 WeakPolarHBondContact O-CB 3.46Å; L184-I188 PolarHBondContact O-N 2.87Å; L184-I192 HydrophobicContact CB-CD1 3.43Å; L184-I192 VanDerWaalsContact CB-CD1 3.43Å; L184-L218 HydrophobicContact CD1-CD1 3.4Å; L184-L218 VanDerWaalsContact CD1-CD1 3.4Å; L184-L218 HydrophobicContact CD1-CD2 4.5Å
185	T	62.6	Low	58.8	Low	50 Å²	50	48 Å²	48	31%	0.307	24%	0.243	S	C	.	.	H	α-helix	trans	-66.9	-22	173.2	52	0	0	0	0	112.7	R181 T182 I188 I192	R181-T185 HydrophobicContact CG-CG2 4.21Å; R181-T185 WeakPolarHBondContact O-CB 3.35Å; R181-T185 VanDerWaalsContact O-CG2 3.27Å; R181-T185 WeakPolarHBondContact O-CG2 3.46Å; R181-T185 PolarHBondContact O-N 2.91Å; R181-T185 PolarHBondContact O-OG1 2.94Å; T182-T185 WeakPolarHBondContact CA-OG1 3.49Å; T182-T185 PolarHBondContact O-OG1 2.95Å; T182-T185 VanDerWaalsContact O-OG1 3.12Å; T185-I188 CarbonylContact C-O 3.57Å; T185-I192 HydrophobicContact CG2-CB 4.21Å
186	K	60.4	Low	58.9	Low	179 Å²	179	47.3 Å²	47.3	78%	0.778	24%	0.24	S	C	*	.	H	α-helix	trans	-80.7	-32.9	173.2	-75.7	172.8	-178.4	176.6	0	112.1	T182 I183 L184	T182-K186 VanDerWaalsContact O-CG 3.27Å; T182-K186 WeakPolarHBondContact O-CG 3.42Å; T182-K186 PolarHBondContact O-N 3Å; I183-K186 WeakPolarHBondContact O-CB 3.5Å; I183-K186 PolarHBondContact O-N 2.81Å; I183-K186 VanDerWaalsContact O-N 3.13Å; L184-K186 PolarHBondContact O-N 2.82Å
187	T	53.9	Low	58.7	Low	68 Å²	68	46.1 Å²	46.1	42%	0.417	23%	0.234	S	C	.	.	H	α-helix	trans	-87.4	-35.8	-179.2	51.7	0	0	0	0	113.1	I183 L184	I183-T187 PolarHBondContact O-N 3.11Å; I183-T187 PolarHBondContact O-OG1 3.38Å; L184-T187 WeakPolarHBondContact CA-OG1 3.43Å; L184-T187 PolarHBondContact O-N 2.74Å; L184-T187 PolarHBondContact O-OG1 3.37Å
188	I	56	Low	58.3	Low	46 Å²	46	51.7 Å²	51.7	24%	0.236	26%	0.258	C	S	.	.	S	Bend	trans	-112.8	111.3	-178.8	-48.4	173	0	0	0	104.4	L184 T185 T190 I192	L184-I188 HydrophobicContact CD2-CD1 4.27Å; L184-I188 WeakPolarHBondContact O-CA 3.38Å; L184-I188 WeakPolarHBondContact O-CB 3.46Å; L184-I188 PolarHBondContact O-N 2.87Å; T185-I188 CarbonylContact C-O 3.57Å; I188-T190 HydrophobicContact CG2-CG2 3.99Å; I188-T190 WeakPolarHBondContact CG2-OG1 3.34Å; I188-T190 PolarHBondContact O-N 3.12Å; I188-I192 HydrophobicContact CB-CD1 4.38Å; I188-I192 HydrophobicContact CD1-CD1 4.11Å
189	D	56.7	Low	57.9	Low	169 Å²	169	49.9 Å²	49.9	90%	0.904	25%	0.252	S	S	*	.	S	Bend	trans	-71.3	48.5	-179.2	-162.2	19.4	0	0	0	111.5
190	T	54.7	Low	57.4	Low	50 Å²	50	49.9 Å²	49.9	31%	0.307	26%	0.256	S	S	.	.	S	Bend	trans	-136.2	146	-178.1	65.6	0	0	0	0	109.8	I188 I192	I188-T190 HydrophobicContact CG2-CG2 3.99Å; I188-T190 WeakPolarHBondContact CG2-OG1 3.34Å; I188-T190 PolarHBondContact O-N 3.12Å; T190-I192 PolarHBondContact O-N 2.87Å
191	D	58	Low	57.1	Low	90 Å²	90	60 Å²	60	48%	0.481	29%	0.294	S	S	.	.			trans	-69.9	104.9	175.2	-99.8	-8.7	0	0	0	110.1	K221	D191-K221 HydrophobicContact CB-CB 4.07Å; D191-K221 HydrophobicContact CB-CD 3.66Å; D191-K221 HydrophobicContact CB-CG 3.93Å; D191-K221 WeakPolarHBondContact O-CB 3.09Å; D191-K221 PolarHBondContact O-N 2.96Å; D191-K221 IonicContact OD2-NZ 3.87Å; D191-K221 PolarHBondContact OD2-NZ 3Å
192	I	61.8	Low	56.5	Low	1 Å²	1	61.2 Å²	61.2	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	123.2	173.2	-59.6	167.6	0	0	0	108.9	R181 L184 T185 I188 T190 L218 E220	R181-I192 PolarHBondContact NE-O 2.89Å; L184-I192 HydrophobicContact CB-CD1 3.43Å; L184-I192 VanDerWaalsContact CB-CD1 3.43Å; T185-I192 HydrophobicContact CG2-CB 4.21Å; I188-I192 HydrophobicContact CB-CD1 4.38Å; I188-I192 HydrophobicContact CD1-CD1 4.11Å; T190-I192 PolarHBondContact O-N 2.87Å; I192-L218 HydrophobicContact CG2-CB 3.86Å; I192-L218 HydrophobicContact CG2-CD2 3.77Å; I192-L218 HydrophobicContact CG2-CG 4.41Å; I192-E220 HydrophobicContact CG1-CG 4.44Å
193	T	56.9	Low	55.9	Low	34 Å²	34	60.7 Å²	60.7	21%	0.209	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	135.3	168.8	60	0	0	0	0	109.2	L218 K219 K221	T193-L218 CarbonylContact O-C 3.5Å; T193-L218 WeakPolarHBondContact O-CA 3.07Å; T193-K219 PolarHBondContact N-O 2.86Å; T193-K219 PolarHBondContact O-N 2.82Å; T193-K219 WeakPolarHBondContact OG1-CB 3.44Å; T193-K219 PolarHBondContact OG1-O 2.76Å; T193-K221 HydrophobicContact CG2-CG 3.91Å
194	C	62.1	Low	55.4	Low	6 Å²	6	63.5 Å²	63.5	4%	0.041	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.1	179.5	-167.6	0	0	0	0	109.6	A177 R181 I216 V217 L218 I258	A177-C194 VanDerWaalsContact CB-SG 3.53Å; R181-C194 HydrophobicContact CB-CB 4.23Å; R181-C194 HydrophobicContact CG-CB 4.47Å; C194-I216 WeakPolarHBondContact SG-CG2 3.33Å; C194-V217 WeakPolarHBondContact CA-O 3.29Å; C194-L218 HydrophobicContact CB-CD2 3.74Å; C194-L218 WeakPolarHBondContact SG-CD2 3.44Å; C194-I258 HydrophobicContact CB-CD1 4.19Å
195	S	55.9	Low	54.9	Low	0 Å²	0	71.3 Å²	71.3	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139.7	178.3	53.1	0	0	0	0	110.7	E197 V217 T256	S195-E197 PolarHBondContact OG-OE1 2.86Å; S195-V217 PolarHBondContact N-O 2.8Å; S195-V217 PolarHBondContact O-N 3.06Å; S195-V217 PolarHBondContact OG-O 3.33Å; S195-T256 CarbonylContact C-O 3.17Å; S195-T256 VanDerWaalsContact CA-O 3.3Å; S195-T256 WeakPolarHBondContact CA-O 3.49Å
196	I	57	Low	54.3	Low	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.1	171	-56.6	171.2	0	0	0	107.4	Y170 L173 L174 Y214 V215 I216 T256	Y170-I196 HydrophobicContact CE2-CD1 4.1Å; Y170-I196 HydrophobicContact CE2-CG2 4.38Å; L173-I196 HydrophobicContact CB-CD1 3.97Å; L174-I196 HydrophobicContact CB-CD1 4.46Å; L174-I196 HydrophobicContact CD2-CD1 3.63Å; L174-I196 HydrophobicContact CG-CD1 3.78Å; I196-Y214 HydrophobicContact CG2-CD1 4.24Å; I196-V215 CarbonylContact C-O 3.6Å; I196-V215 WeakPolarHBondContact CA-O 3.44Å; I196-I216 HydrophobicContact CG1-CG1 4.29Å; I196-T256 PolarHBondContact N-O 3.37Å; I196-T256 PolarHBondContact O-N 3.2Å; I196-T256 PolarHBondContact O-OG1 3.1Å
197	E	53.8	Low	53.5	Low	5 Å²	5	66 Å²	66	2%	0.023	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	147.6	-176.4	-53	-169.3	176.3	0	0	110	S195 Y214 V215 V217 K219 F252 T255	S195-E197 PolarHBondContact OG-OE1 2.86Å; E197-Y214 CarbonylContact O-C 3.59Å; E197-Y214 WeakPolarHBondContact O-CA 3.4Å; E197-V215 PolarHBondContact N-O 3Å; E197-V215 PolarHBondContact O-N 3.42Å; E197-V217 HydrophobicContact CB-CG2 4.08Å; E197-V217 VanDerWaalsContact CD-CG2 3.49Å; E197-V217 HydrophobicContact CG-CB 4.16Å; E197-V217 HydrophobicContact CG-CG2 3.7Å; E197-K219 WeakPolarHBondContact OE1-CE 3.19Å; E197-K219 IonicContact OE1-NZ 2.67Å; E197-K219 PolarHBondContact OE1-NZ 3.34Å; E197-F252 WeakPolarHBondContact OE2-CD1 3.44Å; E197-F252 WeakPolarHBondContact OE2-CE1 3.37Å; E197-F252 VanDerWaalsContact OE2-CG 3.27Å; E197-F252 WeakPolarHBondContact OE2-CG 3.07Å; E197-T255 HydrophobicContact CG-CG2 3.79Å; E197-T255 WeakPolarHBondContact OE1-CG2 3.47Å
198	K	52.5	Low	53.1	Low	117 Å²	117	67.3 Å²	67.3	51%	0.509	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	139	172	-167.2	177.8	-178.9	173.5	0	109.3	P200 N213 Y214	K198-P200 WeakPolarHBondContact O-CD 3.14Å; K198-N213 WeakPolarHBondContact CA-O 3.48Å; K198-N213 VanDerWaalsContact CG-O 3.29Å; K198-N213 WeakPolarHBondContact CG-O 3.27Å; K198-Y214 HydrophobicContact CB-CD1 4.41Å; K198-Y214 HydrophobicContact CB-CE1 4.33Å
199	V	52.3	Low	52.4	Low	12 Å²	12	74 Å²	74	7%	0.073	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-58	124.2	179.8	176.4	0	0	0	0	110.1	F203 L207 V212 N213 V215	V199-F203 HydrophobicContact CG1-CB 4.22Å; V199-L207 HydrophobicContact CG1-CD1 3.5Å; V199-L207 VanDerWaalsContact CG1-CD1 3.5Å; V199-L207 HydrophobicContact CG2-CD1 4.29Å; V199-V212 HydrophobicContact CG2-CG1 4.3Å; V199-N213 PolarHBondContact N-O 3.29Å; V199-V215 HydrophobicContact CG2-CB 4.46Å; V199-V215 HydrophobicContact CG2-CG2 3.48Å; V199-V215 VanDerWaalsContact CG2-CG2 3.48Å
200	P	49.1	Very low	51.7	Low	42 Å²	42	70.9 Å²	70.9	27%	0.273	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-65.5	141.9	174	-15.2	27.4	0	0	0	110.6	K198 N202 F203 Q204 F252	K198-P200 WeakPolarHBondContact O-CD 3.14Å; P200-N202 PolarHBondContact O-N 3.24Å; P200-F203 HydrophobicContact CB-CD2 4.03Å; P200-F203 HydrophobicContact CG-CD2 3.86Å; P200-F203 HydrophobicContact CG-CE2 4.38Å; P200-F203 PolarHBondContact O-N 3.4Å; P200-Q204 PolarHBondContact O-N 3.26Å; P200-F252 HydrophobicContact CG-CD1 4.22Å; P200-F252 HydrophobicContact CG-CE1 3.63Å
201	R	54.1	Low	51.1	Low	212 Å²	212	76.7 Å²	76.7	80%	0.8	37%	0.369	S	S	*	.	H	α-helix	trans	-53.5	-31.3	179.4	-68.7	-176.8	-177.6	172	0.3	113.2	F203 Q204	R201-F203 VanDerWaalsContact C-N 3.25Å; R201-F203 PolarHBondContact O-N 2.63Å; R201-Q204 WeakPolarHBondContact O-CB 3.38Å; R201-Q204 PolarHBondContact O-N 2.95Å
202	N	49.7	Very low	50.5	Low	136 Å²	136	73.2 Å²	73.2	73%	0.727	35%	0.351	S	S	*	.	H	α-helix	trans	-64	-31.7	179.6	-52.5	-0.2	0	0	0	112.3	P200	P200-N202 PolarHBondContact O-N 3.24Å
203	F	48.4	Very low	49.8	Very low	40 Å²	40	78 Å²	78	18%	0.175	38%	0.376	C	S	.	.	H	α-helix	trans	-88.6	-10.8	175.6	-71.8	-83.8	0	0	0	112.4	V199 P200 R201 Q205 S206 L207 F243 L247	V199-F203 HydrophobicContact CG1-CB 4.22Å; P200-F203 HydrophobicContact CB-CD2 4.03Å; P200-F203 HydrophobicContact CG-CD2 3.86Å; P200-F203 HydrophobicContact CG-CE2 4.38Å; P200-F203 PolarHBondContact O-N 3.4Å; R201-F203 VanDerWaalsContact C-N 3.25Å; R201-F203 PolarHBondContact O-N 2.63Å; F203-Q205 VanDerWaalsContact C-N 3.28Å; F203-Q205 PolarHBondContact O-N 2.92Å; F203-S206 PolarHBondContact O-N 3.16Å; F203-S206 VanDerWaalsContact O-N 3.1Å; F203-L207 HydrophobicContact CB-CD1 3.77Å; F203-L207 VanDerWaalsContact O-CB 3.28Å; F203-L207 WeakPolarHBondContact O-CB 3.49Å; F203-L207 WeakPolarHBondContact O-CG 3.26Å; F203-L207 PolarHBondContact O-N 3.42Å; F203-F243 HydrophobicContact CD1-CZ 4.48Å; F203-F243 HydrophobicContact CE1-CE1 4.05Å; F203-F243 HydrophobicContact CE1-CZ 4.05Å; F203-L247 HydrophobicContact CE2-CD2 4.2Å; F203-L247 HydrophobicContact CZ-CD1 4.39Å; F203-L247 HydrophobicContact CZ-CD2 4.06Å
204	Q	49	Very low	49.4	Very low	75 Å²	75	81.2 Å²	81.2	35%	0.35	39%	0.385	S	S	.	.	H	α-helix	trans	-59.4	-42.4	-178.8	-157.4	133.9	11.5	0	0	109.9	P200 R201 S206 L207 D208	P200-Q204 PolarHBondContact O-N 3.26Å; R201-Q204 WeakPolarHBondContact O-CB 3.38Å; R201-Q204 PolarHBondContact O-N 2.95Å; Q204-S206 VanDerWaalsContact C-N 3.33Å; Q204-S206 PolarHBondContact O-N 2.96Å; Q204-L207 CarbonylContact O-C 3.27Å; Q204-L207 VanDerWaalsContact O-C 3.27Å; Q204-L207 WeakPolarHBondContact O-CA 3.3Å; Q204-L207 PolarHBondContact O-N 3.46Å; Q204-D208 WeakPolarHBondContact CG-OD1 3.41Å; Q204-D208 WeakPolarHBondContact O-CA 3.48Å; Q204-D208 WeakPolarHBondContact O-CB 3.43Å; Q204-D208 PolarHBondContact O-N 3.44Å
205	Q	47.9	Very low	49	Very low	166 Å²	166	81.7 Å²	81.7	78%	0.776	39%	0.388	S	S	*	.	H	α-helix	trans	-55.9	-42.6	174.2	-68.7	-179.6	-6	0	0	113.8	F203 L207 D208	F203-Q205 VanDerWaalsContact C-N 3.28Å; F203-Q205 PolarHBondContact O-N 2.92Å; Q205-L207 VanDerWaalsContact C-N 3.3Å; Q205-D208 WeakPolarHBondContact CA-OD2 3.46Å
206	S	49.3	Very low	49	Very low	89 Å²	89	82 Å²	82	62%	0.622	39%	0.389	S	S	*	.	H	α-helix	trans	-73.2	-24.9	177.1	-45.2	0	0	0	0	112.6	F203 Q204	F203-S206 PolarHBondContact O-N 3.16Å; F203-S206 VanDerWaalsContact O-N 3.1Å; Q204-S206 VanDerWaalsContact C-N 3.33Å; Q204-S206 PolarHBondContact O-N 2.96Å
207	L	44.7	Very low	49	Very low	27 Å²	27	82.1 Å²	82.1	14%	0.141	39%	0.39	C	S	.	.	H	α-helix	trans	-106	-1.4	-174.6	-68.2	164.8	0	0	0	113.4	V199 F203 Q204 Q205 K209 Y210 Y230	V199-L207 HydrophobicContact CG1-CD1 3.5Å; V199-L207 VanDerWaalsContact CG1-CD1 3.5Å; V199-L207 HydrophobicContact CG2-CD1 4.29Å; F203-L207 HydrophobicContact CB-CD1 3.77Å; F203-L207 VanDerWaalsContact O-CB 3.28Å; F203-L207 WeakPolarHBondContact O-CB 3.49Å; F203-L207 WeakPolarHBondContact O-CG 3.26Å; F203-L207 PolarHBondContact O-N 3.42Å; Q204-L207 CarbonylContact O-C 3.27Å; Q204-L207 VanDerWaalsContact O-C 3.27Å; Q204-L207 WeakPolarHBondContact O-CA 3.3Å; Q204-L207 PolarHBondContact O-N 3.46Å; Q205-L207 VanDerWaalsContact C-N 3.3Å; L207-K209 PolarHBondContact O-N 3.32Å; L207-Y210 WeakPolarHBondContact O-CA 3.27Å; L207-Y210 WeakPolarHBondContact O-CB 3.17Å; L207-Y210 PolarHBondContact O-N 3.1Å; L207-Y230 HydrophobicContact CD2-CD2 4.17Å; L207-Y230 HydrophobicContact CD2-CE2 4.17Å
208	D	44.7	Very low	49.1	Very low	97 Å²	97	81.9 Å²	81.9	52%	0.519	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-64	-29.8	-172.2	-85.9	-23.7	0	0	0	111	Q204 Q205 Y210	Q204-D208 WeakPolarHBondContact CG-OD1 3.41Å; Q204-D208 WeakPolarHBondContact O-CA 3.48Å; Q204-D208 WeakPolarHBondContact O-CB 3.43Å; Q204-D208 PolarHBondContact O-N 3.44Å; Q205-D208 WeakPolarHBondContact CA-OD2 3.46Å; D208-Y210 PolarHBondContact O-N 2.89Å; D208-Y210 VanDerWaalsContact O-N 3.09Å
209	K	41.8	Very low	49.3	Very low	187 Å²	187	78 Å²	78	81%	0.813	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-58.9	-18.1	171.3	-77.8	-172	176	-177.2	0	113.9	L207	L207-K209 PolarHBondContact O-N 3.32Å
210	Y	41.9	Very low	49.4	Very low	103 Å²	103	79.4 Å²	79.4	40%	0.404	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-118.9	-0.2	-165	-62	-74.5	0	0	0	114.9	L207 D208 V212 Y230 S233	L207-Y210 WeakPolarHBondContact O-CA 3.27Å; L207-Y210 WeakPolarHBondContact O-CB 3.17Å; L207-Y210 PolarHBondContact O-N 3.1Å; D208-Y210 PolarHBondContact O-N 2.89Å; D208-Y210 VanDerWaalsContact O-N 3.09Å; Y210-V212 WeakPolarHBondContact O-CG2 3.42Å; Y210-V212 PolarHBondContact O-N 3.48Å; Y210-Y230 VanDerWaalsContact CB-OH 3.23Å; Y210-Y230 WeakPolarHBondContact CB-OH 3.22Å; Y210-Y230 HydrophobicContact CD1-CE1 4.48Å; Y210-S233 PolarHBondContact O-OG 3.02Å
211	Q	41.5	Very low	49.6	Very low	172 Å²	172	83.7 Å²	83.7	80%	0.804	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.2	51.4	178.5	-62.3	-168.2	-2.2	0	0	114.9
212	V	45.8	Very low	49.3	Very low	16 Å²	16	81.3 Å²	81.3	10%	0.097	39%	0.392	C	S	.	.			trans	-111.2	134	-174.4	-179.2	0	0	0	0	113.9	V199 Y210 Y214 Y230	V199-V212 HydrophobicContact CG2-CG1 4.3Å; Y210-V212 WeakPolarHBondContact O-CG2 3.42Å; Y210-V212 PolarHBondContact O-N 3.48Å; V212-Y214 WeakPolarHBondContact CG1-O 3.34Å; V212-Y230 HydrophobicContact CB-CE2 3.72Å; V212-Y230 HydrophobicContact CG1-CD2 4.27Å; V212-Y230 HydrophobicContact CG1-CE2 3.85Å; V212-Y230 HydrophobicContact CG2-CD2 4.33Å; V212-Y230 HydrophobicContact CG2-CE2 3.2Å; V212-Y230 WeakPolarHBondContact CG2-OH 3.27Å
213	N	48.1	Very low	49.1	Very low	101 Å²	101	78.9 Å²	78.9	54%	0.54	38%	0.379	S	S	.	.			trans	-100.6	-28.8	-179.2	-72.4	-30	0	0	0	114.2	K198 V199	K198-N213 WeakPolarHBondContact CA-O 3.48Å; K198-N213 VanDerWaalsContact CG-O 3.29Å; K198-N213 WeakPolarHBondContact CG-O 3.27Å; V199-N213 PolarHBondContact N-O 3.29Å
214	Y	48.7	Very low	48.9	Very low	103 Å²	103	87.7 Å²	87.7	40%	0.404	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	149.8	-172.4	-65.4	-84.2	0	0	0	112.2	I196 E197 K198 V212	I196-Y214 HydrophobicContact CG2-CD1 4.24Å; E197-Y214 CarbonylContact O-C 3.59Å; E197-Y214 WeakPolarHBondContact O-CA 3.4Å; K198-Y214 HydrophobicContact CB-CD1 4.41Å; K198-Y214 HydrophobicContact CB-CE1 4.33Å; V212-Y214 WeakPolarHBondContact CG1-O 3.34Å
215	V	52.8	Low	48.6	Very low	16 Å²	16	86.6 Å²	86.6	10%	0.097	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	143.2	-174.7	164	0	0	0	0	109.4	I196 E197 V199 V217 I228	I196-V215 CarbonylContact C-O 3.6Å; I196-V215 WeakPolarHBondContact CA-O 3.44Å; E197-V215 PolarHBondContact N-O 3Å; E197-V215 PolarHBondContact O-N 3.42Å; V199-V215 HydrophobicContact CG2-CB 4.46Å; V199-V215 HydrophobicContact CG2-CG2 3.48Å; V199-V215 VanDerWaalsContact CG2-CG2 3.48Å; V215-V217 HydrophobicContact CG1-CG2 4.03Å; V215-I228 HydrophobicContact CG1-CG2 3.19Å
216	I	54.8	Low	48.4	Very low	5 Å²	5	81.2 Å²	81.2	3%	0.026	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	118.7	175	-62.4	164.3	0	0	0	107.4	L173 I176 A177 C194 I196 W229	L173-I216 HydrophobicContact CD2-CD1 4.08Å; L173-I216 HydrophobicContact CD2-CG1 4.33Å; L173-I216 WeakPolarHBondContact O-CD1 3.17Å; I176-I216 HydrophobicContact CB-CD1 3.87Å; I176-I216 HydrophobicContact CG2-CD1 3.67Å; A177-I216 HydrophobicContact CB-CB 4.49Å; A177-I216 HydrophobicContact CB-CD1 3.81Å; A177-I216 HydrophobicContact CB-CG1 3.98Å; A177-I216 HydrophobicContact CB-CG2 3.67Å; C194-I216 WeakPolarHBondContact SG-CG2 3.33Å; I196-I216 HydrophobicContact CG1-CG1 4.29Å; I216-W229 HydrophobicContact CB-CB 4.13Å; I216-W229 PolarHBondContact N-O 3.43Å; I216-W229 PolarHBondContact O-N 3.06Å
217	V	57.4	Low	48.3	Very low	3 Å²	3	78.7 Å²	78.7	2%	0.018	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	124.6	177.6	-173.8	0	0	0	0	108.9	C194 S195 E197 V215 K219 Q226 I228	C194-V217 WeakPolarHBondContact CA-O 3.29Å; S195-V217 PolarHBondContact N-O 2.8Å; S195-V217 PolarHBondContact O-N 3.06Å; S195-V217 PolarHBondContact OG-O 3.33Å; E197-V217 HydrophobicContact CB-CG2 4.08Å; E197-V217 VanDerWaalsContact CD-CG2 3.49Å; E197-V217 HydrophobicContact CG-CB 4.16Å; E197-V217 HydrophobicContact CG-CG2 3.7Å; V215-V217 HydrophobicContact CG1-CG2 4.03Å; V217-K219 HydrophobicContact CG1-CD 4.42Å; V217-K219 VanDerWaalsContact CG1-CE 3.5Å; V217-K219 HydrophobicContact CG1-CG 3.93Å; V217-Q226 HydrophobicContact CG1-CB 4.13Å; V217-I228 HydrophobicContact CG2-CG1 4.48Å
218	L	56	Low	48.3	Very low	0 Å²	0	78.6 Å²	78.6	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	121	175.3	-64.5	161.2	0	0	0	107.4	L184 I192 T193 C194 L227 W229	L184-L218 HydrophobicContact CD1-CD1 3.4Å; L184-L218 VanDerWaalsContact CD1-CD1 3.4Å; L184-L218 HydrophobicContact CD1-CD2 4.5Å; I192-L218 HydrophobicContact CG2-CB 3.86Å; I192-L218 HydrophobicContact CG2-CD2 3.77Å; I192-L218 HydrophobicContact CG2-CG 4.41Å; T193-L218 CarbonylContact O-C 3.5Å; T193-L218 WeakPolarHBondContact O-CA 3.07Å; C194-L218 HydrophobicContact CB-CD2 3.74Å; C194-L218 WeakPolarHBondContact SG-CD2 3.44Å; L218-L227 HydrophobicContact CB-CB 4Å; L218-L227 WeakPolarHBondContact CB-O 3.35Å; L218-L227 PolarHBondContact N-O 3.23Å; L218-L227 PolarHBondContact O-N 2.94Å; L218-W229 HydrophobicContact CD1-CG 4.27Å
219	K	56.5	Low	48	Very low	35 Å²	35	74.5 Å²	74.5	15%	0.152	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127	178.6	-53.4	179	-178.1	161.5	0	108.7	T193 E197 V217 Q226	T193-K219 PolarHBondContact N-O 2.86Å; T193-K219 PolarHBondContact O-N 2.82Å; T193-K219 WeakPolarHBondContact OG1-CB 3.44Å; T193-K219 PolarHBondContact OG1-O 2.76Å; E197-K219 WeakPolarHBondContact OE1-CE 3.19Å; E197-K219 IonicContact OE1-NZ 2.67Å; E197-K219 PolarHBondContact OE1-NZ 3.34Å; V217-K219 HydrophobicContact CG1-CD 4.42Å; V217-K219 VanDerWaalsContact CG1-CE 3.5Å; V217-K219 HydrophobicContact CG1-CG 3.93Å; K219-Q226 HydrophobicContact CD-CG 4.32Å; K219-Q226 HydrophobicContact CG-CG 4.16Å
220	E	55.7	Low	47.9	Very low	42 Å²	42	66.7 Å²	66.7	20%	0.196	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	134.6	170.4	-70.3	174.9	-174.6	0	0	108.8	I192 M222 N223	I192-E220 HydrophobicContact CG1-CG 4.44Å; E220-M222 PolarHBondContact O-N 2.87Å; E220-N223 CarbonylContact O-C 3.56Å
221	K	52.9	Low	47.8	Very low	132 Å²	132	64.2 Å²	64.2	57%	0.574	30%	0.3	S	S	*	.	S	Bend	trans	-62.4	-32.3	-179.9	-91.9	-166.1	-170.3	161.1	0	113.4	D191 T193	D191-K221 HydrophobicContact CB-CB 4.07Å; D191-K221 HydrophobicContact CB-CD 3.66Å; D191-K221 HydrophobicContact CB-CG 3.93Å; D191-K221 WeakPolarHBondContact O-CB 3.09Å; D191-K221 PolarHBondContact O-N 2.96Å; D191-K221 IonicContact OD2-NZ 3.87Å; D191-K221 PolarHBondContact OD2-NZ 3Å; T193-K221 HydrophobicContact CG2-CG 3.91Å
222	M	47.5	Very low	47.4	Very low	163 Å²	163	58 Å²	58	80%	0.803	28%	0.275	S	S	*	.	S	Bend	trans	-88.2	-27.4	-171.8	-63.4	-64.6	-87.7	0	0	112.7	E220	E220-M222 PolarHBondContact O-N 2.87Å
223	N	45.1	Very low	47	Very low	84 Å²	84	60.6 Å²	60.6	45%	0.449	29%	0.294	S	S	.	.	S	Bend	trans	-125.9	126.6	179.3	-65	-28.8	0	0	0	107.7	E220 N225	E220-N223 CarbonylContact O-C 3.56Å; N223-N225 HydrophobicContact CB-CB 4.28Å; N223-N225 PolarHBondContact O-N 2.72Å
224	Y	45.4	Very low	46.5	Very low	225 Å²	225	64.3 Å²	64.3	88%	0.882	31%	0.308	S	S	*	.			trans	-63.6	18.4	175.7	-68.7	-84.5	0	0	0	114.2	Q226	Y224-Q226 PolarHBondContact O-N 3.17Å
225	N	41.3	Very low	45.9	Very low	53 Å²	53	65 Å²	65	28%	0.283	32%	0.319	S	S	.	.			trans	-69.1	118.9	175.5	-69	-8.1	0	0	0	109.4	N223 E245	N223-N225 HydrophobicContact CB-CB 4.28Å; N223-N225 PolarHBondContact O-N 2.72Å; N225-E245 WeakPolarHBondContact OD1-CG 3.25Å; N225-E245 PolarHBondContact OD1-OE1 3.32Å
226	Q	45.7	Very low	45	Very low	52 Å²	52	71 Å²	71	24%	0.243	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	119.7	-178.9	-55.7	-174.5	-8.4	0	0	109.3	V217 K219 Y224	V217-Q226 HydrophobicContact CG1-CB 4.13Å; K219-Q226 HydrophobicContact CD-CG 4.32Å; K219-Q226 HydrophobicContact CG-CG 4.16Å; Y224-Q226 PolarHBondContact O-N 3.17Å
227	L	46	Very low	43.8	Very low	36 Å²	36	74.3 Å²	74.3	19%	0.188	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	112.9	169.4	-71.1	162.7	0	0	0	107.9	L218 R242	L218-L227 HydrophobicContact CB-CB 4Å; L218-L227 WeakPolarHBondContact CB-O 3.35Å; L218-L227 PolarHBondContact N-O 3.23Å; L218-L227 PolarHBondContact O-N 2.94Å; L227-R242 HydrophobicContact CD2-CG 4.07Å
228	I	45.7	Very low	42.4	Very low	25 Å²	25	75.8 Å²	75.8	13%	0.128	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	134.6	-174.8	-59.5	-177.6	0	0	0	109.7	V215 V217 F243	V215-I228 HydrophobicContact CG1-CG2 3.19Å; V217-I228 HydrophobicContact CG2-CG1 4.48Å; I228-F243 HydrophobicContact CB-CD2 4.34Å; I228-F243 HydrophobicContact CD1-CD2 4.26Å
229	W	37	Very low	41.3	Very low	11 Å²	11	81.3 Å²	81.3	4%	0.042	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	144	-179.1	-92.6	68.7	0	0	0	113	L157 I160 L180 I216 L218 L240	L157-W229 HydrophobicContact CD2-CH2 3.49Å; L157-W229 VanDerWaalsContact CD2-CH2 3.49Å; L157-W229 HydrophobicContact CD2-CZ3 3.32Å; L157-W229 HydrophobicContact CG-CH2 4.4Å; I160-W229 HydrophobicContact CD1-CZ3 4.37Å; L180-W229 HydrophobicContact CD1-CB 4.3Å; L180-W229 HydrophobicContact CD1-CD2 3.44Å; L180-W229 VanDerWaalsContact CD1-CD2 3.44Å; L180-W229 HydrophobicContact CD1-CE3 3.32Å; L180-W229 HydrophobicContact CD1-CG 3.9Å; L180-W229 HydrophobicContact CD1-CH2 4.28Å; L180-W229 HydrophobicContact CD1-CZ2 4.37Å; L180-W229 HydrophobicContact CD1-CZ3 3.76Å; L180-W229 HydrophobicContact CD2-CD2 4.13Å; L180-W229 HydrophobicContact CD2-CE3 3.9Å; L180-W229 HydrophobicContact CD2-CH2 3.22Å; L180-W229 HydrophobicContact CD2-CZ2 3.47Å; L180-W229 VanDerWaalsContact CD2-CZ2 3.47Å; L180-W229 HydrophobicContact CD2-CZ3 3.42Å; L180-W229 VanDerWaalsContact CD2-CZ3 3.42Å; L180-W229 HydrophobicContact CG-CD2 4.42Å; L180-W229 HydrophobicContact CG-CE3 4.22Å; L180-W229 HydrophobicContact CG-CH2 4.36Å; L180-W229 HydrophobicContact CG-CZ3 4.17Å; I216-W229 HydrophobicContact CB-CB 4.13Å; I216-W229 PolarHBondContact N-O 3.43Å; I216-W229 PolarHBondContact O-N 3.06Å; L218-W229 HydrophobicContact CD1-CG 4.27Å; W229-L240 HydrophobicContact CD2-CD1 4.17Å; W229-L240 HydrophobicContact CH2-CD1 3.93Å; W229-L240 HydrophobicContact CZ2-CD1 3.17Å
230	Y	41	Very low	40.1	Very low	23 Å²	23	83 Å²	83	9%	0.09	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	140.1	-169.3	173.3	-88.1	0	0	0	111.8	L207 Y210 V212 S232 K239	L207-Y230 HydrophobicContact CD2-CD2 4.17Å; L207-Y230 HydrophobicContact CD2-CE2 4.17Å; Y210-Y230 VanDerWaalsContact CB-OH 3.23Å; Y210-Y230 WeakPolarHBondContact CB-OH 3.22Å; Y210-Y230 HydrophobicContact CD1-CE1 4.48Å; V212-Y230 HydrophobicContact CB-CE2 3.72Å; V212-Y230 HydrophobicContact CG1-CD2 4.27Å; V212-Y230 HydrophobicContact CG1-CE2 3.85Å; V212-Y230 HydrophobicContact CG2-CD2 4.33Å; V212-Y230 HydrophobicContact CG2-CE2 3.2Å; V212-Y230 WeakPolarHBondContact CG2-OH 3.27Å; Y230-S232 PolarHBondContact OH-N 3.01Å; Y230-S232 PolarHBondContact OH-O 3.37Å; Y230-K239 VanDerWaalsContact O-O 3.12Å
231	N	39.1	Very low	39.1	Very low	51 Å²	51	84.5 Å²	84.5	27%	0.273	42%	0.421	S	S	.	.			trans	-170.7	128.2	142.1	-166.6	28.3	0	0	0	114.4	T237 M238	N231-T237 PolarHBondContact ND2-O 3.41Å; N231-T237 PolarHBondContact OD1-O 2.84Å; N231-M238 HydrophobicContact CB-CB 4.12Å; N231-M238 HydrophobicContact CB-CG 3.95Å; N231-M238 VanDerWaalsContact ND2-CA 3.32Å; N231-M238 WeakPolarHBondContact ND2-CA 3.29Å; N231-M238 PolarHBondContact ND2-N 2.75Å; N231-M238 VanDerWaalsContact ND2-N 3.15Å
232	S	32.4	Very low	38.3	Very low	41 Å²	41	86.7 Å²	86.7	29%	0.287	43%	0.426	S	S	.	.			trans	-158.7	129	164.8	167.2	0	0	0	0	112.5	Y230	Y230-S232 PolarHBondContact OH-N 3.01Å; Y230-S232 PolarHBondContact OH-O 3.37Å
233	S	37.8	Very low	37.7	Very low	71 Å²	71	83.5 Å²	83.5	50%	0.497	41%	0.407	S	S	.	.	S	Bend	trans	110.3	-4.6	137.8	70.3	0	0	0	0	124.4	Y210	Y210-S233 PolarHBondContact O-OG 3.02Å
234	E	38.1	Very low	37.1	Very low	179 Å²	179	87.1 Å²	87.1	84%	0.836	42%	0.422	S	S	*	.	S	Bend	trans	-120.2	-49.5	167.9	-70.8	-171.8	164.6	0	0	114.6
235	D	36.1	Very low	36.5	Very low	119 Å²	119	83.3 Å²	83.3	64%	0.636	41%	0.412	S	S	*	.	S	Bend	trans	-106.6	3.7	-174	-71.9	-33.9	0	0	0	115.2	T237	D235-T237 HydrophobicContact CB-CG2 4.23Å; D235-T237 WeakPolarHBondContact CB-OG1 3.39Å; D235-T237 WeakPolarHBondContact O-CG2 3.41Å; D235-T237 PolarHBondContact O-N 2.87Å
236	N	34.2	Very low	36.1	Very low	140 Å²	140	88.2 Å²	88.2	75%	0.749	44%	0.438	S	S	*	.	S	Bend	trans	51.9	9.9	-167.9	-79.7	-32.2	0	0	0	114.3
237	T	28.5	Very low	35.6	Very low	75 Å²	75	90.7 Å²	90.7	46%	0.46	45%	0.453	S	S	.	.			trans	-97.2	120.8	-179	56.5	0	0	0	0	110.9	N231 D235	N231-T237 PolarHBondContact ND2-O 3.41Å; N231-T237 PolarHBondContact OD1-O 2.84Å; D235-T237 HydrophobicContact CB-CG2 4.23Å; D235-T237 WeakPolarHBondContact CB-OG1 3.39Å; D235-T237 WeakPolarHBondContact O-CG2 3.41Å; D235-T237 PolarHBondContact O-N 2.87Å
238	M	28.7	Very low	34.9	Very low	34 Å²	34	98 Å²	98	17%	0.167	48%	0.483	C	S	.	.			trans	-66.4	138.1	178.7	-61.1	-167.8	-156.9	0	0	111.5	L157 I160 I176 N231	L157-M238 HydrophobicContact CD1-CB 4.01Å; L157-M238 VanDerWaalsContact CD1-O 3.26Å; L157-M238 WeakPolarHBondContact CD1-O 3.43Å; L157-M238 HydrophobicContact CD2-CB 3.47Å; L157-M238 VanDerWaalsContact CD2-CB 3.47Å; L157-M238 HydrophobicContact CD2-CG 4.23Å; L157-M238 HydrophobicContact CD2-SD 3.98Å; L157-M238 HydrophobicContact CG-CB 4.29Å; I160-M238 HydrophobicContact CB-CE 3.84Å; I160-M238 HydrophobicContact CB-SD 4.4Å; I160-M238 HydrophobicContact CD1-CE 4.14Å; I160-M238 HydrophobicContact CD1-SD 3.56Å; I160-M238 VanDerWaalsContact CD1-SD 3.56Å; I160-M238 HydrophobicContact CG2-CE 3.33Å; I160-M238 HydrophobicContact CG2-SD 4.21Å; I176-M238 HydrophobicContact CD1-CE 3.79Å; I176-M238 HydrophobicContact CD1-SD 4.37Å; I176-M238 HydrophobicContact CG1-CE 4.02Å; I176-M238 HydrophobicContact CG2-SD 4.19Å; N231-M238 HydrophobicContact CB-CB 4.12Å; N231-M238 HydrophobicContact CB-CG 3.95Å; N231-M238 VanDerWaalsContact ND2-CA 3.32Å; N231-M238 WeakPolarHBondContact ND2-CA 3.29Å; N231-M238 PolarHBondContact ND2-N 2.75Å; N231-M238 VanDerWaalsContact ND2-N 3.15Å
239	K	31.8	Very low	34.4	Very low	117 Å²	117	101.2 Å²	101.2	51%	0.509	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.1	178.6	-71.8	-176	-179.2	172.9	0	110.4	Y230	Y230-K239 VanDerWaalsContact O-O 3.12Å
240	L	31.4	Very low	34.2	Very low	70 Å²	70	107 Å²	107	37%	0.366	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	125.4	179.4	-172.2	83.8	0	0	0	110.4	F153 W229	F153-L240 HydrophobicContact CB-CD2 3.88Å; F153-L240 HydrophobicContact CD1-CD1 4.3Å; F153-L240 HydrophobicContact CD1-CD2 4.43Å; F153-L240 HydrophobicContact CG-CD2 4.13Å; W229-L240 HydrophobicContact CD2-CD1 4.17Å; W229-L240 HydrophobicContact CH2-CD1 3.93Å; W229-L240 HydrophobicContact CZ2-CD1 3.17Å
241	I	35.3	Very low	33.9	Very low	74 Å²	74	113.8 Å²	113.8	38%	0.379	57%	0.572	S	S	.	*			trans	-124.3	102.4	170.9	-53.3	177.8	0	0	0	109.2	F243	I241-F243 HydrophobicContact CB-CE2 4.36Å; I241-F243 HydrophobicContact CG2-CD2 3.81Å; I241-F243 HydrophobicContact CG2-CE2 3.4Å; I241-F243 VanDerWaalsContact CG2-CE2 3.4Å; I241-F243 HydrophobicContact CG2-CZ 4.02Å; I241-F243 PolarHBondContact O-N 2.86Å
242	R	35.9	Very low	33.6	Very low	177 Å²	177	114.3 Å²	114.3	67%	0.668	57%	0.572	S	S	*	*			trans	-81.3	113.6	174.1	-173.1	179.2	-176.5	176.8	1.6	109.2	L227	L227-R242 HydrophobicContact CD2-CG 4.07Å
243	F	35.3	Very low	33.9	Very low	96 Å²	96	117.1 Å²	117.1	42%	0.421	59%	0.59	S	S	.	*			trans	-92.3	121	168	-80.7	-84.2	0	0	0	109.5	F203 I228 I241	F203-F243 HydrophobicContact CD1-CZ 4.48Å; F203-F243 HydrophobicContact CE1-CE1 4.05Å; F203-F243 HydrophobicContact CE1-CZ 4.05Å; I228-F243 HydrophobicContact CB-CD2 4.34Å; I228-F243 HydrophobicContact CD1-CD2 4.26Å; I241-F243 HydrophobicContact CB-CE2 4.36Å; I241-F243 HydrophobicContact CG2-CD2 3.81Å; I241-F243 HydrophobicContact CG2-CE2 3.4Å; I241-F243 VanDerWaalsContact CG2-CE2 3.4Å; I241-F243 HydrophobicContact CG2-CZ 4.02Å; I241-F243 PolarHBondContact O-N 2.86Å
244	Q	32.1	Very low	33.9	Very low	161 Å²	161	120.4 Å²	120.4	75%	0.752	60%	0.598	S	S	*	*			trans	-90.2	147.2	168.6	-75.9	-177.9	-53.3	0	0	110.2
245	E	33.5	Very low	34	Very low	145 Å²	145	113.8 Å²	113.8	68%	0.678	57%	0.57	S	S	*	*	S	Bend	trans	-42.6	128.3	-169.6	-66.7	172	113.7	0	0	116.1	N225	N225-E245 WeakPolarHBondContact OD1-CG 3.25Å; N225-E245 PolarHBondContact OD1-OE1 3.32Å
246	N	32.9	Very low	34.5	Very low	155 Å²	155	110.9 Å²	110.9	83%	0.829	56%	0.556	S	S	*	*			trans	-178.7	42.7	134.8	-99	-28.7	0	0	0	111.9	K248	N246-K248 VanDerWaalsContact C-N 3.27Å; N246-K248 PolarHBondContact O-N 2.74Å
247	L	34.5	Very low	35.5	Very low	105 Å²	105	110.6 Å²	110.6	55%	0.55	55%	0.546	S	S	.	.			trans	-79	84	170.7	-74.8	166.4	0	0	0	108.7	F203 S249 F252	F203-L247 HydrophobicContact CE2-CD2 4.2Å; F203-L247 HydrophobicContact CZ-CD1 4.39Å; F203-L247 HydrophobicContact CZ-CD2 4.06Å; L247-S249 PolarHBondContact O-N 3.47Å; L247-F252 HydrophobicContact CD1-CZ 4.34Å
248	K	32.7	Very low	36.8	Very low	189 Å²	189	108.1 Å²	108.1	82%	0.822	53%	0.529	S	S	*	.			trans	-51.1	116.5	157.8	-74	-176.7	178.4	178.7	0	106.7	N246	N246-K248 VanDerWaalsContact C-N 3.27Å; N246-K248 PolarHBondContact O-N 2.74Å
249	S	35.1	Very low	38.4	Very low	92 Å²	92	112.2 Å²	112.2	64%	0.643	55%	0.546	S	S	*	.			trans	25.9	114.7	160.6	58.9	0	0	0	0	115.4	L247	L247-S249 PolarHBondContact O-N 3.47Å
250	N	31.4	Very low	40	Very low	133 Å²	133	110.9 Å²	110.9	71%	0.711	55%	0.549	S	S	*	.				-179.7	103.1	126.4	-84.3	-18.5	0	0	0	108.9	F252	N250-F252 PolarHBondContact O-N 2.91Å
251	E	34.2	Very low	41.9	Very low	165 Å²	165	108.6 Å²	108.6	77%	0.771	54%	0.537	S	S	*	.			trans	44	69.3	134.5	-63.4	-173.8	167.5	0	0	115.7	C253	E251-C253 PolarHBondContact O-N 2.83Å
252	F	33	Very low	43.4	Very low	62 Å²	62	106.9 Å²	106.9	27%	0.272	53%	0.527	S	S	.	.			trans	-65.2	79.3	153.6	-66.5	-81.7	0	0	0	107.6	E197 P200 L247 N250 Q254 T255	E197-F252 WeakPolarHBondContact OE2-CD1 3.44Å; E197-F252 WeakPolarHBondContact OE2-CE1 3.37Å; E197-F252 VanDerWaalsContact OE2-CG 3.27Å; E197-F252 WeakPolarHBondContact OE2-CG 3.07Å; P200-F252 HydrophobicContact CG-CD1 4.22Å; P200-F252 HydrophobicContact CG-CE1 3.63Å; L247-F252 HydrophobicContact CD1-CZ 4.34Å; N250-F252 PolarHBondContact O-N 2.91Å; F252-Q254 PolarHBondContact O-N 3.02Å; F252-Q254 VanDerWaalsContact O-N 3.11Å; F252-T255 HydrophobicContact CB-CG2 3.83Å
253	C	38.6	Very low	44.9	Very low	101 Å²	101	100 Å²	100	68%	0.682	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-10.4	-171.7	-79.1	0	0	0	0	114	E251	E251-C253 PolarHBondContact O-N 2.83Å
254	Q	38	Very low	46.6	Very low	140 Å²	140	99.3 Å²	99.3	65%	0.654	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.2	65	-173.8	-64.3	-176.2	-8.5	0	0	111.3	F252	F252-Q254 PolarHBondContact O-N 3.02Å; F252-Q254 VanDerWaalsContact O-N 3.11Å
255	T	41.7	Very low	48.5	Very low	39 Å²	39	92 Å²	92	24%	0.239	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	122.2	167.9	70.2	0	0	0	0	109	E197 F252	E197-T255 HydrophobicContact CG-CG2 3.79Å; E197-T255 WeakPolarHBondContact OE1-CG2 3.47Å; F252-T255 HydrophobicContact CB-CG2 3.83Å
256	T	44.9	Very low	50.1	Low	58 Å²	58	85 Å²	85	36%	0.356	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	105.1	173.4	53.1	0	0	0	0	109.2	S195 I196	S195-T256 CarbonylContact C-O 3.17Å; S195-T256 VanDerWaalsContact CA-O 3.3Å; S195-T256 WeakPolarHBondContact CA-O 3.49Å; I196-T256 PolarHBondContact N-O 3.37Å; I196-T256 PolarHBondContact O-N 3.2Å; I196-T256 PolarHBondContact O-OG1 3.1Å
257	Y	55.2	Low	51.7	Low	135 Å²	135	81.3 Å²	81.3	53%	0.529	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	140.3	170.8	-65.6	-82.8	0	0	0	109.9	K259	Y257-K259 PolarHBondContact O-N 2.96Å; Y257-K259 VanDerWaalsContact O-N 3.1Å
258	I	56.8	Low	53.6	Low	23 Å²	23	76.7 Å²	76.7	12%	0.118	39%	0.392	C	S	.	.			trans	-67.6	109.8	171.7	-50.2	-179.3	0	0	0	107.8	L174 A177 C194 V263	L174-I258 HydrophobicContact CD2-CB 4.23Å; L174-I258 HydrophobicContact CD2-CG1 3.9Å; L174-I258 HydrophobicContact CD2-CG2 3.88Å; A177-I258 HydrophobicContact CB-CD1 3.39Å; A177-I258 HydrophobicContact CB-CG1 4.41Å; C194-I258 HydrophobicContact CB-CD1 4.19Å; I258-V263 HydrophobicContact CG2-CG2 3.65Å
259	K	61.5	Low	55.4	Low	119 Å²	119	70.3 Å²	70.3	52%	0.517	36%	0.363	S	S	.	.			trans	-81.5	148.1	179.1	-54.6	-174.4	-178.6	175.8	0	110.5	Y257 E261 Q262 V263	Y257-K259 PolarHBondContact O-N 2.96Å; Y257-K259 VanDerWaalsContact O-N 3.1Å; K259-E261 HydrophobicContact CB-CG 4.17Å; K259-E261 VanDerWaalsContact CB-OE1 3.26Å; K259-E261 WeakPolarHBondContact CB-OE1 3.43Å; K259-E261 VanDerWaalsContact CB-OE2 3.23Å; K259-E261 WeakPolarHBondContact CB-OE2 3.33Å; K259-E261 WeakPolarHBondContact CD-OE1 3.46Å; K259-E261 PolarHBondContact O-N 2.7Å; K259-E261 VanDerWaalsContact O-N 3.14Å; K259-Q262 HydrophobicContact CB-CG 4.41Å; K259-Q262 WeakPolarHBondContact O-CB 3.36Å; K259-Q262 PolarHBondContact O-N 2.6Å; K259-V263 PolarHBondContact O-N 3.1Å
260	P	66.5	Low	56.9	Low	89 Å²	89	70 Å²	70	58%	0.578	35%	0.348	S	S	*	.	H	α-helix	trans	-53.4	-35.4	-179.8	-26.6	34.9	0	0	0	113.8	Q262 V263 K264	P260-Q262 VanDerWaalsContact C-N 3.33Å; P260-Q262 PolarHBondContact O-N 3.13Å; P260-V263 WeakPolarHBondContact O-CB 3.39Å; P260-V263 PolarHBondContact O-N 3.15Å; P260-K264 PolarHBondContact O-N 2.81Å; P260-K264 VanDerWaalsContact O-N 3.1Å
261	E	70.2	Confident	58.8	Low	22 Å²	22	67.6 Å²	67.6	10%	0.103	34%	0.342	C	S	.	.	H	α-helix	trans	-63.3	-35.3	176.2	62.3	-88.9	-157.1	0	0	113.2	K259 V263 K264 L265 L278 C281 L283	K259-E261 HydrophobicContact CB-CG 4.17Å; K259-E261 VanDerWaalsContact CB-OE1 3.26Å; K259-E261 WeakPolarHBondContact CB-OE1 3.43Å; K259-E261 VanDerWaalsContact CB-OE2 3.23Å; K259-E261 WeakPolarHBondContact CB-OE2 3.33Å; K259-E261 WeakPolarHBondContact CD-OE1 3.46Å; K259-E261 PolarHBondContact O-N 2.7Å; K259-E261 VanDerWaalsContact O-N 3.14Å; E261-V263 VanDerWaalsContact C-N 3.3Å; E261-V263 PolarHBondContact O-N 3.18Å; E261-K264 PolarHBondContact O-N 3.45Å; E261-L265 WeakPolarHBondContact O-CB 3.34Å; E261-L265 VanDerWaalsContact O-CG 3.31Å; E261-L265 WeakPolarHBondContact O-CG 3.45Å; E261-L265 PolarHBondContact O-N 2.89Å; E261-L278 HydrophobicContact CB-CD2 4.09Å; E261-C281 HydrophobicContact CB-CB 4.22Å; E261-L283 HydrophobicContact CB-CD2 3.95Å; E261-L283 HydrophobicContact CG-CD2 3.74Å
262	Q	68	Low	60.5	Low	38 Å²	38	61.4 Å²	61.4	18%	0.178	32%	0.322	C	S	.	.	H	α-helix	trans	-67.5	-37	178.1	-65.5	176.3	-47.8	0	0	110.6	Y170 L174 K259 P260 L265 L266	Y170-Q262 PolarHBondContact OH-NE2 2.77Å; L174-Q262 HydrophobicContact CD1-CB 4.11Å; L174-Q262 HydrophobicContact CD1-CG 4.44Å; L174-Q262 HydrophobicContact CD2-CB 4.39Å; K259-Q262 HydrophobicContact CB-CG 4.41Å; K259-Q262 WeakPolarHBondContact O-CB 3.36Å; K259-Q262 PolarHBondContact O-N 2.6Å; P260-Q262 VanDerWaalsContact C-N 3.33Å; P260-Q262 PolarHBondContact O-N 3.13Å; Q262-L265 PolarHBondContact O-N 3.31Å; Q262-L266 WeakPolarHBondContact O-CD1 3.26Å; Q262-L266 VanDerWaalsContact O-CG 3.25Å; Q262-L266 WeakPolarHBondContact O-CG 3.43Å; Q262-L266 PolarHBondContact O-N 2.86Å
263	V	67.6	Low	62.6	Low	34 Å²	34	58.5 Å²	58.5	21%	0.206	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-47.3	174.3	180	0	0	0	0	110.7	R178 I258 K259 P260 E261 L265 L266 D267	R178-V263 VanDerWaalsContact CD-CG1 3.5Å; I258-V263 HydrophobicContact CG2-CG2 3.65Å; K259-V263 PolarHBondContact O-N 3.1Å; P260-V263 WeakPolarHBondContact O-CB 3.39Å; P260-V263 PolarHBondContact O-N 3.15Å; E261-V263 VanDerWaalsContact C-N 3.3Å; E261-V263 PolarHBondContact O-N 3.18Å; V263-L265 VanDerWaalsContact C-N 3.33Å; V263-L265 PolarHBondContact O-N 2.79Å; V263-L266 WeakPolarHBondContact O-CB 3.35Å; V263-L266 PolarHBondContact O-N 2.94Å; V263-L266 VanDerWaalsContact O-N 3.16Å; V263-D267 PolarHBondContact O-N 2.94Å
264	K	71.1	Confident	64.8	Low	81 Å²	81	58.3 Å²	58.3	35%	0.352	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-39.6	177.3	-69.1	-173.7	-176.4	-179.5	0	112.3	P260 E261 D267 S268 T277 L278 E279 C281	P260-K264 PolarHBondContact O-N 2.81Å; P260-K264 VanDerWaalsContact O-N 3.1Å; E261-K264 PolarHBondContact O-N 3.45Å; K264-D267 PolarHBondContact O-N 2.95Å; K264-S268 WeakPolarHBondContact O-CB 3.42Å; K264-S268 PolarHBondContact O-N 3.34Å; K264-S268 PolarHBondContact O-OG 3.46Å; K264-T277 WeakPolarHBondContact CD-O 3.34Å; K264-L278 HydrophobicContact CB-CD2 3.6Å; K264-L278 HydrophobicContact CD-CD2 4.16Å; K264-E279 PolarHBondContact NZ-O 3.14Å; K264-C281 PolarHBondContact NZ-SG 2.81Å
265	L	71.2	Confident	67.2	Low	6 Å²	6	54.3 Å²	54.3	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-61.1	-45.5	173.7	-74.2	173.3	0	0	0	110.9	E261 Q262 V263 S268 Y269 V276 L278 P287 L289 F292	E261-L265 WeakPolarHBondContact O-CB 3.34Å; E261-L265 VanDerWaalsContact O-CG 3.31Å; E261-L265 WeakPolarHBondContact O-CG 3.45Å; E261-L265 PolarHBondContact O-N 2.89Å; Q262-L265 PolarHBondContact O-N 3.31Å; V263-L265 VanDerWaalsContact C-N 3.33Å; V263-L265 PolarHBondContact O-N 2.79Å; L265-S268 VanDerWaalsContact C-OG 3.31Å; L265-S268 WeakPolarHBondContact CA-OG 3.46Å; L265-S268 PolarHBondContact O-N 3.17Å; L265-S268 PolarHBondContact O-OG 3.48Å; L265-Y269 PolarHBondContact O-N 3.49Å; L265-V276 HydrophobicContact CD2-CG1 3.67Å; L265-V276 HydrophobicContact CD2-CG2 4.33Å; L265-L278 HydrophobicContact CD2-CD1 4.05Å; L265-L278 HydrophobicContact CD2-CD2 4.36Å; L265-L278 HydrophobicContact CG-CD1 4.29Å; L265-L278 HydrophobicContact CG-CD2 4.17Å; L265-P287 HydrophobicContact CD1-CB 4Å; L265-P287 HydrophobicContact CD1-CG 4.1Å; L265-L289 HydrophobicContact CD2-CD2 3.51Å; L265-F292 HydrophobicContact CB-CE2 4.44Å; L265-F292 HydrophobicContact CB-CZ 4.47Å; L265-F292 HydrophobicContact CD2-CE2 3.77Å; L265-F292 HydrophobicContact CD2-CZ 4.24Å; L265-F292 WeakPolarHBondContact O-CZ 3.4Å
266	L	66.9	Low	69.4	Low	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-51	176.3	-73.5	163.2	0	0	0	112	H171 L174 L175 Q262 V263 S268 Y269 Y270	H171-L266 HydrophobicContact CB-CD2 3.62Å; H171-L266 WeakPolarHBondContact O-CD2 3.4Å; L174-L266 HydrophobicContact CB-CD1 3.47Å; L174-L266 VanDerWaalsContact CB-CD1 3.47Å; L174-L266 HydrophobicContact CD1-CD1 4.32Å; L175-L266 HydrophobicContact CD1-CD2 4.17Å; L175-L266 HydrophobicContact CD2-CB 3.96Å; L175-L266 HydrophobicContact CD2-CD1 4.12Å; L175-L266 HydrophobicContact CD2-CD2 4.02Å; L175-L266 HydrophobicContact CD2-CG 4.26Å; L175-L266 HydrophobicContact CG-CD1 4.1Å; L175-L266 HydrophobicContact CG-CD2 3.78Å; L175-L266 HydrophobicContact CG-CG 4.39Å; Q262-L266 WeakPolarHBondContact O-CD1 3.26Å; Q262-L266 VanDerWaalsContact O-CG 3.25Å; Q262-L266 WeakPolarHBondContact O-CG 3.43Å; Q262-L266 PolarHBondContact O-N 2.86Å; V263-L266 WeakPolarHBondContact O-CB 3.35Å; V263-L266 PolarHBondContact O-N 2.94Å; V263-L266 VanDerWaalsContact O-N 3.16Å; L266-S268 PolarHBondContact O-N 2.88Å; L266-Y269 WeakPolarHBondContact O-CB 3.37Å; L266-Y269 PolarHBondContact O-N 2.78Å; L266-Y270 VanDerWaalsContact O-CD2 3.3Å; L266-Y270 WeakPolarHBondContact O-CD2 3.36Å; L266-Y270 PolarHBondContact O-N 3.21Å; L266-Y270 VanDerWaalsContact O-N 3.08Å
267	D	67.7	Low	71.4	Confident	76 Å²	76	52.7 Å²	52.7	41%	0.406	28%	0.276	S	S	.	.	H	α-helix	trans	-55.3	-42.6	177.3	-72.1	-36.7	0	0	0	111.8	R178 V263 K264 Y269 Y270 S271	R178-D267 IonicContact CZ-OD1 2.79Å; R178-D267 IonicContact NH1-OD1 3.89Å; R178-D267 PolarHBondContact NH1-OD1 2.78Å; R178-D267 IonicContact NH1-OD2 3.56Å; R178-D267 PolarHBondContact NH1-OD2 2.85Å; R178-D267 VanDerWaalsContact NH1-OD2 3.14Å; R178-D267 IonicContact NH2-OD1 3.38Å; V263-D267 PolarHBondContact O-N 2.94Å; K264-D267 PolarHBondContact O-N 2.95Å; D267-Y269 VanDerWaalsContact C-N 3.32Å; D267-Y269 PolarHBondContact O-N 3.11Å; D267-Y270 PolarHBondContact O-N 3.03Å; D267-S271 PolarHBondContact O-N 2.94Å; D267-S271 PolarHBondContact O-OG 3.03Å
268	S	73.4	Confident	72.9	Confident	8 Å²	8	46.2 Å²	46.2	6%	0.056	25%	0.251	C	S	.	.	H	α-helix	trans	-65.9	-32.3	176.5	67	0	0	0	0	113.6	K264 L265 L266 S271 G273 S275 V276 F292	K264-S268 WeakPolarHBondContact O-CB 3.42Å; K264-S268 PolarHBondContact O-N 3.34Å; K264-S268 PolarHBondContact O-OG 3.46Å; L265-S268 VanDerWaalsContact C-OG 3.31Å; L265-S268 WeakPolarHBondContact CA-OG 3.46Å; L265-S268 PolarHBondContact O-N 3.17Å; L265-S268 PolarHBondContact O-OG 3.48Å; L266-S268 PolarHBondContact O-N 2.88Å; S268-S271 WeakPolarHBondContact CA-OG 3.5Å; S268-S271 PolarHBondContact O-OG 2.73Å; S268-S271 VanDerWaalsContact O-OG 3.05Å; S268-G273 WeakPolarHBondContact O-CA 3.27Å; S268-G273 PolarHBondContact O-N 2.99Å; S268-S275 VanDerWaalsContact CB-O 3.26Å; S268-S275 WeakPolarHBondContact CB-O 3.49Å; S268-V276 WeakPolarHBondContact OG-CG2 3.44Å; S268-F292 WeakPolarHBondContact OG-CE1 3.19Å; S268-F292 WeakPolarHBondContact OG-CZ 3.4Å
269	Y	69.7	Low	74.3	Confident	55 Å²	55	47.9 Å²	47.9	22%	0.216	26%	0.258	C	S	.	.	H	α-helix	trans	-68	-42.7	176.7	-173.6	-93.5	0	0	0	110.8	R166 T167 L265 L266 D267 G272 A291 F292	R166-Y269 PolarHBondContact O-OH 2.97Å; T167-Y269 HydrophobicContact CG2-CD1 4.12Å; T167-Y269 HydrophobicContact CG2-CE1 3.54Å; L265-Y269 PolarHBondContact O-N 3.49Å; L266-Y269 WeakPolarHBondContact O-CB 3.37Å; L266-Y269 PolarHBondContact O-N 2.78Å; D267-Y269 VanDerWaalsContact C-N 3.32Å; D267-Y269 PolarHBondContact O-N 3.11Å; Y269-G272 PolarHBondContact O-N 3.42Å; Y269-A291 HydrophobicContact CD2-CB 4.19Å; Y269-A291 HydrophobicContact CE2-CB 4.18Å; Y269-F292 HydrophobicContact CD2-CE1 4.04Å; Y269-F292 HydrophobicContact CD2-CZ 4.2Å; Y269-F292 HydrophobicContact CG-CE1 4.46Å
270	Y	67.1	Low	75.3	Confident	87 Å²	87	45.1 Å²	45.1	34%	0.341	26%	0.257	S	S	.	.	H	α-helix	trans	-72.9	-26.4	178.1	-78.4	-85.9	0	0	0	113.8	I164 L175 L266 D267 G272	I164-Y270 HydrophobicContact CD1-CD1 4.03Å; I164-Y270 HydrophobicContact CD1-CE1 3.43Å; I164-Y270 VanDerWaalsContact CD1-CE1 3.43Å; I164-Y270 HydrophobicContact CG1-CE1 4.23Å; L175-Y270 HydrophobicContact CD1-CE2 3.35Å; L175-Y270 VanDerWaalsContact CD1-CZ 3.49Å; L175-Y270 WeakPolarHBondContact CD1-OH 2.87Å; L175-Y270 HydrophobicContact CD2-CD2 4.21Å; L175-Y270 HydrophobicContact CD2-CE2 3.69Å; L175-Y270 HydrophobicContact CG-CE2 4.09Å; L266-Y270 VanDerWaalsContact O-CD2 3.3Å; L266-Y270 WeakPolarHBondContact O-CD2 3.36Å; L266-Y270 PolarHBondContact O-N 3.21Å; L266-Y270 VanDerWaalsContact O-N 3.08Å; D267-Y270 PolarHBondContact O-N 3.03Å; Y270-G272 PolarHBondContact O-N 3.36Å
271	S	72.1	Confident	75.7	Confident	81 Å²	81	41.7 Å²	41.7	57%	0.566	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	11.1	170.3	66.7	0	0	0	0	113.7	D267 S268	D267-S271 PolarHBondContact O-N 2.94Å; D267-S271 PolarHBondContact O-OG 3.03Å; S268-S271 WeakPolarHBondContact CA-OG 3.5Å; S268-S271 PolarHBondContact O-OG 2.73Å; S268-S271 VanDerWaalsContact O-OG 3.05Å
272	G	69.3	Low	76.3	Confident	35 Å²	35	47.6 Å²	47.6	36%	0.361	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.1	-1.6	175.3	0	0	0	0	0	114.5	Y269 Y270 H274	Y269-G272 PolarHBondContact O-N 3.42Å; Y270-G272 PolarHBondContact O-N 3.36Å; G272-H274 VanDerWaalsContact C-N 3.26Å; G272-H274 PolarHBondContact O-CE1 2.98Å; G272-H274 PolarHBondContact O-N 3.17Å; G272-H274 PolarHBondContact O-ND1 3.31Å
273	G	77.8	Confident	76.8	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.01	26%	0.256	C	S	.	.	S	Bend	trans	72.6	13.9	172.1	0	0	0	0	0	115.1	S268 T295 L296	S268-G273 WeakPolarHBondContact O-CA 3.27Å; S268-G273 PolarHBondContact O-N 2.99Å; G273-T295 CarbonylContact O-C 3.51Å; G273-T295 WeakPolarHBondContact O-CB 3.21Å; G273-T295 PolarHBondContact O-OG1 3.33Å; G273-L296 WeakPolarHBondContact O-CA 3.21Å; G273-L296 PolarHBondContact O-N 2.75Å
274	H	85.4	Confident	77.5	Confident	97 Å²	97	51.2 Å²	51.2	45%	0.449	28%	0.276	S	S	.	.	S	Bend	trans	-82	-28.6	-179.3	-59.4	99.5	0	0	0	112.9	G272 T295 R297 F298	G272-H274 VanDerWaalsContact C-N 3.26Å; G272-H274 PolarHBondContact O-CE1 2.98Å; G272-H274 PolarHBondContact O-N 3.17Å; G272-H274 PolarHBondContact O-ND1 3.31Å; H274-T295 WeakPolarHBondContact CA-O 3.44Å; H274-T295 PolarHBondContact CD2-O 2.87Å; H274-R297 PolarHBondContact O-N 3.23Å; H274-F298 PolarHBondContact O-N 3.18Å
275	S	88	Confident	78.1	Confident	56 Å²	56	56.6 Å²	56.6	39%	0.392	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	121.3	-175.6	61.8	0	0	0	0	111.5	S268 F298	S268-S275 VanDerWaalsContact CB-O 3.26Å; S268-S275 WeakPolarHBondContact CB-O 3.49Å; S275-F298 CarbonylContact C-O 3.53Å; S275-F298 WeakPolarHBondContact CA-O 3.35Å
276	V	86.6	Confident	78.6	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.2	175.1	170.7	0	0	0	0	108.8	L265 S268 L278 F292 L296 F298 L299 N300	L265-V276 HydrophobicContact CD2-CG1 3.67Å; L265-V276 HydrophobicContact CD2-CG2 4.33Å; S268-V276 WeakPolarHBondContact OG-CG2 3.44Å; V276-L278 HydrophobicContact CG1-CD1 4.14Å; V276-L278 HydrophobicContact CG1-CD2 4.32Å; V276-L278 HydrophobicContact CG1-CG 3.8Å; V276-F292 HydrophobicContact CG2-CD1 3.93Å; V276-F292 HydrophobicContact CG2-CD2 4.39Å; V276-F292 HydrophobicContact CG2-CE1 3.91Å; V276-F292 HydrophobicContact CG2-CE2 4.41Å; V276-F292 HydrophobicContact CG2-CG 4.17Å; V276-F292 HydrophobicContact CG2-CZ 4.17Å; V276-L296 HydrophobicContact CB-CD1 3.74Å; V276-L296 HydrophobicContact CG2-CD1 3.3Å; V276-L296 HydrophobicContact CG2-CD2 4.43Å; V276-F298 PolarHBondContact N-O 3.48Å; V276-L299 HydrophobicContact CB-CD1 3.96Å; V276-L299 HydrophobicContact CG1-CD1 3.82Å; V276-L299 WeakPolarHBondContact O-CA 3.31Å; V276-N300 PolarHBondContact O-N 2.88Å
277	T	88.5	Confident	79.1	Confident	63 Å²	63	59 Å²	59	39%	0.387	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	109.4	174.9	-61.7	0	0	0	0	109.5	K264 E279 N300	K264-T277 WeakPolarHBondContact CD-O 3.34Å; T277-E279 HydrophobicContact CG2-CB 4.14Å; T277-N300 HydrophobicContact CG2-CB 4.12Å
278	L	86.1	Confident	79.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.315	C	S	.	.			trans	-116.2	39.9	174.7	-53.4	176.4	0	0	0	110.9	E261 K264 L265 V276 L283 P287 N300 L301 N304	E261-L278 HydrophobicContact CB-CD2 4.09Å; K264-L278 HydrophobicContact CB-CD2 3.6Å; K264-L278 HydrophobicContact CD-CD2 4.16Å; L265-L278 HydrophobicContact CD2-CD1 4.05Å; L265-L278 HydrophobicContact CD2-CD2 4.36Å; L265-L278 HydrophobicContact CG-CD1 4.29Å; L265-L278 HydrophobicContact CG-CD2 4.17Å; V276-L278 HydrophobicContact CG1-CD1 4.14Å; V276-L278 HydrophobicContact CG1-CD2 4.32Å; V276-L278 HydrophobicContact CG1-CG 3.8Å; L278-L283 HydrophobicContact CB-CD1 3.92Å; L278-L283 HydrophobicContact CD1-CD1 4.06Å; L278-P287 HydrophobicContact CD1-CG 3.54Å; L278-N300 CarbonylContact C-O 3.21Å; L278-N300 PolarHBondContact N-O 2.92Å; L278-L301 HydrophobicContact CB-CD2 4.09Å; L278-L301 HydrophobicContact CD1-CD2 4.05Å; L278-L301 HydrophobicContact CG-CD2 4.49Å; L278-N304 PolarHBondContact O-ND2 3.12Å
279	E	85.9	Confident	79.9	Confident	58 Å²	58	60 Å²	60	27%	0.271	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	137.4	176	-177.8	175	168.3	0	0	111	K264 T277 C281 N300 S302 R303	K264-E279 PolarHBondContact NZ-O 3.14Å; T277-E279 HydrophobicContact CG2-CB 4.14Å; E279-C281 PolarHBondContact O-N 3.15Å; E279-N300 PolarHBondContact OE2-ND2 3.33Å; E279-S302 VanDerWaalsContact CA-O 3.3Å; E279-S302 WeakPolarHBondContact CA-O 3.26Å; E279-S302 WeakPolarHBondContact CG-O 3.44Å; E279-R303 HydrophobicContact CG-CB 4.42Å; E279-R303 WeakPolarHBondContact OE1-CD 3.5Å; E279-R303 IonicContact OE1-CZ 3.28Å; E279-R303 IonicContact OE1-NE 3.56Å; E279-R303 PolarHBondContact OE1-NE 3.2Å; E279-R303 IonicContact OE1-NH1 3.02Å; E279-R303 PolarHBondContact OE1-NH1 3.16Å
280	A	81.9	Confident	80	Confident	60 Å²	60	59.9 Å²	59.9	50%	0.496	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	34.2	174.5	0	0	0	0	0	114.4	Q282 S302 R303	A280-Q282 VanDerWaalsContact C-N 3.27Å; A280-Q282 PolarHBondContact O-N 3.16Å; A280-S302 PolarHBondContact N-O 3.28Å; A280-R303 WeakPolarHBondContact CA-O 3.45Å; A280-R303 HydrophobicContact CB-CB 4.27Å
281	C	76.3	Confident	80.1	Confident	17 Å²	17	57.1 Å²	57.1	12%	0.115	32%	0.317	C	S	.	.	S	Bend	trans	-87	9.5	176.6	-77.2	0	0	0	0	113.2	E261 K264 E279 L283 N304	E261-C281 HydrophobicContact CB-CB 4.22Å; K264-C281 PolarHBondContact NZ-SG 2.81Å; E279-C281 PolarHBondContact O-N 3.15Å; C281-L283 HydrophobicContact CB-CD1 4.13Å; C281-L283 HydrophobicContact CB-CD2 4.1Å; C281-L283 HydrophobicContact CB-CG 3.73Å; C281-L283 PolarHBondContact O-N 3.25Å; C281-L283 VanDerWaalsContact O-N 3.16Å; C281-N304 WeakPolarHBondContact CA-OD1 3.5Å; C281-N304 PolarHBondContact N-OD1 3.42Å
282	Q	81.9	Confident	80.5	Confident	146 Å²	146	53.3 Å²	53.3	68%	0.682	29%	0.29	S	S	*	.			trans	55.4	30.4	-178.1	-55.6	179.2	-17.7	0	0	113.1	A280 K284 N304 Y305	A280-Q282 VanDerWaalsContact C-N 3.27Å; A280-Q282 PolarHBondContact O-N 3.16Å; Q282-K284 PolarHBondContact O-N 3.16Å; Q282-N304 PolarHBondContact N-OD1 3.49Å; Q282-Y305 HydrophobicContact CB-CD2 4.22Å; Q282-Y305 HydrophobicContact CB-CE2 3.97Å; Q282-Y305 HydrophobicContact CG-CE2 4.14Å
283	L	79.2	Confident	81	Confident	8 Å²	8	54.4 Å²	54.4	4%	0.042	28%	0.283	C	S	.	.			trans	-69.1	121.2	-176.4	-60	173.1	0	0	0	110.2	E261 L278 C281 L301 N304 Y305 L306	E261-L283 HydrophobicContact CB-CD2 3.95Å; E261-L283 HydrophobicContact CG-CD2 3.74Å; L278-L283 HydrophobicContact CB-CD1 3.92Å; L278-L283 HydrophobicContact CD1-CD1 4.06Å; C281-L283 HydrophobicContact CB-CD1 4.13Å; C281-L283 HydrophobicContact CB-CD2 4.1Å; C281-L283 HydrophobicContact CB-CG 3.73Å; C281-L283 PolarHBondContact O-N 3.25Å; C281-L283 VanDerWaalsContact O-N 3.16Å; L283-L301 HydrophobicContact CD1-CD2 4.3Å; L283-N304 HydrophobicContact CB-CB 4Å; L283-N304 WeakPolarHBondContact CG-OD1 2.98Å; L283-N304 PolarHBondContact N-OD1 3.02Å; L283-Y305 CarbonylContact O-C 3.37Å; L283-Y305 VanDerWaalsContact O-CA 3.27Å; L283-Y305 WeakPolarHBondContact O-CA 3.3Å; L283-Y305 PolarHBondContact O-N 3.14Å; L283-L306 HydrophobicContact CB-CD2 4.09Å; L283-L306 PolarHBondContact O-N 3.12Å
284	K	81	Confident	81.2	Confident	141 Å²	141	59.9 Å²	59.9	61%	0.613	32%	0.316	S	S	*	.	S	Bend	trans	-85.4	-27.8	168.4	-65.7	-175	179	-177.3	0	112.4	Q282	Q282-K284 PolarHBondContact O-N 3.16Å
285	Y	83.4	Confident	81.1	Confident	193 Å²	193	57.5 Å²	57.5	76%	0.757	31%	0.309	S	S	*	.	S	Bend	trans	-133.9	150.2	179.4	-53	-73.5	0	0	0	108.9	L306	Y285-L306 VanDerWaalsContact C-CD2 3.4Å
286	L	82.5	Confident	81	Confident	28 Å²	28	54.8 Å²	54.8	15%	0.147	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-64.2	130.3	174.3	-171.8	77.9	0	0	0	109.5	L289 L301 P310 F313	L286-L289 HydrophobicContact CD1-CD1 4.12Å; L286-L289 HydrophobicContact CD2-CD1 4.25Å; L286-L289 HydrophobicContact CG-CD1 4.36Å; L286-L301 HydrophobicContact CD1-CD1 3.35Å; L286-L301 HydrophobicContact CD1-CD2 3.87Å; L286-L301 HydrophobicContact CD1-CG 4.26Å; L286-P310 HydrophobicContact CB-CG 4.06Å; L286-P310 HydrophobicContact CD2-CG 3.68Å; L286-F313 HydrophobicContact CD1-CD2 4.46Å; L286-F313 HydrophobicContact CD2-CB 4.23Å; L286-F313 HydrophobicContact CD2-CD2 3.53Å; L286-F313 HydrophobicContact CD2-CE2 4.36Å; L286-F313 HydrophobicContact CD2-CG 4.33Å
287	P	77.4	Confident	81.4	Confident	28 Å²	28	61 Å²	61	18%	0.182	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-69.6	166.9	172.2	30.1	-34.3	0	0	0	111.1	L265 L278 L289	L265-P287 HydrophobicContact CD1-CB 4Å; L265-P287 HydrophobicContact CD1-CG 4.1Å; L278-P287 HydrophobicContact CD1-CG 3.54Å; P287-L289 HydrophobicContact CG-CD2 4.49Å; P287-L289 PolarHBondContact O-N 3.36Å
288	D	76.4	Confident	81.6	Confident	100 Å²	100	61.3 Å²	61.3	54%	0.535	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-65.9	118.2	174.6	-177.4	15.8	0	0	0	110.8	S290	D288-S290 WeakPolarHBondContact OD1-CB 3.41Å; D288-S290 PolarHBondContact OD1-N 2.74Å; D288-S290 PolarHBondContact OD1-OG 2.88Å; D288-S290 PolarHBondContact OD2-OG 2.89Å
289	L	80.8	Confident	82	Confident	5 Å²	5	61.3 Å²	61.3	3%	0.026	31%	0.309	C	S	.	.			trans	-107.4	12.5	177.5	-62.1	-179.8	0	0	0	112.3	L265 L286 P287 A291 F292 Y293 L299 L316	L265-L289 HydrophobicContact CD2-CD2 3.51Å; L286-L289 HydrophobicContact CD1-CD1 4.12Å; L286-L289 HydrophobicContact CD2-CD1 4.25Å; L286-L289 HydrophobicContact CG-CD1 4.36Å; P287-L289 HydrophobicContact CG-CD2 4.49Å; P287-L289 PolarHBondContact O-N 3.36Å; L289-A291 PolarHBondContact O-N 2.85Å; L289-A291 VanDerWaalsContact O-N 3.15Å; L289-F292 HydrophobicContact CD2-CD2 4.29Å; L289-F292 PolarHBondContact O-N 2.78Å; L289-Y293 HydrophobicContact CB-CE1 4.37Å; L289-Y293 VanDerWaalsContact O-CD1 3.26Å; L289-Y293 WeakPolarHBondContact O-CD1 3.4Å; L289-Y293 WeakPolarHBondContact O-CE1 3.49Å; L289-L299 HydrophobicContact CD1-CD1 4.22Å; L289-L299 HydrophobicContact CD1-CD2 3.72Å; L289-L316 HydrophobicContact CB-CD2 4.46Å; L289-L316 HydrophobicContact CD1-CD1 4.1Å
290	S	73.2	Confident	82.4	Confident	54 Å²	54	59.4 Å²	59.4	38%	0.378	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-53.2	-36.1	-178.1	60.6	0	0	0	0	113.6	D288 F292 Y293	D288-S290 WeakPolarHBondContact OD1-CB 3.41Å; D288-S290 PolarHBondContact OD1-N 2.74Å; D288-S290 PolarHBondContact OD1-OG 2.88Å; D288-S290 PolarHBondContact OD2-OG 2.89Å; S290-F292 PolarHBondContact O-N 2.87Å; S290-F292 VanDerWaalsContact O-N 3.11Å; S290-Y293 PolarHBondContact O-N 2.88Å
291	A	68.4	Low	82.9	Confident	29 Å²	29	56.5 Å²	56.5	24%	0.24	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-61.7	-18.6	176.7	0	0	0	0	0	114	Y269 L289	Y269-A291 HydrophobicContact CD2-CB 4.19Å; Y269-A291 HydrophobicContact CE2-CB 4.18Å; L289-A291 PolarHBondContact O-N 2.85Å; L289-A291 VanDerWaalsContact O-N 3.15Å
292	F	80	Confident	83.6	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-113.2	1.3	-174.1	-53.1	-88.2	0	0	0	113.9	L265 S268 Y269 V276 L289 S290 V294 T295 L296	L265-F292 HydrophobicContact CB-CE2 4.44Å; L265-F292 HydrophobicContact CB-CZ 4.47Å; L265-F292 HydrophobicContact CD2-CE2 3.77Å; L265-F292 HydrophobicContact CD2-CZ 4.24Å; L265-F292 WeakPolarHBondContact O-CZ 3.4Å; S268-F292 WeakPolarHBondContact OG-CE1 3.19Å; S268-F292 WeakPolarHBondContact OG-CZ 3.4Å; Y269-F292 HydrophobicContact CD2-CE1 4.04Å; Y269-F292 HydrophobicContact CD2-CZ 4.2Å; Y269-F292 HydrophobicContact CG-CE1 4.46Å; V276-F292 HydrophobicContact CG2-CD1 3.93Å; V276-F292 HydrophobicContact CG2-CD2 4.39Å; V276-F292 HydrophobicContact CG2-CE1 3.91Å; V276-F292 HydrophobicContact CG2-CE2 4.41Å; V276-F292 HydrophobicContact CG2-CG 4.17Å; V276-F292 HydrophobicContact CG2-CZ 4.17Å; L289-F292 HydrophobicContact CD2-CD2 4.29Å; L289-F292 PolarHBondContact O-N 2.78Å; S290-F292 PolarHBondContact O-N 2.87Å; S290-F292 VanDerWaalsContact O-N 3.11Å; F292-V294 PolarHBondContact O-N 2.97Å; F292-T295 PolarHBondContact O-N 3.18Å; F292-L296 HydrophobicContact CB-CB 3.89Å; F292-L296 HydrophobicContact CB-CD1 4.22Å; F292-L296 HydrophobicContact CB-CD2 4.35Å; F292-L296 HydrophobicContact CB-CG 4.38Å; F292-L296 HydrophobicContact CD1-CD1 4.44Å; F292-L296 VanDerWaalsContact O-CB 3.29Å; F292-L296 WeakPolarHBondContact O-CB 3.24Å; F292-L296 PolarHBondContact O-N 2.59Å
293	Y	81.3	Confident	83.9	Confident	58 Å²	58	56 Å²	56	23%	0.227	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-32	-175.2	-72.6	-10.2	0	0	0	114.6	L289 S290 L315 L316	L289-Y293 HydrophobicContact CB-CE1 4.37Å; L289-Y293 VanDerWaalsContact O-CD1 3.26Å; L289-Y293 WeakPolarHBondContact O-CD1 3.4Å; L289-Y293 WeakPolarHBondContact O-CE1 3.49Å; S290-Y293 PolarHBondContact O-N 2.88Å; Y293-L315 HydrophobicContact CD1-CB 4.19Å; Y293-L315 HydrophobicContact CD2-CB 3.88Å; Y293-L315 HydrophobicContact CD2-CD1 4.14Å; Y293-L315 HydrophobicContact CE1-CB 4.08Å; Y293-L315 HydrophobicContact CE2-CB 3.79Å; Y293-L315 HydrophobicContact CE2-CD1 3.43Å; Y293-L315 VanDerWaalsContact CE2-CD1 3.43Å; Y293-L315 HydrophobicContact CE2-CG 4.26Å; Y293-L315 HydrophobicContact CG-CB 4.08Å; Y293-L316 HydrophobicContact CD1-CD2 3.67Å; Y293-L316 HydrophobicContact CD1-CG 4.22Å; Y293-L316 HydrophobicContact CE1-CD2 4.23Å; Y293-L316 HydrophobicContact CE1-CG 4.48Å
294	V	80.2	Confident	84.3	Confident	117 Å²	117	55.8 Å²	55.8	71%	0.709	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-30.6	-179.8	-173.9	0	0	0	0	112.4	F292 N318	F292-V294 PolarHBondContact O-N 2.97Å; V294-N318 PolarHBondContact O-ND2 3.03Å
295	T	83.2	Confident	84.6	Confident	46 Å²	46	54.6 Å²	54.6	28%	0.282	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-26.7	-169.7	57.4	0	0	0	0	113.7	G273 H274 F292 R297	G273-T295 CarbonylContact O-C 3.51Å; G273-T295 WeakPolarHBondContact O-CB 3.21Å; G273-T295 PolarHBondContact O-OG1 3.33Å; H274-T295 WeakPolarHBondContact CA-O 3.44Å; H274-T295 PolarHBondContact CD2-O 2.87Å; F292-T295 PolarHBondContact O-N 3.18Å; T295-R297 PolarHBondContact O-N 3.4Å
296	L	87.7	Confident	84.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.223	C	C	.	.			trans	-70.1	125.6	-167.5	-156.3	63.3	0	0	0	112.3	G273 V276 F292 L299 L316 N318 L319	G273-L296 WeakPolarHBondContact O-CA 3.21Å; G273-L296 PolarHBondContact O-N 2.75Å; V276-L296 HydrophobicContact CB-CD1 3.74Å; V276-L296 HydrophobicContact CG2-CD1 3.3Å; V276-L296 HydrophobicContact CG2-CD2 4.43Å; F292-L296 HydrophobicContact CB-CB 3.89Å; F292-L296 HydrophobicContact CB-CD1 4.22Å; F292-L296 HydrophobicContact CB-CD2 4.35Å; F292-L296 HydrophobicContact CB-CG 4.38Å; F292-L296 HydrophobicContact CD1-CD1 4.44Å; F292-L296 VanDerWaalsContact O-CB 3.29Å; F292-L296 WeakPolarHBondContact O-CB 3.24Å; F292-L296 PolarHBondContact O-N 2.59Å; L296-L299 HydrophobicContact CD2-CB 3.96Å; L296-L299 HydrophobicContact CD2-CD1 4.23Å; L296-L299 HydrophobicContact CD2-CD2 4.06Å; L296-L299 HydrophobicContact CD2-CG 4.31Å; L296-L316 HydrophobicContact CB-CD2 4.03Å; L296-L316 HydrophobicContact CD2-CD1 4.15Å; L296-L316 HydrophobicContact CD2-CD2 3.7Å; L296-N318 CarbonylContact O-C 3.43Å; L296-L319 HydrophobicContact CD2-CD1 4.06Å; L296-L319 HydrophobicContact CG-CD1 3.98Å; L296-L319 PolarHBondContact O-N 3.05Å
297	R	93.4	Very high	85.2	Confident	129 Å²	129	51 Å²	51	49%	0.487	25%	0.248	S	C	.	.			trans	-117.8	-33.5	174.4	-62.8	-178.3	-178.7	-140.1	10.9	112.3	H274 T295 E320 F321	H274-R297 PolarHBondContact O-N 3.23Å; T295-R297 PolarHBondContact O-N 3.4Å; R297-E320 HydrophobicContact CB-CG 4.4Å; R297-E320 WeakPolarHBondContact CD-OE1 2.91Å; R297-E320 IonicContact CZ-OE1 3.73Å; R297-E320 IonicContact NE-OE1 3.9Å; R297-E320 IonicContact NH1-OE1 2.89Å; R297-E320 PolarHBondContact NH1-OE1 3.41Å; R297-E320 WeakPolarHBondContact O-CA 3.35Å; R297-E320 PolarHBondContact O-N 2.86Å; R297-F321 PolarHBondContact O-N 3.32Å
298	F	94.1	Very high	85.6	Confident	70 Å²	70	54.6 Å²	54.6	31%	0.307	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.7	-179.8	-178.8	-81.2	0	0	0	110.4	H274 S275 V276 N300 F321	H274-F298 PolarHBondContact O-N 3.18Å; S275-F298 CarbonylContact C-O 3.53Å; S275-F298 WeakPolarHBondContact CA-O 3.35Å; V276-F298 PolarHBondContact N-O 3.48Å; F298-N300 HydrophobicContact CE1-CB 3.72Å; F298-N300 HydrophobicContact CZ-CB 4.18Å; F298-F321 HydrophobicContact CD1-CD1 4.4Å; F298-F321 HydrophobicContact CD2-CB 3.68Å; F298-F321 AromaticContact CD2-CD1 3.22Å; F298-F321 HydrophobicContact CD2-CD1 3.22Å; F298-F321 HydrophobicContact CD2-CD2 4.38Å; F298-F321 AromaticContact CD2-CE1 3.92Å; F298-F321 HydrophobicContact CD2-CE1 3.92Å; F298-F321 AromaticContact CD2-CG 3.51Å; F298-F321 HydrophobicContact CD2-CG 3.51Å; F298-F321 HydrophobicContact CE1-CD1 4.3Å; F298-F321 HydrophobicContact CE1-CE1 4.31Å; F298-F321 HydrophobicContact CE2-CB 4.29Å; F298-F321 AromaticContact CE2-CD1 3.08Å; F298-F321 HydrophobicContact CE2-CD1 3.08Å; F298-F321 HydrophobicContact CE2-CD2 4.16Å; F298-F321 AromaticContact CE2-CE1 3.25Å; F298-F321 HydrophobicContact CE2-CE1 3.25Å; F298-F321 HydrophobicContact CE2-CE2 4.32Å; F298-F321 AromaticContact CE2-CG 3.59Å; F298-F321 HydrophobicContact CE2-CG 3.59Å; F298-F321 AromaticContact CE2-CZ 3.9Å; F298-F321 HydrophobicContact CE2-CZ 3.9Å; F298-F321 HydrophobicContact CG-CB 4.39Å; F298-F321 AromaticContact CG-CD1 3.91Å; F298-F321 HydrophobicContact CG-CD1 3.91Å; F298-F321 HydrophobicContact CG-CG 4.43Å; F298-F321 AromaticContact CZ-CD1 3.67Å; F298-F321 HydrophobicContact CZ-CD1 3.67Å; F298-F321 AromaticContact CZ-CE1 3.48Å; F298-F321 HydrophobicContact CZ-CE1 3.48Å; F298-F321 VanDerWaalsContact CZ-CE1 3.48Å; F298-F321 HydrophobicContact CZ-CZ 4.27Å
299	L	94.1	Very high	86	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	114.4	176.5	-179.7	54.5	0	0	0	110.8	V276 L289 L296 L301 F313 L316 L319 F321 L322 S323	V276-L299 HydrophobicContact CB-CD1 3.96Å; V276-L299 HydrophobicContact CG1-CD1 3.82Å; V276-L299 WeakPolarHBondContact O-CA 3.31Å; L289-L299 HydrophobicContact CD1-CD1 4.22Å; L289-L299 HydrophobicContact CD1-CD2 3.72Å; L296-L299 HydrophobicContact CD2-CB 3.96Å; L296-L299 HydrophobicContact CD2-CD1 4.23Å; L296-L299 HydrophobicContact CD2-CD2 4.06Å; L296-L299 HydrophobicContact CD2-CG 4.31Å; L299-L301 HydrophobicContact CD1-CD1 4.29Å; L299-L301 HydrophobicContact CD1-CD2 4.01Å; L299-L301 HydrophobicContact CD1-CG 3.85Å; L299-L301 HydrophobicContact CD2-CD1 3.9Å; L299-L301 HydrophobicContact CD2-CG 4.35Å; L299-L301 HydrophobicContact CG-CD1 3.99Å; L299-L301 HydrophobicContact CG-CG 3.91Å; L299-F313 HydrophobicContact CD2-CE2 3.7Å; L299-F313 HydrophobicContact CD2-CZ 4.34Å; L299-L316 HydrophobicContact CD2-CD1 3.76Å; L299-L319 HydrophobicContact CB-CD1 3.6Å; L299-L319 HydrophobicContact CB-CD2 4.37Å; L299-F321 PolarHBondContact N-O 2.81Å; L299-L322 HydrophobicContact CB-CD1 4.2Å; L299-L322 HydrophobicContact CD2-CD1 4.1Å; L299-L322 HydrophobicContact CG-CD1 4.08Å; L299-L322 WeakPolarHBondContact O-CA 3.23Å; L299-S323 PolarHBondContact O-N 2.91Å
300	N	93.4	Very high	85.9	Confident	18 Å²	18	52.6 Å²	52.6	10%	0.096	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	111.4	173.3	179.9	8.1	0	0	0	110.4	V276 T277 L278 E279 F298 S302	V276-N300 PolarHBondContact O-N 2.88Å; T277-N300 HydrophobicContact CG2-CB 4.12Å; L278-N300 CarbonylContact C-O 3.21Å; L278-N300 PolarHBondContact N-O 2.92Å; E279-N300 PolarHBondContact OE2-ND2 3.33Å; F298-N300 HydrophobicContact CE1-CB 3.72Å; F298-N300 HydrophobicContact CZ-CB 4.18Å; N300-S302 WeakPolarHBondContact OD1-CB 3.49Å; N300-S302 PolarHBondContact OD1-N 3.16Å; N300-S302 PolarHBondContact OD1-OG 3.46Å
301	L	93.1	Very high	86	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.271	C	S	.	.			trans	-113.9	21.1	177.4	-65.6	168.5	0	0	0	111.4	L278 L283 L286 L299 N304 L306 F313 S323 L324 N327	L278-L301 HydrophobicContact CB-CD2 4.09Å; L278-L301 HydrophobicContact CD1-CD2 4.05Å; L278-L301 HydrophobicContact CG-CD2 4.49Å; L283-L301 HydrophobicContact CD1-CD2 4.3Å; L286-L301 HydrophobicContact CD1-CD1 3.35Å; L286-L301 HydrophobicContact CD1-CD2 3.87Å; L286-L301 HydrophobicContact CD1-CG 4.26Å; L299-L301 HydrophobicContact CD1-CD1 4.29Å; L299-L301 HydrophobicContact CD1-CD2 4.01Å; L299-L301 HydrophobicContact CD1-CG 3.85Å; L299-L301 HydrophobicContact CD2-CD1 3.9Å; L299-L301 HydrophobicContact CD2-CG 4.35Å; L299-L301 HydrophobicContact CG-CD1 3.99Å; L299-L301 HydrophobicContact CG-CG 3.91Å; L301-N304 VanDerWaalsContact C-ND2 3.34Å; L301-N304 PolarHBondContact O-ND2 3.14Å; L301-L306 HydrophobicContact CB-CD1 4.09Å; L301-L306 HydrophobicContact CD1-CD1 4.2Å; L301-F313 HydrophobicContact CD1-CE2 4.21Å; L301-S323 WeakPolarHBondContact CA-O 3.28Å; L301-S323 PolarHBondContact N-O 2.77Å; L301-L324 HydrophobicContact CB-CD2 3.89Å; L301-L324 HydrophobicContact CD1-CD2 3.73Å; L301-L324 HydrophobicContact CG-CD2 4.47Å; L301-N327 PolarHBondContact O-ND2 3.41Å
302	S	90.7	Very high	86.2	Confident	6 Å²	6	59.1 Å²	59.1	4%	0.042	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	155.4	-173.5	-50.6	0	0	0	0	112.7	E279 A280 N300 N304 S323 R325	E279-S302 VanDerWaalsContact CA-O 3.3Å; E279-S302 WeakPolarHBondContact CA-O 3.26Å; E279-S302 WeakPolarHBondContact CG-O 3.44Å; A280-S302 PolarHBondContact N-O 3.28Å; N300-S302 WeakPolarHBondContact OD1-CB 3.49Å; N300-S302 PolarHBondContact OD1-N 3.16Å; N300-S302 PolarHBondContact OD1-OG 3.46Å; S302-N304 VanDerWaalsContact C-N 3.3Å; S302-N304 PolarHBondContact O-N 3.46Å; S302-N304 PolarHBondContact O-ND2 3.23Å; S302-S323 WeakPolarHBondContact OG-CB 3.25Å; S302-S323 PolarHBondContact OG-OG 2.77Å; S302-R325 CarbonylContact C-O 3.59Å; S302-R325 WeakPolarHBondContact CA-O 3.5Å; S302-R325 WeakPolarHBondContact CB-O 3.27Å
303	R	88	Confident	86.1	Confident	146 Å²	146	59.3 Å²	59.3	55%	0.551	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	39.9	174.5	-54.7	178.4	-179.6	177	-2.6	113.2	E279 A280 R325 S326	E279-R303 HydrophobicContact CG-CB 4.42Å; E279-R303 WeakPolarHBondContact OE1-CD 3.5Å; E279-R303 IonicContact OE1-CZ 3.28Å; E279-R303 IonicContact OE1-NE 3.56Å; E279-R303 PolarHBondContact OE1-NE 3.2Å; E279-R303 IonicContact OE1-NH1 3.02Å; E279-R303 PolarHBondContact OE1-NH1 3.16Å; A280-R303 WeakPolarHBondContact CA-O 3.45Å; A280-R303 HydrophobicContact CB-CB 4.27Å; R303-R325 PolarHBondContact N-O 3.46Å; R303-S326 WeakPolarHBondContact CA-O 3.49Å
304	N	87.5	Confident	85.8	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.016	28%	0.275	C	S	.	.	S	Bend	trans	-109.4	-171.5	172.3	-74.8	-63.6	0	0	0	110.2	L278 C281 Q282 L283 L301 S302 L306 N327	L278-N304 PolarHBondContact O-ND2 3.12Å; C281-N304 WeakPolarHBondContact CA-OD1 3.5Å; C281-N304 PolarHBondContact N-OD1 3.42Å; Q282-N304 PolarHBondContact N-OD1 3.49Å; L283-N304 HydrophobicContact CB-CB 4Å; L283-N304 WeakPolarHBondContact CG-OD1 2.98Å; L283-N304 PolarHBondContact N-OD1 3.02Å; L301-N304 VanDerWaalsContact C-ND2 3.34Å; L301-N304 PolarHBondContact O-ND2 3.14Å; S302-N304 VanDerWaalsContact C-N 3.3Å; S302-N304 PolarHBondContact O-N 3.46Å; S302-N304 PolarHBondContact O-ND2 3.23Å; N304-L306 HydrophobicContact CB-CG 4.18Å; N304-N327 VanDerWaalsContact CA-OD1 3.27Å; N304-N327 WeakPolarHBondContact CA-OD1 3.47Å; N304-N327 WeakPolarHBondContact CB-OD1 3.19Å; N304-N327 PolarHBondContact N-OD1 2.7Å; N304-N327 PolarHBondContact O-OD1 3.33Å; N304-N327 VanDerWaalsContact O-OD1 3.11Å
305	Y	87.5	Confident	85.8	Confident	116 Å²	116	54 Å²	54	46%	0.455	26%	0.257	S	S	.	.			trans	-112.6	33.2	178.3	-57.8	-68.9	0	0	0	111.5	Q282 L283 E307 N327	Q282-Y305 HydrophobicContact CB-CD2 4.22Å; Q282-Y305 HydrophobicContact CB-CE2 3.97Å; Q282-Y305 HydrophobicContact CG-CE2 4.14Å; L283-Y305 CarbonylContact O-C 3.37Å; L283-Y305 VanDerWaalsContact O-CA 3.27Å; L283-Y305 WeakPolarHBondContact O-CA 3.3Å; L283-Y305 PolarHBondContact O-N 3.14Å; Y305-E307 PolarHBondContact O-N 3.29Å; Y305-N327 PolarHBondContact N-OD1 3.29Å
306	L	88.7	Confident	85.9	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.244	C	C	.	.			trans	-69	115.1	179.2	-58.2	174.1	0	0	0	109.5	L283 Y285 L301 N304 L309 L324 N327 P328 L329	L283-L306 HydrophobicContact CB-CD2 4.09Å; L283-L306 PolarHBondContact O-N 3.12Å; Y285-L306 VanDerWaalsContact C-CD2 3.4Å; L301-L306 HydrophobicContact CB-CD1 4.09Å; L301-L306 HydrophobicContact CD1-CD1 4.2Å; N304-L306 HydrophobicContact CB-CG 4.18Å; L306-L309 HydrophobicContact CD1-CD2 4.29Å; L306-L324 HydrophobicContact CD1-CD2 4.06Å; L306-N327 HydrophobicContact CB-CB 4.18Å; L306-N327 VanDerWaalsContact CB-OD1 3.3Å; L306-N327 WeakPolarHBondContact CB-OD1 3.3Å; L306-N327 WeakPolarHBondContact CG-OD1 3.49Å; L306-N327 PolarHBondContact N-OD1 3.05Å; L306-P328 CarbonylContact O-C 3.59Å; L306-P328 VanDerWaalsContact O-CD 3.3Å; L306-P328 WeakPolarHBondContact O-CD 3.4Å; L306-L329 HydrophobicContact CB-CD2 4.4Å; L306-L329 WeakPolarHBondContact O-CG 3.35Å; L306-L329 PolarHBondContact O-N 3.46Å
307	E	89.3	Confident	85.8	Confident	145 Å²	145	55.6 Å²	55.6	68%	0.678	26%	0.264	S	S	*	.	S	Bend	trans	-91.2	-25.6	175	-68.5	-176.9	-170.7	0	0	112.4	Y305 P328	Y305-E307 PolarHBondContact O-N 3.29Å; E307-P328 HydrophobicContact CG-CB 4.45Å; E307-P328 HydrophobicContact CG-CG 3.87Å
308	D	85.8	Confident	85.6	Confident	105 Å²	105	51.8 Å²	51.8	56%	0.561	25%	0.253	S	S	*	.			trans	-147.4	164.1	177.9	-152.3	-8.8	0	0	0	110.9
309	L	85.4	Confident	85.6	Confident	7 Å²	7	48.5 Å²	48.5	4%	0.037	24%	0.239	C	C	.	.			trans	-117.9	131.9	174.9	-67.6	170.8	0	0	0	109.7	L306 F313 L324 L329 P333	L306-L309 HydrophobicContact CD1-CD2 4.29Å; L309-F313 HydrophobicContact CB-CD1 4.5Å; L309-F313 HydrophobicContact CB-CG 4.48Å; L309-F313 HydrophobicContact CD1-CD1 4.14Å; L309-F313 HydrophobicContact CD1-CE1 4.01Å; L309-F313 HydrophobicContact CD1-CZ 4.39Å; L309-F313 HydrophobicContact CD2-CD2 4.48Å; L309-L324 HydrophobicContact CD1-CD1 3.63Å; L309-L324 HydrophobicContact CD1-CD2 4.28Å; L309-L324 HydrophobicContact CD2-CD2 3.98Å; L309-L329 HydrophobicContact CD1-CD1 4.5Å; L309-L329 HydrophobicContact CG-CD2 4.14Å; L309-P333 HydrophobicContact CB-CG 3.93Å
310	P	79.6	Confident	85.8	Confident	56 Å²	56	50.4 Å²	50.4	36%	0.364	25%	0.248	S	C	.	.			trans	-65.3	152.3	179.7	28.4	-34.3	0	0	0	111.2	L286 D312 F313	L286-P310 HydrophobicContact CB-CG 4.06Å; L286-P310 HydrophobicContact CD2-CG 3.68Å; P310-D312 PolarHBondContact O-N 2.97Å; P310-F313 HydrophobicContact CG-CB 4.32Å; P310-F313 WeakPolarHBondContact O-CB 3.35Å; P310-F313 PolarHBondContact O-N 3.03Å
311	N	75.2	Confident	85.9	Confident	120 Å²	120	52.3 Å²	52.3	64%	0.642	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-59.3	-30.8	178.8	-71.2	-26.5	0	0	0	113	F313 C314	N311-F313 PolarHBondContact O-N 3.03Å; N311-C314 PolarHBondContact O-N 3.48Å
312	D	72.5	Confident	86.1	Confident	100 Å²	100	52.3 Å²	52.3	54%	0.535	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-70	-15.3	178.7	-58.9	-28	0	0	0	113	P310 C314 L315	P310-D312 PolarHBondContact O-N 2.97Å; D312-C314 PolarHBondContact O-N 2.91Å; D312-L315 HydrophobicContact CB-CD1 4.13Å; D312-L315 WeakPolarHBondContact O-CB 3.49Å; D312-L315 WeakPolarHBondContact O-CG 3.46Å; D312-L315 PolarHBondContact O-N 2.97Å
313	F	77.7	Confident	86.3	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.018	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-51	-30.9	171.7	178.5	-110.7	0	0	0	112.1	L286 L299 L301 L309 P310 N311 L315 L316 L322 L339	L286-F313 HydrophobicContact CD1-CD2 4.46Å; L286-F313 HydrophobicContact CD2-CB 4.23Å; L286-F313 HydrophobicContact CD2-CD2 3.53Å; L286-F313 HydrophobicContact CD2-CE2 4.36Å; L286-F313 HydrophobicContact CD2-CG 4.33Å; L299-F313 HydrophobicContact CD2-CE2 3.7Å; L299-F313 HydrophobicContact CD2-CZ 4.34Å; L301-F313 HydrophobicContact CD1-CE2 4.21Å; L309-F313 HydrophobicContact CB-CD1 4.5Å; L309-F313 HydrophobicContact CB-CG 4.48Å; L309-F313 HydrophobicContact CD1-CD1 4.14Å; L309-F313 HydrophobicContact CD1-CE1 4.01Å; L309-F313 HydrophobicContact CD1-CZ 4.39Å; L309-F313 HydrophobicContact CD2-CD2 4.48Å; P310-F313 HydrophobicContact CG-CB 4.32Å; P310-F313 WeakPolarHBondContact O-CB 3.35Å; P310-F313 PolarHBondContact O-N 3.03Å; N311-F313 PolarHBondContact O-N 3.03Å; F313-L315 VanDerWaalsContact C-N 3.26Å; F313-L315 PolarHBondContact O-N 3.43Å; F313-L316 HydrophobicContact CD2-CD1 4.08Å; F313-L316 HydrophobicContact CE2-CD1 4.04Å; F313-L316 WeakPolarHBondContact O-CD1 3.37Å; F313-L316 WeakPolarHBondContact O-CG 2.97Å; F313-L322 HydrophobicContact CE1-CD2 3.61Å; F313-L322 HydrophobicContact CE2-CD1 4.32Å; F313-L322 HydrophobicContact CZ-CD1 3.65Å; F313-L322 HydrophobicContact CZ-CD2 3.38Å; F313-L322 HydrophobicContact CZ-CG 4.15Å; F313-L339 HydrophobicContact CE1-CD1 3.97Å
314	C	73.7	Confident	86.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-86.2	5.1	-174.4	-54.3	0	0	0	0	113.5	N311 D312 N317 S335 I336 K338	N311-C314 PolarHBondContact O-N 3.48Å; D312-C314 PolarHBondContact O-N 2.91Å; C314-N317 PolarHBondContact O-OD1 2.98Å; C314-S335 WeakPolarHBondContact CB-O 3.43Å; C314-S335 WeakPolarHBondContact SG-CB 3.44Å; C314-S335 PolarHBondContact SG-O 2.61Å; C314-S335 PolarHBondContact SG-OG 2.97Å; C314-I336 PolarHBondContact SG-N 3.37Å; C314-I336 VanDerWaalsContact SG-N 3.42Å; C314-K338 HydrophobicContact CB-CB 4.04Å; C314-K338 HydrophobicContact CB-CD 4.16Å; C314-K338 HydrophobicContact CB-CG 4.47Å; C314-K338 WeakPolarHBondContact O-CB 3.32Å
315	L	80.4	Confident	86.9	Confident	62 Å²	62	48.8 Å²	48.8	33%	0.325	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-78.5	-8.1	169.7	-64	174.3	0	0	0	112.8	Y293 D312 F313 N317	Y293-L315 HydrophobicContact CD1-CB 4.19Å; Y293-L315 HydrophobicContact CD2-CB 3.88Å; Y293-L315 HydrophobicContact CD2-CD1 4.14Å; Y293-L315 HydrophobicContact CE1-CB 4.08Å; Y293-L315 HydrophobicContact CE2-CB 3.79Å; Y293-L315 HydrophobicContact CE2-CD1 3.43Å; Y293-L315 VanDerWaalsContact CE2-CD1 3.43Å; Y293-L315 HydrophobicContact CE2-CG 4.26Å; Y293-L315 HydrophobicContact CG-CB 4.08Å; D312-L315 HydrophobicContact CB-CD1 4.13Å; D312-L315 WeakPolarHBondContact O-CB 3.49Å; D312-L315 WeakPolarHBondContact O-CG 3.46Å; D312-L315 PolarHBondContact O-N 2.97Å; F313-L315 VanDerWaalsContact C-N 3.26Å; F313-L315 PolarHBondContact O-N 3.43Å; L315-N317 PolarHBondContact O-N 3.11Å
316	L	86.9	Confident	87.1	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.233	C	C	.	.			trans	-72.9	60.6	173.3	-61.1	168.9	0	0	0	111.2	L289 Y293 L296 L299 F313 N318 L319 L339	L289-L316 HydrophobicContact CB-CD2 4.46Å; L289-L316 HydrophobicContact CD1-CD1 4.1Å; Y293-L316 HydrophobicContact CD1-CD2 3.67Å; Y293-L316 HydrophobicContact CD1-CG 4.22Å; Y293-L316 HydrophobicContact CE1-CD2 4.23Å; Y293-L316 HydrophobicContact CE1-CG 4.48Å; L296-L316 HydrophobicContact CB-CD2 4.03Å; L296-L316 HydrophobicContact CD2-CD1 4.15Å; L296-L316 HydrophobicContact CD2-CD2 3.7Å; L299-L316 HydrophobicContact CD2-CD1 3.76Å; F313-L316 HydrophobicContact CD2-CD1 4.08Å; F313-L316 HydrophobicContact CE2-CD1 4.04Å; F313-L316 WeakPolarHBondContact O-CD1 3.37Å; F313-L316 WeakPolarHBondContact O-CG 2.97Å; L316-N318 PolarHBondContact O-N 3.01Å; L316-N318 VanDerWaalsContact O-N 3.12Å; L316-L319 HydrophobicContact CB-CB 4.06Å; L316-L319 HydrophobicContact CB-CD2 4.46Å; L316-L319 HydrophobicContact CD1-CD2 4.35Å; L316-L319 WeakPolarHBondContact O-CB 3.11Å; L316-L319 PolarHBondContact O-N 3.43Å; L316-L339 HydrophobicContact CB-CD2 4.07Å; L316-L339 VanDerWaalsContact O-CD2 3.24Å; L316-L339 WeakPolarHBondContact O-CD2 3.43Å
317	N	84.8	Confident	87	Confident	79 Å²	79	45.2 Å²	45.2	42%	0.422	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.8	-168.8	-64.5	-34.5	0	0	0	114.3	C314 L315	C314-N317 PolarHBondContact O-OD1 2.98Å; L315-N317 PolarHBondContact O-N 3.11Å
318	N	90	Very high	87.1	Confident	50 Å²	50	40.2 Å²	40.2	27%	0.267	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	8	179.5	-64.9	-28.6	0	0	0	113	V294 L296 L316 E320 Q341	V294-N318 PolarHBondContact O-ND2 3.03Å; L296-N318 CarbonylContact O-C 3.43Å; L316-N318 PolarHBondContact O-N 3.01Å; L316-N318 VanDerWaalsContact O-N 3.12Å; N318-E320 PolarHBondContact O-N 3.06Å; N318-Q341 PolarHBondContact OD1-NE2 3.29Å
319	L	94.1	Very high	87.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.188	C	C	.	.			trans	-69.4	122.4	-178.7	-165.4	71.7	0	0	0	110.6	L296 L299 L316 L322 L339 Q341 L342	L296-L319 HydrophobicContact CD2-CD1 4.06Å; L296-L319 HydrophobicContact CG-CD1 3.98Å; L296-L319 PolarHBondContact O-N 3.05Å; L299-L319 HydrophobicContact CB-CD1 3.6Å; L299-L319 HydrophobicContact CB-CD2 4.37Å; L316-L319 HydrophobicContact CB-CB 4.06Å; L316-L319 HydrophobicContact CB-CD2 4.46Å; L316-L319 HydrophobicContact CD1-CD2 4.35Å; L316-L319 WeakPolarHBondContact O-CB 3.11Å; L316-L319 PolarHBondContact O-N 3.43Å; L319-L322 HydrophobicContact CD2-CB 3.91Å; L319-L322 HydrophobicContact CD2-CD1 4.29Å; L319-L322 HydrophobicContact CD2-CD2 4.28Å; L319-L322 HydrophobicContact CD2-CG 4.38Å; L319-L339 HydrophobicContact CB-CD2 4.43Å; L319-L339 HydrophobicContact CD2-CD1 4.31Å; L319-Q341 CarbonylContact O-C 3.43Å; L319-L342 HydrophobicContact CD2-CD1 4.2Å; L319-L342 HydrophobicContact CG-CD1 4.2Å; L319-L342 WeakPolarHBondContact O-CA 3.37Å; L319-L342 PolarHBondContact O-N 2.79Å; L319-L342 VanDerWaalsContact O-N 3.1Å
320	E	96.4	Very high	87.4	Confident	41 Å²	41	41.3 Å²	41.3	19%	0.192	21%	0.21	C	C	.	.			trans	-103.9	-35.7	180	-60.8	-172.8	-137.4	0	0	111.9	R297 N318 Q341 K343 S344	R297-E320 HydrophobicContact CB-CG 4.4Å; R297-E320 WeakPolarHBondContact CD-OE1 2.91Å; R297-E320 IonicContact CZ-OE1 3.73Å; R297-E320 IonicContact NE-OE1 3.9Å; R297-E320 IonicContact NH1-OE1 2.89Å; R297-E320 PolarHBondContact NH1-OE1 3.41Å; R297-E320 WeakPolarHBondContact O-CA 3.35Å; R297-E320 PolarHBondContact O-N 2.86Å; N318-E320 PolarHBondContact O-N 3.06Å; E320-Q341 WeakPolarHBondContact CA-O 3.36Å; E320-K343 WeakPolarHBondContact O-CA 3.1Å; E320-K343 PolarHBondContact O-N 3.17Å; E320-K343 IonicContact OE2-NZ 3.59Å; E320-K343 PolarHBondContact OE2-NZ 3.21Å; E320-S344 PolarHBondContact O-N 2.8Å
321	F	96.8	Very high	87.7	Confident	58 Å²	58	45.8 Å²	45.8	25%	0.254	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	127.7	179.2	178.3	-83	0	0	0	110.8	R297 F298 L299 S344	R297-F321 PolarHBondContact O-N 3.32Å; F298-F321 HydrophobicContact CD1-CD1 4.4Å; F298-F321 HydrophobicContact CD2-CB 3.68Å; F298-F321 AromaticContact CD2-CD1 3.22Å; F298-F321 HydrophobicContact CD2-CD1 3.22Å; F298-F321 HydrophobicContact CD2-CD2 4.38Å; F298-F321 AromaticContact CD2-CE1 3.92Å; F298-F321 HydrophobicContact CD2-CE1 3.92Å; F298-F321 AromaticContact CD2-CG 3.51Å; F298-F321 HydrophobicContact CD2-CG 3.51Å; F298-F321 HydrophobicContact CE1-CD1 4.3Å; F298-F321 HydrophobicContact CE1-CE1 4.31Å; F298-F321 HydrophobicContact CE2-CB 4.29Å; F298-F321 AromaticContact CE2-CD1 3.08Å; F298-F321 HydrophobicContact CE2-CD1 3.08Å; F298-F321 HydrophobicContact CE2-CD2 4.16Å; F298-F321 AromaticContact CE2-CE1 3.25Å; F298-F321 HydrophobicContact CE2-CE1 3.25Å; F298-F321 HydrophobicContact CE2-CE2 4.32Å; F298-F321 AromaticContact CE2-CG 3.59Å; F298-F321 HydrophobicContact CE2-CG 3.59Å; F298-F321 AromaticContact CE2-CZ 3.9Å; F298-F321 HydrophobicContact CE2-CZ 3.9Å; F298-F321 HydrophobicContact CG-CB 4.39Å; F298-F321 AromaticContact CG-CD1 3.91Å; F298-F321 HydrophobicContact CG-CD1 3.91Å; F298-F321 HydrophobicContact CG-CG 4.43Å; F298-F321 AromaticContact CZ-CD1 3.67Å; F298-F321 HydrophobicContact CZ-CD1 3.67Å; F298-F321 AromaticContact CZ-CE1 3.48Å; F298-F321 HydrophobicContact CZ-CE1 3.48Å; F298-F321 VanDerWaalsContact CZ-CE1 3.48Å; F298-F321 HydrophobicContact CZ-CZ 4.27Å; L299-F321 PolarHBondContact N-O 2.81Å; F321-S344 WeakPolarHBondContact CA-O 3.26Å; F321-S344 WeakPolarHBondContact CD2-OG 3.36Å
322	L	96	Very high	88.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	120.4	175.1	175.9	55.9	0	0	0	110.6	L299 F313 L319 L324 L339 L342 S344 L345 N346	L299-L322 HydrophobicContact CB-CD1 4.2Å; L299-L322 HydrophobicContact CD2-CD1 4.1Å; L299-L322 HydrophobicContact CG-CD1 4.08Å; L299-L322 WeakPolarHBondContact O-CA 3.23Å; F313-L322 HydrophobicContact CE1-CD2 3.61Å; F313-L322 HydrophobicContact CE2-CD1 4.32Å; F313-L322 HydrophobicContact CZ-CD1 3.65Å; F313-L322 HydrophobicContact CZ-CD2 3.38Å; F313-L322 HydrophobicContact CZ-CG 4.15Å; L319-L322 HydrophobicContact CD2-CB 3.91Å; L319-L322 HydrophobicContact CD2-CD1 4.29Å; L319-L322 HydrophobicContact CD2-CD2 4.28Å; L319-L322 HydrophobicContact CD2-CG 4.38Å; L322-L324 HydrophobicContact CD1-CD1 4.24Å; L322-L324 HydrophobicContact CD1-CG 4Å; L322-L324 HydrophobicContact CD2-CD1 3.9Å; L322-L324 HydrophobicContact CG-CD1 4.05Å; L322-L324 HydrophobicContact CG-CG 4.18Å; L322-L339 HydrophobicContact CD2-CD1 4.3Å; L322-L342 HydrophobicContact CB-CD1 3.68Å; L322-S344 PolarHBondContact N-O 3.26Å; L322-L345 HydrophobicContact CB-CD1 3.96Å; L322-L345 HydrophobicContact CD2-CD1 3.71Å; L322-L345 HydrophobicContact CG-CD1 3.81Å; L322-L345 CarbonylContact O-C 3.52Å; L322-L345 WeakPolarHBondContact O-CA 3.34Å; L322-N346 PolarHBondContact O-N 3.47Å
323	S	95.8	Very high	89	Confident	6 Å²	6	36.4 Å²	36.4	4%	0.042	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	122	168.3	-171.7	0	0	0	0	111.5	L299 L301 S302	L299-S323 PolarHBondContact O-N 2.91Å; L301-S323 WeakPolarHBondContact CA-O 3.28Å; L301-S323 PolarHBondContact N-O 2.77Å; S302-S323 WeakPolarHBondContact OG-CB 3.25Å; S302-S323 PolarHBondContact OG-OG 2.77Å
324	L	94.6	Very high	89.5	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.016	20%	0.199	C	C	.	.			trans	-117.8	14.4	173.9	-71.8	160.1	0	0	0	111.3	L301 L306 L309 L322 S326 N327 L329 N346 L347 C350	L301-L324 HydrophobicContact CB-CD2 3.89Å; L301-L324 HydrophobicContact CD1-CD2 3.73Å; L301-L324 HydrophobicContact CG-CD2 4.47Å; L306-L324 HydrophobicContact CD1-CD2 4.06Å; L309-L324 HydrophobicContact CD1-CD1 3.63Å; L309-L324 HydrophobicContact CD1-CD2 4.28Å; L309-L324 HydrophobicContact CD2-CD2 3.98Å; L322-L324 HydrophobicContact CD1-CD1 4.24Å; L322-L324 HydrophobicContact CD1-CG 4Å; L322-L324 HydrophobicContact CD2-CD1 3.9Å; L322-L324 HydrophobicContact CG-CD1 4.05Å; L322-L324 HydrophobicContact CG-CG 4.18Å; L324-S326 PolarHBondContact O-N 3.41Å; L324-N327 WeakPolarHBondContact O-CB 3.46Å; L324-N327 PolarHBondContact O-N 2.87Å; L324-N327 PolarHBondContact O-ND2 3.49Å; L324-L329 HydrophobicContact CB-CD1 3.92Å; L324-L329 HydrophobicContact CD1-CD1 4.04Å; L324-L329 HydrophobicContact CD2-CD1 4.11Å; L324-L329 HydrophobicContact CG-CD1 4.25Å; L324-N346 PolarHBondContact N-O 3.04Å; L324-L347 HydrophobicContact CB-CD2 3.94Å; L324-L347 HydrophobicContact CD1-CD2 3.69Å; L324-L347 HydrophobicContact CG-CD2 4.48Å; L324-C350 PolarHBondContact O-SG 2.88Å
325	R	92.9	Very high	90.1	Very high	72 Å²	72	43 Å²	43	27%	0.272	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.9	138.7	-177.5	170.4	175.3	178.1	95.6	-0.5	112.5	S302 R303 N327 N346 S348 Y349	S302-R325 CarbonylContact C-O 3.59Å; S302-R325 WeakPolarHBondContact CA-O 3.5Å; S302-R325 WeakPolarHBondContact CB-O 3.27Å; R303-R325 PolarHBondContact N-O 3.46Å; R325-N327 PolarHBondContact O-N 2.78Å; R325-N346 PolarHBondContact N-O 2.81Å; R325-S348 CarbonylContact C-O 3.57Å; R325-S348 VanDerWaalsContact CA-O 3.23Å; R325-S348 WeakPolarHBondContact CA-O 3.27Å; R325-S348 WeakPolarHBondContact CD-OG 3.37Å; R325-S348 VanDerWaalsContact CG-OG 3.25Å; R325-S348 WeakPolarHBondContact CG-OG 3.43Å; R325-S348 PolarHBondContact NH1-OG 3.23Å; R325-Y349 VanDerWaalsContact CZ-CE2 3.41Å
326	S	91.4	Very high	90.5	Very high	39 Å²	39	40.3 Å²	40.3	27%	0.273	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	44.3	176	-54.8	0	0	0	0	113.4	R303 L324 S348 Y349	R303-S326 WeakPolarHBondContact CA-O 3.49Å; L324-S326 PolarHBondContact O-N 3.41Å; S326-S348 PolarHBondContact N-O 2.81Å; S326-Y349 WeakPolarHBondContact CA-O 3.47Å
327	N	87.8	Confident	90.6	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.011	21%	0.205	C	C	.	.			trans	-113.1	146.2	165	-79.4	-83.3	0	0	0	109.6	L301 N304 Y305 L306 L324 R325 L329 C350	L301-N327 PolarHBondContact O-ND2 3.41Å; N304-N327 VanDerWaalsContact CA-OD1 3.27Å; N304-N327 WeakPolarHBondContact CA-OD1 3.47Å; N304-N327 WeakPolarHBondContact CB-OD1 3.19Å; N304-N327 PolarHBondContact N-OD1 2.7Å; N304-N327 PolarHBondContact O-OD1 3.33Å; N304-N327 VanDerWaalsContact O-OD1 3.11Å; Y305-N327 PolarHBondContact N-OD1 3.29Å; L306-N327 HydrophobicContact CB-CB 4.18Å; L306-N327 VanDerWaalsContact CB-OD1 3.3Å; L306-N327 WeakPolarHBondContact CB-OD1 3.3Å; L306-N327 WeakPolarHBondContact CG-OD1 3.49Å; L306-N327 PolarHBondContact N-OD1 3.05Å; L324-N327 WeakPolarHBondContact O-CB 3.46Å; L324-N327 PolarHBondContact O-N 2.87Å; L324-N327 PolarHBondContact O-ND2 3.49Å; R325-N327 PolarHBondContact O-N 2.78Å; N327-L329 HydrophobicContact CB-CD1 4.15Å; N327-L329 HydrophobicContact CB-CG 4.01Å; N327-L329 PolarHBondContact O-N 3.49Å; N327-C350 WeakPolarHBondContact O-CA 3.38Å; N327-C350 WeakPolarHBondContact O-CB 3.38Å; N327-C350 PolarHBondContact O-SG 3.44Å; N327-C350 VanDerWaalsContact O-SG 3.36Å
328	P	90.9	Very high	90.8	Very high	40 Å²	40	44.4 Å²	44.4	26%	0.26	21%	0.207	S	C	.	.			trans	-71.7	30.7	178.3	32	-36.7	0	0	0	114.5	L306 E307 R330 L351	L306-P328 CarbonylContact O-C 3.59Å; L306-P328 VanDerWaalsContact O-CD 3.3Å; L306-P328 WeakPolarHBondContact O-CD 3.4Å; E307-P328 HydrophobicContact CG-CB 4.45Å; E307-P328 HydrophobicContact CG-CG 3.87Å; P328-R330 PolarHBondContact O-N 3.43Å; P328-L351 HydrophobicContact CB-CD1 4.16Å
329	L	90.6	Very high	90.9	Very high	1 Å²	1	42 Å²	42	1%	0.005	19%	0.194	C	C	.	.			trans	-62.7	125.8	178.2	-71	169.1	0	0	0	110.9	L306 L309 L324 N327 L347 C350 L351 I352	L306-L329 HydrophobicContact CB-CD2 4.4Å; L306-L329 WeakPolarHBondContact O-CG 3.35Å; L306-L329 PolarHBondContact O-N 3.46Å; L309-L329 HydrophobicContact CD1-CD1 4.5Å; L309-L329 HydrophobicContact CG-CD2 4.14Å; L324-L329 HydrophobicContact CB-CD1 3.92Å; L324-L329 HydrophobicContact CD1-CD1 4.04Å; L324-L329 HydrophobicContact CD2-CD1 4.11Å; L324-L329 HydrophobicContact CG-CD1 4.25Å; N327-L329 HydrophobicContact CB-CD1 4.15Å; N327-L329 HydrophobicContact CB-CG 4.01Å; N327-L329 PolarHBondContact O-N 3.49Å; L329-L347 HydrophobicContact CD1-CD2 4.49Å; L329-C350 HydrophobicContact CB-CB 4.22Å; L329-L351 CarbonylContact O-C 3.36Å; L329-L351 VanDerWaalsContact O-CA 3.29Å; L329-L351 WeakPolarHBondContact O-CA 3.15Å; L329-L351 PolarHBondContact O-N 3.07Å; L329-I352 PolarHBondContact O-N 3.06Å
330	R	88	Confident	90.7	Very high	134 Å²	134	49.6 Å²	49.6	51%	0.506	23%	0.227	S	C	.	.			trans	-97.8	-25.9	176.5	-68.9	176.6	177	-95.4	2.6	113.7	P328 L351 E353	P328-R330 PolarHBondContact O-N 3.43Å; R330-L351 WeakPolarHBondContact CA-O 3.38Å; R330-L351 HydrophobicContact CG-CB 4.03Å; R330-E353 IonicContact NH1-OE1 3.41Å
331	K	85.7	Confident	90.6	Very high	150 Å²	150	51.5 Å²	51.5	65%	0.652	24%	0.236	S	C	*	.			trans	-143.7	157.6	-175.7	-64.2	-177.1	-177.8	177.3	0	108.9
332	I	87.9	Confident	90.5	Very high	9 Å²	9	48.8 Å²	48.8	5%	0.046	22%	0.224	C	C	.	.			trans	-105.8	136	172.7	-57.6	171.4	0	0	0	106.9	I336 L347 I352 L355 F359	I332-I336 HydrophobicContact CG2-CB 3.87Å; I332-I336 HydrophobicContact CG2-CD1 3.39Å; I332-I336 HydrophobicContact CG2-CG1 4.17Å; I332-I336 HydrophobicContact CG2-CG2 3.85Å; I332-L347 HydrophobicContact CD1-CD1 3.41Å; I332-L347 VanDerWaalsContact CD1-CD1 3.41Å; I332-L347 HydrophobicContact CG1-CD1 4.28Å; I332-I352 HydrophobicContact CD1-CD1 4.17Å; I332-I352 HydrophobicContact CG1-CD1 4.18Å; I332-L355 HydrophobicContact CD1-CD2 3.72Å; I332-F359 HydrophobicContact CD1-CD2 3.49Å; I332-F359 VanDerWaalsContact CD1-CD2 3.49Å; I332-F359 HydrophobicContact CD1-CE2 3.5Å; I332-F359 VanDerWaalsContact CD1-CE2 3.5Å; I332-F359 HydrophobicContact CG2-CD2 4.47Å
333	P	87.1	Confident	90.6	Very high	14 Å²	14	52.7 Å²	52.7	9%	0.091	24%	0.241	C	C	.	.			trans	-64.9	142.1	178.6	28.9	-37.1	0	0	0	110.6	L309 S335 I336	L309-P333 HydrophobicContact CB-CG 3.93Å; P333-S335 PolarHBondContact O-N 2.89Å; P333-S335 VanDerWaalsContact O-N 3.12Å; P333-I336 WeakPolarHBondContact O-CB 3.48Å; P333-I336 WeakPolarHBondContact O-CG2 3.36Å; P333-I336 PolarHBondContact O-N 3.37Å
334	K	87	Confident	90.6	Very high	125 Å²	125	53.2 Å²	53.2	54%	0.543	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-57.1	-28.9	178.5	-66.4	179.6	158.6	-128.7	0	113.1	I336 I337 T356 E358	K334-I336 PolarHBondContact O-N 2.93Å; K334-I336 VanDerWaalsContact O-N 3.14Å; K334-I337 WeakPolarHBondContact O-CG2 3.45Å; K334-T356 HydrophobicContact CG-CG2 4.44Å; K334-E358 HydrophobicContact CB-CB 4.5Å; K334-E358 HydrophobicContact CB-CG 4.14Å; K334-E358 VanDerWaalsContact CD-OE1 3.27Å; K334-E358 WeakPolarHBondContact CD-OE1 3.35Å; K334-E358 WeakPolarHBondContact CE-OE1 3.31Å; K334-E358 IonicContact NZ-OE1 3.14Å; K334-E358 PolarHBondContact NZ-OE1 2.86Å; K334-E358 WeakPolarHBondContact O-CB 3.49Å
335	S	86.6	Confident	90.8	Very high	18 Å²	18	53.1 Å²	53.1	13%	0.126	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-65.3	-10.2	178.4	49.1	0	0	0	0	113.5	C314 P333 I337 K338	C314-S335 WeakPolarHBondContact CB-O 3.43Å; C314-S335 WeakPolarHBondContact SG-CB 3.44Å; C314-S335 PolarHBondContact SG-O 2.61Å; C314-S335 PolarHBondContact SG-OG 2.97Å; P333-S335 PolarHBondContact O-N 2.89Å; P333-S335 VanDerWaalsContact O-N 3.12Å; S335-I337 PolarHBondContact O-N 2.9Å; S335-K338 WeakPolarHBondContact O-CB 3.37Å; S335-K338 WeakPolarHBondContact O-CG 3.23Å; S335-K338 PolarHBondContact O-N 2.78Å
336	I	89.9	Confident	90.9	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.021	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-52.7	-29.6	177.8	-162.6	170.6	0	0	0	112.5	C314 I332 P333 K334 K338 L339 L345 F359 L362	C314-I336 PolarHBondContact SG-N 3.37Å; C314-I336 VanDerWaalsContact SG-N 3.42Å; I332-I336 HydrophobicContact CG2-CB 3.87Å; I332-I336 HydrophobicContact CG2-CD1 3.39Å; I332-I336 HydrophobicContact CG2-CG1 4.17Å; I332-I336 HydrophobicContact CG2-CG2 3.85Å; P333-I336 WeakPolarHBondContact O-CB 3.48Å; P333-I336 WeakPolarHBondContact O-CG2 3.36Å; P333-I336 PolarHBondContact O-N 3.37Å; K334-I336 PolarHBondContact O-N 2.93Å; K334-I336 VanDerWaalsContact O-N 3.14Å; I336-K338 PolarHBondContact O-N 2.85Å; I336-L339 HydrophobicContact CG1-CD1 3.97Å; I336-L339 WeakPolarHBondContact O-CB 3.18Å; I336-L339 PolarHBondContact O-N 3.27Å; I336-L345 HydrophobicContact CD1-CD2 4.02Å; I336-F359 HydrophobicContact CD1-CD2 4.39Å; I336-L362 HydrophobicContact CD1-CD1 4.03Å; I336-L362 HydrophobicContact CG1-CD1 4.14Å; I336-L362 HydrophobicContact CG1-CD2 4.36Å; I336-L362 WeakPolarHBondContact O-CD2 3.34Å
337	I	88.1	Confident	91.2	Very high	60 Å²	60	49.4 Å²	49.4	31%	0.308	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-51.8	-23.5	173.7	-166.7	169.2	0	0	0	114.4	K334 S335 L339 E358 D361	K334-I337 WeakPolarHBondContact O-CG2 3.45Å; S335-I337 PolarHBondContact O-N 2.9Å; I337-L339 VanDerWaalsContact C-N 3.29Å; I337-L339 PolarHBondContact O-N 3.22Å; I337-E358 HydrophobicContact CB-CB 4.26Å; I337-E358 HydrophobicContact CD1-CB 4.48Å; I337-D361 HydrophobicContact CD1-CB 3.51Å; I337-D361 WeakPolarHBondContact CD1-OD2 3.36Å; I337-D361 HydrophobicContact CG1-CB 3.77Å
338	K	89	Confident	91.3	Very high	106 Å²	106	49.3 Å²	49.3	46%	0.461	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-74.2	-18	177.5	-60.9	-179	177.1	-179	0	113.2	C314 S335 I336 K340	C314-K338 HydrophobicContact CB-CB 4.04Å; C314-K338 HydrophobicContact CB-CD 4.16Å; C314-K338 HydrophobicContact CB-CG 4.47Å; C314-K338 WeakPolarHBondContact O-CB 3.32Å; S335-K338 WeakPolarHBondContact O-CB 3.37Å; S335-K338 WeakPolarHBondContact O-CG 3.23Å; S335-K338 PolarHBondContact O-N 2.78Å; I336-K338 PolarHBondContact O-N 2.85Å; K338-K340 PolarHBondContact O-N 3.34Å
339	L	92	Very high	91.4	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	23%	0.231	C	C	.	.			trans	-76.4	62.7	177	-57.1	-178.4	0	0	0	110.8	F313 L316 L319 L322 I336 I337 Q341 L342	F313-L339 HydrophobicContact CE1-CD1 3.97Å; L316-L339 HydrophobicContact CB-CD2 4.07Å; L316-L339 VanDerWaalsContact O-CD2 3.24Å; L316-L339 WeakPolarHBondContact O-CD2 3.43Å; L319-L339 HydrophobicContact CB-CD2 4.43Å; L319-L339 HydrophobicContact CD2-CD1 4.31Å; L322-L339 HydrophobicContact CD2-CD1 4.3Å; I336-L339 HydrophobicContact CG1-CD1 3.97Å; I336-L339 WeakPolarHBondContact O-CB 3.18Å; I336-L339 PolarHBondContact O-N 3.27Å; I337-L339 VanDerWaalsContact C-N 3.29Å; I337-L339 PolarHBondContact O-N 3.22Å; L339-Q341 PolarHBondContact O-N 3.3Å; L339-L342 HydrophobicContact CB-CB 4.05Å; L339-L342 HydrophobicContact CB-CD2 4.45Å; L339-L342 HydrophobicContact CD1-CD2 4.25Å; L339-L342 VanDerWaalsContact O-CB 3.27Å; L339-L342 WeakPolarHBondContact O-CB 3.48Å; L339-L342 PolarHBondContact O-N 3.18Å; L339-L342 VanDerWaalsContact O-N 3.13Å
340	K	89.6	Confident	91.5	Very high	159 Å²	159	51.9 Å²	51.9	69%	0.691	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-19.1	-171.6	-66.5	-175.8	179.7	-177.5	0	114.2	K338 S364	K338-K340 PolarHBondContact O-N 3.34Å; K340-S364 WeakPolarHBondContact O-CB 3.49Å; K340-S364 PolarHBondContact O-OG 3.33Å
341	Q	93.9	Very high	91.6	Very high	81 Å²	81	47.8 Å²	47.8	38%	0.379	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	3.4	179.1	-64.6	-173.4	40.5	0	0	113.1	N318 L319 E320 L339 K343	N318-Q341 PolarHBondContact OD1-NE2 3.29Å; L319-Q341 CarbonylContact O-C 3.43Å; E320-Q341 WeakPolarHBondContact CA-O 3.36Å; L339-Q341 PolarHBondContact O-N 3.3Å; Q341-K343 PolarHBondContact O-N 3.33Å; Q341-K343 VanDerWaalsContact O-N 3.15Å
342	L	95.9	Very high	91.8	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	19%	0.189	C	C	.	.			trans	-68.8	114.4	-175.7	-167.5	70.9	0	0	0	110.5	L319 L322 L339 L345 L362 S364 L365	L319-L342 HydrophobicContact CD2-CD1 4.2Å; L319-L342 HydrophobicContact CG-CD1 4.2Å; L319-L342 WeakPolarHBondContact O-CA 3.37Å; L319-L342 PolarHBondContact O-N 2.79Å; L319-L342 VanDerWaalsContact O-N 3.1Å; L322-L342 HydrophobicContact CB-CD1 3.68Å; L339-L342 HydrophobicContact CB-CB 4.05Å; L339-L342 HydrophobicContact CB-CD2 4.45Å; L339-L342 HydrophobicContact CD1-CD2 4.25Å; L339-L342 VanDerWaalsContact O-CB 3.27Å; L339-L342 WeakPolarHBondContact O-CB 3.48Å; L339-L342 PolarHBondContact O-N 3.18Å; L339-L342 VanDerWaalsContact O-N 3.13Å; L342-L345 HydrophobicContact CD2-CB 4.06Å; L342-L345 HydrophobicContact CD2-CD1 4.31Å; L342-L345 HydrophobicContact CD2-CD2 4.07Å; L342-L345 HydrophobicContact CD2-CG 4.39Å; L342-L362 HydrophobicContact CD2-CD1 4.5Å; L342-S364 CarbonylContact O-C 3.56Å; L342-L365 HydrophobicContact CD2-CD1 4.17Å; L342-L365 HydrophobicContact CG-CD1 4.06Å; L342-L365 VanDerWaalsContact O-CA 3.28Å; L342-L365 WeakPolarHBondContact O-CA 3.3Å; L342-L365 PolarHBondContact O-N 3.25Å
343	K	97	Very high	91.6	Very high	81 Å²	81	43.4 Å²	43.4	35%	0.352	20%	0.201	S	C	.	.			trans	-98.9	-35.8	179	-66.4	176.1	-176	160.8	0	112.4	E320 Q341 S364 E366 Q367	E320-K343 WeakPolarHBondContact O-CA 3.1Å; E320-K343 PolarHBondContact O-N 3.17Å; E320-K343 IonicContact OE2-NZ 3.59Å; E320-K343 PolarHBondContact OE2-NZ 3.21Å; Q341-K343 PolarHBondContact O-N 3.33Å; Q341-K343 VanDerWaalsContact O-N 3.15Å; K343-S364 WeakPolarHBondContact CA-O 3.27Å; K343-E366 HydrophobicContact CB-CG 4.45Å; K343-E366 CarbonylContact O-C 3.52Å; K343-E366 WeakPolarHBondContact O-CA 3.48Å; K343-E366 PolarHBondContact O-N 2.82Å; K343-Q367 PolarHBondContact O-N 3.38Å
344	S	97.5	Very high	91.2	Very high	17 Å²	17	46 Å²	46	12%	0.119	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	124.6	-177.5	-175.1	0	0	0	0	110.9	E320 F321 L322 Q367	E320-S344 PolarHBondContact O-N 2.8Å; F321-S344 WeakPolarHBondContact CA-O 3.26Å; F321-S344 WeakPolarHBondContact CD2-OG 3.36Å; L322-S344 PolarHBondContact N-O 3.26Å; S344-Q367 WeakPolarHBondContact CA-O 3.27Å
345	L	97.1	Very high	91.1	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	115.8	-179.5	179.5	53.7	0	0	0	110.5	L322 I336 L342 L347 F359 L362 L365 Q367 L368 D369	L322-L345 HydrophobicContact CB-CD1 3.96Å; L322-L345 HydrophobicContact CD2-CD1 3.71Å; L322-L345 HydrophobicContact CG-CD1 3.81Å; L322-L345 CarbonylContact O-C 3.52Å; L322-L345 WeakPolarHBondContact O-CA 3.34Å; I336-L345 HydrophobicContact CD1-CD2 4.02Å; L342-L345 HydrophobicContact CD2-CB 4.06Å; L342-L345 HydrophobicContact CD2-CD1 4.31Å; L342-L345 HydrophobicContact CD2-CD2 4.07Å; L342-L345 HydrophobicContact CD2-CG 4.39Å; L345-L347 HydrophobicContact CD1-CD1 4.15Å; L345-L347 HydrophobicContact CD1-CD2 4.37Å; L345-L347 HydrophobicContact CD1-CG 3.91Å; L345-L347 HydrophobicContact CD2-CD1 3.7Å; L345-L347 HydrophobicContact CD2-CG 4.37Å; L345-L347 HydrophobicContact CG-CD1 3.79Å; L345-L347 HydrophobicContact CG-CG 3.94Å; L345-F359 HydrophobicContact CD2-CE2 3.67Å; L345-F359 HydrophobicContact CD2-CZ 4.12Å; L345-L362 HydrophobicContact CD2-CD1 4.3Å; L345-L365 HydrophobicContact CB-CD1 3.68Å; L345-L365 HydrophobicContact CB-CD2 4.5Å; L345-Q367 PolarHBondContact N-O 3.12Å; L345-L368 HydrophobicContact CB-CD1 4.08Å; L345-L368 HydrophobicContact CD2-CD1 4.13Å; L345-L368 HydrophobicContact CG-CD1 4.07Å; L345-L368 WeakPolarHBondContact O-CA 3.27Å; L345-D369 PolarHBondContact O-N 3.05Å
346	N	96.9	Very high	91	Very high	32 Å²	32	41.5 Å²	41.5	17%	0.171	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	111.8	173.8	-167.2	-27.7	0	0	0	111	L322 L324 R325 S348 D369	L322-N346 PolarHBondContact O-N 3.47Å; L324-N346 PolarHBondContact N-O 3.04Å; R325-N346 PolarHBondContact N-O 2.81Å; N346-S348 VanDerWaalsContact OD1-CB 3.26Å; N346-S348 WeakPolarHBondContact OD1-CB 3.38Å; N346-S348 PolarHBondContact OD1-N 2.94Å; N346-S348 PolarHBondContact OD1-OG 3.29Å; N346-D369 HydrophobicContact CB-CB 4.41Å
347	L	95.9	Very high	90.5	Very high	1 Å²	1	48 Å²	48	1%	0.005	22%	0.219	C	C	.	.			trans	-118.2	20.5	176.6	-70.2	163.1	0	0	0	111.2	L324 L329 I332 L345 C350 I352 F359 D369 L370 N373	L324-L347 HydrophobicContact CB-CD2 3.94Å; L324-L347 HydrophobicContact CD1-CD2 3.69Å; L324-L347 HydrophobicContact CG-CD2 4.48Å; L329-L347 HydrophobicContact CD1-CD2 4.49Å; I332-L347 HydrophobicContact CD1-CD1 3.41Å; I332-L347 VanDerWaalsContact CD1-CD1 3.41Å; I332-L347 HydrophobicContact CG1-CD1 4.28Å; L345-L347 HydrophobicContact CD1-CD1 4.15Å; L345-L347 HydrophobicContact CD1-CD2 4.37Å; L345-L347 HydrophobicContact CD1-CG 3.91Å; L345-L347 HydrophobicContact CD2-CD1 3.7Å; L345-L347 HydrophobicContact CD2-CG 4.37Å; L345-L347 HydrophobicContact CG-CD1 3.79Å; L345-L347 HydrophobicContact CG-CG 3.94Å; L347-C350 WeakPolarHBondContact O-CB 3.46Å; L347-C350 PolarHBondContact O-SG 3.38Å; L347-I352 HydrophobicContact CB-CD1 3.79Å; L347-I352 HydrophobicContact CD1-CD1 4.01Å; L347-I352 HydrophobicContact CD2-CD1 4.04Å; L347-I352 HydrophobicContact CG-CD1 4.18Å; L347-F359 HydrophobicContact CD1-CE2 4.09Å; L347-D369 CarbonylContact C-O 3.17Å; L347-D369 WeakPolarHBondContact CA-O 3.45Å; L347-D369 PolarHBondContact N-O 3.36Å; L347-L370 HydrophobicContact CB-CD2 3.91Å; L347-L370 HydrophobicContact CD1-CD2 3.85Å; L347-N373 PolarHBondContact O-ND2 3.3Å
348	S	91.7	Very high	90.4	Very high	0 Å²	0	47 Å²	47	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	150.9	-176.8	60.6	0	0	0	0	112.8	R325 S326 N346 C350 D369 S371	R325-S348 CarbonylContact C-O 3.57Å; R325-S348 VanDerWaalsContact CA-O 3.23Å; R325-S348 WeakPolarHBondContact CA-O 3.27Å; R325-S348 WeakPolarHBondContact CD-OG 3.37Å; R325-S348 VanDerWaalsContact CG-OG 3.25Å; R325-S348 WeakPolarHBondContact CG-OG 3.43Å; R325-S348 PolarHBondContact NH1-OG 3.23Å; S326-S348 PolarHBondContact N-O 2.81Å; N346-S348 VanDerWaalsContact OD1-CB 3.26Å; N346-S348 WeakPolarHBondContact OD1-CB 3.38Å; N346-S348 PolarHBondContact OD1-N 2.94Å; N346-S348 PolarHBondContact OD1-OG 3.29Å; S348-C350 PolarHBondContact O-N 3.37Å; S348-D369 WeakPolarHBondContact CB-OD1 3.2Å; S348-D369 PolarHBondContact N-O 3.43Å; S348-S371 CarbonylContact C-O 3.21Å; S348-S371 WeakPolarHBondContact CA-O 3.08Å; S348-S371 WeakPolarHBondContact CB-OG 3.42Å
349	Y	92.5	Very high	90.4	Very high	94 Å²	94	41.9 Å²	41.9	37%	0.369	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	33	-178.6	-64.9	-99.2	0	0	0	113.7	R325 S326 S371 Y372	R325-Y349 VanDerWaalsContact CZ-CE2 3.41Å; S326-Y349 WeakPolarHBondContact CA-O 3.47Å; Y349-S371 PolarHBondContact N-O 3.17Å; Y349-Y372 HydrophobicContact CD1-CD2 4.48Å; Y349-Y372 HydrophobicContact CD1-CG 4.18Å; Y349-Y372 AromaticContact CD2-CD2 3.93Å; Y349-Y372 HydrophobicContact CD2-CD2 3.93Å; Y349-Y372 HydrophobicContact CD2-CG 4.31Å; Y349-Y372 HydrophobicContact CE1-CD1 4.3Å; Y349-Y372 AromaticContact CE1-CD2 3.87Å; Y349-Y372 HydrophobicContact CE1-CD2 3.87Å; Y349-Y372 HydrophobicContact CE1-CE2 4.49Å; Y349-Y372 AromaticContact CE1-CG 3.74Å; Y349-Y372 HydrophobicContact CE1-CG 3.74Å; Y349-Y372 AromaticContact CE2-CD2 3.21Å; Y349-Y372 HydrophobicContact CE2-CD2 3.21Å; Y349-Y372 AromaticContact CE2-CE2 3.84Å; Y349-Y372 HydrophobicContact CE2-CE2 3.84Å; Y349-Y372 AromaticContact CE2-CG 3.87Å; Y349-Y372 HydrophobicContact CE2-CG 3.87Å; Y349-Y372 HydrophobicContact CG-CG 4.47Å; Y349-Y372 AromaticContact CZ-CD2 3.2Å; Y349-Y372 AromaticContact CZ-CE2 3.62Å; Y349-Y372 AromaticContact CZ-CG 3.59Å; Y349-Y372 WeakPolarHBondContact OH-CD2 3.37Å; Y349-Y372 WeakPolarHBondContact OH-CE2 3.46Å
350	C	92.1	Very high	90.1	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.007	19%	0.191	C	C	.	.	S	Bend	trans	-91.9	-164.6	166.7	-59	0	0	0	0	110.1	L324 N327 L329 L347 S348 I352 N373	L324-C350 PolarHBondContact O-SG 2.88Å; N327-C350 WeakPolarHBondContact O-CA 3.38Å; N327-C350 WeakPolarHBondContact O-CB 3.38Å; N327-C350 PolarHBondContact O-SG 3.44Å; N327-C350 VanDerWaalsContact O-SG 3.36Å; L329-C350 HydrophobicContact CB-CB 4.22Å; L347-C350 WeakPolarHBondContact O-CB 3.46Å; L347-C350 PolarHBondContact O-SG 3.38Å; S348-C350 PolarHBondContact O-N 3.37Å; C350-I352 HydrophobicContact CB-CD1 4.21Å; C350-I352 HydrophobicContact CB-CG1 4Å; C350-N373 VanDerWaalsContact CA-OD1 3.26Å; C350-N373 WeakPolarHBondContact CA-OD1 3.3Å; C350-N373 WeakPolarHBondContact CB-OD1 3.44Å; C350-N373 PolarHBondContact N-OD1 2.86Å; C350-N373 PolarHBondContact O-OD1 3.28Å
351	L	90.1	Very high	90.1	Very high	49 Å²	49	37.8 Å²	37.8	26%	0.257	18%	0.176	S	C	.	.			trans	-118.6	30.1	176.7	-61.2	177.1	0	0	0	111	P328 L329 R330 E353 N373	P328-L351 HydrophobicContact CB-CD1 4.16Å; L329-L351 CarbonylContact O-C 3.36Å; L329-L351 VanDerWaalsContact O-CA 3.29Å; L329-L351 WeakPolarHBondContact O-CA 3.15Å; L329-L351 PolarHBondContact O-N 3.07Å; R330-L351 WeakPolarHBondContact CA-O 3.38Å; R330-L351 HydrophobicContact CG-CB 4.03Å; L351-E353 PolarHBondContact O-N 2.96Å; L351-N373 PolarHBondContact N-OD1 3.25Å
352	I	90.6	Very high	90	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.159	C	C	.	.			trans	-68.1	118.9	-174.3	-58.9	170.1	0	0	0	108.9	L329 I332 L347 C350 L355 L370 N373 C374 L375	L329-I352 PolarHBondContact O-N 3.06Å; I332-I352 HydrophobicContact CD1-CD1 4.17Å; I332-I352 HydrophobicContact CG1-CD1 4.18Å; L347-I352 HydrophobicContact CB-CD1 3.79Å; L347-I352 HydrophobicContact CD1-CD1 4.01Å; L347-I352 HydrophobicContact CD2-CD1 4.04Å; L347-I352 HydrophobicContact CG-CD1 4.18Å; C350-I352 HydrophobicContact CB-CD1 4.21Å; C350-I352 HydrophobicContact CB-CG1 4Å; I352-L355 HydrophobicContact CG2-CD2 4.03Å; I352-L370 HydrophobicContact CD1-CD2 4.19Å; I352-N373 HydrophobicContact CB-CB 4.25Å; I352-N373 WeakPolarHBondContact CB-OD1 3.23Å; I352-N373 WeakPolarHBondContact CG1-OD1 3.47Å; I352-N373 PolarHBondContact N-OD1 3.13Å; I352-C374 CarbonylContact O-C 3.26Å; I352-C374 VanDerWaalsContact O-C 3.32Å; I352-C374 WeakPolarHBondContact O-CA 3.36Å; I352-C374 PolarHBondContact O-N 3.28Å; I352-L375 HydrophobicContact CG2-CD2 3.91Å; I352-L375 PolarHBondContact O-N 3.2Å
353	E	82.9	Confident	89.7	Confident	67 Å²	67	40.4 Å²	40.4	31%	0.313	19%	0.186	S	C	.	.			trans	-92.6	-37.8	179	-65.1	178.7	-177.2	0	0	111	R330 L351 C374	R330-E353 IonicContact NH1-OE1 3.41Å; L351-E353 PolarHBondContact O-N 2.96Å; E353-C374 HydrophobicContact CG-CB 4.06Å
354	H	78.4	Confident	89.5	Confident	69 Å²	69	38.8 Å²	38.8	32%	0.319	19%	0.185	S	C	.	.			trans	-145.5	148.8	-178.8	-50.2	-53.6	0	0	0	110.6	Y377	H354-Y377 AromaticContact CE1-CE1 3.93Å; H354-Y377 AromaticContact ND1-CE1 3.38Å; H354-Y377 WeakPolarHBondContact ND1-CE1 3.42Å
355	L	86.3	Confident	89.4	Confident	14 Å²	14	38 Å²	38	7%	0.073	18%	0.179	C	C	.	.			trans	-92.2	145.9	169.9	-59.6	172.9	0	0	0	109.6	I332 I352 F359 Y360 L370 L375 L378	I332-L355 HydrophobicContact CD1-CD2 3.72Å; I352-L355 HydrophobicContact CG2-CD2 4.03Å; L355-F359 HydrophobicContact CB-CB 4.39Å; L355-F359 HydrophobicContact CB-CD1 4.26Å; L355-F359 HydrophobicContact CB-CG 4.32Å; L355-F359 HydrophobicContact CD1-CD1 3.82Å; L355-F359 HydrophobicContact CD1-CE1 3.76Å; L355-F359 HydrophobicContact CD1-CZ 4.42Å; L355-F359 HydrophobicContact CD2-CD1 4.26Å; L355-F359 HydrophobicContact CD2-CD2 4.22Å; L355-F359 HydrophobicContact CD2-CE1 4.28Å; L355-F359 HydrophobicContact CD2-CE2 4.22Å; L355-F359 HydrophobicContact CD2-CG 4.24Å; L355-F359 HydrophobicContact CD2-CZ 4.26Å; L355-F359 HydrophobicContact CG-CD1 4.34Å; L355-Y360 HydrophobicContact CB-CE2 4.37Å; L355-Y360 HydrophobicContact CD1-CE1 4.31Å; L355-L370 HydrophobicContact CD1-CD1 3.86Å; L355-L370 HydrophobicContact CD2-CD1 4.47Å; L355-L370 HydrophobicContact CD2-CD2 4.11Å; L355-L375 HydrophobicContact CG-CD2 4.26Å; L355-L378 HydrophobicContact CD1-CD1 3.72Å
356	T	83.9	Confident	89.4	Confident	33 Å²	33	41.2 Å²	41.2	20%	0.202	19%	0.194	C	C	.	.			trans	-79.4	162.1	175.2	55.2	0	0	0	0	110.8	K334 E358 F359 Y360	K334-T356 HydrophobicContact CG-CG2 4.44Å; T356-E358 VanDerWaalsContact C-N 3.27Å; T356-E358 WeakPolarHBondContact CB-OE2 3.42Å; T356-E358 PolarHBondContact O-N 2.82Å; T356-F359 WeakPolarHBondContact O-CB 3.48Å; T356-F359 PolarHBondContact O-N 2.61Å; T356-F359 VanDerWaalsContact O-N 3.17Å; T356-Y360 WeakPolarHBondContact O-CD2 3.26Å
357	Y	79.5	Confident	89.3	Confident	140 Å²	140	44.2 Å²	44.2	55%	0.549	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-63.1	-38.6	-179.8	-50	-40.9	0	0	0	111.8	F359 Y360	Y357-F359 PolarHBondContact O-N 2.81Å; Y357-Y360 PolarHBondContact O-N 3.42Å
358	E	85.7	Confident	89.4	Confident	39 Å²	39	44.3 Å²	44.3	18%	0.182	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-65.4	-20.2	179.2	-58.8	87	163.5	0	0	112.6	K334 I337 T356 Y360 D361	K334-E358 HydrophobicContact CB-CB 4.5Å; K334-E358 HydrophobicContact CB-CG 4.14Å; K334-E358 VanDerWaalsContact CD-OE1 3.27Å; K334-E358 WeakPolarHBondContact CD-OE1 3.35Å; K334-E358 WeakPolarHBondContact CE-OE1 3.31Å; K334-E358 IonicContact NZ-OE1 3.14Å; K334-E358 PolarHBondContact NZ-OE1 2.86Å; K334-E358 WeakPolarHBondContact O-CB 3.49Å; I337-E358 HydrophobicContact CB-CB 4.26Å; I337-E358 HydrophobicContact CD1-CB 4.48Å; T356-E358 VanDerWaalsContact C-N 3.27Å; T356-E358 WeakPolarHBondContact CB-OE2 3.42Å; T356-E358 PolarHBondContact O-N 2.82Å; E358-Y360 VanDerWaalsContact C-N 3.3Å; E358-Y360 PolarHBondContact O-N 2.93Å; E358-D361 PolarHBondContact O-N 2.83Å
359	F	88.9	Confident	89.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-64.9	-35.7	174.8	-178.8	-88.9	0	0	0	111.9	I332 I336 L345 L347 L355 T356 Y357 D361 L362 L368 L385	I332-F359 HydrophobicContact CD1-CD2 3.49Å; I332-F359 VanDerWaalsContact CD1-CD2 3.49Å; I332-F359 HydrophobicContact CD1-CE2 3.5Å; I332-F359 VanDerWaalsContact CD1-CE2 3.5Å; I332-F359 HydrophobicContact CG2-CD2 4.47Å; I336-F359 HydrophobicContact CD1-CD2 4.39Å; L345-F359 HydrophobicContact CD2-CE2 3.67Å; L345-F359 HydrophobicContact CD2-CZ 4.12Å; L347-F359 HydrophobicContact CD1-CE2 4.09Å; L355-F359 HydrophobicContact CB-CB 4.39Å; L355-F359 HydrophobicContact CB-CD1 4.26Å; L355-F359 HydrophobicContact CB-CG 4.32Å; L355-F359 HydrophobicContact CD1-CD1 3.82Å; L355-F359 HydrophobicContact CD1-CE1 3.76Å; L355-F359 HydrophobicContact CD1-CZ 4.42Å; L355-F359 HydrophobicContact CD2-CD1 4.26Å; L355-F359 HydrophobicContact CD2-CD2 4.22Å; L355-F359 HydrophobicContact CD2-CE1 4.28Å; L355-F359 HydrophobicContact CD2-CE2 4.22Å; L355-F359 HydrophobicContact CD2-CG 4.24Å; L355-F359 HydrophobicContact CD2-CZ 4.26Å; L355-F359 HydrophobicContact CG-CD1 4.34Å; T356-F359 WeakPolarHBondContact O-CB 3.48Å; T356-F359 PolarHBondContact O-N 2.61Å; T356-F359 VanDerWaalsContact O-N 3.17Å; Y357-F359 PolarHBondContact O-N 2.81Å; F359-D361 PolarHBondContact O-N 2.8Å; F359-L362 HydrophobicContact CD2-CD1 4.11Å; F359-L362 HydrophobicContact CE2-CD1 4.14Å; F359-L362 WeakPolarHBondContact O-CG 3.35Å; F359-L362 PolarHBondContact O-N 2.98Å; F359-L368 HydrophobicContact CE1-CD2 3.76Å; F359-L368 HydrophobicContact CZ-CD1 3.79Å; F359-L368 HydrophobicContact CZ-CD2 3.7Å; F359-L368 HydrophobicContact CZ-CG 4.42Å; F359-L385 HydrophobicContact CE1-CD1 4.43Å
360	Y	86	Confident	89.8	Confident	5 Å²	5	40.8 Å²	40.8	2%	0.02	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-73.6	-7.8	-177	-61	-68.2	0	0	0	113.4	L355 T356 Y357 E358 L362 D379 R381 I382 N384 L385	L355-Y360 HydrophobicContact CB-CE2 4.37Å; L355-Y360 HydrophobicContact CD1-CE1 4.31Å; T356-Y360 WeakPolarHBondContact O-CD2 3.26Å; Y357-Y360 PolarHBondContact O-N 3.42Å; E358-Y360 VanDerWaalsContact C-N 3.3Å; E358-Y360 PolarHBondContact O-N 2.93Å; Y360-L362 VanDerWaalsContact C-N 3.35Å; Y360-D379 HydrophobicContact CD2-CB 4.5Å; Y360-D379 HydrophobicContact CE1-CB 4.34Å; Y360-D379 HydrophobicContact CE2-CB 3.6Å; Y360-D379 VanDerWaalsContact OH-CB 3.31Å; Y360-D379 WeakPolarHBondContact OH-CB 3.4Å; Y360-D379 PolarHBondContact OH-N 2.82Å; Y360-R381 HydrophobicContact CD1-CB 4.24Å; Y360-R381 HydrophobicContact CD2-CB 3.82Å; Y360-R381 HydrophobicContact CE2-CB 4.46Å; Y360-R381 HydrophobicContact CG-CB 3.69Å; Y360-I382 HydrophobicContact CD1-CB 4.23Å; Y360-I382 HydrophobicContact CD1-CD1 4.07Å; Y360-I382 HydrophobicContact CE1-CB 4.01Å; Y360-I382 HydrophobicContact CE1-CD1 3.8Å; Y360-N384 WeakPolarHBondContact O-CB 3.45Å; Y360-L385 WeakPolarHBondContact O-CD2 3.14Å
361	D	88.7	Confident	89.7	Confident	69 Å²	69	41 Å²	41	37%	0.369	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-93	8.7	178	-67.8	-32.7	0	0	0	113.1	I337 E358 F359 K363	I337-D361 HydrophobicContact CD1-CB 3.51Å; I337-D361 WeakPolarHBondContact CD1-OD2 3.36Å; I337-D361 HydrophobicContact CG1-CB 3.77Å; E358-D361 PolarHBondContact O-N 2.83Å; F359-D361 PolarHBondContact O-N 2.8Å; D361-K363 PolarHBondContact O-N 2.97Å
362	L	92.6	Very high	89.7	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.021	20%	0.197	C	C	.	.			trans	-73.8	68.9	172.2	-68.1	174.2	0	0	0	111.3	I336 L342 L345 F359 Y360 S364 L365 L385	I336-L362 HydrophobicContact CD1-CD1 4.03Å; I336-L362 HydrophobicContact CG1-CD1 4.14Å; I336-L362 HydrophobicContact CG1-CD2 4.36Å; I336-L362 WeakPolarHBondContact O-CD2 3.34Å; L342-L362 HydrophobicContact CD2-CD1 4.5Å; L345-L362 HydrophobicContact CD2-CD1 4.3Å; F359-L362 HydrophobicContact CD2-CD1 4.11Å; F359-L362 HydrophobicContact CE2-CD1 4.14Å; F359-L362 WeakPolarHBondContact O-CG 3.35Å; F359-L362 PolarHBondContact O-N 2.98Å; Y360-L362 VanDerWaalsContact C-N 3.35Å; L362-S364 VanDerWaalsContact C-N 3.28Å; L362-S364 PolarHBondContact O-N 3.08Å; L362-L365 HydrophobicContact CB-CB 4.29Å; L362-L365 VanDerWaalsContact O-CB 3.25Å; L362-L365 WeakPolarHBondContact O-CB 3.39Å; L362-L365 PolarHBondContact O-N 2.94Å; L362-L365 VanDerWaalsContact O-N 3.15Å; L362-L385 HydrophobicContact CB-CD2 4.04Å; L362-L385 WeakPolarHBondContact O-CD2 3.25Å
363	K	88.9	Confident	89.7	Confident	133 Å²	133	42 Å²	42	58%	0.578	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-36	-169.9	-63.1	-170.4	178.6	-169.8	0	114.2	D361 L365 H387	D361-K363 PolarHBondContact O-N 2.97Å; K363-L365 PolarHBondContact O-N 3.34Å; K363-H387 PolarHBondContact O-CD2 2.95Å
364	S	93.4	Very high	89.8	Confident	46 Å²	46	40.1 Å²	40.1	32%	0.322	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	2	-176.3	-52.5	0	0	0	0	114.3	K340 L342 K343 L362 E366	K340-S364 WeakPolarHBondContact O-CB 3.49Å; K340-S364 PolarHBondContact O-OG 3.33Å; L342-S364 CarbonylContact O-C 3.56Å; K343-S364 WeakPolarHBondContact CA-O 3.27Å; L362-S364 VanDerWaalsContact C-N 3.28Å; L362-S364 PolarHBondContact O-N 3.08Å; S364-E366 PolarHBondContact O-N 2.72Å
365	L	95.7	Very high	90	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.177	C	C	.	.			trans	-74.6	119.1	-173.9	-161.9	73.6	0	0	0	111.2	L342 L345 L362 K363 L368 L385 H387 I388	L342-L365 HydrophobicContact CD2-CD1 4.17Å; L342-L365 HydrophobicContact CG-CD1 4.06Å; L342-L365 VanDerWaalsContact O-CA 3.28Å; L342-L365 WeakPolarHBondContact O-CA 3.3Å; L342-L365 PolarHBondContact O-N 3.25Å; L345-L365 HydrophobicContact CB-CD1 3.68Å; L345-L365 HydrophobicContact CB-CD2 4.5Å; L362-L365 HydrophobicContact CB-CB 4.29Å; L362-L365 VanDerWaalsContact O-CB 3.25Å; L362-L365 WeakPolarHBondContact O-CB 3.39Å; L362-L365 PolarHBondContact O-N 2.94Å; L362-L365 VanDerWaalsContact O-N 3.15Å; K363-L365 PolarHBondContact O-N 3.34Å; L365-L368 HydrophobicContact CD2-CB 3.85Å; L365-L368 HydrophobicContact CD2-CD1 4.13Å; L365-L368 HydrophobicContact CD2-CD2 4.01Å; L365-L368 HydrophobicContact CD2-CG 4.21Å; L365-L385 HydrophobicContact CD2-CD1 4.31Å; L365-H387 CarbonylContact O-C 3.45Å; L365-H387 VanDerWaalsContact O-C 3.26Å; L365-I388 VanDerWaalsContact O-CA 3.27Å; L365-I388 WeakPolarHBondContact O-CA 3.38Å; L365-I388 PolarHBondContact O-N 3.11Å; L365-I388 VanDerWaalsContact O-N 3.14Å
366	E	96	Very high	89.4	Confident	69 Å²	69	38.9 Å²	38.9	32%	0.322	19%	0.19	S	C	.	.			trans	-101.6	-33.5	179.7	-62.4	177.5	-160.3	0	0	112.3	K343 S364 H387 K389 V390	K343-E366 HydrophobicContact CB-CG 4.45Å; K343-E366 CarbonylContact O-C 3.52Å; K343-E366 WeakPolarHBondContact O-CA 3.48Å; K343-E366 PolarHBondContact O-N 2.82Å; S364-E366 PolarHBondContact O-N 2.72Å; E366-H387 WeakPolarHBondContact CA-O 3.29Å; E366-K389 PolarHBondContact O-N 3.15Å; E366-V390 PolarHBondContact O-N 3.26Å
367	Q	96.4	Very high	88.6	Confident	96 Å²	96	40.7 Å²	40.7	45%	0.449	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	125.7	-178.8	-57.8	-175.1	7.6	0	0	110.4	K343 S344 L345 V390	K343-Q367 PolarHBondContact O-N 3.38Å; S344-Q367 WeakPolarHBondContact CA-O 3.27Å; L345-Q367 PolarHBondContact N-O 3.12Å; Q367-V390 WeakPolarHBondContact CA-O 3.33Å; Q367-V390 HydrophobicContact CB-CB 4.39Å; Q367-V390 HydrophobicContact CG-CB 4.11Å; Q367-V390 HydrophobicContact CG-CG2 4.27Å
368	L	96.8	Very high	88.4	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	119.7	178.2	179.3	54	0	0	0	110.6	L345 F359 L365 L370 L385 I388 V390 L391 K392	L345-L368 HydrophobicContact CB-CD1 4.08Å; L345-L368 HydrophobicContact CD2-CD1 4.13Å; L345-L368 HydrophobicContact CG-CD1 4.07Å; L345-L368 WeakPolarHBondContact O-CA 3.27Å; F359-L368 HydrophobicContact CE1-CD2 3.76Å; F359-L368 HydrophobicContact CZ-CD1 3.79Å; F359-L368 HydrophobicContact CZ-CD2 3.7Å; F359-L368 HydrophobicContact CZ-CG 4.42Å; L365-L368 HydrophobicContact CD2-CB 3.85Å; L365-L368 HydrophobicContact CD2-CD1 4.13Å; L365-L368 HydrophobicContact CD2-CD2 4.01Å; L365-L368 HydrophobicContact CD2-CG 4.21Å; L368-L370 HydrophobicContact CD1-CD1 4.2Å; L368-L370 HydrophobicContact CD1-CD2 4.47Å; L368-L370 HydrophobicContact CD1-CG 3.9Å; L368-L370 HydrophobicContact CD2-CD1 3.74Å; L368-L370 HydrophobicContact CD2-CG 4.34Å; L368-L370 HydrophobicContact CG-CD1 3.95Å; L368-L370 HydrophobicContact CG-CG 4Å; L368-L385 HydrophobicContact CD2-CD1 4.14Å; L368-I388 HydrophobicContact CB-CD1 3.8Å; L368-I388 HydrophobicContact CD2-CD1 4.28Å; L368-V390 PolarHBondContact N-O 3.21Å; L368-L391 HydrophobicContact CB-CD1 3.99Å; L368-L391 HydrophobicContact CD2-CD1 3.9Å; L368-L391 HydrophobicContact CG-CD1 3.97Å; L368-L391 WeakPolarHBondContact O-CA 3.43Å; L368-K392 PolarHBondContact O-N 3.43Å
369	D	96.5	Very high	88	Confident	21 Å²	21	33.1 Å²	33.1	11%	0.112	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	107.6	173.1	-170.4	-8.5	0	0	0	110.6	L345 N346 L347 S348 S371 K392	L345-D369 PolarHBondContact O-N 3.05Å; N346-D369 HydrophobicContact CB-CB 4.41Å; L347-D369 CarbonylContact C-O 3.17Å; L347-D369 WeakPolarHBondContact CA-O 3.45Å; L347-D369 PolarHBondContact N-O 3.36Å; S348-D369 WeakPolarHBondContact CB-OD1 3.2Å; S348-D369 PolarHBondContact N-O 3.43Å; D369-S371 WeakPolarHBondContact OD1-CB 3.37Å; D369-S371 PolarHBondContact OD1-N 3.1Å; D369-S371 PolarHBondContact OD1-OG 2.87Å; D369-K392 HydrophobicContact CB-CB 4.34Å; D369-K392 HydrophobicContact CB-CD 4.47Å
370	L	95.3	Very high	87	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.174	C	C	.	.			trans	-111.5	18.2	174.9	-74.7	166	0	0	0	111.2	L347 I352 L355 L368 N373 L375 K392 L393 N396	L347-L370 HydrophobicContact CB-CD2 3.91Å; L347-L370 HydrophobicContact CD1-CD2 3.85Å; I352-L370 HydrophobicContact CD1-CD2 4.19Å; L355-L370 HydrophobicContact CD1-CD1 3.86Å; L355-L370 HydrophobicContact CD2-CD1 4.47Å; L355-L370 HydrophobicContact CD2-CD2 4.11Å; L368-L370 HydrophobicContact CD1-CD1 4.2Å; L368-L370 HydrophobicContact CD1-CD2 4.47Å; L368-L370 HydrophobicContact CD1-CG 3.9Å; L368-L370 HydrophobicContact CD2-CD1 3.74Å; L368-L370 HydrophobicContact CD2-CG 4.34Å; L368-L370 HydrophobicContact CG-CD1 3.95Å; L368-L370 HydrophobicContact CG-CG 4Å; L370-N373 VanDerWaalsContact C-ND2 3.33Å; L370-N373 PolarHBondContact O-ND2 3.18Å; L370-L375 HydrophobicContact CB-CD1 4.02Å; L370-L375 HydrophobicContact CD1-CD1 4.02Å; L370-L375 HydrophobicContact CD2-CD1 4.43Å; L370-L375 HydrophobicContact CG-CD1 4.4Å; L370-K392 CarbonylContact C-O 3.2Å; L370-K392 WeakPolarHBondContact CA-O 3.33Å; L370-K392 PolarHBondContact N-O 3.33Å; L370-L393 HydrophobicContact CB-CD2 3.96Å; L370-L393 HydrophobicContact CD1-CD2 3.98Å; L370-N396 PolarHBondContact O-ND2 2.98Å
371	S	90.5	Very high	86.7	Confident	5 Å²	5	38.3 Å²	38.3	4%	0.035	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	149	-175.3	62	0	0	0	0	113.3	S348 Y349 D369 N373 K392 N394	S348-S371 CarbonylContact C-O 3.21Å; S348-S371 WeakPolarHBondContact CA-O 3.08Å; S348-S371 WeakPolarHBondContact CB-OG 3.42Å; Y349-S371 PolarHBondContact N-O 3.17Å; D369-S371 WeakPolarHBondContact OD1-CB 3.37Å; D369-S371 PolarHBondContact OD1-N 3.1Å; D369-S371 PolarHBondContact OD1-OG 2.87Å; S371-N373 VanDerWaalsContact C-N 3.25Å; S371-N373 PolarHBondContact O-N 3.19Å; S371-N373 PolarHBondContact O-ND2 2.67Å; S371-K392 PolarHBondContact N-O 3.08Å; S371-N394 CarbonylContact C-O 3.6Å; S371-N394 WeakPolarHBondContact CA-O 3.31Å; S371-N394 VanDerWaalsContact CB-O 3.29Å; S371-N394 WeakPolarHBondContact CB-O 3.42Å; S371-N394 WeakPolarHBondContact CB-OD1 3.49Å
372	Y	91.3	Very high	86.4	Confident	66 Å²	66	35 Å²	35	26%	0.259	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	30.4	176.7	-58.8	-76.8	0	0	0	115.1	R10 Y349 N394 G395 D420	R10-Y372 PolarHBondContact NH1-O 3.02Å; R10-Y372 PolarHBondContact NH2-O 2.94Å; Y349-Y372 HydrophobicContact CD1-CD2 4.48Å; Y349-Y372 HydrophobicContact CD1-CG 4.18Å; Y349-Y372 AromaticContact CD2-CD2 3.93Å; Y349-Y372 HydrophobicContact CD2-CD2 3.93Å; Y349-Y372 HydrophobicContact CD2-CG 4.31Å; Y349-Y372 HydrophobicContact CE1-CD1 4.3Å; Y349-Y372 AromaticContact CE1-CD2 3.87Å; Y349-Y372 HydrophobicContact CE1-CD2 3.87Å; Y349-Y372 HydrophobicContact CE1-CE2 4.49Å; Y349-Y372 AromaticContact CE1-CG 3.74Å; Y349-Y372 HydrophobicContact CE1-CG 3.74Å; Y349-Y372 AromaticContact CE2-CD2 3.21Å; Y349-Y372 HydrophobicContact CE2-CD2 3.21Å; Y349-Y372 AromaticContact CE2-CE2 3.84Å; Y349-Y372 HydrophobicContact CE2-CE2 3.84Å; Y349-Y372 AromaticContact CE2-CG 3.87Å; Y349-Y372 HydrophobicContact CE2-CG 3.87Å; Y349-Y372 HydrophobicContact CG-CG 4.47Å; Y349-Y372 AromaticContact CZ-CD2 3.2Å; Y349-Y372 AromaticContact CZ-CE2 3.62Å; Y349-Y372 AromaticContact CZ-CG 3.59Å; Y349-Y372 WeakPolarHBondContact OH-CD2 3.37Å; Y349-Y372 WeakPolarHBondContact OH-CE2 3.46Å; Y372-N394 VanDerWaalsContact CE2-ND2 3.27Å; Y372-N394 WeakPolarHBondContact CE2-ND2 3.3Å; Y372-N394 PolarHBondContact N-O 2.9Å; Y372-G395 VanDerWaalsContact CA-O 3.27Å; Y372-G395 WeakPolarHBondContact CA-O 3.22Å; Y372-D420 PolarHBondContact OH-OD2 2.84Å
373	N	89.3	Confident	85.7	Confident	4 Å²	4	37.8 Å²	37.8	2%	0.021	18%	0.183	C	C	.	.	S	Bend	trans	-89.2	-156.7	170.1	-81.5	-71.5	0	0	0	111.1	L347 C350 L351 I352 L370 S371 L375 N396	L347-N373 PolarHBondContact O-ND2 3.3Å; C350-N373 VanDerWaalsContact CA-OD1 3.26Å; C350-N373 WeakPolarHBondContact CA-OD1 3.3Å; C350-N373 WeakPolarHBondContact CB-OD1 3.44Å; C350-N373 PolarHBondContact N-OD1 2.86Å; C350-N373 PolarHBondContact O-OD1 3.28Å; L351-N373 PolarHBondContact N-OD1 3.25Å; I352-N373 HydrophobicContact CB-CB 4.25Å; I352-N373 WeakPolarHBondContact CB-OD1 3.23Å; I352-N373 WeakPolarHBondContact CG1-OD1 3.47Å; I352-N373 PolarHBondContact N-OD1 3.13Å; L370-N373 VanDerWaalsContact C-ND2 3.33Å; L370-N373 PolarHBondContact O-ND2 3.18Å; S371-N373 VanDerWaalsContact C-N 3.25Å; S371-N373 PolarHBondContact O-N 3.19Å; S371-N373 PolarHBondContact O-ND2 2.67Å; N373-L375 HydrophobicContact CB-CG 4.33Å; N373-N396 VanDerWaalsContact CA-OD1 3.27Å; N373-N396 WeakPolarHBondContact CA-OD1 3.43Å; N373-N396 WeakPolarHBondContact CB-OD1 3.42Å; N373-N396 PolarHBondContact N-OD1 3.22Å
374	C	85.8	Confident	85.5	Confident	28 Å²	28	33.9 Å²	33.9	19%	0.189	17%	0.168	C	C	.	.			trans	-124.9	30.2	178.9	-56.5	0	0	0	0	110.5	I352 E353 T376 N396	I352-C374 CarbonylContact O-C 3.26Å; I352-C374 VanDerWaalsContact O-C 3.32Å; I352-C374 WeakPolarHBondContact O-CA 3.36Å; I352-C374 PolarHBondContact O-N 3.28Å; E353-C374 HydrophobicContact CG-CB 4.06Å; C374-T376 PolarHBondContact O-N 3.4Å; C374-N396 PolarHBondContact N-OD1 3.42Å
375	L	82.8	Confident	85.4	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	15%	0.153	C	C	.	.			trans	-69.5	120.2	-176.8	-63.9	172.8	0	0	0	109.6	I352 L355 L370 N373 L393 N396 D397 L398	I352-L375 HydrophobicContact CG2-CD2 3.91Å; I352-L375 PolarHBondContact O-N 3.2Å; L355-L375 HydrophobicContact CG-CD2 4.26Å; L370-L375 HydrophobicContact CB-CD1 4.02Å; L370-L375 HydrophobicContact CD1-CD1 4.02Å; L370-L375 HydrophobicContact CD2-CD1 4.43Å; L370-L375 HydrophobicContact CG-CD1 4.4Å; N373-L375 HydrophobicContact CB-CG 4.33Å; L375-L393 HydrophobicContact CD1-CD2 4.2Å; L375-N396 HydrophobicContact CB-CB 4.13Å; L375-N396 WeakPolarHBondContact CB-OD1 3.29Å; L375-N396 PolarHBondContact N-OD1 2.84Å; L375-N396 VanDerWaalsContact N-OD1 3.08Å; L375-D397 CarbonylContact O-C 3.14Å; L375-D397 WeakPolarHBondContact O-CA 3.24Å; L375-D397 PolarHBondContact O-N 3.14Å; L375-L398 HydrophobicContact CB-CD2 4.01Å; L375-L398 PolarHBondContact O-N 3.02Å
376	T	72.6	Confident	84.9	Confident	55 Å²	55	36.4 Å²	36.4	34%	0.337	17%	0.174	S	C	.	.			trans	-94.4	-24.5	177.6	56.2	0	0	0	0	113.3	C374 D397	C374-T376 PolarHBondContact O-N 3.4Å; T376-D397 WeakPolarHBondContact CA-O 3.34Å; T376-D397 HydrophobicContact CG2-CB 4.03Å
377	Y	67.1	Low	84.6	Confident	72 Å²	72	38.3 Å²	38.3	28%	0.282	18%	0.183	S	C	.	.			trans	-148.1	163.6	174	74.6	-77.7	0	0	0	109.4	H354 I546	H354-Y377 AromaticContact CE1-CE1 3.93Å; H354-Y377 AromaticContact ND1-CE1 3.38Å; H354-Y377 WeakPolarHBondContact ND1-CE1 3.42Å; Y377-I546 HydrophobicContact CD1-CD1 4.32Å; Y377-I546 HydrophobicContact CD1-CG1 4.3Å; Y377-I546 HydrophobicContact CE1-CD1 3.42Å; Y377-I546 VanDerWaalsContact CE1-CD1 3.42Å; Y377-I546 HydrophobicContact CE1-CG1 3.87Å
378	L	75.8	Confident	84.5	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.01	16%	0.162	C	C	.	.			trans	-123.6	138.1	171.7	-167.6	70.9	0	0	0	108.2	L355 I382 L393 L398 P402 L405 W512	L355-L378 HydrophobicContact CD1-CD1 3.72Å; L378-I382 HydrophobicContact CD1-CD1 4.3Å; L378-I382 HydrophobicContact CD2-CB 4.08Å; L378-I382 HydrophobicContact CD2-CD1 4.07Å; L378-I382 HydrophobicContact CD2-CG1 3.85Å; L378-I382 HydrophobicContact CD2-CG2 4.17Å; L378-I382 HydrophobicContact CG-CB 4.31Å; L378-I382 HydrophobicContact CG-CD1 4.41Å; L378-I382 HydrophobicContact CG-CG1 4.45Å; L378-L393 HydrophobicContact CD2-CD1 4.07Å; L378-L398 HydrophobicContact CB-CD2 4.48Å; L378-P402 HydrophobicContact CB-CG 3.69Å; L378-P402 HydrophobicContact CD2-CG 4.17Å; L378-P402 HydrophobicContact CG-CG 4.19Å; L378-P402 VanDerWaalsContact O-CG 3.26Å; L378-P402 WeakPolarHBondContact O-CG 3.35Å; L378-L405 HydrophobicContact CD2-CD2 4.45Å; L378-W512 VanDerWaalsContact O-CZ3 3.3Å; L378-W512 WeakPolarHBondContact O-CZ3 3.49Å
379	D	76.8	Confident	84.2	Confident	18 Å²	18	37.5 Å²	37.5	10%	0.096	18%	0.178	C	C	.	.			trans	-73.6	147	178.4	-162.2	-67.9	0	0	0	111.2	Y360 R381 I382	Y360-D379 HydrophobicContact CD2-CB 4.5Å; Y360-D379 HydrophobicContact CE1-CB 4.34Å; Y360-D379 HydrophobicContact CE2-CB 3.6Å; Y360-D379 VanDerWaalsContact OH-CB 3.31Å; Y360-D379 WeakPolarHBondContact OH-CB 3.4Å; Y360-D379 PolarHBondContact OH-N 2.82Å; D379-R381 VanDerWaalsContact CG-NE 3.3Å; D379-R381 PolarHBondContact O-N 3.2Å; D379-R381 VanDerWaalsContact O-N 3.14Å; D379-R381 WeakPolarHBondContact OD1-CB 3.26Å; D379-R381 WeakPolarHBondContact OD1-CG 3.23Å; D379-R381 IonicContact OD1-CZ 2.74Å; D379-R381 PolarHBondContact OD1-N 3.39Å; D379-R381 IonicContact OD1-NE 3.4Å; D379-R381 PolarHBondContact OD1-NE 3.15Å; D379-R381 IonicContact OD1-NH2 3.46Å; D379-R381 IonicContact OD2-CZ 2.8Å; D379-R381 IonicContact OD2-NE 3.49Å; D379-R381 PolarHBondContact OD2-NE 2.84Å; D379-R381 IonicContact OD2-NH2 2.73Å; D379-R381 PolarHBondContact OD2-NH2 3.14Å; D379-I382 WeakPolarHBondContact O-CB 3.48Å; D379-I382 WeakPolarHBondContact O-CG2 3.15Å; D379-I382 PolarHBondContact O-N 3.18Å
380	S	69.3	Low	84	Confident	32 Å²	32	37.9 Å²	37.9	22%	0.224	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-59.1	-19.7	172.4	66.2	0	0	0	0	114	I382 K383 G404	S380-I382 PolarHBondContact O-N 2.91Å; S380-I382 VanDerWaalsContact O-N 3.12Å; S380-K383 WeakPolarHBondContact O-CG 3.48Å; S380-K383 PolarHBondContact O-N 3.14Å; S380-G404 WeakPolarHBondContact O-CA 3.41Å
381	R	79.4	Confident	83.9	Confident	81 Å²	81	37.9 Å²	37.9	31%	0.306	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-63.3	-9.7	171.6	-75.9	172.9	-78.1	-170.4	-6.7	114.2	Y360 D379 K383 N384	Y360-R381 HydrophobicContact CD1-CB 4.24Å; Y360-R381 HydrophobicContact CD2-CB 3.82Å; Y360-R381 HydrophobicContact CE2-CB 4.46Å; Y360-R381 HydrophobicContact CG-CB 3.69Å; D379-R381 VanDerWaalsContact CG-NE 3.3Å; D379-R381 PolarHBondContact O-N 3.2Å; D379-R381 VanDerWaalsContact O-N 3.14Å; D379-R381 WeakPolarHBondContact OD1-CB 3.26Å; D379-R381 WeakPolarHBondContact OD1-CG 3.23Å; D379-R381 IonicContact OD1-CZ 2.74Å; D379-R381 PolarHBondContact OD1-N 3.39Å; D379-R381 IonicContact OD1-NE 3.4Å; D379-R381 PolarHBondContact OD1-NE 3.15Å; D379-R381 IonicContact OD1-NH2 3.46Å; D379-R381 IonicContact OD2-CZ 2.8Å; D379-R381 IonicContact OD2-NE 3.49Å; D379-R381 PolarHBondContact OD2-NE 2.84Å; D379-R381 IonicContact OD2-NH2 2.73Å; D379-R381 PolarHBondContact OD2-NH2 3.14Å; R381-K383 PolarHBondContact O-N 3.31Å; R381-N384 VanDerWaalsContact O-CB 3.23Å; R381-N384 WeakPolarHBondContact O-CB 3.47Å; R381-N384 PolarHBondContact O-N 3.21Å
382	I	82.9	Confident	84	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-51.6	-28.3	168.9	-162.8	75.3	0	0	0	112.4	Y360 L378 D379 S380 N384 L385 L405 L408	Y360-I382 HydrophobicContact CD1-CB 4.23Å; Y360-I382 HydrophobicContact CD1-CD1 4.07Å; Y360-I382 HydrophobicContact CE1-CB 4.01Å; Y360-I382 HydrophobicContact CE1-CD1 3.8Å; L378-I382 HydrophobicContact CD1-CD1 4.3Å; L378-I382 HydrophobicContact CD2-CB 4.08Å; L378-I382 HydrophobicContact CD2-CD1 4.07Å; L378-I382 HydrophobicContact CD2-CG1 3.85Å; L378-I382 HydrophobicContact CD2-CG2 4.17Å; L378-I382 HydrophobicContact CG-CB 4.31Å; L378-I382 HydrophobicContact CG-CD1 4.41Å; L378-I382 HydrophobicContact CG-CG1 4.45Å; D379-I382 WeakPolarHBondContact O-CB 3.48Å; D379-I382 WeakPolarHBondContact O-CG2 3.15Å; D379-I382 PolarHBondContact O-N 3.18Å; S380-I382 PolarHBondContact O-N 2.91Å; S380-I382 VanDerWaalsContact O-N 3.12Å; I382-N384 PolarHBondContact O-N 2.94Å; I382-L385 HydrophobicContact CD1-CD1 3.48Å; I382-L385 VanDerWaalsContact CD1-CD1 3.48Å; I382-L385 HydrophobicContact CD1-CG 4.36Å; I382-L385 HydrophobicContact CG1-CD1 4.33Å; I382-L385 WeakPolarHBondContact O-CB 3.16Å; I382-L385 PolarHBondContact O-N 3.02Å; I382-L405 HydrophobicContact CG2-CB 4.01Å; I382-L408 HydrophobicContact CB-CD1 4.42Å; I382-L408 HydrophobicContact CG1-CD1 3.72Å; I382-L408 HydrophobicContact CG2-CD1 4.26Å; I382-L408 WeakPolarHBondContact O-CD1 3.43Å
383	K	76.8	Confident	83.9	Confident	63 Å²	63	38.3 Å²	38.3	27%	0.274	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-55	-22.1	173.2	75	179.3	-176.2	161.9	0	115	S380 R381 L385 G404 C407 L531	S380-K383 WeakPolarHBondContact O-CG 3.48Å; S380-K383 PolarHBondContact O-N 3.14Å; R381-K383 PolarHBondContact O-N 3.31Å; K383-L385 VanDerWaalsContact C-N 3.25Å; K383-L385 PolarHBondContact O-N 3.32Å; K383-G404 WeakPolarHBondContact CB-O 3.42Å; K383-C407 HydrophobicContact CB-CB 4.09Å; K383-L531 HydrophobicContact CD-CD2 3.99Å
384	N	85.3	Confident	83.7	Confident	51 Å²	51	38.9 Å²	38.9	27%	0.273	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-74.6	-15.4	-179.9	-66.4	4.6	0	0	0	112.6	Y360 R381 I382 E386	Y360-N384 WeakPolarHBondContact O-CB 3.45Å; R381-N384 VanDerWaalsContact O-CB 3.23Å; R381-N384 WeakPolarHBondContact O-CB 3.47Å; R381-N384 PolarHBondContact O-N 3.21Å; I382-N384 PolarHBondContact O-N 2.94Å; N384-E386 PolarHBondContact O-N 3.41Å
385	L	90.9	Very high	83.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.185	C	C	.	.			trans	-80	64.1	172.9	-56	-177.4	0	0	0	109.6	F359 Y360 L362 L365 L368 I382 K383 H387 I388 L408	F359-L385 HydrophobicContact CE1-CD1 4.43Å; Y360-L385 WeakPolarHBondContact O-CD2 3.14Å; L362-L385 HydrophobicContact CB-CD2 4.04Å; L362-L385 WeakPolarHBondContact O-CD2 3.25Å; L365-L385 HydrophobicContact CD2-CD1 4.31Å; L368-L385 HydrophobicContact CD2-CD1 4.14Å; I382-L385 HydrophobicContact CD1-CD1 3.48Å; I382-L385 VanDerWaalsContact CD1-CD1 3.48Å; I382-L385 HydrophobicContact CD1-CG 4.36Å; I382-L385 HydrophobicContact CG1-CD1 4.33Å; I382-L385 WeakPolarHBondContact O-CB 3.16Å; I382-L385 PolarHBondContact O-N 3.02Å; K383-L385 VanDerWaalsContact C-N 3.25Å; K383-L385 PolarHBondContact O-N 3.32Å; L385-H387 PolarHBondContact O-N 3.42Å; L385-H387 VanDerWaalsContact O-N 3.16Å; L385-I388 HydrophobicContact CB-CB 4.19Å; L385-I388 HydrophobicContact CB-CG2 4.26Å; L385-I388 HydrophobicContact CD1-CD1 4.13Å; L385-I388 WeakPolarHBondContact O-CB 3.15Å; L385-I388 WeakPolarHBondContact O-CG2 3.48Å; L385-I388 PolarHBondContact O-N 2.83Å; L385-I388 VanDerWaalsContact O-N 3.12Å; L385-L408 WeakPolarHBondContact O-CD2 3.38Å
386	E	84.9	Confident	83.6	Confident	98 Å²	98	38.4 Å²	38.4	46%	0.458	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.5	-166	-56	-167.6	126.1	0	0	114.5	N384 K411	N384-E386 PolarHBondContact O-N 3.41Å; E386-K411 IonicContact OE1-NZ 2.75Å; E386-K411 PolarHBondContact OE1-NZ 2.82Å
387	H	91.1	Very high	83.8	Confident	110 Å²	110	39.8 Å²	39.8	51%	0.509	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	4.3	-179.6	-65.7	-56.2	0	0	0	113.7	K363 L365 E366 L385 K389	K363-H387 PolarHBondContact O-CD2 2.95Å; L365-H387 CarbonylContact O-C 3.45Å; L365-H387 VanDerWaalsContact O-C 3.26Å; E366-H387 WeakPolarHBondContact CA-O 3.29Å; L385-H387 PolarHBondContact O-N 3.42Å; L385-H387 VanDerWaalsContact O-N 3.16Å; H387-K389 PolarHBondContact O-N 3.32Å
388	I	92.9	Very high	84	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.179	C	C	.	.			trans	-70	123.7	-176.4	-160.4	168.6	0	0	0	111.5	L365 L368 L385 L391 L408 A412 L413	L365-I388 VanDerWaalsContact O-CA 3.27Å; L365-I388 WeakPolarHBondContact O-CA 3.38Å; L365-I388 PolarHBondContact O-N 3.11Å; L365-I388 VanDerWaalsContact O-N 3.14Å; L368-I388 HydrophobicContact CB-CD1 3.8Å; L368-I388 HydrophobicContact CD2-CD1 4.28Å; L385-I388 HydrophobicContact CB-CB 4.19Å; L385-I388 HydrophobicContact CB-CG2 4.26Å; L385-I388 HydrophobicContact CD1-CD1 4.13Å; L385-I388 WeakPolarHBondContact O-CB 3.15Å; L385-I388 WeakPolarHBondContact O-CG2 3.48Å; L385-I388 PolarHBondContact O-N 2.83Å; L385-I388 VanDerWaalsContact O-N 3.12Å; I388-L391 HydrophobicContact CD1-CB 4.03Å; I388-L391 HydrophobicContact CD1-CD1 4.01Å; I388-L391 HydrophobicContact CD1-CD2 4.36Å; I388-L391 HydrophobicContact CD1-CG 4.35Å; I388-L408 HydrophobicContact CG2-CB 4.44Å; I388-L408 HydrophobicContact CG2-CD1 3.65Å; I388-L408 HydrophobicContact CG2-CD2 3.84Å; I388-L408 HydrophobicContact CG2-CG 4.18Å; I388-A412 CarbonylContact O-C 3.32Å; I388-L413 HydrophobicContact CG1-CD1 4.47Å; I388-L413 HydrophobicContact CG2-CD1 4.07Å; I388-L413 WeakPolarHBondContact O-CA 3.14Å; I388-L413 PolarHBondContact O-N 2.92Å
389	K	91.8	Very high	83.4	Confident	79 Å²	79	38.4 Å²	38.4	34%	0.343	19%	0.19	S	C	.	.			trans	-106.5	-40.9	178.8	-65.6	178.6	169.8	-158.8	0	111.9	E366 H387 E414 S415	E366-K389 PolarHBondContact O-N 3.15Å; H387-K389 PolarHBondContact O-N 3.32Å; K389-E414 HydrophobicContact CB-CB 4.47Å; K389-E414 HydrophobicContact CB-CG 4.26Å; K389-E414 WeakPolarHBondContact CD-OE1 3.24Å; K389-E414 WeakPolarHBondContact CE-OE1 3.47Å; K389-E414 HydrophobicContact CG-CG 4.47Å; K389-E414 IonicContact NZ-OE1 2.65Å; K389-E414 PolarHBondContact NZ-OE1 2.96Å; K389-E414 WeakPolarHBondContact O-CA 3.33Å; K389-E414 PolarHBondContact O-N 3.13Å; K389-S415 PolarHBondContact O-N 3.31Å
390	V	92.2	Very high	82.7	Confident	30 Å²	30	38.6 Å²	38.6	18%	0.182	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	117.3	-177.8	-177.3	0	0	0	0	109.4	E366 Q367 L368 K392	E366-V390 PolarHBondContact O-N 3.26Å; Q367-V390 WeakPolarHBondContact CA-O 3.33Å; Q367-V390 HydrophobicContact CB-CB 4.39Å; Q367-V390 HydrophobicContact CG-CB 4.11Å; Q367-V390 HydrophobicContact CG-CG2 4.27Å; L368-V390 PolarHBondContact N-O 3.21Å; V390-K392 HydrophobicContact CG1-CG 4.29Å
391	L	93.3	Very high	82.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	112.4	176.8	179.5	55.6	0	0	0	110.6	L368 I388 L393 L405 L413 S415 L416 N417	L368-L391 HydrophobicContact CB-CD1 3.99Å; L368-L391 HydrophobicContact CD2-CD1 3.9Å; L368-L391 HydrophobicContact CG-CD1 3.97Å; L368-L391 WeakPolarHBondContact O-CA 3.43Å; I388-L391 HydrophobicContact CD1-CB 4.03Å; I388-L391 HydrophobicContact CD1-CD1 4.01Å; I388-L391 HydrophobicContact CD1-CD2 4.36Å; I388-L391 HydrophobicContact CD1-CG 4.35Å; L391-L393 HydrophobicContact CD1-CD1 4.29Å; L391-L393 HydrophobicContact CD1-CD2 4.28Å; L391-L393 HydrophobicContact CD1-CG 3.98Å; L391-L393 HydrophobicContact CD2-CD1 3.9Å; L391-L393 HydrophobicContact CD2-CG 4.46Å; L391-L393 HydrophobicContact CG-CD1 3.93Å; L391-L393 HydrophobicContact CG-CG 3.98Å; L391-L405 HydrophobicContact CD2-CD1 3.48Å; L391-L405 VanDerWaalsContact CD2-CD1 3.48Å; L391-L413 HydrophobicContact CB-CD1 3.83Å; L391-S415 PolarHBondContact N-O 3.07Å; L391-L416 HydrophobicContact CB-CD1 4.08Å; L391-L416 HydrophobicContact CD2-CD1 4.05Å; L391-L416 HydrophobicContact CG-CD1 4.02Å; L391-L416 WeakPolarHBondContact O-CA 3.45Å; L391-N417 PolarHBondContact O-N 3.12Å
392	K	91.8	Very high	82.2	Confident	79 Å²	79	34.4 Å²	34.4	34%	0.343	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	115.1	176.4	-58.9	-178.9	-179.2	-179.5	0	110	L368 D369 L370 S371 V390 N417	L368-K392 PolarHBondContact O-N 3.43Å; D369-K392 HydrophobicContact CB-CB 4.34Å; D369-K392 HydrophobicContact CB-CD 4.47Å; L370-K392 CarbonylContact C-O 3.2Å; L370-K392 WeakPolarHBondContact CA-O 3.33Å; L370-K392 PolarHBondContact N-O 3.33Å; S371-K392 PolarHBondContact N-O 3.08Å; V390-K392 HydrophobicContact CG1-CG 4.29Å; K392-N417 HydrophobicContact CG-CB 4.35Å
393	L	89.2	Confident	81.2	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.			trans	-121.2	10.4	-179.9	-71.3	168.1	0	0	0	111.8	L370 L375 L378 L391 N396 L398 L405 L416 N417 L418 N421	L370-L393 HydrophobicContact CB-CD2 3.96Å; L370-L393 HydrophobicContact CD1-CD2 3.98Å; L375-L393 HydrophobicContact CD1-CD2 4.2Å; L378-L393 HydrophobicContact CD2-CD1 4.07Å; L391-L393 HydrophobicContact CD1-CD1 4.29Å; L391-L393 HydrophobicContact CD1-CD2 4.28Å; L391-L393 HydrophobicContact CD1-CG 3.98Å; L391-L393 HydrophobicContact CD2-CD1 3.9Å; L391-L393 HydrophobicContact CD2-CG 4.46Å; L391-L393 HydrophobicContact CG-CD1 3.93Å; L391-L393 HydrophobicContact CG-CG 3.98Å; L393-N396 PolarHBondContact O-ND2 3.44Å; L393-L398 HydrophobicContact CB-CD1 3.98Å; L393-L398 HydrophobicContact CD1-CD1 4.12Å; L393-L398 HydrophobicContact CD2-CD1 4.34Å; L393-L398 HydrophobicContact CG-CD1 4.39Å; L393-L405 HydrophobicContact CD1-CD2 4.25Å; L393-L416 HydrophobicContact CD1-CD1 4.46Å; L393-N417 CarbonylContact C-O 3.51Å; L393-N417 WeakPolarHBondContact CA-O 3.5Å; L393-N417 PolarHBondContact N-O 3.4Å; L393-L418 HydrophobicContact CB-CD2 3.97Å; L393-L418 HydrophobicContact CD1-CD2 3.9Å; L393-N421 PolarHBondContact O-ND2 3.34Å
394	N	85.8	Confident	80.7	Confident	17 Å²	17	33.2 Å²	33.2	9%	0.091	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	147	-174.3	58	-68.1	0	0	0	113.4	S371 Y372 N417 N419	S371-N394 CarbonylContact C-O 3.6Å; S371-N394 WeakPolarHBondContact CA-O 3.31Å; S371-N394 VanDerWaalsContact CB-O 3.29Å; S371-N394 WeakPolarHBondContact CB-O 3.42Å; S371-N394 WeakPolarHBondContact CB-OD1 3.49Å; Y372-N394 VanDerWaalsContact CE2-ND2 3.27Å; Y372-N394 WeakPolarHBondContact CE2-ND2 3.3Å; Y372-N394 PolarHBondContact N-O 2.9Å; N394-N417 WeakPolarHBondContact CB-OD1 3.25Å; N394-N417 PolarHBondContact N-O 2.87Å; N394-N419 CarbonylContact C-O 3.41Å; N394-N419 WeakPolarHBondContact CA-O 3.39Å; N394-N419 HydrophobicContact CB-CB 4.01Å; N394-N419 VanDerWaalsContact CB-O 3.25Å; N394-N419 WeakPolarHBondContact CB-O 3.43Å
395	G	81.8	Confident	80.2	Confident	15 Å²	15	30.8 Å²	30.8	16%	0.155	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	26.9	177.5	0	0	0	0	0	114	Y372 N419 D420	Y372-G395 VanDerWaalsContact CA-O 3.27Å; Y372-G395 WeakPolarHBondContact CA-O 3.22Å; G395-N419 PolarHBondContact N-O 3.32Å; G395-D420 WeakPolarHBondContact CA-O 3.26Å
396	N	83.6	Confident	79.1	Confident	3 Å²	3	31.6 Å²	31.6	2%	0.016	17%	0.168	C	C	.	.	S	Bend	trans	-102.1	-177.1	171.1	-78.3	-74.9	0	0	0	110.6	L370 N373 C374 L375 L393 L398 N421	L370-N396 PolarHBondContact O-ND2 2.98Å; N373-N396 VanDerWaalsContact CA-OD1 3.27Å; N373-N396 WeakPolarHBondContact CA-OD1 3.43Å; N373-N396 WeakPolarHBondContact CB-OD1 3.42Å; N373-N396 PolarHBondContact N-OD1 3.22Å; C374-N396 PolarHBondContact N-OD1 3.42Å; L375-N396 HydrophobicContact CB-CB 4.13Å; L375-N396 WeakPolarHBondContact CB-OD1 3.29Å; L375-N396 PolarHBondContact N-OD1 2.84Å; L375-N396 VanDerWaalsContact N-OD1 3.08Å; L393-N396 PolarHBondContact O-ND2 3.44Å; N396-L398 HydrophobicContact CB-CG 4.06Å; N396-N421 WeakPolarHBondContact CA-OD1 3.37Å; N396-N421 WeakPolarHBondContact CB-OD1 3.34Å; N396-N421 PolarHBondContact N-OD1 3.05Å; N396-N421 PolarHBondContact O-OD1 3.49Å; N396-N421 VanDerWaalsContact O-OD1 3.05Å
397	D	76.4	Confident	78.4	Confident	85 Å²	85	28 Å²	28	46%	0.455	15%	0.153	S	C	.	.			trans	-103.5	29.7	177.7	-66.1	-49	0	0	0	111.2	L375 T376 T399	L375-D397 CarbonylContact O-C 3.14Å; L375-D397 WeakPolarHBondContact O-CA 3.24Å; L375-D397 PolarHBondContact O-N 3.14Å; T376-D397 WeakPolarHBondContact CA-O 3.34Å; T376-D397 HydrophobicContact CG2-CB 4.03Å; D397-T399 PolarHBondContact O-N 2.87Å
398	L	72.8	Confident	77.7	Confident	4 Å²	4	22.9 Å²	22.9	2%	0.021	13%	0.129	C	C	.	.			trans	-67.8	124.2	-177.1	-60.8	173.5	0	0	0	110.3	L375 L378 L393 N396 L418 N421 P422 L423	L375-L398 HydrophobicContact CB-CD2 4.01Å; L375-L398 PolarHBondContact O-N 3.02Å; L378-L398 HydrophobicContact CB-CD2 4.48Å; L393-L398 HydrophobicContact CB-CD1 3.98Å; L393-L398 HydrophobicContact CD1-CD1 4.12Å; L393-L398 HydrophobicContact CD2-CD1 4.34Å; L393-L398 HydrophobicContact CG-CD1 4.39Å; N396-L398 HydrophobicContact CB-CG 4.06Å; L398-L418 HydrophobicContact CD1-CD2 4.36Å; L398-N421 HydrophobicContact CB-CB 4.24Å; L398-N421 VanDerWaalsContact CB-OD1 3.26Å; L398-N421 WeakPolarHBondContact CB-OD1 3.44Å; L398-N421 WeakPolarHBondContact CG-OD1 3.09Å; L398-N421 PolarHBondContact N-OD1 3.15Å; L398-N421 VanDerWaalsContact N-OD1 3.1Å; L398-P422 CarbonylContact O-C 3.26Å; L398-P422 VanDerWaalsContact O-C 3.26Å; L398-P422 WeakPolarHBondContact O-CD 3.42Å; L398-L423 HydrophobicContact CB-CD2 4.09Å; L398-L423 WeakPolarHBondContact O-CD2 2.78Å; L398-L423 PolarHBondContact O-N 2.98Å
399	T	62.9	Low	76.7	Confident	40 Å²	40	23 Å²	23	25%	0.245	13%	0.13	C	C	.	.			trans	-97.3	-11.9	179.8	48.4	0	0	0	0	113.5	D397 P422 L424 C544	D397-T399 PolarHBondContact O-N 2.87Å; T399-P422 WeakPolarHBondContact CA-O 3.47Å; T399-P422 HydrophobicContact CG2-CG 4.44Å; T399-L424 WeakPolarHBondContact O-CB 3.29Å; T399-L424 WeakPolarHBondContact O-CG 3.27Å; T399-L424 PolarHBondContact O-N 3.3Å; T399-C544 PolarHBondContact OG1-SG 3.17Å
400	G	61.5	Low	75.5	Confident	22 Å²	22	24.1 Å²	24.1	23%	0.227	14%	0.137	C	C	.	.	S	Bend	trans	-164.5	170.3	-179.5	0	0	0	0	0	112.6
401	I	70.4	Confident	74.6	Confident	25 Å²	25	28 Å²	28	13%	0.128	15%	0.151	C	C	.	.			trans	-106.2	130.7	-177.4	-69.8	-175.5	0	0	0	110.6	L405 L406 L418 L423 F427 F431	I401-L405 HydrophobicContact CG2-CB 4.09Å; I401-L405 HydrophobicContact CG2-CD2 4.06Å; I401-L405 HydrophobicContact CG2-CG 4.28Å; I401-L406 HydrophobicContact CG2-CD2 3.9Å; I401-L406 HydrophobicContact CG2-CG 4.35Å; I401-L418 HydrophobicContact CD1-CD1 3.6Å; I401-L418 HydrophobicContact CG1-CD1 4.39Å; I401-L423 HydrophobicContact CG1-CD2 4.25Å; I401-F427 HydrophobicContact CD1-CD1 3.82Å; I401-F427 HydrophobicContact CD1-CE1 3.28Å; I401-F427 HydrophobicContact CD1-CZ 4.23Å; I401-F427 HydrophobicContact CG1-CE1 4.29Å; I401-F431 HydrophobicContact CD1-CE2 4.09Å; I401-F431 HydrophobicContact CG2-CE2 4.46Å
402	P	68.6	Low	73.8	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.006	17%	0.169	C	C	.	.			trans	-65.6	145.6	174.3	-17.8	29	0	0	0	113.2	L378 G404 L405 L406 W512	L378-P402 HydrophobicContact CB-CG 3.69Å; L378-P402 HydrophobicContact CD2-CG 4.17Å; L378-P402 HydrophobicContact CG-CG 4.19Å; L378-P402 VanDerWaalsContact O-CG 3.26Å; L378-P402 WeakPolarHBondContact O-CG 3.35Å; P402-G404 PolarHBondContact O-N 2.86Å; P402-L405 HydrophobicContact CB-CB 4.16Å; P402-L405 HydrophobicContact CG-CB 4.09Å; P402-L405 WeakPolarHBondContact O-CB 3.26Å; P402-L405 PolarHBondContact O-N 3.2Å; P402-L406 PolarHBondContact O-N 2.9Å; P402-W512 HydrophobicContact CB-CE3 4.4Å; P402-W512 HydrophobicContact CB-CH2 3.94Å; P402-W512 HydrophobicContact CB-CZ3 3.38Å; P402-W512 HydrophobicContact CG-CH2 3.85Å; P402-W512 HydrophobicContact CG-CZ3 3.62Å
403	P	61.1	Low	73.4	Confident	37 Å²	37	26.7 Å²	26.7	24%	0.24	15%	0.154	C	C	.	.	H	α-helix	trans	-54.4	-37.4	165.4	-23.4	32.7	0	0	0	112.3	L405 L406 C407 F532	P403-L405 VanDerWaalsContact C-N 3.28Å; P403-L405 PolarHBondContact O-N 3.29Å; P403-L406 VanDerWaalsContact O-CB 3.24Å; P403-L406 WeakPolarHBondContact O-CB 3.06Å; P403-L406 PolarHBondContact O-N 2.74Å; P403-L406 VanDerWaalsContact O-N 3.07Å; P403-C407 PolarHBondContact O-N 3.28Å; P403-C407 VanDerWaalsContact O-N 3.12Å; P403-F532 HydrophobicContact CB-CE2 3.51Å; P403-F532 HydrophobicContact CB-CZ 3.85Å
404	G	67.1	Low	73.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.4	-25.8	176.3	0	0	0	0	0	115.2	S380 K383 P402 L408	S380-G404 WeakPolarHBondContact O-CA 3.41Å; K383-G404 WeakPolarHBondContact CB-O 3.42Å; P402-G404 PolarHBondContact O-N 2.86Å; G404-L408 PolarHBondContact O-N 3.49Å
405	L	74	Confident	73.2	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-73.6	-33.1	172.9	-178.1	56.2	0	0	0	110.3	L378 I382 L391 L393 I401 P402 P403 C407 L408 C409 L416	L378-L405 HydrophobicContact CD2-CD2 4.45Å; I382-L405 HydrophobicContact CG2-CB 4.01Å; L391-L405 HydrophobicContact CD2-CD1 3.48Å; L391-L405 VanDerWaalsContact CD2-CD1 3.48Å; L393-L405 HydrophobicContact CD1-CD2 4.25Å; I401-L405 HydrophobicContact CG2-CB 4.09Å; I401-L405 HydrophobicContact CG2-CD2 4.06Å; I401-L405 HydrophobicContact CG2-CG 4.28Å; P402-L405 HydrophobicContact CB-CB 4.16Å; P402-L405 HydrophobicContact CG-CB 4.09Å; P402-L405 WeakPolarHBondContact O-CB 3.26Å; P402-L405 PolarHBondContact O-N 3.2Å; P403-L405 VanDerWaalsContact C-N 3.28Å; P403-L405 PolarHBondContact O-N 3.29Å; L405-C407 VanDerWaalsContact C-N 3.34Å; L405-L408 HydrophobicContact CD1-CD1 4.12Å; L405-L408 WeakPolarHBondContact O-CB 3.27Å; L405-L408 PolarHBondContact O-N 3Å; L405-C409 PolarHBondContact O-N 3.15Å; L405-C409 VanDerWaalsContact O-N 3.13Å; L405-C409 PolarHBondContact O-SG 3.44Å; L405-L416 HydrophobicContact CD1-CD1 4.39Å; L405-L416 HydrophobicContact CD2-CD1 4.47Å; L405-L416 HydrophobicContact CD2-CD2 4.48Å
406	L	67.8	Low	73.4	Confident	17 Å²	17	30.7 Å²	30.7	9%	0.089	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-41.2	172.3	-48.6	167.2	0	0	0	111.3	I401 P402 P403 L408 C409 E410 P428 F431	I401-L406 HydrophobicContact CG2-CD2 3.9Å; I401-L406 HydrophobicContact CG2-CG 4.35Å; P402-L406 PolarHBondContact O-N 2.9Å; P403-L406 VanDerWaalsContact O-CB 3.24Å; P403-L406 WeakPolarHBondContact O-CB 3.06Å; P403-L406 PolarHBondContact O-N 2.74Å; P403-L406 VanDerWaalsContact O-N 3.07Å; L406-L408 PolarHBondContact O-N 3.07Å; L406-C409 WeakPolarHBondContact O-CA 3.27Å; L406-C409 VanDerWaalsContact O-CB 3.26Å; L406-C409 WeakPolarHBondContact O-CB 3.25Å; L406-C409 PolarHBondContact O-N 3.09Å; L406-E410 PolarHBondContact O-N 3.37Å; L406-P428 HydrophobicContact CD1-CB 3.88Å; L406-P428 HydrophobicContact CD1-CG 3.5Å; L406-P428 VanDerWaalsContact CD1-CG 3.5Å; L406-P428 HydrophobicContact CD2-CB 4.34Å; L406-P428 HydrophobicContact CD2-CG 3.91Å; L406-P428 HydrophobicContact CG-CG 4.32Å; L406-F431 HydrophobicContact CD2-CD2 3.52Å; L406-F431 HydrophobicContact CD2-CE2 3.51Å
407	C	69.5	Low	73.4	Confident	21 Å²	21	31.4 Å²	31.4	14%	0.142	17%	0.173	C	C	.	.	H	α-helix	trans	-59.8	-33	175	-62.3	0	0	0	0	112.5	K383 P403 L405 K411 F532	K383-C407 HydrophobicContact CB-CB 4.09Å; P403-C407 PolarHBondContact O-N 3.28Å; P403-C407 VanDerWaalsContact O-N 3.12Å; L405-C407 VanDerWaalsContact C-N 3.34Å; C407-K411 WeakPolarHBondContact O-CG 3.21Å; C407-F532 VanDerWaalsContact SG-CE1 3.51Å; C407-F532 WeakPolarHBondContact SG-CZ 3.36Å
408	L	77.8	Confident	73.6	Confident	3 Å²	3	27.4 Å²	27.4	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-70.9	-38.2	175	-67.9	177.9	0	0	0	111.6	I382 L385 I388 G404 L405 L406 E410 K411 L413	I382-L408 HydrophobicContact CB-CD1 4.42Å; I382-L408 HydrophobicContact CG1-CD1 3.72Å; I382-L408 HydrophobicContact CG2-CD1 4.26Å; I382-L408 WeakPolarHBondContact O-CD1 3.43Å; L385-L408 WeakPolarHBondContact O-CD2 3.38Å; I388-L408 HydrophobicContact CG2-CB 4.44Å; I388-L408 HydrophobicContact CG2-CD1 3.65Å; I388-L408 HydrophobicContact CG2-CD2 3.84Å; I388-L408 HydrophobicContact CG2-CG 4.18Å; G404-L408 PolarHBondContact O-N 3.49Å; L405-L408 HydrophobicContact CD1-CD1 4.12Å; L405-L408 WeakPolarHBondContact O-CB 3.27Å; L405-L408 PolarHBondContact O-N 3Å; L406-L408 PolarHBondContact O-N 3.07Å; L408-E410 VanDerWaalsContact C-N 3.28Å; L408-E410 PolarHBondContact O-N 3.12Å; L408-K411 PolarHBondContact O-N 3.33Å; L408-L413 VanDerWaalsContact O-CB 3.31Å; L408-L413 WeakPolarHBondContact O-CB 3.45Å; L408-L413 PolarHBondContact O-N 3.26Å
409	C	70.6	Confident	73.7	Confident	4 Å²	4	29.6 Å²	29.6	3%	0.027	16%	0.164	C	C	.	.	H	α-helix	trans	-59.4	-39.4	175.5	-66.5	0	0	0	0	111.8	L405 L406 K411 F431 N434 I437	L405-C409 PolarHBondContact O-N 3.15Å; L405-C409 VanDerWaalsContact O-N 3.13Å; L405-C409 PolarHBondContact O-SG 3.44Å; L406-C409 WeakPolarHBondContact O-CA 3.27Å; L406-C409 VanDerWaalsContact O-CB 3.26Å; L406-C409 WeakPolarHBondContact O-CB 3.25Å; L406-C409 PolarHBondContact O-N 3.09Å; C409-K411 PolarHBondContact O-N 2.94Å; C409-F431 VanDerWaalsContact SG-CZ 3.52Å; C409-N434 VanDerWaalsContact C-ND2 3.32Å; C409-N434 WeakPolarHBondContact CB-ND2 3Å; C409-I437 HydrophobicContact CB-CD1 3.21Å; C409-I437 VanDerWaalsContact O-CD1 3.24Å; C409-I437 WeakPolarHBondContact O-CD1 3.39Å
410	E	67.6	Low	74.2	Confident	103 Å²	103	32.8 Å²	32.8	48%	0.481	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-10.8	176.2	-67.7	176.2	173.2	0	0	114	L406 L408	L406-E410 PolarHBondContact O-N 3.37Å; L408-E410 VanDerWaalsContact C-N 3.28Å; L408-E410 PolarHBondContact O-N 3.12Å
411	K	74.2	Confident	74.6	Confident	112 Å²	112	32.4 Å²	32.4	49%	0.487	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-115.4	-177.8	-71.3	-179.6	175.2	-171.1	0	111.4	E386 C407 L408 C409	E386-K411 IonicContact OE1-NZ 2.75Å; E386-K411 PolarHBondContact OE1-NZ 2.82Å; C407-K411 WeakPolarHBondContact O-CG 3.21Å; L408-K411 PolarHBondContact O-N 3.33Å; C409-K411 PolarHBondContact O-N 2.94Å
412	A	76.2	Confident	74.3	Confident	45 Å²	45	34.7 Å²	34.7	37%	0.372	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	7.5	-167.3	0	0	0	0	0	113.3	I388 E414	I388-A412 CarbonylContact O-C 3.32Å; A412-E414 PolarHBondContact O-N 3.42Å
413	L	82.5	Confident	74.1	Confident	6 Å²	6	35.7 Å²	35.7	3%	0.031	19%	0.194	C	C	.	.			trans	-70.4	113.7	-179.4	-169.4	72.5	0	0	0	109.5	I388 L391 L408 L416 I437	I388-L413 HydrophobicContact CG1-CD1 4.47Å; I388-L413 HydrophobicContact CG2-CD1 4.07Å; I388-L413 WeakPolarHBondContact O-CA 3.14Å; I388-L413 PolarHBondContact O-N 2.92Å; L391-L413 HydrophobicContact CB-CD1 3.83Å; L408-L413 VanDerWaalsContact O-CB 3.31Å; L408-L413 WeakPolarHBondContact O-CB 3.45Å; L408-L413 PolarHBondContact O-N 3.26Å; L413-L416 HydrophobicContact CD2-CB 3.91Å; L413-L416 HydrophobicContact CD2-CD1 4.36Å; L413-L416 HydrophobicContact CD2-CD2 4.2Å; L413-L416 HydrophobicContact CD2-CG 4.38Å; L413-I437 HydrophobicContact CD2-CG2 4.49Å; L413-I437 HydrophobicContact CG-CG2 4.5Å; L413-I437 WeakPolarHBondContact O-CG1 3.26Å
414	E	86.7	Confident	73.6	Confident	102 Å²	102	38.1 Å²	38.1	48%	0.477	20%	0.204	S	C	.	.			trans	-90.3	-34	-179.4	-65.3	168.5	-168.9	0	0	111.2	K389 A412 E438	K389-E414 HydrophobicContact CB-CB 4.47Å; K389-E414 HydrophobicContact CB-CG 4.26Å; K389-E414 WeakPolarHBondContact CD-OE1 3.24Å; K389-E414 WeakPolarHBondContact CE-OE1 3.47Å; K389-E414 HydrophobicContact CG-CG 4.47Å; K389-E414 IonicContact NZ-OE1 2.65Å; K389-E414 PolarHBondContact NZ-OE1 2.96Å; K389-E414 WeakPolarHBondContact O-CA 3.33Å; K389-E414 PolarHBondContact O-N 3.13Å; A412-E414 PolarHBondContact O-N 3.42Å; E414-E438 PolarHBondContact O-N 2.73Å
415	S	85.3	Confident	72.7	Confident	13 Å²	13	42.9 Å²	42.9	9%	0.091	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	128.3	-175.7	-177.1	0	0	0	0	112	K389 L391	K389-S415 PolarHBondContact O-N 3.31Å; L391-S415 PolarHBondContact N-O 3.07Å
416	L	85.4	Confident	71.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	115.9	177.5	179.8	58.9	0	0	0	110.6	L391 L393 L405 L413 L418 F431 I437 E438 I439 Q440	L391-L416 HydrophobicContact CB-CD1 4.08Å; L391-L416 HydrophobicContact CD2-CD1 4.05Å; L391-L416 HydrophobicContact CG-CD1 4.02Å; L391-L416 WeakPolarHBondContact O-CA 3.45Å; L393-L416 HydrophobicContact CD1-CD1 4.46Å; L405-L416 HydrophobicContact CD1-CD1 4.39Å; L405-L416 HydrophobicContact CD2-CD1 4.47Å; L405-L416 HydrophobicContact CD2-CD2 4.48Å; L413-L416 HydrophobicContact CD2-CB 3.91Å; L413-L416 HydrophobicContact CD2-CD1 4.36Å; L413-L416 HydrophobicContact CD2-CD2 4.2Å; L413-L416 HydrophobicContact CD2-CG 4.38Å; L416-L418 HydrophobicContact CD1-CD1 4.41Å; L416-L418 HydrophobicContact CD1-CD2 4.4Å; L416-L418 HydrophobicContact CD1-CG 4.08Å; L416-L418 HydrophobicContact CD2-CD1 3.75Å; L416-L418 HydrophobicContact CD2-CG 4.28Å; L416-L418 HydrophobicContact CG-CD1 3.96Å; L416-L418 HydrophobicContact CG-CG 3.96Å; L416-F431 HydrophobicContact CD2-CE1 4.17Å; L416-F431 HydrophobicContact CD2-CZ 3.67Å; L416-I437 HydrophobicContact CB-CG2 4.11Å; L416-E438 PolarHBondContact N-O 3.48Å; L416-I439 WeakPolarHBondContact O-CA 3.16Å; L416-Q440 PolarHBondContact O-N 2.93Å
417	N	83.1	Confident	70.6	Confident	18 Å²	18	47.4 Å²	47.4	10%	0.096	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	114.4	175.9	-163.3	-30.2	0	0	0	111.4	L391 K392 L393 N394 N419 Q440	L391-N417 PolarHBondContact O-N 3.12Å; K392-N417 HydrophobicContact CG-CB 4.35Å; L393-N417 CarbonylContact C-O 3.51Å; L393-N417 WeakPolarHBondContact CA-O 3.5Å; L393-N417 PolarHBondContact N-O 3.4Å; N394-N417 WeakPolarHBondContact CB-OD1 3.25Å; N394-N417 PolarHBondContact N-O 2.87Å; N417-N419 WeakPolarHBondContact OD1-CB 3.22Å; N417-N419 PolarHBondContact OD1-N 3.07Å; N417-N419 VanDerWaalsContact OD1-N 3.09Å; N417-Q440 HydrophobicContact CB-CB 4.1Å; N417-Q440 PolarHBondContact ND2-OE1 3.41Å; N417-Q440 PolarHBondContact OD1-O 3.2Å
418	L	79.7	Confident	69.7	Low	1 Å²	1	47.5 Å²	47.5	1%	0.005	26%	0.26	C	S	.	.			trans	-118	10.9	-178.6	-73	168.6	0	0	0	113.1	L393 L398 I401 L416 N421 L423 V444	L393-L418 HydrophobicContact CB-CD2 3.97Å; L393-L418 HydrophobicContact CD1-CD2 3.9Å; L398-L418 HydrophobicContact CD1-CD2 4.36Å; I401-L418 HydrophobicContact CD1-CD1 3.6Å; I401-L418 HydrophobicContact CG1-CD1 4.39Å; L416-L418 HydrophobicContact CD1-CD1 4.41Å; L416-L418 HydrophobicContact CD1-CD2 4.4Å; L416-L418 HydrophobicContact CD1-CG 4.08Å; L416-L418 HydrophobicContact CD2-CD1 3.75Å; L416-L418 HydrophobicContact CD2-CG 4.28Å; L416-L418 HydrophobicContact CG-CD1 3.96Å; L416-L418 HydrophobicContact CG-CG 3.96Å; L418-N421 WeakPolarHBondContact O-CB 3.38Å; L418-N421 PolarHBondContact O-ND2 3.37Å; L418-L423 HydrophobicContact CB-CD1 4.06Å; L418-L423 HydrophobicContact CD1-CD1 4.33Å; L418-V444 HydrophobicContact CB-CG2 3.97Å; L418-V444 HydrophobicContact CD1-CG2 3.87Å
419	N	75.8	Confident	68.4	Low	51 Å²	51	53.2 Å²	53.2	27%	0.273	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	160.1	179.8	-82.5	-23.9	0	0	0	113.6	N394 G395 N417 N421 Q440 S441	N394-N419 CarbonylContact C-O 3.41Å; N394-N419 WeakPolarHBondContact CA-O 3.39Å; N394-N419 HydrophobicContact CB-CB 4.01Å; N394-N419 VanDerWaalsContact CB-O 3.25Å; N394-N419 WeakPolarHBondContact CB-O 3.43Å; G395-N419 PolarHBondContact N-O 3.32Å; N417-N419 WeakPolarHBondContact OD1-CB 3.22Å; N417-N419 PolarHBondContact OD1-N 3.07Å; N417-N419 VanDerWaalsContact OD1-N 3.09Å; N419-N421 PolarHBondContact O-N 2.97Å; N419-N421 VanDerWaalsContact O-N 3.09Å; N419-N421 PolarHBondContact O-ND2 3.14Å; N419-Q440 PolarHBondContact ND2-O 2.97Å; N419-Q440 PolarHBondContact OD1-O 3.47Å; N419-Q440 VanDerWaalsContact OD1-O 3.13Å; N419-S441 WeakPolarHBondContact OD1-CA 3.35Å; N419-S441 PolarHBondContact OD1-OG 3.15Å
420	D	73.8	Confident	67.5	Low	106 Å²	106	55.8 Å²	55.8	57%	0.567	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	32.2	176.2	-54.1	-33.3	0	0	0	113.4	Y372 G395	Y372-D420 PolarHBondContact OH-OD2 2.84Å; G395-D420 WeakPolarHBondContact CA-O 3.26Å
421	N	68.4	Low	66.9	Low	14 Å²	14	51.1 Å²	51.1	8%	0.075	27%	0.274	C	S	.	.			trans	-115	142.1	170.9	-76.8	-84.3	0	0	0	110.6	L393 N396 L398 L418 N419 L423	L393-N421 PolarHBondContact O-ND2 3.34Å; N396-N421 WeakPolarHBondContact CA-OD1 3.37Å; N396-N421 WeakPolarHBondContact CB-OD1 3.34Å; N396-N421 PolarHBondContact N-OD1 3.05Å; N396-N421 PolarHBondContact O-OD1 3.49Å; N396-N421 VanDerWaalsContact O-OD1 3.05Å; L398-N421 HydrophobicContact CB-CB 4.24Å; L398-N421 VanDerWaalsContact CB-OD1 3.26Å; L398-N421 WeakPolarHBondContact CB-OD1 3.44Å; L398-N421 WeakPolarHBondContact CG-OD1 3.09Å; L398-N421 PolarHBondContact N-OD1 3.15Å; L398-N421 VanDerWaalsContact N-OD1 3.1Å; L418-N421 WeakPolarHBondContact O-CB 3.38Å; L418-N421 PolarHBondContact O-ND2 3.37Å; N419-N421 PolarHBondContact O-N 2.97Å; N419-N421 VanDerWaalsContact O-N 3.09Å; N419-N421 PolarHBondContact O-ND2 3.14Å; N421-L423 HydrophobicContact CB-CD1 4.45Å; N421-L423 HydrophobicContact CB-CD2 4.43Å; N421-L423 HydrophobicContact CB-CG 3.92Å; N421-L423 PolarHBondContact O-N 2.91Å
422	P	64.9	Low	65.8	Low	73 Å²	73	51.5 Å²	51.5	47%	0.474	28%	0.276	S	S	.	.			trans	-78.5	52	176	35.7	-37.5	0	0	0	112.3	L398 T399 L424	L398-P422 CarbonylContact O-C 3.26Å; L398-P422 VanDerWaalsContact O-C 3.26Å; L398-P422 WeakPolarHBondContact O-CD 3.42Å; T399-P422 WeakPolarHBondContact CA-O 3.47Å; T399-P422 HydrophobicContact CG2-CG 4.44Å; P422-L424 PolarHBondContact O-N 3.19Å
423	L	64.2	Low	64.6	Low	23 Å²	23	55.5 Å²	55.5	12%	0.12	29%	0.291	C	S	.	.			trans	-63.4	128.8	-178.4	-66.3	173.1	0	0	0	110.8	L398 I401 L418 N421 F427 V444	L398-L423 HydrophobicContact CB-CD2 4.09Å; L398-L423 WeakPolarHBondContact O-CD2 2.78Å; L398-L423 PolarHBondContact O-N 2.98Å; I401-L423 HydrophobicContact CG1-CD2 4.25Å; L418-L423 HydrophobicContact CB-CD1 4.06Å; L418-L423 HydrophobicContact CD1-CD1 4.33Å; N421-L423 HydrophobicContact CB-CD1 4.45Å; N421-L423 HydrophobicContact CB-CD2 4.43Å; N421-L423 HydrophobicContact CB-CG 3.92Å; N421-L423 PolarHBondContact O-N 2.91Å; L423-F427 HydrophobicContact CB-CZ 4.29Å; L423-F427 HydrophobicContact CD1-CE1 4.5Å; L423-F427 HydrophobicContact CD1-CZ 3.96Å; L423-V444 HydrophobicContact CD1-CG2 3.71Å
424	L	51.1	Low	63.3	Low	88 Å²	88	56.6 Å²	56.6	46%	0.461	30%	0.297	S	S	.	.			trans	-71.2	139.5	168.2	-65.2	167.2	0	0	0	108.6	T399 P422 L426	T399-L424 WeakPolarHBondContact O-CB 3.29Å; T399-L424 WeakPolarHBondContact O-CG 3.27Å; T399-L424 PolarHBondContact O-N 3.3Å; P422-L424 PolarHBondContact O-N 3.19Å; L424-L426 PolarHBondContact O-N 3.24Å
425	C	47.4	Very low	61.7	Low	99 Å²	99	57.1 Å²	57.1	67%	0.669	31%	0.312	S	S	*	.	S	Bend	trans	-66.5	20.4	-169.9	-55.8	0	0	0	0	116	F427	C425-F427 PolarHBondContact O-N 3.29Å
426	L	46.7	Very low	60.7	Low	96 Å²	96	61.6 Å²	61.6	50%	0.503	34%	0.343	S	S	.	.			trans	-92.3	86.8	-179.3	-65.1	168.7	0	0	0	109.3	L424 C540	L424-L426 PolarHBondContact O-N 3.24Å; L426-C540 WeakPolarHBondContact CD1-O 3.46Å
427	F	51.8	Low	59.9	Low	17 Å²	17	62.4 Å²	62.4	8%	0.075	35%	0.347	C	S	.	.			trans	-102.2	136.5	174.5	-69.8	-94.3	0	0	0	111.2	I401 L423 C425 V444 S447 L448 R451	I401-F427 HydrophobicContact CD1-CD1 3.82Å; I401-F427 HydrophobicContact CD1-CE1 3.28Å; I401-F427 HydrophobicContact CD1-CZ 4.23Å; I401-F427 HydrophobicContact CG1-CE1 4.29Å; L423-F427 HydrophobicContact CB-CZ 4.29Å; L423-F427 HydrophobicContact CD1-CE1 4.5Å; L423-F427 HydrophobicContact CD1-CZ 3.96Å; C425-F427 PolarHBondContact O-N 3.29Å; F427-V444 HydrophobicContact CD1-CG1 3.87Å; F427-V444 HydrophobicContact CE1-CB 3.88Å; F427-V444 HydrophobicContact CE1-CG1 3.4Å; F427-V444 VanDerWaalsContact CE1-CG1 3.4Å; F427-V444 HydrophobicContact CE1-CG2 3.64Å; F427-V444 HydrophobicContact CZ-CB 3.97Å; F427-V444 HydrophobicContact CZ-CG1 4Å; F427-V444 HydrophobicContact CZ-CG2 3.61Å; F427-S447 VanDerWaalsContact CE2-CB 3.46Å; F427-L448 HydrophobicContact CB-CD2 3.56Å; F427-L448 HydrophobicContact CB-CG 4.29Å; F427-L448 HydrophobicContact CG-CD2 4.22Å; F427-L448 HydrophobicContact CG-CG 4.49Å; F427-R451 VanDerWaalsContact C-NH1 3.26Å; F427-R451 PolarHBondContact O-NH1 3.26Å
428	P	50.9	Low	59.4	Low	24 Å²	24	66.9 Å²	66.9	16%	0.156	37%	0.367	C	S	.	.			trans	-73.1	143.2	175.4	-21.8	38.2	0	0	0	112.7	L406 E430 F431 R451	L406-P428 HydrophobicContact CD1-CB 3.88Å; L406-P428 HydrophobicContact CD1-CG 3.5Å; L406-P428 VanDerWaalsContact CD1-CG 3.5Å; L406-P428 HydrophobicContact CD2-CB 4.34Å; L406-P428 HydrophobicContact CD2-CG 3.91Å; L406-P428 HydrophobicContact CG-CG 4.32Å; P428-E430 VanDerWaalsContact CA-OE2 3.29Å; P428-E430 WeakPolarHBondContact CA-OE2 3.26Å; P428-E430 WeakPolarHBondContact CB-OE2 3.13Å; P428-E430 PolarHBondContact O-N 3.41Å; P428-E430 VanDerWaalsContact O-N 3.12Å; P428-F431 PolarHBondContact O-N 3.14Å; P428-R451 PolarHBondContact O-NH1 3.42Å
429	K	49	Very low	58.8	Low	123 Å²	123	67.8 Å²	67.8	54%	0.535	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-55.9	-29.2	-173.4	-80.3	-177	177	179.1	0	112.9	F431 K432 R451 N455	K429-F431 PolarHBondContact O-N 3.22Å; K429-K432 WeakPolarHBondContact O-CB 3.44Å; K429-K432 PolarHBondContact O-N 3.1Å; K429-K432 VanDerWaalsContact O-N 3.15Å; K429-R451 VanDerWaalsContact CA-CZ 3.45Å; K429-R451 VanDerWaalsContact CA-NH1 3.3Å; K429-R451 VanDerWaalsContact N-NH1 3.16Å; K429-N455 VanDerWaalsContact CE-ND2 3.27Å; K429-N455 WeakPolarHBondContact CE-ND2 3.5Å; K429-N455 PolarHBondContact NZ-OD1 3.05Å
430	E	51.9	Low	58.3	Low	58 Å²	58	68.5 Å²	68.5	27%	0.271	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-56.7	-31.5	-177.2	-59.6	75.7	-163.3	0	0	112.7	P428 K432 N433	P428-E430 VanDerWaalsContact CA-OE2 3.29Å; P428-E430 WeakPolarHBondContact CA-OE2 3.26Å; P428-E430 WeakPolarHBondContact CB-OE2 3.13Å; P428-E430 PolarHBondContact O-N 3.41Å; P428-E430 VanDerWaalsContact O-N 3.12Å; E430-K432 PolarHBondContact O-N 3.05Å; E430-K432 VanDerWaalsContact O-N 3.07Å; E430-N433 PolarHBondContact O-N 3.03Å
431	F	55.2	Low	58	Low	5 Å²	5	63.5 Å²	63.5	2%	0.022	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-59.5	-24.5	178.7	-117	-73.4	0	0	0	113.8	I401 L406 C409 L416 P428 K429 N433 I439 L448	I401-F431 HydrophobicContact CD1-CE2 4.09Å; I401-F431 HydrophobicContact CG2-CE2 4.46Å; L406-F431 HydrophobicContact CD2-CD2 3.52Å; L406-F431 HydrophobicContact CD2-CE2 3.51Å; C409-F431 VanDerWaalsContact SG-CZ 3.52Å; L416-F431 HydrophobicContact CD2-CE1 4.17Å; L416-F431 HydrophobicContact CD2-CZ 3.67Å; P428-F431 PolarHBondContact O-N 3.14Å; K429-F431 PolarHBondContact O-N 3.22Å; F431-N433 VanDerWaalsContact C-N 3.34Å; F431-I439 HydrophobicContact CD1-CD1 3.32Å; F431-I439 HydrophobicContact CD1-CG1 4.31Å; F431-I439 HydrophobicContact CE1-CD1 3.36Å; F431-I439 HydrophobicContact CE1-CG1 3.87Å; F431-L448 HydrophobicContact CB-CD1 3.84Å; F431-L448 HydrophobicContact CB-CD2 3.56Å; F431-L448 HydrophobicContact CB-CG 4.37Å; F431-L448 HydrophobicContact CD1-CD1 4.22Å; F431-L448 HydrophobicContact CG-CD1 4.21Å; F431-L448 HydrophobicContact CG-CD2 4.41Å
432	K	52	Low	57.6	Low	119 Å²	119	65.5 Å²	65.5	52%	0.517	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-69.9	-32.4	177.1	-172.8	179.5	-174.6	156.4	0	112.3	K429 E430 N434 D452	K429-K432 WeakPolarHBondContact O-CB 3.44Å; K429-K432 PolarHBondContact O-N 3.1Å; K429-K432 VanDerWaalsContact O-N 3.15Å; E430-K432 PolarHBondContact O-N 3.05Å; E430-K432 VanDerWaalsContact O-N 3.07Å; K432-N434 VanDerWaalsContact C-N 3.32Å; K432-D452 VanDerWaalsContact CD-OD2 3.26Å; K432-D452 WeakPolarHBondContact CD-OD2 3.32Å; K432-D452 VanDerWaalsContact CE-OD2 3.25Å; K432-D452 WeakPolarHBondContact CE-OD2 3.37Å; K432-D452 IonicContact NZ-OD2 2.68Å; K432-D452 PolarHBondContact NZ-OD2 2.91Å
433	N	50.6	Low	57.3	Low	130 Å²	130	65.4 Å²	65.4	70%	0.695	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-17.3	-173.9	-70.2	-3.6	0	0	0	112.6	E430 F431 S435	E430-N433 PolarHBondContact O-N 3.03Å; F431-N433 VanDerWaalsContact C-N 3.34Å; N433-S435 PolarHBondContact O-N 3.42Å
434	N	54.8	Low	57.2	Low	29 Å²	29	64.3 Å²	64.3	16%	0.155	35%	0.35	C	S	.	.			trans	-83.8	69.7	178.4	-62.4	-26.5	0	0	0	110	C409 K432 S436 I437	C409-N434 VanDerWaalsContact C-ND2 3.32Å; C409-N434 WeakPolarHBondContact CB-ND2 3Å; K432-N434 VanDerWaalsContact C-N 3.32Å; N434-S436 PolarHBondContact O-N 2.67Å; N434-I437 HydrophobicContact CB-CD1 3.49Å; N434-I437 VanDerWaalsContact CB-CD1 3.49Å; N434-I437 HydrophobicContact CB-CG1 3.78Å; N434-I437 PolarHBondContact O-N 2.7Å
435	S	53.9	Low	57.8	Low	112 Å²	112	63 Å²	63	78%	0.783	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.1	-178.1	53.5	0	0	0	0	113.7	N433	N433-S435 PolarHBondContact O-N 3.42Å
436	S	63.5	Low	58.3	Low	108 Å²	108	58.8 Å²	58.8	76%	0.755	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-9.8	-178.3	-54.7	0	0	0	0	114.7	N434	N434-S436 PolarHBondContact O-N 2.67Å
437	I	68.4	Low	58.9	Low	16 Å²	16	55.1 Å²	55.1	8%	0.082	30%	0.298	C	S	.	.			trans	-91.5	123.2	-176.6	-42.3	178.8	0	0	0	110.1	C409 L413 L416 N434 I439	C409-I437 HydrophobicContact CB-CD1 3.21Å; C409-I437 VanDerWaalsContact O-CD1 3.24Å; C409-I437 WeakPolarHBondContact O-CD1 3.39Å; L413-I437 HydrophobicContact CD2-CG2 4.49Å; L413-I437 HydrophobicContact CG-CG2 4.5Å; L413-I437 WeakPolarHBondContact O-CG1 3.26Å; L416-I437 HydrophobicContact CB-CG2 4.11Å; N434-I437 HydrophobicContact CB-CD1 3.49Å; N434-I437 VanDerWaalsContact CB-CD1 3.49Å; N434-I437 HydrophobicContact CB-CG1 3.78Å; N434-I437 PolarHBondContact O-N 2.7Å; I437-I439 HydrophobicContact CB-CG1 4.47Å; I437-I439 HydrophobicContact CG2-CG1 4.27Å; I437-I439 PolarHBondContact O-N 3.45Å; I437-I439 VanDerWaalsContact O-N 3.08Å
438	E	72.4	Confident	59.3	Low	112 Å²	112	55 Å²	55	52%	0.523	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	97.7	167	-163.6	-168.3	147.5	0	0	109.8	E414 L416 Q440	E414-E438 PolarHBondContact O-N 2.73Å; L416-E438 PolarHBondContact N-O 3.48Å; E438-Q440 HydrophobicContact CG-CG 4.18Å; E438-Q440 PolarHBondContact O-N 3.09Å; E438-Q440 WeakPolarHBondContact OE1-CG 3.33Å; E438-Q440 PolarHBondContact OE1-NE2 3.39Å
439	I	67.9	Low	59.8	Low	21 Å²	21	58.6 Å²	58.6	11%	0.108	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	101.9	173.8	-56.2	164.7	0	0	0	108.3	L416 F431 I437 S441 V444 L445 L448	L416-I439 WeakPolarHBondContact O-CA 3.16Å; F431-I439 HydrophobicContact CD1-CD1 3.32Å; F431-I439 HydrophobicContact CD1-CG1 4.31Å; F431-I439 HydrophobicContact CE1-CD1 3.36Å; F431-I439 HydrophobicContact CE1-CG1 3.87Å; I437-I439 HydrophobicContact CB-CG1 4.47Å; I437-I439 HydrophobicContact CG2-CG1 4.27Å; I437-I439 PolarHBondContact O-N 3.45Å; I437-I439 VanDerWaalsContact O-N 3.08Å; I439-S441 PolarHBondContact O-N 3.38Å; I439-V444 HydrophobicContact CG2-CB 4.06Å; I439-V444 HydrophobicContact CG2-CG1 3.82Å; I439-L445 HydrophobicContact CB-CD2 4.24Å; I439-L445 HydrophobicContact CD1-CD2 4.39Å; I439-L445 HydrophobicContact CG2-CG 4.38Å; I439-L448 HydrophobicContact CD1-CD1 4.33Å
440	Q	65.8	Low	60.2	Low	66 Å²	66	54.8 Å²	54.8	31%	0.308	30%	0.296	S	S	.	.			trans	-82.1	39.8	179	-62.7	-177.8	-15.8	0	0	111.2	L416 N417 N419 E438	L416-Q440 PolarHBondContact O-N 2.93Å; N417-Q440 HydrophobicContact CB-CB 4.1Å; N417-Q440 PolarHBondContact ND2-OE1 3.41Å; N417-Q440 PolarHBondContact OD1-O 3.2Å; N419-Q440 PolarHBondContact ND2-O 2.97Å; N419-Q440 PolarHBondContact OD1-O 3.47Å; N419-Q440 VanDerWaalsContact OD1-O 3.13Å; E438-Q440 HydrophobicContact CG-CG 4.18Å; E438-Q440 PolarHBondContact O-N 3.09Å; E438-Q440 WeakPolarHBondContact OE1-CG 3.33Å; E438-Q440 PolarHBondContact OE1-NE2 3.39Å
441	S	67.9	Low	60.5	Low	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.29	C	S	.	.			trans	-133.7	110	178.8	-173.2	0	0	0	0	114.6	N419 I439 T443 V444 L445	N419-S441 WeakPolarHBondContact OD1-CA 3.35Å; N419-S441 PolarHBondContact OD1-OG 3.15Å; I439-S441 PolarHBondContact O-N 3.38Å; S441-T443 VanDerWaalsContact C-N 3.32Å; S441-T443 PolarHBondContact O-N 2.92Å; S441-T443 PolarHBondContact OG-OG1 3.49Å; S441-T443 VanDerWaalsContact OG-OG1 3.11Å; S441-V444 PolarHBondContact O-N 3.34Å; S441-V444 WeakPolarHBondContact OG-CG2 3.39Å; S441-L445 WeakPolarHBondContact O-CG 3.44Å; S441-L445 PolarHBondContact O-N 2.79Å
442	L	59.6	Low	60.8	Low	56 Å²	56	54.6 Å²	54.6	29%	0.293	29%	0.294	S	S	.	.	H	α-helix	trans	-62.7	-38.5	179.8	-65.2	172.7	0	0	0	111.6	V444 L445 A446 T476 N484 L486	L442-V444 PolarHBondContact O-N 2.74Å; L442-L445 PolarHBondContact O-N 3.11Å; L442-A446 WeakPolarHBondContact O-CA 2.98Å; L442-A446 WeakPolarHBondContact O-CB 3.5Å; L442-A446 PolarHBondContact O-N 3.32Å; L442-T476 HydrophobicContact CD1-CG2 4.26Å; L442-T476 HydrophobicContact CD2-CG2 4.49Å; L442-N484 HydrophobicContact CD2-CB 4.14Å; L442-L486 HydrophobicContact CD2-CD1 4.09Å; L442-L486 HydrophobicContact CD2-CD2 4Å; L442-L486 HydrophobicContact CD2-CG 4.27Å
443	T	57.9	Low	61	Low	72 Å²	72	50.8 Å²	50.8	44%	0.442	28%	0.279	S	S	.	.	H	α-helix	trans	-65.9	-37.8	178	51.6	0	0	0	0	112.3	S441 S447	S441-T443 VanDerWaalsContact C-N 3.32Å; S441-T443 PolarHBondContact O-N 2.92Å; S441-T443 PolarHBondContact OG-OG1 3.49Å; S441-T443 VanDerWaalsContact OG-OG1 3.11Å; T443-S447 WeakPolarHBondContact O-CB 3.48Å; T443-S447 PolarHBondContact O-N 3.43Å; T443-S447 PolarHBondContact O-OG 3.15Å
444	V	63.3	Low	61.4	Low	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.2	-53.6	173.6	175.4	0	0	0	0	110.1	L418 L423 F427 I439 S441 L442 A446 S447 L448	L418-V444 HydrophobicContact CB-CG2 3.97Å; L418-V444 HydrophobicContact CD1-CG2 3.87Å; L423-V444 HydrophobicContact CD1-CG2 3.71Å; F427-V444 HydrophobicContact CD1-CG1 3.87Å; F427-V444 HydrophobicContact CE1-CB 3.88Å; F427-V444 HydrophobicContact CE1-CG1 3.4Å; F427-V444 VanDerWaalsContact CE1-CG1 3.4Å; F427-V444 HydrophobicContact CE1-CG2 3.64Å; F427-V444 HydrophobicContact CZ-CB 3.97Å; F427-V444 HydrophobicContact CZ-CG1 4Å; F427-V444 HydrophobicContact CZ-CG2 3.61Å; I439-V444 HydrophobicContact CG2-CB 4.06Å; I439-V444 HydrophobicContact CG2-CG1 3.82Å; S441-V444 PolarHBondContact O-N 3.34Å; S441-V444 WeakPolarHBondContact OG-CG2 3.39Å; L442-V444 PolarHBondContact O-N 2.74Å; V444-A446 VanDerWaalsContact C-N 3.29Å; V444-A446 PolarHBondContact O-N 2.75Å; V444-S447 PolarHBondContact O-N 3.01Å; V444-S447 VanDerWaalsContact O-N 3.15Å; V444-L448 HydrophobicContact CG1-CD1 3.96Å; V444-L448 HydrophobicContact CG1-CG 4.43Å; V444-L448 WeakPolarHBondContact O-CG 3.36Å; V444-L448 PolarHBondContact O-N 3.07Å
445	L	62.8	Low	61.6	Low	59 Å²	59	48.3 Å²	48.3	31%	0.309	27%	0.265	S	S	.	.	H	α-helix	trans	-58.6	-41.9	179.8	-69.9	170.6	0	0	0	111.7	I439 S441 L442 L448 K449 L486	I439-L445 HydrophobicContact CB-CD2 4.24Å; I439-L445 HydrophobicContact CD1-CD2 4.39Å; I439-L445 HydrophobicContact CG2-CG 4.38Å; S441-L445 WeakPolarHBondContact O-CG 3.44Å; S441-L445 PolarHBondContact O-N 2.79Å; L442-L445 PolarHBondContact O-N 3.11Å; L445-L448 PolarHBondContact O-N 3.47Å; L445-K449 WeakPolarHBondContact O-CB 3.39Å; L445-K449 PolarHBondContact O-N 2.71Å; L445-L486 HydrophobicContact CB-CD1 3.7Å; L445-L486 HydrophobicContact CD1-CD1 4Å; L445-L486 HydrophobicContact CG-CD1 4.5Å
446	A	57.8	Low	61.9	Low	11 Å²	11	47.7 Å²	47.7	9%	0.091	25%	0.25	C	S	.	.	H	α-helix	trans	-60	-48.2	175.1	0	0	0	0	0	111.9	L442 V444 L448 K449 M450 L474 F488	L442-A446 WeakPolarHBondContact O-CA 2.98Å; L442-A446 WeakPolarHBondContact O-CB 3.5Å; L442-A446 PolarHBondContact O-N 3.32Å; V444-A446 VanDerWaalsContact C-N 3.29Å; V444-A446 PolarHBondContact O-N 2.75Å; A446-L448 PolarHBondContact O-N 3.22Å; A446-K449 PolarHBondContact O-N 2.94Å; A446-M450 WeakPolarHBondContact O-CB 3.48Å; A446-M450 WeakPolarHBondContact O-CG 3.01Å; A446-M450 PolarHBondContact O-N 2.97Å; A446-L474 HydrophobicContact CB-CD1 4Å; A446-L474 HydrophobicContact CB-CD2 3.5Å; A446-L474 HydrophobicContact CB-CG 4.3Å; A446-F488 HydrophobicContact CB-CE2 4.29Å; A446-F488 HydrophobicContact CB-CZ 3.71Å; A446-F488 WeakPolarHBondContact O-CE2 2.83Å; A446-F488 WeakPolarHBondContact O-CZ 3Å
447	S	58.9	Low	61.4	Low	19 Å²	19	44.4 Å²	44.4	13%	0.133	23%	0.225	C	C	.	.	H	α-helix	trans	-64	-40.3	178.8	-59.9	0	0	0	0	111.9	F427 T443 V444 R451	F427-S447 VanDerWaalsContact CE2-CB 3.46Å; T443-S447 WeakPolarHBondContact O-CB 3.48Å; T443-S447 PolarHBondContact O-N 3.43Å; T443-S447 PolarHBondContact O-OG 3.15Å; V444-S447 PolarHBondContact O-N 3.01Å; V444-S447 VanDerWaalsContact O-N 3.15Å; S447-R451 VanDerWaalsContact O-CB 3.29Å; S447-R451 WeakPolarHBondContact O-CB 3.33Å; S447-R451 PolarHBondContact O-N 3Å
448	L	61	Low	60.6	Low	14 Å²	14	48.1 Å²	48.1	7%	0.073	25%	0.246	C	C	.	.	H	α-helix	trans	-62.8	-46.4	175.5	-69.6	171.6	0	0	0	111.6	F427 F431 I439 V444 L445 A446 R451 D452	F427-L448 HydrophobicContact CB-CD2 3.56Å; F427-L448 HydrophobicContact CB-CG 4.29Å; F427-L448 HydrophobicContact CG-CD2 4.22Å; F427-L448 HydrophobicContact CG-CG 4.49Å; F431-L448 HydrophobicContact CB-CD1 3.84Å; F431-L448 HydrophobicContact CB-CD2 3.56Å; F431-L448 HydrophobicContact CB-CG 4.37Å; F431-L448 HydrophobicContact CD1-CD1 4.22Å; F431-L448 HydrophobicContact CG-CD1 4.21Å; F431-L448 HydrophobicContact CG-CD2 4.41Å; I439-L448 HydrophobicContact CD1-CD1 4.33Å; V444-L448 HydrophobicContact CG1-CD1 3.96Å; V444-L448 HydrophobicContact CG1-CG 4.43Å; V444-L448 WeakPolarHBondContact O-CG 3.36Å; V444-L448 PolarHBondContact O-N 3.07Å; L445-L448 PolarHBondContact O-N 3.47Å; A446-L448 PolarHBondContact O-N 3.22Å; L448-R451 PolarHBondContact O-N 3.09Å; L448-D452 VanDerWaalsContact O-CG 3.3Å; L448-D452 PolarHBondContact O-N 2.96Å
449	K	60.3	Low	59.6	Low	100 Å²	100	51 Å²	51	44%	0.435	26%	0.256	S	S	.	.	H	α-helix	trans	-69.1	-38.6	179.5	-176.2	68.1	172.9	-179.1	0	112.5	L445 A446 D452 L453 F488	L445-K449 WeakPolarHBondContact O-CB 3.39Å; L445-K449 PolarHBondContact O-N 2.71Å; A446-K449 PolarHBondContact O-N 2.94Å; K449-D452 WeakPolarHBondContact O-CB 3.27Å; K449-D452 PolarHBondContact O-N 2.89Å; K449-L453 WeakPolarHBondContact O-CG 3.29Å; K449-L453 PolarHBondContact O-N 3.32Å; K449-F488 HydrophobicContact CB-CD2 4.13Å; K449-F488 HydrophobicContact CB-CE2 3.78Å; K449-F488 HydrophobicContact CG-CD2 3.69Å; K449-F488 HydrophobicContact CG-CE2 3.88Å
450	M	57.8	Low	58.7	Low	44 Å²	44	57 Å²	57	22%	0.217	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-44.9	171.9	-85.6	-69.1	-76.9	0	0	112.3	A446 D452 L453 L454 Y472 F488	A446-M450 WeakPolarHBondContact O-CB 3.48Å; A446-M450 WeakPolarHBondContact O-CG 3.01Å; A446-M450 PolarHBondContact O-N 2.97Å; M450-D452 VanDerWaalsContact C-N 3.27Å; M450-D452 PolarHBondContact O-N 3.26Å; M450-L453 PolarHBondContact O-N 3.2Å; M450-L454 WeakPolarHBondContact O-CB 3.41Å; M450-L454 WeakPolarHBondContact O-CG 3.16Å; M450-L454 PolarHBondContact O-N 3.39Å; M450-Y472 HydrophobicContact CE-CD2 3.62Å; M450-Y472 HydrophobicContact CE-CE2 4.49Å; M450-Y472 HydrophobicContact CE-CG 3.94Å; M450-Y472 VanDerWaalsContact SD-CB 3.59Å; M450-Y472 HydrophobicContact SD-CD1 4.38Å; M450-Y472 HydrophobicContact SD-CD2 3.96Å; M450-Y472 HydrophobicContact SD-CG 3.74Å; M450-F488 HydrophobicContact CB-CZ 4.31Å; M450-F488 HydrophobicContact CG-CD1 3.64Å; M450-F488 HydrophobicContact CG-CD2 4.26Å; M450-F488 HydrophobicContact CG-CE1 3.1Å; M450-F488 HydrophobicContact CG-CE2 3.81Å; M450-F488 HydrophobicContact CG-CG 4.16Å; M450-F488 HydrophobicContact CG-CZ 3.19Å; M450-F488 HydrophobicContact SD-CD1 3.31Å; M450-F488 WeakPolarHBondContact SD-CD1 3.33Å; M450-F488 HydrophobicContact SD-CD2 4.46Å; M450-F488 HydrophobicContact SD-CE1 3.43Å; M450-F488 WeakPolarHBondContact SD-CE1 3.25Å; M450-F488 HydrophobicContact SD-CG 3.85Å; M450-F488 HydrophobicContact SD-CZ 4.07Å
451	R	57.9	Low	57.6	Low	38 Å²	38	57.2 Å²	57.2	14%	0.143	29%	0.287	C	S	.	.	H	α-helix	trans	-62.3	-40	176.7	-174.6	-159.7	63.4	-156.4	-4.2	110.7	F427 P428 K429 S447 L448 L454 N455	F427-R451 VanDerWaalsContact C-NH1 3.26Å; F427-R451 PolarHBondContact O-NH1 3.26Å; P428-R451 PolarHBondContact O-NH1 3.42Å; K429-R451 VanDerWaalsContact CA-CZ 3.45Å; K429-R451 VanDerWaalsContact CA-NH1 3.3Å; K429-R451 VanDerWaalsContact N-NH1 3.16Å; S447-R451 VanDerWaalsContact O-CB 3.29Å; S447-R451 WeakPolarHBondContact O-CB 3.33Å; S447-R451 PolarHBondContact O-N 3Å; L448-R451 PolarHBondContact O-N 3.09Å; R451-L454 PolarHBondContact O-N 3.15Å; R451-N455 WeakPolarHBondContact O-CB 3.32Å; R451-N455 PolarHBondContact O-N 2.91Å; R451-N455 PolarHBondContact O-ND2 2.91Å
452	D	61.8	Low	56.3	Low	21 Å²	21	65.6 Å²	65.6	11%	0.112	33%	0.326	C	S	.	.	H	α-helix	trans	-62.6	-45.9	175.7	-73.9	1.4	0	0	0	111.7	K432 L448 K449 M450 L454 N455 E456	K432-D452 VanDerWaalsContact CD-OD2 3.26Å; K432-D452 WeakPolarHBondContact CD-OD2 3.32Å; K432-D452 VanDerWaalsContact CE-OD2 3.25Å; K432-D452 WeakPolarHBondContact CE-OD2 3.37Å; K432-D452 IonicContact NZ-OD2 2.68Å; K432-D452 PolarHBondContact NZ-OD2 2.91Å; L448-D452 VanDerWaalsContact O-CG 3.3Å; L448-D452 PolarHBondContact O-N 2.96Å; K449-D452 WeakPolarHBondContact O-CB 3.27Å; K449-D452 PolarHBondContact O-N 2.89Å; M450-D452 VanDerWaalsContact C-N 3.27Å; M450-D452 PolarHBondContact O-N 3.26Å; D452-L454 PolarHBondContact O-N 3.31Å; D452-N455 PolarHBondContact O-N 3.39Å; D452-E456 WeakPolarHBondContact O-CG 3.43Å; D452-E456 PolarHBondContact O-N 3.4Å
453	L	57.2	Low	55.3	Low	39 Å²	39	70.9 Å²	70.9	20%	0.204	35%	0.349	C	S	.	.	H	α-helix	trans	-59	-45.9	174.4	-72.8	168.6	0	0	0	112	K449 M450 N455 E456 T457 F488	K449-L453 WeakPolarHBondContact O-CG 3.29Å; K449-L453 PolarHBondContact O-N 3.32Å; M450-L453 PolarHBondContact O-N 3.2Å; L453-N455 VanDerWaalsContact C-N 3.3Å; L453-N455 PolarHBondContact O-N 3.3Å; L453-E456 PolarHBondContact O-N 3.17Å; L453-T457 WeakPolarHBondContact O-CG2 3.44Å; L453-T457 PolarHBondContact O-N 2.87Å; L453-T457 PolarHBondContact O-OG1 2.87Å; L453-F488 HydrophobicContact CD1-CB 3.57Å; L453-F488 HydrophobicContact CD1-CD2 4.14Å; L453-F488 HydrophobicContact CD1-CG 4.01Å
454	L	58.1	Low	54.2	Low	65 Å²	65	71.8 Å²	71.8	34%	0.34	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-35.1	176.8	-72.9	169.7	0	0	0	112.4	M450 R451 D452 T457 N458	M450-L454 WeakPolarHBondContact O-CB 3.41Å; M450-L454 WeakPolarHBondContact O-CG 3.16Å; M450-L454 PolarHBondContact O-N 3.39Å; R451-L454 PolarHBondContact O-N 3.15Å; D452-L454 PolarHBondContact O-N 3.31Å; L454-T457 WeakPolarHBondContact CA-OG1 3.48Å; L454-T457 PolarHBondContact O-OG1 3.43Å; L454-N458 WeakPolarHBondContact O-CB 3.44Å; L454-N458 PolarHBondContact O-N 2.99Å; L454-N458 PolarHBondContact O-ND2 2.86Å
455	N	58.8	Low	52.8	Low	41 Å²	41	76.5 Å²	76.5	22%	0.219	39%	0.392	C	S	.	.	H	α-helix	trans	-70.3	-38.4	174.4	-72.8	-50.8	0	0	0	111.7	K429 R451 D452 L453 N458 K459	K429-N455 VanDerWaalsContact CE-ND2 3.27Å; K429-N455 WeakPolarHBondContact CE-ND2 3.5Å; K429-N455 PolarHBondContact NZ-OD1 3.05Å; R451-N455 WeakPolarHBondContact O-CB 3.32Å; R451-N455 PolarHBondContact O-N 2.91Å; R451-N455 PolarHBondContact O-ND2 2.91Å; D452-N455 PolarHBondContact O-N 3.39Å; L453-N455 VanDerWaalsContact C-N 3.3Å; L453-N455 PolarHBondContact O-N 3.3Å; N455-N458 PolarHBondContact O-N 2.74Å; N455-K459 WeakPolarHBondContact O-CG 3.44Å; N455-K459 PolarHBondContact O-N 2.88Å
456	E	60.6	Low	51.5	Low	100 Å²	100	85.9 Å²	85.9	47%	0.467	42%	0.423	S	S	.	.	H	α-helix	trans	-64.8	-43.1	175.1	-74.3	171.2	-173.8	0	0	111.1	D452 L453 K459 Q460	D452-E456 WeakPolarHBondContact O-CG 3.43Å; D452-E456 PolarHBondContact O-N 3.4Å; L453-E456 PolarHBondContact O-N 3.17Å; E456-K459 PolarHBondContact O-N 3.44Å; E456-Q460 WeakPolarHBondContact O-CG 3.49Å; E456-Q460 PolarHBondContact O-N 3.25Å; E456-Q460 VanDerWaalsContact O-N 3.12Å
457	T	54.3	Low	50.4	Low	38 Å²	38	92.2 Å²	92.2	23%	0.233	45%	0.451	C	S	.	.	H	α-helix	trans	-65.4	-39.2	173.9	56.3	0	0	0	0	112	L453 L454 K459 Q460 N461	L453-T457 WeakPolarHBondContact O-CG2 3.44Å; L453-T457 PolarHBondContact O-N 2.87Å; L453-T457 PolarHBondContact O-OG1 2.87Å; L454-T457 WeakPolarHBondContact CA-OG1 3.48Å; L454-T457 PolarHBondContact O-OG1 3.43Å; T457-K459 VanDerWaalsContact C-N 3.33Å; T457-K459 PolarHBondContact O-N 3.35Å; T457-Q460 PolarHBondContact O-N 3.12Å; T457-Q460 VanDerWaalsContact O-N 3.16Å; T457-N461 VanDerWaalsContact O-CB 3.31Å; T457-N461 WeakPolarHBondContact O-CB 3.42Å; T457-N461 PolarHBondContact O-N 3.33Å
458	N	50.8	Low	49.2	Very low	95 Å²	95	100.6 Å²	100.6	51%	0.508	49%	0.485	S	S	.	.	H	α-helix	trans	-65.1	-37.1	176.9	-74.1	-15.7	0	0	0	112	L454 N455 Q460 N461 E462	L454-N458 WeakPolarHBondContact O-CB 3.44Å; L454-N458 PolarHBondContact O-N 2.99Å; L454-N458 PolarHBondContact O-ND2 2.86Å; N455-N458 PolarHBondContact O-N 2.74Å; N458-Q460 VanDerWaalsContact C-N 3.3Å; N458-Q460 PolarHBondContact O-N 3.12Å; N458-N461 PolarHBondContact O-N 3.2Å; N458-E462 PolarHBondContact O-N 2.88Å
459	K	51.9	Low	48.1	Very low	172 Å²	172	105.3 Å²	105.3	75%	0.748	52%	0.516	S	S	*	.	H	α-helix	trans	-65.2	-32.5	173	-76.1	-178.4	177.1	-173.1	0	112.7	N455 E456 T457	N455-K459 WeakPolarHBondContact O-CG 3.44Å; N455-K459 PolarHBondContact O-N 2.88Å; E456-K459 PolarHBondContact O-N 3.44Å; T457-K459 VanDerWaalsContact C-N 3.33Å; T457-K459 PolarHBondContact O-N 3.35Å
460	Q	48	Very low	47.3	Very low	147 Å²	147	101.7 Å²	101.7	69%	0.687	51%	0.508	S	S	*	.	H	α-helix	trans	-77.1	-33.6	175.4	-70.7	178.1	-11.2	0	0	112.2	E456 T457 N458	E456-Q460 WeakPolarHBondContact O-CG 3.49Å; E456-Q460 PolarHBondContact O-N 3.25Å; E456-Q460 VanDerWaalsContact O-N 3.12Å; T457-Q460 PolarHBondContact O-N 3.12Å; T457-Q460 VanDerWaalsContact O-N 3.16Å; N458-Q460 VanDerWaalsContact C-N 3.3Å; N458-Q460 PolarHBondContact O-N 3.12Å
461	N	42.4	Very low	46.6	Very low	70 Å²	70	104.4 Å²	104.4	37%	0.374	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	3.4	-176.8	-66.2	-8.6	0	0	0	114.2	T457 N458 E463	T457-N461 VanDerWaalsContact O-CB 3.31Å; T457-N461 WeakPolarHBondContact O-CB 3.42Å; T457-N461 PolarHBondContact O-N 3.33Å; N458-N461 PolarHBondContact O-N 3.2Å; N461-E463 CarbonylContact O-C 3.6Å; N461-E463 PolarHBondContact O-N 3.43Å
462	E	40.6	Very low	46	Very low	177 Å²	177	105.1 Å²	105.1	83%	0.827	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-12.6	165.8	-83.1	-173.5	174.1	0	0	111.9	N458	N458-E462 PolarHBondContact O-N 2.88Å
463	E	39.3	Very low	45	Very low	166 Å²	166	108.4 Å²	108.4	78%	0.776	54%	0.54	S	S	*	.	S	Bend	trans	-110.5	105.4	157.9	-68.8	-178.7	173.9	0	0	109.8	N461	N461-E463 CarbonylContact O-C 3.6Å; N461-E463 PolarHBondContact O-N 3.43Å
464	S	34.9	Very low	44.2	Very low	92 Å²	92	109.3 Å²	109.3	64%	0.643	54%	0.544	S	S	*	.	S	Bend	trans	84	115	164.9	76.8	0	0	0	0	120
465	S	34.9	Very low	43.6	Very low	98 Å²	98	109.2 Å²	109.2	69%	0.685	54%	0.543	S	S	*	.			trans	68.2	138.9	145	52.8	0	0	0	0	121.5	E467	S465-E467 PolarHBondContact O-N 3.02Å
466	R	34.8	Very low	42.7	Very low	257 Å²	257	110 Å²	110	97%	0.97	55%	0.549	S	S	*	.			trans	-69.7	80.6	-174	-62.1	169.3	-178.5	172.3	-0.2	112
467	E	33.6	Very low	41.7	Very low	143 Å²	143	109.9 Å²	109.9	67%	0.668	55%	0.552	S	S	*	*			trans	-78.4	137.8	164.8	-75	-164	159.6	0	0	111.3	S465	S465-E467 PolarHBondContact O-N 3.02Å
468	K	34.5	Very low	40.9	Very low	195 Å²	195	114.7 Å²	114.7	85%	0.848	58%	0.576	S	S	*	*			trans	-63.1	145.3	174.4	-73.7	177.1	179.7	174.2	0	109.5	G470	K468-G470 PolarHBondContact O-N 3.47Å
469	P	38	Very low	40.2	Very low	113 Å²	113	116.5 Å²	116.5	73%	0.734	58%	0.581	S	S	*	*			trans	-59.6	114.5	177.5	24.6	-32.4	0	0	0	109.1
470	G	44.1	Very low	39.7	Very low	25 Å²	25	117.7 Å²	117.7	26%	0.258	59%	0.589	S	S	.	*			trans	-56.3	141.9	177.4	0	0	0	0	0	110.6	K468 Y472	K468-G470 PolarHBondContact O-N 3.47Å; G470-Y472 WeakPolarHBondContact O-CD2 3.31Å; G470-Y472 WeakPolarHBondContact O-CE2 3.44Å
471	Q	42.5	Very low	39	Very low	100 Å²	100	117.6 Å²	117.6	47%	0.467	59%	0.594	S	S	.	*			trans	-76	133	168.9	-67	179.8	7.4	0	0	108.1	V491	Q471-V491 HydrophobicContact CB-CB 4.2Å; Q471-V491 HydrophobicContact CB-CG2 4.17Å; Q471-V491 PolarHBondContact O-N 2.88Å
472	Y	45.2	Very low	38.8	Very low	54 Å²	54	121.7 Å²	121.7	21%	0.212	62%	0.616	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-121	137.3	177.1	-65.5	-102.2	0	0	0	109.7	M450 G470 F488 R489 K490	M450-Y472 HydrophobicContact CE-CD2 3.62Å; M450-Y472 HydrophobicContact CE-CE2 4.49Å; M450-Y472 HydrophobicContact CE-CG 3.94Å; M450-Y472 VanDerWaalsContact SD-CB 3.59Å; M450-Y472 HydrophobicContact SD-CD1 4.38Å; M450-Y472 HydrophobicContact SD-CD2 3.96Å; M450-Y472 HydrophobicContact SD-CG 3.74Å; G470-Y472 WeakPolarHBondContact O-CD2 3.31Å; G470-Y472 WeakPolarHBondContact O-CE2 3.44Å; Y472-F488 HydrophobicContact CD1-CB 4.2Å; Y472-R489 CarbonylContact C-O 3.58Å; Y472-R489 WeakPolarHBondContact CA-O 3.43Å; Y472-K490 HydrophobicContact CD1-CB 4.17Å; Y472-K490 HydrophobicContact CE1-CB 3.97Å; Y472-K490 HydrophobicContact CE1-CG 4.42Å
473	I	40.6	Very low	38.4	Very low	90 Å²	90	116.6 Å²	116.6	46%	0.462	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.2	130.6	169.7	-68.2	165.9	0	0	0	107.8	I475 F488 R489 V491	I473-I475 HydrophobicContact CG2-CG1 4.24Å; I473-F488 WeakPolarHBondContact O-CA 3.29Å; I473-R489 PolarHBondContact N-O 3.35Å; I473-R489 PolarHBondContact O-N 3.16Å; I473-V491 HydrophobicContact CB-CG2 4.37Å; I473-V491 HydrophobicContact CD1-CG2 3.48Å; I473-V491 VanDerWaalsContact CD1-CG2 3.48Å; I473-V491 HydrophobicContact CG1-CG2 3.45Å; I473-V491 VanDerWaalsContact CG1-CG2 3.45Å
474	L	40.9	Very low	38.3	Very low	57 Å²	57	112.3 Å²	112.3	30%	0.298	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.6	118.3	169.6	-178.9	76.1	0	0	0	109.1	A446 T476 L486 F488	A446-L474 HydrophobicContact CB-CD1 4Å; A446-L474 HydrophobicContact CB-CD2 3.5Å; A446-L474 HydrophobicContact CB-CG 4.3Å; L474-T476 HydrophobicContact CD2-CG2 4.18Å; L474-T476 HydrophobicContact CG-CG2 4.4Å; L474-L486 HydrophobicContact CD1-CB 4.16Å; L474-L486 HydrophobicContact CD1-CD2 3.47Å; L474-L486 VanDerWaalsContact CD1-CD2 3.47Å; L474-L486 HydrophobicContact CD1-CG 4.45Å; L474-L486 HydrophobicContact CD2-CD2 3.68Å; L474-L486 HydrophobicContact CG-CD2 3.85Å; L474-F488 HydrophobicContact CB-CD1 4.21Å; L474-F488 HydrophobicContact CB-CE1 3.67Å; L474-F488 HydrophobicContact CB-CZ 3.98Å; L474-F488 HydrophobicContact CD1-CD1 4.19Å; L474-F488 HydrophobicContact CD1-CD2 3.82Å; L474-F488 HydrophobicContact CD1-CE1 3.7Å; L474-F488 HydrophobicContact CD1-CE2 3.25Å; L474-F488 HydrophobicContact CD1-CG 4.25Å; L474-F488 HydrophobicContact CD1-CZ 3.2Å; L474-F488 HydrophobicContact CG-CE1 4.27Å; L474-F488 HydrophobicContact CG-CZ 4.09Å
475	I	44.8	Very low	38.4	Very low	63 Å²	63	114.1 Å²	114.1	32%	0.323	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.8	120	173.7	-55.7	175.9	0	0	0	107.5	I473 E487 R489	I473-I475 HydrophobicContact CG2-CG1 4.24Å; I475-E487 PolarHBondContact N-O 3.31Å; I475-E487 PolarHBondContact O-N 3.47Å; I475-R489 HydrophobicContact CD1-CB 4.13Å
476	T	40.9	Very low	38.7	Very low	57 Å²	57	111.2 Å²	111.2	35%	0.35	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.9	113.5	173	53	0	0	0	0	108.6	L442 L474 F485 L486	L442-T476 HydrophobicContact CD1-CG2 4.26Å; L442-T476 HydrophobicContact CD2-CG2 4.49Å; L474-T476 HydrophobicContact CD2-CG2 4.18Å; L474-T476 HydrophobicContact CG-CG2 4.4Å; T476-F485 WeakPolarHBondContact CA-O 3.19Å; T476-L486 HydrophobicContact CG2-CD2 3.59Å
477	N	39.2	Very low	39	Very low	98 Å²	98	103.2 Å²	103.2	52%	0.524	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	108.8	165.6	-116.8	0.9	0	0	0	108.3	E479 F485	N477-E479 VanDerWaalsContact C-N 3.34Å; N477-E479 PolarHBondContact O-N 3.3Å; N477-F485 PolarHBondContact N-O 3.33Å; N477-F485 VanDerWaalsContact N-O 3.07Å; N477-F485 PolarHBondContact O-N 2.85Å
478	L	38.2	Very low	39.6	Very low	140 Å²	140	98 Å²	98	73%	0.733	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	87.7	166	-83.7	141.7	0	0	0	106.8
479	E	34.7	Very low	40.2	Very low	133 Å²	133	96.3 Å²	96.3	62%	0.621	50%	0.496	S	S	*	.			trans	-77.7	141.5	160.6	-70.4	-165.7	175.4	0	0	108.8	N477 N481 N482	N477-E479 VanDerWaalsContact C-N 3.34Å; N477-E479 PolarHBondContact O-N 3.3Å; E479-N481 PolarHBondContact O-N 2.88Å; E479-N482 PolarHBondContact O-N 3.3Å
480	E	41.1	Very low	40.6	Very low	196 Å²	196	96.9 Å²	96.9	92%	0.916	49%	0.487	S	S	*	.	S	Bend	trans	-55	-15.4	-175.1	-68.9	-178.5	157	0	0	113.8	N482	E480-N482 PolarHBondContact O-N 2.94Å
481	N	34.1	Very low	40.9	Very low	145 Å²	145	97 Å²	97	78%	0.775	48%	0.483	S	S	*	.	S	Bend	trans	-97.5	45.7	-179.4	-71	-26.2	0	0	0	114	E479 A483	E479-N481 PolarHBondContact O-N 2.88Å; N481-A483 PolarHBondContact O-N 3.18Å
482	N	37.9	Very low	40.9	Very low	157 Å²	157	96.2 Å²	96.2	84%	0.84	49%	0.488	S	S	*	.	S	Bend	trans	54.2	-0.5	166.4	-75.7	-21.4	0	0	0	118.6	E479 E480 N484	E479-N482 PolarHBondContact O-N 3.3Å; E480-N482 PolarHBondContact O-N 2.94Å; N482-N484 PolarHBondContact O-N 3.38Å
483	A	31.7	Very low	41.2	Very low	69 Å²	69	101 Å²	101	57%	0.57	52%	0.517	S	S	*	.			trans	-88.4	89.3	173.8	0	0	0	0	0	108.7	N481 F485	N481-A483 PolarHBondContact O-N 3.18Å; A483-F485 PolarHBondContact O-N 3.31Å
484	N	38.6	Very low	41.2	Very low	77 Å²	77	106.2 Å²	106.2	41%	0.412	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	100.8	171	-72.4	-36.3	0	0	0	109	L442 N482 L486	L442-N484 HydrophobicContact CD2-CB 4.14Å; N482-N484 PolarHBondContact O-N 3.38Å; N484-L486 PolarHBondContact O-N 2.8Å
485	F	35.8	Very low	40.9	Very low	130 Å²	130	110.3 Å²	110.3	57%	0.57	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.5	120.4	171.5	-169.2	-103.6	0	0	0	109	T476 N477 A483 E487	T476-F485 WeakPolarHBondContact CA-O 3.19Å; N477-F485 PolarHBondContact N-O 3.33Å; N477-F485 VanDerWaalsContact N-O 3.07Å; N477-F485 PolarHBondContact O-N 2.85Å; A483-F485 PolarHBondContact O-N 3.31Å; F485-E487 HydrophobicContact CD1-CB 4.2Å; F485-E487 HydrophobicContact CE1-CB 3.73Å; F485-E487 HydrophobicContact CE1-CG 4.18Å
486	L	41.9	Very low	40.2	Very low	36 Å²	36	114.7 Å²	114.7	19%	0.188	57%	0.574	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.2	103.8	179.4	-76.3	155.1	0	0	0	108.6	L442 L445 L474 T476 N484	L442-L486 HydrophobicContact CD2-CD1 4.09Å; L442-L486 HydrophobicContact CD2-CD2 4Å; L442-L486 HydrophobicContact CD2-CG 4.27Å; L445-L486 HydrophobicContact CB-CD1 3.7Å; L445-L486 HydrophobicContact CD1-CD1 4Å; L445-L486 HydrophobicContact CG-CD1 4.5Å; L474-L486 HydrophobicContact CD1-CB 4.16Å; L474-L486 HydrophobicContact CD1-CD2 3.47Å; L474-L486 VanDerWaalsContact CD1-CD2 3.47Å; L474-L486 HydrophobicContact CD1-CG 4.45Å; L474-L486 HydrophobicContact CD2-CD2 3.68Å; L474-L486 HydrophobicContact CG-CD2 3.85Å; T476-L486 HydrophobicContact CG2-CD2 3.59Å; N484-L486 PolarHBondContact O-N 2.8Å
487	E	40.9	Very low	39.5	Very low	90 Å²	90	117.3 Å²	117.3	42%	0.421	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.9	131.6	175.5	-160.5	-177.8	159.2	0	0	110.5	I475 F485	I475-E487 PolarHBondContact N-O 3.31Å; I475-E487 PolarHBondContact O-N 3.47Å; F485-E487 HydrophobicContact CD1-CB 4.2Å; F485-E487 HydrophobicContact CE1-CB 3.73Å; F485-E487 HydrophobicContact CE1-CG 4.18Å
488	F	46.5	Very low	39.1	Very low	32 Å²	32	119 Å²	119	14%	0.14	61%	0.607	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.2	118.2	170.4	-82.9	-79.4	0	0	0	109.8	A446 K449 M450 L453 Y472 I473 L474	A446-F488 HydrophobicContact CB-CE2 4.29Å; A446-F488 HydrophobicContact CB-CZ 3.71Å; A446-F488 WeakPolarHBondContact O-CE2 2.83Å; A446-F488 WeakPolarHBondContact O-CZ 3Å; K449-F488 HydrophobicContact CB-CD2 4.13Å; K449-F488 HydrophobicContact CB-CE2 3.78Å; K449-F488 HydrophobicContact CG-CD2 3.69Å; K449-F488 HydrophobicContact CG-CE2 3.88Å; M450-F488 HydrophobicContact CB-CZ 4.31Å; M450-F488 HydrophobicContact CG-CD1 3.64Å; M450-F488 HydrophobicContact CG-CD2 4.26Å; M450-F488 HydrophobicContact CG-CE1 3.1Å; M450-F488 HydrophobicContact CG-CE2 3.81Å; M450-F488 HydrophobicContact CG-CG 4.16Å; M450-F488 HydrophobicContact CG-CZ 3.19Å; M450-F488 HydrophobicContact SD-CD1 3.31Å; M450-F488 WeakPolarHBondContact SD-CD1 3.33Å; M450-F488 HydrophobicContact SD-CD2 4.46Å; M450-F488 HydrophobicContact SD-CE1 3.43Å; M450-F488 WeakPolarHBondContact SD-CE1 3.25Å; M450-F488 HydrophobicContact SD-CG 3.85Å; M450-F488 HydrophobicContact SD-CZ 4.07Å; L453-F488 HydrophobicContact CD1-CB 3.57Å; L453-F488 HydrophobicContact CD1-CD2 4.14Å; L453-F488 HydrophobicContact CD1-CG 4.01Å; Y472-F488 HydrophobicContact CD1-CB 4.2Å; I473-F488 WeakPolarHBondContact O-CA 3.29Å; L474-F488 HydrophobicContact CB-CD1 4.21Å; L474-F488 HydrophobicContact CB-CE1 3.67Å; L474-F488 HydrophobicContact CB-CZ 3.98Å; L474-F488 HydrophobicContact CD1-CD1 4.19Å; L474-F488 HydrophobicContact CD1-CD2 3.82Å; L474-F488 HydrophobicContact CD1-CE1 3.7Å; L474-F488 HydrophobicContact CD1-CE2 3.25Å; L474-F488 HydrophobicContact CD1-CG 4.25Å; L474-F488 HydrophobicContact CD1-CZ 3.2Å; L474-F488 HydrophobicContact CG-CE1 4.27Å; L474-F488 HydrophobicContact CG-CZ 4.09Å
489	R	46.4	Very low	38.4	Very low	161 Å²	161	121.4 Å²	121.4	61%	0.608	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.8	125.5	175.2	-145.5	178.4	-152.1	160.7	7.9	109.7	Y472 I473 I475 V491	Y472-R489 CarbonylContact C-O 3.58Å; Y472-R489 WeakPolarHBondContact CA-O 3.43Å; I473-R489 PolarHBondContact N-O 3.35Å; I473-R489 PolarHBondContact O-N 3.16Å; I475-R489 HydrophobicContact CD1-CB 4.13Å; R489-V491 PolarHBondContact O-N 3.06Å
490	K	47.5	Very low	37.9	Very low	125 Å²	125	122.4 Å²	122.4	54%	0.543	62%	0.619	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-64.6	123.1	171.4	-170.1	176.9	-180	179.5	0	107.9	Y472 S492	Y472-K490 HydrophobicContact CD1-CB 4.17Å; Y472-K490 HydrophobicContact CE1-CB 3.97Å; Y472-K490 HydrophobicContact CE1-CG 4.42Å; K490-S492 PolarHBondContact O-N 2.91Å
491	V	50	Low	37.1	Very low	28 Å²	28	120.4 Å²	120.4	17%	0.17	62%	0.615	C	S	.	*	P	Polyproline II helix	trans	-68.9	124.5	175.8	-173.9	0	0	0	0	107.4	Q471 I473 R489 E495	Q471-V491 HydrophobicContact CB-CB 4.2Å; Q471-V491 HydrophobicContact CB-CG2 4.17Å; Q471-V491 PolarHBondContact O-N 2.88Å; I473-V491 HydrophobicContact CB-CG2 4.37Å; I473-V491 HydrophobicContact CD1-CG2 3.48Å; I473-V491 VanDerWaalsContact CD1-CG2 3.48Å; I473-V491 HydrophobicContact CG1-CG2 3.45Å; I473-V491 VanDerWaalsContact CG1-CG2 3.45Å; R489-V491 PolarHBondContact O-N 3.06Å; V491-E495 HydrophobicContact CG1-CB 4.36Å
492	S	42.7	Very low	36.7	Very low	82 Å²	82	123.6 Å²	123.6	57%	0.573	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-74.1	148.8	174.2	52.1	0	0	0	0	109.9	K490 K494 E495	K490-S492 PolarHBondContact O-N 2.91Å; S492-K494 PolarHBondContact O-N 3.45Å; S492-E495 PolarHBondContact O-N 3.08Å
493	D	50.8	Low	36.1	Very low	155 Å²	155	123.4 Å²	123.4	83%	0.829	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	1.6	-171.1	-60.8	-39.7	0	0	0	115.9
494	K	40.9	Very low	35.7	Very low	200 Å²	200	126.9 Å²	126.9	87%	0.87	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	4.1	-176.9	-74.3	-170	176.1	-178	0	115.7	S492	S492-K494 PolarHBondContact O-N 3.45Å
495	E	34.4	Very low	34.9	Very low	143 Å²	143	130.5 Å²	130.5	67%	0.668	65%	0.647	S	S	*	*			trans	-118.5	33.1	176	-65.5	-174	167.8	0	0	113.2	V491 S492 C497	V491-E495 HydrophobicContact CG1-CB 4.36Å; S492-E495 PolarHBondContact O-N 3.08Å; E495-C497 VanDerWaalsContact C-N 3.32Å; E495-C497 PolarHBondContact O-N 3.47Å
496	E	29.3	Very low	34.4	Very low	155 Å²	155	129.1 Å²	129.1	72%	0.724	65%	0.652	S	S	*	*			trans	-70.2	84.3	167.2	-76.7	-167.4	151.7	0	0	110.8
497	C	27.7	Very low	33.5	Very low	111 Å²	111	130.1 Å²	130.1	75%	0.75	66%	0.662	S	S	*	*			trans	-152.9	114.8	160.9	-100.6	0	0	0	0	113.3	E495	E495-C497 VanDerWaalsContact C-N 3.32Å; E495-C497 PolarHBondContact O-N 3.47Å
498	T	29.1	Very low	33	Very low	133 Å²	133	126.1 Å²	126.1	82%	0.816	64%	0.644	S	S	*	*	S	Bend	trans	77.3	54.6	150.3	67.6	0	0	0	0	120
499	M	24.1	Very low	32.3	Very low	192 Å²	192	127 Å²	127	95%	0.946	65%	0.654	S	S	*	*			trans	-143.7	54.9	150.4	-83.4	-137.4	-171	0	0	112.1
500	F	24.2	Very low	31.6	Very low	153 Å²	153	120.8 Å²	120.8	67%	0.671	64%	0.635	S	S	*	*			trans	-112.8	119.8	168.5	-101.1	-92	0	0	0	109.3
501	N	25.1	Very low	31.2	Very low	155 Å²	155	117.6 Å²	117.6	83%	0.829	63%	0.628	S	S	*	*	S	Bend	trans	157.9	29	142.5	-78.5	-19.8	0	0	0	116.7
502	K	24.5	Very low	30.6	Very low	211 Å²	211	119.8 Å²	119.8	92%	0.917	63%	0.634	S	S	*	*	S	Bend	trans	-136.6	4.9	168.9	-83.5	-164.5	178.9	175.1	0	118.8
503	L	25.1	Very low	30.3	Very low	154 Å²	154	118.4 Å²	118.4	81%	0.806	62%	0.623	S	S	*	*	S	Bend	trans	-126.2	136.6	172.2	-78	143.8	0	0	0	107
504	L	23.4	Very low	29.6	Very low	142 Å²	142	114.2 Å²	114.2	74%	0.743	62%	0.617	S	S	*	*			trans	96.9	94.1	-173.3	-59.9	138.5	0	0	0	114.5
505	N	22.7	Very low	29	Very low	152 Å²	152	111.3 Å²	111.3	81%	0.813	61%	0.608	S	S	*	*				-153.6	93.4	128.6	-91.7	-20.7	0	0	0	107.3	S507	N505-S507 PolarHBondContact O-N 2.93Å
506	P	25.6	Very low	28.7	Very low	102 Å²	102	111.9 Å²	111.9	66%	0.662	62%	0.616	S	S	*	*			trans	-81.7	114.1	-176.4	32	-29.2	0	0	0	109.5
507	S	23.6	Very low	28.7	Very low	56 Å²	56	115.6 Å²	115.6	39%	0.392	62%	0.623	S	S	.	*			trans	-151.5	111.8	169.5	57.8	0	0	0	0	109.8	N505 F561	N505-S507 PolarHBondContact O-N 2.93Å; S507-F561 WeakPolarHBondContact O-CE1 3.39Å
508	G	30.2	Very low	29	Very low	6 Å²	6	115.2 Å²	115.2	6%	0.062	61%	0.606	C	S	.	*			trans	162.2	130.3	173.5	0	0	0	0	0	114.1	L542 C543	G508-L542 WeakPolarHBondContact O-CB 2.96Å; G508-L542 WeakPolarHBondContact O-CD2 3.15Å; G508-C543 WeakPolarHBondContact O-CB 3.2Å
509	S	31	Very low	29	Very low	50 Å²	50	115.5 Å²	115.5	35%	0.35	60%	0.603	S	S	.	*			trans	-94.4	149.4	-175	46.4	0	0	0	0	113.8	C543	S509-C543 WeakPolarHBondContact O-CB 3.07Å; S509-C543 PolarHBondContact O-SG 3.18Å
510	C	31.3	Very low	29.6	Very low	31 Å²	31	115.2 Å²	115.2	21%	0.209	60%	0.599	C	S	.	*			trans	-72.3	141.7	-163	98.8	0	0	0	0	115.3
511	C	38.5	Very low	30.2	Very low	58 Å²	58	117 Å²	117	39%	0.392	61%	0.607	S	S	.	*			trans	-156.3	103.2	158.4	173.9	0	0	0	0	108.7
512	W	38.5	Very low	30.5	Very low	75 Å²	75	115 Å²	115	28%	0.284	60%	0.596	S	S	.	*	S	Bend	trans	-106	-21	175.1	-89.6	44.9	0	0	0	113.3	L378 P402	L378-W512 VanDerWaalsContact O-CZ3 3.3Å; L378-W512 WeakPolarHBondContact O-CZ3 3.49Å; P402-W512 HydrophobicContact CB-CE3 4.4Å; P402-W512 HydrophobicContact CB-CH2 3.94Å; P402-W512 HydrophobicContact CB-CZ3 3.38Å; P402-W512 HydrophobicContact CG-CH2 3.85Å; P402-W512 HydrophobicContact CG-CZ3 3.62Å
513	C	36.8	Very low	31	Very low	52 Å²	52	109.5 Å²	109.5	35%	0.351	58%	0.581	S	S	.	*	S	Bend	trans	-96.3	1.5	-176	66.1	0	0	0	0	114.8	M515 H527	C513-M515 PolarHBondContact O-N 2.95Å; C513-H527 HydrophobicContact CB-CB 4.34Å
514	G	35.3	Very low	31.2	Very low	67 Å²	67	104.8 Å²	104.8	69%	0.691	56%	0.556	S	S	*	*			trans	62.9	14.1	176.7	0	0	0	0	0	115
515	M	28.2	Very low	31.9	Very low	140 Å²	140	98.9 Å²	98.9	69%	0.69	53%	0.526	S	S	*	.			trans	-109.3	128.2	177	-72.5	-79.9	-158.4	0	0	109.9	C513 R517	C513-M515 PolarHBondContact O-N 2.95Å; M515-R517 PolarHBondContact O-N 3.09Å
516	D	28.1	Very low	32.3	Very low	155 Å²	155	98.1 Å²	98.1	83%	0.829	52%	0.519	S	S	*	.			trans	-67.6	124.7	171.2	-67.1	-40	0	0	0	109.6
517	R	29.7	Very low	32.7	Very low	232 Å²	232	98.2 Å²	98.2	88%	0.875	51%	0.51	S	S	*	.				164.4	132.1	128.1	-87.8	161.8	-158.2	-142.9	7.9	112.5	M515	M515-R517 PolarHBondContact O-N 3.09Å
518	Y	33.9	Very low	33.2	Very low	103 Å²	103	97.3 Å²	97.3	40%	0.404	50%	0.504	S	S	.	.			trans	-129.9	120.4	156.3	-79.5	-77.2	0	0	0	110.5	N522 T523 I524 C525	Y518-N522 WeakPolarHBondContact CD1-O 3.04Å; Y518-T523 VanDerWaalsContact CE1-C 3.46Å; Y518-I524 VanDerWaalsContact CE1-N 3.3Å; Y518-I524 WeakPolarHBondContact CE1-O 3.14Å; Y518-I524 VanDerWaalsContact OH-C 3.25Å; Y518-C525 VanDerWaalsContact CZ-CA 3.48Å; Y518-C525 WeakPolarHBondContact OH-CA 3.43Å; Y518-C525 WeakPolarHBondContact OH-CB 3.42Å; Y518-C525 PolarHBondContact OH-N 3.19Å
519	D	29.8	Very low	33.4	Very low	139 Å²	139	98.3 Å²	98.3	74%	0.743	51%	0.508	S	S	*	.			trans	-69.7	147.5	169.9	-164.6	-2.1	0	0	0	110.2	K521 N522	D519-K521 PolarHBondContact O-N 3.27Å; D519-N522 PolarHBondContact O-N 3.19Å
520	Q	36.9	Very low	33.4	Very low	186 Å²	186	101.2 Å²	101.2	87%	0.869	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-6.1	-161.4	-67.3	-179.2	-2.6	0	0	115.7
521	K	35.3	Very low	33.6	Very low	190 Å²	190	102.5 Å²	102.5	83%	0.826	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-26	-178	-79.2	-176.6	175.4	179.3	0	115.5	D519	D519-K521 PolarHBondContact O-N 3.27Å
522	N	32.4	Very low	33.2	Very low	113 Å²	113	102.3 Å²	102.3	60%	0.604	52%	0.517	S	S	*	.			trans	-127.6	120.6	-171.6	-73.6	-18.1	0	0	0	110.8	Y518 D519 I524	Y518-N522 WeakPolarHBondContact CD1-O 3.04Å; D519-N522 PolarHBondContact O-N 3.19Å; N522-I524 PolarHBondContact O-N 3.36Å
523	T	34.1	Very low	33.1	Very low	97 Å²	97	106.1 Å²	106.1	60%	0.595	54%	0.543	S	S	*	.			trans	-85.8	16.3	-179.8	49.6	0	0	0	0	112.9	Y518 I539	Y518-T523 VanDerWaalsContact CE1-C 3.46Å; T523-I539 HydrophobicContact CG2-CD1 4.42Å; T523-I539 WeakPolarHBondContact O-CD1 3.34Å; T523-I539 WeakPolarHBondContact O-CG1 3.06Å; T523-I539 VanDerWaalsContact OG1-CD1 3.25Å; T523-I539 WeakPolarHBondContact OG1-CD1 3.34Å
524	I	31.2	Very low	32.9	Very low	55 Å²	55	108 Å²	108	28%	0.282	54%	0.544	S	S	.	.			trans	-104.4	121.2	-167.5	-55.8	169.4	0	0	0	115.1	Y518 N522 M526 V529	Y518-I524 VanDerWaalsContact CE1-N 3.3Å; Y518-I524 WeakPolarHBondContact CE1-O 3.14Å; Y518-I524 VanDerWaalsContact OH-C 3.25Å; N522-I524 PolarHBondContact O-N 3.36Å; I524-M526 PolarHBondContact O-N 3.48Å; I524-V529 HydrophobicContact CG2-CG2 3.53Å
525	C	36.4	Very low	32.8	Very low	18 Å²	18	111 Å²	111	12%	0.122	55%	0.554	C	S	.	*			trans	-70.9	102	-173.6	-174.9	0	0	0	0	109.2	Y518 H527 C528 V529	Y518-C525 VanDerWaalsContact CZ-CA 3.48Å; Y518-C525 WeakPolarHBondContact OH-CA 3.43Å; Y518-C525 WeakPolarHBondContact OH-CB 3.42Å; Y518-C525 PolarHBondContact OH-N 3.19Å; C525-H527 PolarHBondContact O-N 2.89Å; C525-H527 VanDerWaalsContact O-N 3.14Å; C525-C528 HydrophobicContact CB-CB 4.08Å; C525-C528 PolarHBondContact O-N 2.84Å; C525-C528 VanDerWaalsContact SG-SG 3.65Å; C525-V529 PolarHBondContact O-N 2.89Å; C525-V529 VanDerWaalsContact O-N 3.15Å
526	M	31.9	Very low	32.7	Very low	135 Å²	135	106.9 Å²	106.9	67%	0.665	54%	0.542	S	S	*	.	H	α-helix	trans	-53.9	-35.7	-179.4	-70.1	-89.8	-69.3	0	0	111.7	I524 C528 V529 D530	I524-M526 PolarHBondContact O-N 3.48Å; M526-C528 VanDerWaalsContact C-N 3.33Å; M526-C528 PolarHBondContact O-N 3.16Å; M526-V529 PolarHBondContact O-N 3.46Å; M526-V529 VanDerWaalsContact O-N 3.15Å; M526-D530 PolarHBondContact O-N 2.96Å
527	H	34.5	Very low	32.8	Very low	104 Å²	104	100.9 Å²	100.9	48%	0.481	51%	0.511	S	S	.	.	H	α-helix	trans	-68.4	-29.9	179.6	-135.9	153.3	0	0	0	113.6	C513 C525	C513-H527 HydrophobicContact CB-CB 4.34Å; C525-H527 PolarHBondContact O-N 2.89Å; C525-H527 VanDerWaalsContact O-N 3.14Å
528	C	33.7	Very low	32.7	Very low	38 Å²	38	93.8 Å²	93.8	26%	0.257	50%	0.495	S	S	.	.	H	α-helix	trans	-80.7	-23.7	174.3	-63.1	0	0	0	0	112.1	C525 M526	C525-C528 HydrophobicContact CB-CB 4.08Å; C525-C528 PolarHBondContact O-N 2.84Å; C525-C528 VanDerWaalsContact SG-SG 3.65Å; M526-C528 VanDerWaalsContact C-N 3.33Å; M526-C528 PolarHBondContact O-N 3.16Å
529	V	33.6	Very low	32.5	Very low	26 Å²	26	91.4 Å²	91.4	16%	0.158	49%	0.489	C	S	.	.	H	α-helix	trans	-78	-46.3	179	163.1	0	0	0	0	111.2	I524 C525 M526 L531 F532 N533 Y534 V537	I524-V529 HydrophobicContact CG2-CG2 3.53Å; C525-V529 PolarHBondContact O-N 2.89Å; C525-V529 VanDerWaalsContact O-N 3.15Å; M526-V529 PolarHBondContact O-N 3.46Å; M526-V529 VanDerWaalsContact O-N 3.15Å; V529-L531 PolarHBondContact O-N 3.33Å; V529-L531 VanDerWaalsContact O-N 3.15Å; V529-F532 PolarHBondContact O-N 2.92Å; V529-N533 PolarHBondContact O-N 2.75Å; V529-Y534 VanDerWaalsContact CG1-O 3.22Å; V529-Y534 WeakPolarHBondContact CG1-O 3.33Å; V529-V537 HydrophobicContact CG2-CG2 4.42Å
530	D	32.2	Very low	32.4	Very low	112 Å²	112	88.4 Å²	88.4	60%	0.599	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.3	-178.4	-73.3	-16.7	0	0	0	113	M526 F532	M526-D530 PolarHBondContact O-N 2.96Å; D530-F532 VanDerWaalsContact C-N 3.29Å; D530-F532 PolarHBondContact O-N 2.51Å
531	L	34	Very low	32	Very low	58 Å²	58	84.4 Å²	84.4	30%	0.304	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-16.7	-174.5	-124.9	147.1	0	0	0	113.5	K383 V529	K383-L531 HydrophobicContact CD-CD2 3.99Å; V529-L531 PolarHBondContact O-N 3.33Å; V529-L531 VanDerWaalsContact O-N 3.15Å
532	F	30.6	Very low	32	Very low	54 Å²	54	78.5 Å²	78.5	24%	0.237	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.9	8.2	-173.1	-70.9	-85.2	0	0	0	114.5	P403 C407 V529 D530 Y534	P403-F532 HydrophobicContact CB-CE2 3.51Å; P403-F532 HydrophobicContact CB-CZ 3.85Å; C407-F532 VanDerWaalsContact SG-CE1 3.51Å; C407-F532 WeakPolarHBondContact SG-CZ 3.36Å; V529-F532 PolarHBondContact O-N 2.92Å; D530-F532 VanDerWaalsContact C-N 3.29Å; D530-F532 PolarHBondContact O-N 2.51Å; F532-Y534 HydrophobicContact CB-CD2 3.15Å; F532-Y534 HydrophobicContact CB-CE1 4.45Å; F532-Y534 HydrophobicContact CB-CE2 3.03Å; F532-Y534 HydrophobicContact CB-CG 3.93Å; F532-Y534 AromaticContact CD1-CE2 3.84Å; F532-Y534 HydrophobicContact CD1-CE2 3.84Å; F532-Y534 HydrophobicContact CD2-CD2 4.16Å; F532-Y534 AromaticContact CD2-CE2 3.72Å; F532-Y534 HydrophobicContact CD2-CE2 3.72Å; F532-Y534 AromaticContact CG-CD2 3.85Å; F532-Y534 HydrophobicContact CG-CD2 3.85Å; F532-Y534 AromaticContact CG-CE2 3.28Å; F532-Y534 HydrophobicContact CG-CE2 3.28Å; F532-Y534 PolarHBondContact O-N 3.34Å; F532-Y534 VanDerWaalsContact O-N 3.15Å
533	N	36	Very low	32.2	Very low	154 Å²	154	74.1 Å²	74.1	82%	0.824	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	33.1	-173.1	-75.1	-13.9	0	0	0	113.4	V529	V529-N533 PolarHBondContact O-N 2.75Å
534	Y	32.8	Very low	32.2	Very low	92 Å²	92	71.4 Å²	71.4	36%	0.361	40%	0.4	S	S	.	.			trans	-77	138.2	177.1	-71.4	-55.2	0	0	0	111	V529 F532 A536 V537	V529-Y534 VanDerWaalsContact CG1-O 3.22Å; V529-Y534 WeakPolarHBondContact CG1-O 3.33Å; F532-Y534 HydrophobicContact CB-CD2 3.15Å; F532-Y534 HydrophobicContact CB-CE1 4.45Å; F532-Y534 HydrophobicContact CB-CE2 3.03Å; F532-Y534 HydrophobicContact CB-CG 3.93Å; F532-Y534 AromaticContact CD1-CE2 3.84Å; F532-Y534 HydrophobicContact CD1-CE2 3.84Å; F532-Y534 HydrophobicContact CD2-CD2 4.16Å; F532-Y534 AromaticContact CD2-CE2 3.72Å; F532-Y534 HydrophobicContact CD2-CE2 3.72Å; F532-Y534 AromaticContact CG-CD2 3.85Å; F532-Y534 HydrophobicContact CG-CD2 3.85Å; F532-Y534 AromaticContact CG-CE2 3.28Å; F532-Y534 HydrophobicContact CG-CE2 3.28Å; F532-Y534 PolarHBondContact O-N 3.34Å; F532-Y534 VanDerWaalsContact O-N 3.15Å; Y534-A536 VanDerWaalsContact C-N 3.32Å; Y534-A536 PolarHBondContact O-N 3.28Å; Y534-V537 HydrophobicContact CD2-CG2 3.76Å; Y534-V537 HydrophobicContact CG-CG2 4.17Å
535	S	33	Very low	32.5	Very low	129 Å²	129	69.7 Å²	69.7	90%	0.902	40%	0.396	S	S	*	.	S	Bend	trans	-72.7	-24.5	175.2	54.1	0	0	0	0	113.5
536	A	27.6	Very low	32.6	Very low	54 Å²	54	71.3 Å²	71.3	45%	0.446	40%	0.403	S	S	.	.			trans	-164.3	133.3	170.7	0	0	0	0	0	109.5	Y534	Y534-A536 VanDerWaalsContact C-N 3.32Å; Y534-A536 PolarHBondContact O-N 3.28Å
537	V	30.4	Very low	32.7	Very low	29 Å²	29	70.8 Å²	70.8	18%	0.176	40%	0.399	C	S	.	.			trans	-102.8	111.3	165.9	-177.9	0	0	0	0	107.2	V529 Y534 I539 M541	V529-V537 HydrophobicContact CG2-CG2 4.42Å; Y534-V537 HydrophobicContact CD2-CG2 3.76Å; Y534-V537 HydrophobicContact CG-CG2 4.17Å; V537-I539 PolarHBondContact O-N 3.4Å; V537-M541 HydrophobicContact CG1-CE 3.3Å
538	P	27.5	Very low	32.8	Very low	83 Å²	83	67 Å²	67	54%	0.539	38%	0.383	S	S	.	.			trans	-56.6	127.6	178.1	-25.8	35.7	0	0	0	110.5	C540 M541	P538-C540 WeakPolarHBondContact CB-SG 3.24Å; P538-C540 PolarHBondContact O-N 2.96Å; P538-M541 PolarHBondContact O-N 3.3Å
539	I	28.9	Very low	32.9	Very low	53 Å²	53	67.7 Å²	67.7	27%	0.272	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-9.4	178.8	-58.7	148.6	0	0	0	112	T523 V537 M541 L542	T523-I539 HydrophobicContact CG2-CD1 4.42Å; T523-I539 WeakPolarHBondContact O-CD1 3.34Å; T523-I539 WeakPolarHBondContact O-CG1 3.06Å; T523-I539 VanDerWaalsContact OG1-CD1 3.25Å; T523-I539 WeakPolarHBondContact OG1-CD1 3.34Å; V537-I539 PolarHBondContact O-N 3.4Å; I539-M541 PolarHBondContact O-N 3.17Å; I539-L542 HydrophobicContact CG2-CD2 4.15Å; I539-L542 VanDerWaalsContact O-CD2 3.24Å; I539-L542 WeakPolarHBondContact O-CD2 3.32Å; I539-L542 VanDerWaalsContact O-CG 3.3Å; I539-L542 WeakPolarHBondContact O-CG 3.3Å
540	C	26.9	Very low	33.2	Very low	77 Å²	77	73.2 Å²	73.2	52%	0.52	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	0.3	175.3	55.6	0	0	0	0	114.9	L426 P538 L542	L426-C540 WeakPolarHBondContact CD1-O 3.46Å; P538-C540 WeakPolarHBondContact CB-SG 3.24Å; P538-C540 PolarHBondContact O-N 2.96Å; C540-L542 PolarHBondContact O-N 3.49Å; C540-L542 VanDerWaalsContact O-N 3.09Å
541	M	28.8	Very low	33.5	Very low	101 Å²	101	70.3 Å²	70.3	50%	0.498	40%	0.397	S	S	.	.	S	Bend	trans	-81.5	56.3	160.9	-66.3	-160.5	-95	0	0	112.1	V537 P538 I539 C543	V537-M541 HydrophobicContact CG1-CE 3.3Å; P538-M541 PolarHBondContact O-N 3.3Å; I539-M541 PolarHBondContact O-N 3.17Å; M541-C543 PolarHBondContact O-N 2.72Å
542	L	35.7	Very low	33.7	Very low	67 Å²	67	70.8 Å²	70.8	35%	0.351	40%	0.402	S	S	.	.			trans	-71	103.5	-157.6	-68	152.8	0	0	0	115	G508 I539 C540	G508-L542 WeakPolarHBondContact O-CB 2.96Å; G508-L542 WeakPolarHBondContact O-CD2 3.15Å; I539-L542 HydrophobicContact CG2-CD2 4.15Å; I539-L542 VanDerWaalsContact O-CD2 3.24Å; I539-L542 WeakPolarHBondContact O-CD2 3.32Å; I539-L542 VanDerWaalsContact O-CG 3.3Å; I539-L542 WeakPolarHBondContact O-CG 3.3Å; C540-L542 PolarHBondContact O-N 3.49Å; C540-L542 VanDerWaalsContact O-N 3.09Å
543	C	35.7	Very low	34.3	Very low	20 Å²	20	76 Å²	76	14%	0.135	42%	0.424	C	S	.	.			trans	48	115.7	141.1	-167.6	0	0	0	0	121	G508 S509 M541 C548	G508-C543 WeakPolarHBondContact O-CB 3.2Å; S509-C543 WeakPolarHBondContact O-CB 3.07Å; S509-C543 PolarHBondContact O-SG 3.18Å; M541-C543 PolarHBondContact O-N 2.72Å; C543-C548 PolarHBondContact SG-SG 3.02Å
544	C	35.9	Very low	34.8	Very low	40 Å²	40	75.2 Å²	75.2	27%	0.27	42%	0.416	S	S	.	.			trans	-160.9	59.1	148.9	41	0	0	0	0	111.3	T399	T399-C544 PolarHBondContact OG1-SG 3.17Å
545	G	37	Very low	35	Very low	19 Å²	19	71.8 Å²	71.8	20%	0.196	41%	0.405	C	S	.	.			trans	-63.5	154.1	162.2	0	0	0	0	0	111	Q547 C548 A549	G545-Q547 PolarHBondContact O-N 3.18Å; G545-Q547 VanDerWaalsContact O-N 3.08Å; G545-C548 PolarHBondContact O-N 3.41Å; G545-A549 PolarHBondContact O-N 2.96Å
546	I	38	Very low	35.5	Very low	52 Å²	52	70.2 Å²	70.2	27%	0.267	39%	0.394	S	S	.	.	H	α-helix	trans	-49.7	-36.1	178.8	-71.2	156.3	0	0	0	112.5	Y377 A549 K550	Y377-I546 HydrophobicContact CD1-CD1 4.32Å; Y377-I546 HydrophobicContact CD1-CG1 4.3Å; Y377-I546 HydrophobicContact CE1-CD1 3.42Å; Y377-I546 VanDerWaalsContact CE1-CD1 3.42Å; Y377-I546 HydrophobicContact CE1-CG1 3.87Å; I546-A549 PolarHBondContact O-N 3.45Å; I546-K550 HydrophobicContact CG2-CD 4.3Å; I546-K550 PolarHBondContact O-N 2.86Å; I546-K550 VanDerWaalsContact O-N 3.16Å
547	Q	34.9	Very low	36.2	Very low	125 Å²	125	70.9 Å²	70.9	58%	0.584	39%	0.393	S	S	*	.	H	α-helix	trans	-63.9	-48.5	-178.9	-147.6	75.3	1.2	0	0	110.8	G545 A549 K550 E551	G545-Q547 PolarHBondContact O-N 3.18Å; G545-Q547 VanDerWaalsContact O-N 3.08Å; Q547-A549 PolarHBondContact O-N 3.01Å; Q547-K550 PolarHBondContact O-N 3.05Å; Q547-E551 WeakPolarHBondContact O-CB 3.34Å; Q547-E551 VanDerWaalsContact O-CG 3.29Å; Q547-E551 WeakPolarHBondContact O-CG 3.31Å; Q547-E551 PolarHBondContact O-N 2.83Å
548	C	35.9	Very low	36.7	Very low	23 Å²	23	73.4 Å²	73.4	16%	0.155	41%	0.412	C	S	.	.	H	α-helix	trans	-65	-40.1	177.8	-63.9	0	0	0	0	112	C543 G545 K550 E551 V552	C543-C548 PolarHBondContact SG-SG 3.02Å; G545-C548 PolarHBondContact O-N 3.41Å; C548-K550 VanDerWaalsContact C-N 3.32Å; C548-K550 PolarHBondContact O-N 3.32Å; C548-E551 PolarHBondContact O-N 3.17Å; C548-V552 WeakPolarHBondContact O-CB 3.33Å; C548-V552 WeakPolarHBondContact O-CG2 3.11Å; C548-V552 PolarHBondContact O-N 3.33Å
549	A	35.9	Very low	37.6	Very low	54 Å²	54	73.8 Å²	73.8	45%	0.446	41%	0.406	S	S	.	.	H	α-helix	trans	-64.1	-35.4	178.5	0	0	0	0	0	113.1	G545 I546 Q547 K553	G545-A549 PolarHBondContact O-N 2.96Å; I546-A549 PolarHBondContact O-N 3.45Å; Q547-A549 PolarHBondContact O-N 3.01Å; A549-K553 WeakPolarHBondContact O-CG 3.32Å
550	K	39.6	Very low	38.4	Very low	142 Å²	142	75.8 Å²	75.8	62%	0.617	42%	0.415	S	S	*	.	H	α-helix	trans	-74.8	-39.4	174.5	-74.8	-178.6	-179.5	174.7	0	112.2	I546 Q547 C548	I546-K550 HydrophobicContact CG2-CD 4.3Å; I546-K550 PolarHBondContact O-N 2.86Å; I546-K550 VanDerWaalsContact O-N 3.16Å; Q547-K550 PolarHBondContact O-N 3.05Å; C548-K550 VanDerWaalsContact C-N 3.32Å; C548-K550 PolarHBondContact O-N 3.32Å
551	E	38.2	Very low	39.1	Very low	51 Å²	51	72.5 Å²	72.5	24%	0.238	39%	0.391	C	S	.	.	H	α-helix	trans	-80.3	-33.1	-176.3	-69.7	172.8	169.3	0	0	112.9	Q547 C548 K553 Q554 C555 Y565	Q547-E551 WeakPolarHBondContact O-CB 3.34Å; Q547-E551 VanDerWaalsContact O-CG 3.29Å; Q547-E551 WeakPolarHBondContact O-CG 3.31Å; Q547-E551 PolarHBondContact O-N 2.83Å; C548-E551 PolarHBondContact O-N 3.17Å; E551-K553 VanDerWaalsContact C-N 3.27Å; E551-K553 PolarHBondContact O-N 3.07Å; E551-Q554 WeakPolarHBondContact O-CA 3.31Å; E551-Q554 WeakPolarHBondContact O-CB 3.33Å; E551-Q554 PolarHBondContact O-N 3.49Å; E551-C555 PolarHBondContact O-N 3.08Å; E551-C555 PolarHBondContact O-SG 2.9Å; E551-C555 VanDerWaalsContact O-SG 3.34Å; E551-Y565 VanDerWaalsContact CB-OH 3.31Å; E551-Y565 WeakPolarHBondContact CB-OH 3.35Å; E551-Y565 PolarHBondContact OE2-OH 3.18Å
552	V	38.9	Very low	39.8	Very low	67 Å²	67	68.2 Å²	68.2	41%	0.406	37%	0.372	S	S	.	.	H	α-helix	trans	-60.5	-38.5	169.9	169.6	0	0	0	0	110.2	C548 Q554 C555 F561	C548-V552 WeakPolarHBondContact O-CB 3.33Å; C548-V552 WeakPolarHBondContact O-CG2 3.11Å; C548-V552 PolarHBondContact O-N 3.33Å; V552-Q554 PolarHBondContact O-N 3.37Å; V552-C555 PolarHBondContact O-N 3.28Å; V552-C555 VanDerWaalsContact O-N 3.08Å; V552-F561 HydrophobicContact CG2-CD2 3.78Å; V552-F561 HydrophobicContact CG2-CE2 3.48Å; V552-F561 VanDerWaalsContact CG2-CE2 3.48Å; V552-F561 HydrophobicContact CG2-CZ 4.2Å
553	K	43.6	Very low	40.3	Very low	163 Å²	163	70.8 Å²	70.8	71%	0.709	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.5	173.5	-77.7	-179.7	-179.9	178.8	0	113.9	A549 E551	A549-K553 WeakPolarHBondContact O-CG 3.32Å; E551-K553 VanDerWaalsContact C-N 3.27Å; E551-K553 PolarHBondContact O-N 3.07Å
554	Q	45.4	Very low	40.7	Very low	138 Å²	138	77.5 Å²	77.5	65%	0.645	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-15.7	175.5	-62.5	-178.2	0.4	0	0	113.1	E551 V552	E551-Q554 WeakPolarHBondContact O-CA 3.31Å; E551-Q554 WeakPolarHBondContact O-CB 3.33Å; E551-Q554 PolarHBondContact O-N 3.49Å; V552-Q554 PolarHBondContact O-N 3.37Å
555	C	36.4	Very low	40.9	Very low	20 Å²	20	79.3 Å²	79.3	14%	0.135	41%	0.405	C	S	.	.			trans	-88.4	119.5	178.4	-60.3	0	0	0	0	108.8	E551 V552 T557 Q560 F561	E551-C555 PolarHBondContact O-N 3.08Å; E551-C555 PolarHBondContact O-SG 2.9Å; E551-C555 VanDerWaalsContact O-SG 3.34Å; V552-C555 PolarHBondContact O-N 3.28Å; V552-C555 VanDerWaalsContact O-N 3.08Å; C555-T557 VanDerWaalsContact C-N 3.32Å; C555-Q560 HydrophobicContact CB-CB 4.48Å; C555-F561 HydrophobicContact CB-CB 4.06Å
556	S	44.5	Very low	41	Very low	97 Å²	97	81.4 Å²	81.4	68%	0.678	41%	0.407	S	S	*	.	S	Bend	trans	-76.7	-21.9	-178.1	56.9	0	0	0	0	112.9	Q560	S556-Q560 PolarHBondContact OG-NE2 2.97Å; S556-Q560 PolarHBondContact OG-OE1 2.93Å
557	T	41.3	Very low	41.1	Very low	68 Å²	68	89.1 Å²	89.1	42%	0.417	44%	0.439	S	S	.	.	S	Bend	trans	-137.7	154.1	178.7	64.5	0	0	0	0	111.6	C555 E559 Q560 F561	C555-T557 VanDerWaalsContact C-N 3.32Å; T557-E559 PolarHBondContact O-N 2.79Å; T557-Q560 PolarHBondContact O-N 3.48Å; T557-Q560 PolarHBondContact OG1-N 3.44Å; T557-F561 PolarHBondContact O-N 3.38Å
558	S	41.1	Very low	41.4	Very low	82 Å²	82	85.8 Å²	85.8	57%	0.573	43%	0.429	S	S	*	.	H	α-helix	trans	-56.1	-35.6	173.1	49.1	0	0	0	0	112	F561 A562	S558-F561 PolarHBondContact O-N 2.72Å; S558-A562 WeakPolarHBondContact O-CB 3.48Å; S558-A562 PolarHBondContact O-N 2.78Å
559	E	46.4	Very low	41.4	Very low	90 Å²	90	87.8 Å²	87.8	42%	0.421	43%	0.434	S	S	.	.	H	α-helix	trans	-65.6	-40.1	177.6	-169.4	-178	175.2	0	0	112.6	T557 A562 K563 Y569	T557-E559 PolarHBondContact O-N 2.79Å; E559-A562 PolarHBondContact O-N 3.13Å; E559-K563 HydrophobicContact CG-CD 4.32Å; E559-K563 WeakPolarHBondContact O-CB 3.49Å; E559-K563 WeakPolarHBondContact O-CG 3.25Å; E559-K563 PolarHBondContact O-N 2.86Å; E559-K563 WeakPolarHBondContact OE1-CE 3.46Å; E559-K563 IonicContact OE1-NZ 2.97Å; E559-K563 PolarHBondContact OE1-NZ 2.99Å; E559-Y569 HydrophobicContact CG-CE1 4.34Å
560	Q	45.8	Very low	41.6	Very low	96 Å²	96	93.1 Å²	93.1	45%	0.449	45%	0.45	S	S	.	.	H	α-helix	trans	-63.3	-43.9	174.6	-79.6	-177	-7	0	0	111.6	C555 S556 T557 A562 R564	C555-Q560 HydrophobicContact CB-CB 4.48Å; S556-Q560 PolarHBondContact OG-NE2 2.97Å; S556-Q560 PolarHBondContact OG-OE1 2.93Å; T557-Q560 PolarHBondContact O-N 3.48Å; T557-Q560 PolarHBondContact OG1-N 3.44Å; Q560-A562 VanDerWaalsContact C-N 3.33Å; Q560-R564 VanDerWaalsContact O-CB 3.26Å; Q560-R564 WeakPolarHBondContact O-CB 3.27Å; Q560-R564 PolarHBondContact O-N 3.37Å
561	F	42.6	Very low	41.7	Very low	7 Å²	7	91.7 Å²	91.7	3%	0.031	45%	0.449	C	S	.	.	H	α-helix	trans	-59.4	-47.8	175	179.5	-95.8	0	0	0	110.3	S507 V552 C555 T557 S558 K563 R564 Y565	S507-F561 WeakPolarHBondContact O-CE1 3.39Å; V552-F561 HydrophobicContact CG2-CD2 3.78Å; V552-F561 HydrophobicContact CG2-CE2 3.48Å; V552-F561 VanDerWaalsContact CG2-CE2 3.48Å; V552-F561 HydrophobicContact CG2-CZ 4.2Å; C555-F561 HydrophobicContact CB-CB 4.06Å; T557-F561 PolarHBondContact O-N 3.38Å; S558-F561 PolarHBondContact O-N 2.72Å; F561-K563 PolarHBondContact O-N 3.36Å; F561-R564 PolarHBondContact O-N 3.41Å; F561-R564 VanDerWaalsContact O-N 3.17Å; F561-Y565 AromaticContact CD2-CD2 3.62Å; F561-Y565 HydrophobicContact CD2-CD2 3.62Å; F561-Y565 AromaticContact CD2-CE2 3.66Å; F561-Y565 HydrophobicContact CD2-CE2 3.66Å; F561-Y565 HydrophobicContact CE1-CD2 4.44Å; F561-Y565 AromaticContact CE2-CD2 3.5Å; F561-Y565 HydrophobicContact CE2-CD2 3.5Å; F561-Y565 VanDerWaalsContact CE2-CD2 3.5Å; F561-Y565 AromaticContact CE2-CE2 3.57Å; F561-Y565 HydrophobicContact CE2-CE2 3.57Å; F561-Y565 HydrophobicContact CE2-CG 4.33Å; F561-Y565 HydrophobicContact CG-CD2 4.15Å; F561-Y565 AromaticContact CZ-CD2 3.95Å; F561-Y565 HydrophobicContact CZ-CD2 3.95Å; F561-Y565 HydrophobicContact CZ-CE2 4.42Å; F561-Y565 HydrophobicContact CZ-CG 4.42Å; F561-Y565 WeakPolarHBondContact O-CD2 3.26Å; F561-Y565 PolarHBondContact O-N 3.46Å
562	A	43.1	Very low	41.4	Very low	11 Å²	11	97 Å²	97	9%	0.091	47%	0.468	C	S	.	.	H	α-helix	trans	-64.1	-44.7	-178.2	0	0	0	0	0	112.7	S558 E559 Q560 R564 Y566 Y569	S558-A562 WeakPolarHBondContact O-CB 3.48Å; S558-A562 PolarHBondContact O-N 2.78Å; E559-A562 PolarHBondContact O-N 3.13Å; Q560-A562 VanDerWaalsContact C-N 3.33Å; A562-R564 VanDerWaalsContact C-N 3.25Å; A562-R564 PolarHBondContact O-N 3.09Å; A562-Y566 HydrophobicContact CB-CD2 3.8Å; A562-Y566 HydrophobicContact CB-CE2 4.12Å; A562-Y566 WeakPolarHBondContact O-CA 3.46Å; A562-Y566 VanDerWaalsContact O-CB 3.25Å; A562-Y566 WeakPolarHBondContact O-CB 3.41Å; A562-Y566 VanDerWaalsContact O-CD2 3.27Å; A562-Y566 WeakPolarHBondContact O-CD2 3.45Å; A562-Y566 PolarHBondContact O-N 3.32Å; A562-Y569 HydrophobicContact CB-CD2 3.46Å; A562-Y569 VanDerWaalsContact CB-CD2 3.46Å; A562-Y569 HydrophobicContact CB-CE2 3.27Å
563	K	46.6	Very low	41.5	Very low	122 Å²	122	98.2 Å²	98.2	53%	0.53	48%	0.476	S	S	.	.	H	α-helix	trans	-61.3	-32.5	174.4	-76.2	177.9	-177.1	167.6	0	113	E559 F561 Y569	E559-K563 HydrophobicContact CG-CD 4.32Å; E559-K563 WeakPolarHBondContact O-CB 3.49Å; E559-K563 WeakPolarHBondContact O-CG 3.25Å; E559-K563 PolarHBondContact O-N 2.86Å; E559-K563 WeakPolarHBondContact OE1-CE 3.46Å; E559-K563 IonicContact OE1-NZ 2.97Å; E559-K563 PolarHBondContact OE1-NZ 2.99Å; F561-K563 PolarHBondContact O-N 3.36Å; K563-Y569 HydrophobicContact CG-CD1 3.7Å; K563-Y569 HydrophobicContact CG-CE1 4.04Å; K563-Y569 HydrophobicContact CG-CG 4.11Å
564	R	43.4	Very low	41.2	Very low	161 Å²	161	97.1 Å²	97.1	61%	0.608	48%	0.477	S	S	*	.	H	α-helix	trans	-79.6	-37.1	-175.8	-156.6	174.5	-165.6	172.4	1.2	112.9	Q560 F561 A562	Q560-R564 VanDerWaalsContact O-CB 3.26Å; Q560-R564 WeakPolarHBondContact O-CB 3.27Å; Q560-R564 PolarHBondContact O-N 3.37Å; F561-R564 PolarHBondContact O-N 3.41Å; F561-R564 VanDerWaalsContact O-N 3.17Å; A562-R564 VanDerWaalsContact C-N 3.25Å; A562-R564 PolarHBondContact O-N 3.09Å
565	Y	40.8	Very low	40.5	Very low	78 Å²	78	104.1 Å²	104.1	31%	0.306	50%	0.498	S	S	.	.	H	α-helix	trans	-103.9	-23.4	-176.2	-67.3	-83.9	0	0	0	114.2	E551 F561	E551-Y565 VanDerWaalsContact CB-OH 3.31Å; E551-Y565 WeakPolarHBondContact CB-OH 3.35Å; E551-Y565 PolarHBondContact OE2-OH 3.18Å; F561-Y565 AromaticContact CD2-CD2 3.62Å; F561-Y565 HydrophobicContact CD2-CD2 3.62Å; F561-Y565 AromaticContact CD2-CE2 3.66Å; F561-Y565 HydrophobicContact CD2-CE2 3.66Å; F561-Y565 HydrophobicContact CE1-CD2 4.44Å; F561-Y565 AromaticContact CE2-CD2 3.5Å; F561-Y565 HydrophobicContact CE2-CD2 3.5Å; F561-Y565 VanDerWaalsContact CE2-CD2 3.5Å; F561-Y565 AromaticContact CE2-CE2 3.57Å; F561-Y565 HydrophobicContact CE2-CE2 3.57Å; F561-Y565 HydrophobicContact CE2-CG 4.33Å; F561-Y565 HydrophobicContact CG-CD2 4.15Å; F561-Y565 AromaticContact CZ-CD2 3.95Å; F561-Y565 HydrophobicContact CZ-CD2 3.95Å; F561-Y565 HydrophobicContact CZ-CE2 4.42Å; F561-Y565 HydrophobicContact CZ-CG 4.42Å; F561-Y565 WeakPolarHBondContact O-CD2 3.26Å; F561-Y565 PolarHBondContact O-N 3.46Å
566	Y	39.4	Very low	40.7	Very low	62 Å²	62	108.3 Å²	108.3	24%	0.243	52%	0.516	C	S	.	.			trans	-96.7	97.1	172.6	-55.7	-67.6	0	0	0	109.4	A562 S568 Y569	A562-Y566 HydrophobicContact CB-CD2 3.8Å; A562-Y566 HydrophobicContact CB-CE2 4.12Å; A562-Y566 WeakPolarHBondContact O-CA 3.46Å; A562-Y566 VanDerWaalsContact O-CB 3.25Å; A562-Y566 WeakPolarHBondContact O-CB 3.41Å; A562-Y566 VanDerWaalsContact O-CD2 3.27Å; A562-Y566 WeakPolarHBondContact O-CD2 3.45Å; A562-Y566 PolarHBondContact O-N 3.32Å; Y566-S568 PolarHBondContact O-N 3.3Å; Y566-Y569 WeakPolarHBondContact O-CB 3.42Å; Y566-Y569 PolarHBondContact O-N 3.19Å
567	K	40.1	Very low	40.5	Very low	214 Å²	214	108.9 Å²	108.9	93%	0.93	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-25.5	166.3	-96.9	-176	175.6	179.7	0	112.2
568	S	41.1	Very low	40.5	Very low	55 Å²	55	111.2 Å²	111.2	39%	0.385	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	25.4	178.7	72.6	0	0	0	0	113.6	Y566 Q570 N571 Y572	Y566-S568 PolarHBondContact O-N 3.3Å; S568-Q570 PolarHBondContact O-N 3.16Å; S568-Q570 VanDerWaalsContact O-N 3.13Å; S568-N571 WeakPolarHBondContact O-CA 3.44Å; S568-N571 WeakPolarHBondContact O-CB 3.15Å; S568-N571 PolarHBondContact O-N 3.3Å; S568-Y572 PolarHBondContact O-N 2.77Å; S568-Y572 VanDerWaalsContact O-N 3.09Å
569	Y	35	Very low	40.4	Very low	66 Å²	66	112.9 Å²	112.9	26%	0.259	51%	0.509	S	S	.	.	H	α-helix	trans	-53.4	-34.9	178.6	-170.7	-103.8	0	0	0	112	E559 A562 K563 Y566 N571 Y572 T573	E559-Y569 HydrophobicContact CG-CE1 4.34Å; A562-Y569 HydrophobicContact CB-CD2 3.46Å; A562-Y569 VanDerWaalsContact CB-CD2 3.46Å; A562-Y569 HydrophobicContact CB-CE2 3.27Å; K563-Y569 HydrophobicContact CG-CD1 3.7Å; K563-Y569 HydrophobicContact CG-CE1 4.04Å; K563-Y569 HydrophobicContact CG-CG 4.11Å; Y566-Y569 WeakPolarHBondContact O-CB 3.42Å; Y566-Y569 PolarHBondContact O-N 3.19Å; Y569-N571 VanDerWaalsContact C-N 3.29Å; Y569-N571 PolarHBondContact O-N 2.68Å; Y569-Y572 PolarHBondContact O-N 3.2Å; Y569-T573 PolarHBondContact O-N 3.45Å
570	Q	40.4	Very low	40	Very low	165 Å²	165	114.3 Å²	114.3	77%	0.771	51%	0.514	S	S	*	.	H	α-helix	trans	-62.5	-30.1	171.9	-77.5	-177.2	-24.7	0	0	114.1	S568 T573	S568-Q570 PolarHBondContact O-N 3.16Å; S568-Q570 VanDerWaalsContact O-N 3.13Å; Q570-T573 PolarHBondContact O-OG1 2.99Å
571	N	40.9	Very low	39.7	Very low	112 Å²	112	115.5 Å²	115.5	60%	0.599	52%	0.519	S	S	*	.	H	α-helix	trans	-82.6	-22.7	175.9	-67	-12.7	0	0	0	112.4	S568 Y569 N574	S568-N571 WeakPolarHBondContact O-CA 3.44Å; S568-N571 WeakPolarHBondContact O-CB 3.15Å; S568-N571 PolarHBondContact O-N 3.3Å; Y569-N571 VanDerWaalsContact C-N 3.29Å; Y569-N571 PolarHBondContact O-N 2.68Å; N571-N574 PolarHBondContact O-N 3.23Å
572	Y	31.8	Very low	39.5	Very low	164 Å²	164	123.3 Å²	123.3	64%	0.643	55%	0.553	S	S	*	*	H	α-helix	trans	-75.1	-26.3	-179.5	-145.7	-82.2	0	0	0	112.2	S568 Y569 N574	S568-Y572 PolarHBondContact O-N 2.77Å; S568-Y572 VanDerWaalsContact O-N 3.09Å; Y569-Y572 PolarHBondContact O-N 3.2Å; Y572-N574 VanDerWaalsContact C-N 3.32Å
573	T	41.6	Very low	39.2	Very low	92 Å²	92	131.9 Å²	131.9	56%	0.564	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-12.6	173.8	49.9	0	0	0	0	113.8	Y569 Q570	Y569-T573 PolarHBondContact O-N 3.45Å; Q570-T573 PolarHBondContact O-OG1 2.99Å
574	N	37.8	Very low	38.6	Very low	139 Å²	139	132.8 Å²	132.8	74%	0.743	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	2.2	-178.4	-74.8	-4.3	0	0	0	113.8	N571 Y572	N571-N574 PolarHBondContact O-N 3.23Å; Y572-N574 VanDerWaalsContact C-N 3.32Å
575	R	30.5	Very low	38.1	Very low	285 Å²	285	130.2 Å²	130.2	100%	1.075	59%	0.593	S	S	*	*			trans	-114.6	0	168	-77	-173.4	176.5	-177.8	-1	108.8

Retrieved 575 of 575 residues in 698.8 ms (Link to these results)

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