A0A3Q0KFY2_SCHMA Loading...

Amiloride-sensitive sodium channel,putative AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KFY2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 504 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	41.8	Very low	33.1	Very low	251 Å²	251	151.8 Å²	151.8	100%	1.236	80%	0.802	S	S	*	*				0	118.9	0	-85.2	168.4	168.9	0	0	107.3
2	L	29.5	Very low	32.5	Very low	170 Å²	170	152.3 Å²	152.3	89%	0.89	81%	0.805	S	S	*	*			trans	-67.1	169.7	-172.5	-83.6	166.5	0	0	0	113.3
3	P	37.5	Very low	32.4	Very low	103 Å²	103	150.7 Å²	150.7	67%	0.669	81%	0.805	S	S	*	*				-129.1	-165.3	-99.2	30.4	-4.4	0	0	0	111
4	L	38.5	Very low	32.3	Very low	171 Å²	171	151.5 Å²	151.5	90%	0.895	81%	0.808	S	S	*	*			trans	177.7	120.8	132.5	-92.7	162.8	0	0	0	111.9
5	E	31	Very low	32	Very low	169 Å²	169	152.5 Å²	152.5	79%	0.79	81%	0.811	S	S	*	*			trans	-65.5	146.2	165.4	-68.2	163.5	124.6	0	0	111.6
6	N	35.2	Very low	31.9	Very low	148 Å²	148	151.8 Å²	151.8	79%	0.791	81%	0.808	S	S	*	*				178.1	131.5	102	-109	-31.3	0	0	0	114
7	N	30	Very low	31.7	Very low	136 Å²	136	151.6 Å²	151.6	73%	0.727	81%	0.807	S	S	*	*			trans	-29.1	140.6	152	-84.5	-25.3	0	0	0	116
8	N	32	Very low	31.7	Very low	127 Å²	127	154.3 Å²	154.3	68%	0.679	81%	0.814	S	S	*	*				162.6	146.1	88.9	-110.7	-15.1	0	0	0	113.3
9	N	30.5	Very low	31.4	Very low	127 Å²	127	158.8 Å²	158.8	68%	0.679	82%	0.819	S	S	*	*			trans	79.1	107.4	139.6	-67.2	-12.9	0	0	0	121.5
10	S	26.6	Very low	31.3	Very low	94 Å²	94	157 Å²	157	66%	0.657	82%	0.821	S	S	*	*				54.6	119.5	122.8	67.8	0	0	0	0	118.9
11	H	32	Very low	31.2	Very low	174 Å²	174	154.3 Å²	154.3	81%	0.806	82%	0.821	S	S	*	*				-167.5	123.7	110.3	-108.1	-75	0	0	0	111.5
12	N	25.8	Very low	30.7	Very low	157 Å²	157	148.5 Å²	148.5	84%	0.84	80%	0.8	S	S	*	*			trans	-61.1	132	160.3	-75.4	-32.2	0	0	0	109.6
13	T	31.2	Very low	30.7	Very low	132 Å²	132	147.8 Å²	147.8	81%	0.81	80%	0.797	S	S	*	*			trans	-137.7	111	156.4	35.1	0	0	0	0	109.8
14	L	31	Very low	30.4	Very low	162 Å²	162	152.7 Å²	152.7	85%	0.848	81%	0.808	S	S	*	*			trans	-55.2	128.1	167.7	-81.3	132.2	0	0	0	110.8
15	I	27.9	Very low	30	Very low	166 Å²	166	153.1 Å²	153.1	85%	0.851	81%	0.81	S	S	*	*			trans	-86.5	108.2	166.2	-63.6	172.7	0	0	0	106.3
16	N	30.4	Very low	29.9	Very low	142 Å²	142	149.4 Å²	149.4	76%	0.759	81%	0.809	S	S	*	*			trans	-116.7	117.1	164.9	-104.9	-4.6	0	0	0	109
17	D	27.6	Very low	29.8	Very low	148 Å²	148	153.1 Å²	153.1	79%	0.791	81%	0.813	S	S	*	*			trans	8.6	111.3	145.3	-92.4	-31.5	0	0	0	117.5
18	Q	32.2	Very low	30	Very low	200 Å²	200	153.8 Å²	153.8	94%	0.935	82%	0.817	S	S	*	*			trans	-143.2	92.5	143.8	-77.2	-158.1	-27.4	0	0	110.8
19	R	27	Very low	30	Very low	241 Å²	241	154 Å²	154	91%	0.909	83%	0.826	S	S	*	*			trans	-67.3	144.9	153.3	-118.8	171.8	178.2	170	-0.3	108.8
20	S	28.3	Very low	30.2	Very low	122 Å²	122	153 Å²	153	85%	0.853	83%	0.827	S	S	*	*			trans	93.9	87.8	169.1	-159.4	0	0	0	0	116.2
21	A	29.1	Very low	30.7	Very low	100 Å²	100	157 Å²	157	83%	0.826	84%	0.835	S	S	*	*			trans	-144.2	69.6	162.6	0	0	0	0	0	109.7
22	T	30.7	Very low	30.9	Very low	129 Å²	129	156 Å²	156	79%	0.791	83%	0.834	S	S	*	*			trans	-145.6	73.2	162.3	51.7	0	0	0	0	108.7
23	D	30.1	Very low	31.6	Very low	156 Å²	156	156 Å²	156	83%	0.834	83%	0.832	S	S	*	*			trans	-162.6	136.3	160.8	-94.2	-31.3	0	0	0	107.2
24	K	31.4	Very low	31.8	Very low	205 Å²	205	158.4 Å²	158.4	89%	0.891	83%	0.834	S	S	*	*			trans	105.1	80.9	177.4	-58.4	166.8	-178.8	179.6	0	115.7
25	L	30.5	Very low	32.1	Very low	181 Å²	181	160.3 Å²	160.3	95%	0.948	84%	0.841	S	S	*	*			trans	-155.8	81	149.4	-112.5	144.3	0	0	0	109.7
26	A	29.6	Very low	32.4	Very low	91 Å²	91	160.9 Å²	160.9	75%	0.752	84%	0.838	S	S	*	*			trans	177	94	152.2	0	0	0	0	0	110
27	Y	31.1	Very low	32.9	Very low	226 Å²	226	161.6 Å²	161.6	89%	0.886	84%	0.836	S	S	*	*			trans	-168.1	107.9	149.9	-118.1	-82	0	0	0	109.2
28	N	35.6	Very low	33.5	Very low	150 Å²	150	159.6 Å²	159.6	80%	0.802	83%	0.832	S	S	*	*			trans	154	111.1	141.7	-83.1	-14.2	0	0	0	112.1
29	C	31.7	Very low	33.6	Very low	130 Å²	130	155.4 Å²	155.4	88%	0.878	82%	0.824	S	S	*	*				-176.1	132.8	114	-103.5	0	0	0	0	111.4
30	P	34.9	Very low	34.1	Very low	107 Å²	107	153.5 Å²	153.5	70%	0.695	82%	0.822	S	S	*	*			trans	-104.2	174	-177.1	35.6	-24.5	0	0	0	114.6
31	H	35.8	Very low	34.9	Very low	177 Å²	177	155.7 Å²	155.7	82%	0.819	82%	0.823	S	S	*	*			trans	80.6	119	168.9	-69.6	-80	0	0	0	118.7
32	I	37.5	Very low	35.8	Very low	155 Å²	155	157.3 Å²	157.3	80%	0.795	82%	0.822	S	S	*	*				-171.1	110.5	119.4	-89.7	154.1	0	0	0	109.9
33	I	40.4	Very low	36.9	Very low	155 Å²	155	160 Å²	160	80%	0.795	82%	0.823	S	S	*	*			trans	57.9	124	134	-52.7	169.4	0	0	0	120.4
34	Q	34.3	Very low	38	Very low	184 Å²	184	162.3 Å²	162.3	86%	0.86	83%	0.826	S	S	*	*			trans	-63.3	138.2	170.5	-66	178.6	-29.2	0	0	113.7
35	M	37.8	Very low	39.4	Very low	201 Å²	201	156.8 Å²	156.8	99%	0.99	81%	0.809	S	S	*	*			trans	-145.5	149.8	142.5	-85	-163.7	169.5	0	0	109.9
36	K	35.1	Very low	41.3	Very low	179 Å²	179	151.1 Å²	151.1	78%	0.778	78%	0.784	S	S	*	*			trans	-98.7	147.5	-153.8	-171.6	-178.9	178.7	-168.1	0	112.9
37	E	41.2	Very low	43.3	Very low	156 Å²	156	153.1 Å²	153.1	73%	0.729	78%	0.781	S	S	*	*			trans	72.6	156.9	158.8	-87.8	165.5	-156.7	0	0	121
38	P	39.9	Very low	45	Very low	107 Å²	107	147.9 Å²	147.9	70%	0.695	77%	0.767	S	S	*	*			cis	-129.8	163.1	-39.4	27.5	-7.4	0	0	0	113.5
39	S	34.3	Very low	46.6	Very low	112 Å²	112	144.2 Å²	144.2	78%	0.783	75%	0.746	S	S	*	*			trans	43.2	94.5	157	63	0	0	0	0	119.5
40	K	37.5	Very low	48.5	Very low	200 Å²	200	142.4 Å²	142.4	87%	0.87	73%	0.726	S	S	*	*			trans	-134.8	125.6	154.3	-86.6	-176	179.9	172.5	0	111	V42	K40-V42 PolarHBondContact O-N 3.2Å; K40-V42 VanDerWaalsContact O-N 3.15Å
41	I	45.4	Very low	50.1	Low	169 Å²	169	140.5 Å²	140.5	87%	0.867	71%	0.709	S	S	*	*			trans	-54.1	113.3	176.2	-62.3	166	0	0	0	108.8	K43	I41-K43 PolarHBondContact O-N 3.42Å; I41-K43 VanDerWaalsContact O-N 3.12Å
42	V	48.2	Very low	51.6	Low	133 Å²	133	132.5 Å²	132.5	81%	0.806	67%	0.673	S	S	*	*			trans	-69.9	105.6	174.9	178	0	0	0	0	108.1	K40 K44	K40-V42 PolarHBondContact O-N 3.2Å; K40-V42 VanDerWaalsContact O-N 3.15Å; V42-K44 PolarHBondContact O-N 3.1Å
43	K	52.2	Low	53.1	Low	186 Å²	186	130 Å²	130	81%	0.809	66%	0.662	S	S	*	*			trans	-64.5	117	167.9	-91.5	-178.8	173.5	179.1	0	108.3	I41 V45	I41-K43 PolarHBondContact O-N 3.42Å; I41-K43 VanDerWaalsContact O-N 3.12Å; K43-V45 VanDerWaalsContact C-N 3.35Å; K43-V45 PolarHBondContact O-N 3.37Å
44	K	53.2	Low	54.5	Low	205 Å²	205	127.3 Å²	127.3	89%	0.891	65%	0.652	S	S	*	*			trans	-61.8	96.7	165.2	-86.4	-178.4	172.8	178.8	0	108.4	V42 S46	V42-K44 PolarHBondContact O-N 3.1Å; K44-S46 PolarHBondContact O-N 3.2Å
45	V	60.5	Low	56.3	Low	89 Å²	89	123.7 Å²	123.7	54%	0.539	63%	0.634	S	S	.	*			trans	-66.3	118.6	165.1	179.3	0	0	0	0	106.4	K43 E49 I50	K43-V45 VanDerWaalsContact C-N 3.35Å; K43-V45 PolarHBondContact O-N 3.37Å; V45-E49 HydrophobicContact CG1-CB 4.08Å; V45-I50 HydrophobicContact CG1-CD1 4.22Å; V45-I50 HydrophobicContact CG1-CG1 3.88Å
46	S	70.3	Confident	57.9	Low	61 Å²	61	120 Å²	120	43%	0.427	63%	0.628	S	S	.	*			trans	-74	144.8	177.9	69.1	0	0	0	0	109.8	K44 L48 E49 I50	K44-S46 PolarHBondContact O-N 3.2Å; S46-L48 PolarHBondContact O-N 2.97Å; S46-L48 VanDerWaalsContact O-N 3.1Å; S46-E49 WeakPolarHBondContact O-CA 3.22Å; S46-E49 WeakPolarHBondContact O-CB 3.37Å; S46-E49 PolarHBondContact O-N 3.04Å; S46-E49 PolarHBondContact OG-N 2.97Å; S46-I50 PolarHBondContact O-N 3.12Å
47	I	72.8	Confident	59.8	Low	134 Å²	134	115.6 Å²	115.6	69%	0.687	61%	0.612	S	S	*	*	H	α-helix	trans	-50.1	-35.2	173	-86.7	164.1	0	0	0	111.6	E49 I50 I51	I47-E49 PolarHBondContact O-N 2.83Å; I47-I50 PolarHBondContact O-N 3.22Å; I47-I51 HydrophobicContact CG2-CD1 3.53Å; I47-I51 HydrophobicContact CG2-CG1 4.3Å; I47-I51 VanDerWaalsContact O-CG1 3.28Å; I47-I51 WeakPolarHBondContact O-CG1 3.3Å; I47-I51 PolarHBondContact O-N 3Å
48	L	67	Low	61.3	Low	115 Å²	115	117.7 Å²	117.7	60%	0.602	61%	0.613	S	S	*	*	H	α-helix	trans	-60	-33.9	176.2	-151.9	94.1	0	0	0	112.6	S46 C52	S46-L48 PolarHBondContact O-N 2.97Å; S46-L48 VanDerWaalsContact O-N 3.1Å; L48-C52 VanDerWaalsContact O-CB 3.31Å; L48-C52 WeakPolarHBondContact O-CB 3.47Å; L48-C52 PolarHBondContact O-N 3.33Å; L48-C52 PolarHBondContact O-SG 3.08Å
49	E	68.2	Low	62.8	Low	74 Å²	74	112.9 Å²	112.9	35%	0.346	58%	0.583	S	S	.	*	H	α-helix	trans	-74.1	-37.7	-179.1	-159.2	169	-167	0	0	111.7	V45 S46 I47 D53 K64	V45-E49 HydrophobicContact CG1-CB 4.08Å; S46-E49 WeakPolarHBondContact O-CA 3.22Å; S46-E49 WeakPolarHBondContact O-CB 3.37Å; S46-E49 PolarHBondContact O-N 3.04Å; S46-E49 PolarHBondContact OG-N 2.97Å; I47-E49 PolarHBondContact O-N 2.83Å; E49-D53 WeakPolarHBondContact O-CB 3.05Å; E49-D53 PolarHBondContact O-N 2.93Å; E49-D53 VanDerWaalsContact O-N 3.15Å; E49-K64 HydrophobicContact CG-CD 4.48Å; E49-K64 WeakPolarHBondContact OE1-CE 3.39Å; E49-K64 IonicContact OE1-NZ 3.06Å; E49-K64 PolarHBondContact OE1-NZ 3.09Å; E49-K64 VanDerWaalsContact OE1-NZ 3.15Å
50	I	71.3	Confident	64.6	Low	92 Å²	92	108.1 Å²	108.1	47%	0.472	55%	0.549	S	S	.	.	H	α-helix	trans	-66.2	-46.9	172.7	-64.1	167.6	0	0	0	109.5	V45 S46 I47 C52 D53 T54	V45-I50 HydrophobicContact CG1-CD1 4.22Å; V45-I50 HydrophobicContact CG1-CG1 3.88Å; S46-I50 PolarHBondContact O-N 3.12Å; I47-I50 PolarHBondContact O-N 3.22Å; I50-C52 PolarHBondContact O-N 3.09Å; I50-D53 PolarHBondContact O-N 3.47Å; I50-T54 HydrophobicContact CG2-CG2 4.22Å; I50-T54 WeakPolarHBondContact O-CB 3.38Å; I50-T54 WeakPolarHBondContact O-CG2 3.2Å; I50-T54 PolarHBondContact O-N 3.45Å; I50-T54 PolarHBondContact O-OG1 3.31Å
51	I	69.7	Low	66.2	Low	66 Å²	66	100.9 Å²	100.9	34%	0.338	53%	0.526	S	S	.	.	H	α-helix	trans	-59.9	-45.6	178.6	-69.9	168.6	0	0	0	110.9	I47 D53 T54 F55 V60	I47-I51 HydrophobicContact CG2-CD1 3.53Å; I47-I51 HydrophobicContact CG2-CG1 4.3Å; I47-I51 VanDerWaalsContact O-CG1 3.28Å; I47-I51 WeakPolarHBondContact O-CG1 3.3Å; I47-I51 PolarHBondContact O-N 3Å; I51-D53 VanDerWaalsContact C-N 3.32Å; I51-D53 PolarHBondContact O-N 2.88Å; I51-T54 PolarHBondContact O-N 3.48Å; I51-F55 HydrophobicContact CB-CD2 4.35Å; I51-F55 HydrophobicContact CG1-CE2 4.48Å; I51-F55 HydrophobicContact CG2-CD2 3.69Å; I51-F55 HydrophobicContact CG2-CE2 3.88Å; I51-F55 HydrophobicContact CG2-CG 4.41Å; I51-F55 WeakPolarHBondContact O-CB 3.32Å; I51-F55 WeakPolarHBondContact O-CD2 3.24Å; I51-F55 PolarHBondContact O-N 3.07Å; I51-V60 HydrophobicContact CG2-CG1 4.45Å
52	C	66.3	Low	67.5	Low	9 Å²	9	98.5 Å²	98.5	6%	0.061	51%	0.506	C	S	.	.	H	α-helix	trans	-66.7	-29.4	179.4	-74.5	0	0	0	0	114.3	L48 I50 K64	L48-C52 VanDerWaalsContact O-CB 3.31Å; L48-C52 WeakPolarHBondContact O-CB 3.47Å; L48-C52 PolarHBondContact O-N 3.33Å; L48-C52 PolarHBondContact O-SG 3.08Å; I50-C52 PolarHBondContact O-N 3.09Å; C52-K64 HydrophobicContact CB-CB 4.41Å; C52-K64 HydrophobicContact CB-CD 4.44Å
53	D	69.8	Low	68.7	Low	104 Å²	104	94.2 Å²	94.2	56%	0.556	48%	0.478	S	S	*	.	H	α-helix	trans	-91.7	-19.6	-179.8	-70.8	-11.8	0	0	0	113	E49 I50 I51 K64	E49-D53 WeakPolarHBondContact O-CB 3.05Å; E49-D53 PolarHBondContact O-N 2.93Å; E49-D53 VanDerWaalsContact O-N 3.15Å; I50-D53 PolarHBondContact O-N 3.47Å; I51-D53 VanDerWaalsContact C-N 3.32Å; I51-D53 PolarHBondContact O-N 2.88Å; D53-K64 WeakPolarHBondContact OD1-CD 3.48Å; D53-K64 IonicContact OD1-NZ 3.31Å; D53-K64 PolarHBondContact OD1-NZ 3.06Å; D53-K64 IonicContact OD2-NZ 3.35Å; D53-K64 PolarHBondContact OD2-NZ 3.28Å
54	T	70.8	Confident	69.6	Low	97 Å²	97	88.5 Å²	88.5	60%	0.595	45%	0.453	S	S	*	.	H	α-helix	trans	-101.6	-27.4	-179	51.7	0	0	0	0	114.7	I50 I51 S56	I50-T54 HydrophobicContact CG2-CG2 4.22Å; I50-T54 WeakPolarHBondContact O-CB 3.38Å; I50-T54 WeakPolarHBondContact O-CG2 3.2Å; I50-T54 PolarHBondContact O-N 3.45Å; I50-T54 PolarHBondContact O-OG1 3.31Å; I51-T54 PolarHBondContact O-N 3.48Å; T54-S56 PolarHBondContact O-N 3.27Å
55	F	71	Confident	70.3	Confident	109 Å²	109	88.2 Å²	88.2	48%	0.478	45%	0.447	S	S	.	.			trans	-71.8	127.7	179.6	-91.7	-107.7	0	0	0	111.7	I51 I57 V60	I51-F55 HydrophobicContact CB-CD2 4.35Å; I51-F55 HydrophobicContact CG1-CE2 4.48Å; I51-F55 HydrophobicContact CG2-CD2 3.69Å; I51-F55 HydrophobicContact CG2-CE2 3.88Å; I51-F55 HydrophobicContact CG2-CG 4.41Å; I51-F55 WeakPolarHBondContact O-CB 3.32Å; I51-F55 WeakPolarHBondContact O-CD2 3.24Å; I51-F55 PolarHBondContact O-N 3.07Å; F55-I57 HydrophobicContact CD1-CD1 3.98Å; F55-I57 HydrophobicContact CD1-CG1 4.32Å; F55-I57 PolarHBondContact O-N 3.4Å; F55-V60 HydrophobicContact CB-CB 4.38Å; F55-V60 HydrophobicContact CB-CG1 4.12Å
56	S	72.3	Confident	70.9	Confident	123 Å²	123	85.7 Å²	85.7	86%	0.86	44%	0.439	S	S	*	.			trans	-68.7	-10	176.1	63.3	0	0	0	0	113.9	T54 R58	T54-S56 PolarHBondContact O-N 3.27Å; S56-R58 PolarHBondContact O-N 2.84Å; S56-R58 VanDerWaalsContact O-N 3.09Å
57	I	73.6	Confident	71.5	Confident	86 Å²	86	86.1 Å²	86.1	44%	0.441	44%	0.44	S	S	.	.			trans	-69.4	108.6	-179.4	-57.2	175.9	0	0	0	108.8	F55 G59 V60 A61	F55-I57 HydrophobicContact CD1-CD1 3.98Å; F55-I57 HydrophobicContact CD1-CG1 4.32Å; F55-I57 PolarHBondContact O-N 3.4Å; I57-G59 PolarHBondContact O-N 2.8Å; I57-V60 HydrophobicContact CB-CB 4.27Å; I57-V60 HydrophobicContact CB-CG2 3.79Å; I57-V60 HydrophobicContact CD1-CG2 4.45Å; I57-V60 HydrophobicContact CG2-CG2 3.81Å; I57-V60 WeakPolarHBondContact O-CB 3.35Å; I57-V60 PolarHBondContact O-N 3Å; I57-A61 PolarHBondContact O-N 3.01Å
58	R	72.9	Confident	71.9	Confident	201 Å²	201	85 Å²	85	76%	0.758	44%	0.442	S	S	*	.	H	α-helix	trans	-51.8	-29.6	-175.7	-165.5	-179.6	-93.3	161.2	-8.4	113.8	S56 R62	S56-R58 PolarHBondContact O-N 2.84Å; S56-R58 VanDerWaalsContact O-N 3.09Å; R58-R62 WeakPolarHBondContact O-CG 3.18Å
59	G	70.8	Confident	72.8	Confident	5 Å²	5	87.2 Å²	87.2	5%	0.052	45%	0.447	C	S	.	.	H	α-helix	trans	-73.4	-34.7	176	0	0	0	0	0	114.3	I57 R62 M63	I57-G59 PolarHBondContact O-N 2.8Å; G59-R62 PolarHBondContact O-N 3.36Å; G59-M63 PolarHBondContact O-N 2.66Å
60	V	73.4	Confident	73.5	Confident	13 Å²	13	87.4 Å²	87.4	8%	0.079	45%	0.449	C	S	.	.	H	α-helix	trans	-71	-41.1	-177.7	178.6	0	0	0	0	110.6	I51 F55 I57 R62 M63 V78	I51-V60 HydrophobicContact CG2-CG1 4.45Å; F55-V60 HydrophobicContact CB-CB 4.38Å; F55-V60 HydrophobicContact CB-CG1 4.12Å; I57-V60 HydrophobicContact CB-CB 4.27Å; I57-V60 HydrophobicContact CB-CG2 3.79Å; I57-V60 HydrophobicContact CD1-CG2 4.45Å; I57-V60 HydrophobicContact CG2-CG2 3.81Å; I57-V60 WeakPolarHBondContact O-CB 3.35Å; I57-V60 PolarHBondContact O-N 3Å; V60-R62 PolarHBondContact O-N 3.27Å; V60-M63 WeakPolarHBondContact O-CB 3.22Å; V60-M63 PolarHBondContact O-N 2.97Å; V60-M63 VanDerWaalsContact O-N 3.12Å; V60-V78 HydrophobicContact CG2-CG1 4.03Å; V60-V78 HydrophobicContact CG2-CG2 4.24Å
61	A	71.6	Confident	74.1	Confident	47 Å²	47	88.4 Å²	88.4	39%	0.388	45%	0.448	S	S	.	.	H	α-helix	trans	-61.3	-27.1	174	0	0	0	0	0	113.5	I57	I57-A61 PolarHBondContact O-N 3.01Å
62	R	71.8	Confident	74.8	Confident	119 Å²	119	87 Å²	87	45%	0.449	45%	0.449	S	S	.	.	H	α-helix	trans	-83.5	-10	179	-69.7	-176.4	178.2	-166.7	-2.3	113.8	R58 G59 V60 K64 R65 W74	R58-R62 WeakPolarHBondContact O-CG 3.18Å; G59-R62 PolarHBondContact O-N 3.36Å; V60-R62 PolarHBondContact O-N 3.27Å; R62-K64 PolarHBondContact O-N 3.43Å; R62-R65 VanDerWaalsContact O-O 3.09Å; R62-W74 HydrophobicContact CB-CB 4.41Å; R62-W74 HydrophobicContact CB-CD2 3.77Å; R62-W74 HydrophobicContact CB-CE3 4.38Å; R62-W74 HydrophobicContact CB-CG 3.71Å; R62-W74 VanDerWaalsContact CD-CZ2 3.42Å; R62-W74 HydrophobicContact CG-CD2 4.46Å
63	M	74.3	Confident	75.9	Confident	44 Å²	44	90.9 Å²	90.9	22%	0.217	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-22.5	172.3	-66.8	173.6	47.5	0	0	112.4	G59 V60 R71 W74 F75 V78	G59-M63 PolarHBondContact O-N 2.66Å; V60-M63 WeakPolarHBondContact O-CB 3.22Å; V60-M63 PolarHBondContact O-N 2.97Å; V60-M63 VanDerWaalsContact O-N 3.12Å; M63-R71 WeakPolarHBondContact O-CD 3.32Å; M63-W74 HydrophobicContact CG-CB 4.4Å; M63-F75 HydrophobicContact CE-CB 4.5Å; M63-F75 HydrophobicContact CE-CD2 3.57Å; M63-F75 HydrophobicContact CE-CE2 4.32Å; M63-F75 HydrophobicContact SD-CD2 4.33Å; M63-V78 HydrophobicContact SD-CG2 4.41Å
64	K	69.7	Low	76.6	Confident	65 Å²	65	88.5 Å²	88.5	28%	0.283	45%	0.452	S	S	.	.	S	Bend	trans	-89	-26.2	-179.3	-168	175.7	178	176.3	0	113.7	E49 C52 D53 R62	E49-K64 HydrophobicContact CG-CD 4.48Å; E49-K64 WeakPolarHBondContact OE1-CE 3.39Å; E49-K64 IonicContact OE1-NZ 3.06Å; E49-K64 PolarHBondContact OE1-NZ 3.09Å; E49-K64 VanDerWaalsContact OE1-NZ 3.15Å; C52-K64 HydrophobicContact CB-CB 4.41Å; C52-K64 HydrophobicContact CB-CD 4.44Å; D53-K64 WeakPolarHBondContact OD1-CD 3.48Å; D53-K64 IonicContact OD1-NZ 3.31Å; D53-K64 PolarHBondContact OD1-NZ 3.06Å; D53-K64 IonicContact OD2-NZ 3.35Å; D53-K64 PolarHBondContact OD2-NZ 3.28Å; R62-K64 PolarHBondContact O-N 3.43Å
65	R	67.7	Low	77.3	Confident	199 Å²	199	88.9 Å²	88.9	75%	0.751	45%	0.445	S	S	*	.	S	Bend	trans	-120.3	132.7	-170.9	-70	-178.1	-178.3	162.3	2.9	112	R62	R62-R65 VanDerWaalsContact O-O 3.09Å
66	G	73.9	Confident	78.2	Confident	36 Å²	36	86.9 Å²	86.9	37%	0.371	44%	0.444	S	S	.	.	S	Bend	trans	121	175.2	177.2	0	0	0	0	0	114.1	R71	G66-R71 VanDerWaalsContact O-CZ 3.27Å; G66-R71 PolarHBondContact O-NE 3.25Å; G66-R71 PolarHBondContact O-NH2 3.14Å
67	P	83.3	Confident	79	Confident	71 Å²	71	85.6 Å²	85.6	46%	0.461	42%	0.423	S	S	.	.			trans	-65.7	156.4	174.4	28.2	-34.1	0	0	0	111.3	F69 L70 R71	P67-F69 PolarHBondContact O-N 3.01Å; P67-F69 VanDerWaalsContact O-N 3.13Å; P67-L70 HydrophobicContact CG-CB 4.04Å; P67-L70 HydrophobicContact CG-CD1 3.56Å; P67-L70 HydrophobicContact CG-CG 4.15Å; P67-L70 PolarHBondContact O-N 3.32Å; P67-R71 PolarHBondContact O-N 3.46Å; P67-R71 VanDerWaalsContact O-N 3.14Å
68	P	81.6	Confident	79.7	Confident	110 Å²	110	82.6 Å²	82.6	71%	0.714	41%	0.409	S	S	*	.	H	α-helix	trans	-55.9	-35.1	-173.5	21.5	-33.5	0	0	0	113.1	R71 G72	P68-R71 PolarHBondContact O-N 3.09Å; P68-G72 PolarHBondContact O-N 2.84Å
69	F	85.1	Confident	80.6	Confident	161 Å²	161	77 Å²	77	71%	0.706	39%	0.394	S	S	*	.	H	α-helix	trans	-60	-49.5	175.3	177.6	-101.8	0	0	0	113.1	P67 R71 G72 L73	P67-F69 PolarHBondContact O-N 3.01Å; P67-F69 VanDerWaalsContact O-N 3.13Å; F69-R71 VanDerWaalsContact C-N 3.33Å; F69-R71 PolarHBondContact O-N 3.44Å; F69-G72 PolarHBondContact O-N 3.04Å; F69-L73 PolarHBondContact O-N 3.47Å
70	L	83.5	Confident	81.7	Confident	78 Å²	78	81.9 Å²	81.9	41%	0.408	42%	0.417	S	S	.	.	H	α-helix	trans	-65.9	-36.2	179.1	-87.7	159.9	0	0	0	111.6	P67 L73 W74	P67-L70 HydrophobicContact CG-CB 4.04Å; P67-L70 HydrophobicContact CG-CD1 3.56Å; P67-L70 HydrophobicContact CG-CG 4.15Å; P67-L70 PolarHBondContact O-N 3.32Å; L70-L73 PolarHBondContact O-N 3.02Å; L70-W74 PolarHBondContact O-N 3.14Å
71	R	82.7	Confident	82.6	Confident	114 Å²	114	86.1 Å²	86.1	43%	0.43	44%	0.438	S	S	.	.	H	α-helix	trans	-63.8	-42.8	174.7	-63.8	-179.3	-166.7	-176.1	2.3	111.8	M63 G66 P67 P68 F69 W74 F75	M63-R71 WeakPolarHBondContact O-CD 3.32Å; G66-R71 VanDerWaalsContact O-CZ 3.27Å; G66-R71 PolarHBondContact O-NE 3.25Å; G66-R71 PolarHBondContact O-NH2 3.14Å; P67-R71 PolarHBondContact O-N 3.46Å; P67-R71 VanDerWaalsContact O-N 3.14Å; P68-R71 PolarHBondContact O-N 3.09Å; F69-R71 VanDerWaalsContact C-N 3.33Å; F69-R71 PolarHBondContact O-N 3.44Å; R71-W74 PolarHBondContact O-N 3.01Å; R71-F75 WeakPolarHBondContact O-CB 3.43Å; R71-F75 PolarHBondContact O-N 3.35Å
72	G	85.6	Confident	83.6	Confident	35 Å²	35	86.8 Å²	86.8	36%	0.361	44%	0.437	S	S	.	.	H	α-helix	trans	-59.5	-45.2	173.9	0	0	0	0	0	111.8	P68 F69 F75 C76	P68-G72 PolarHBondContact O-N 2.84Å; F69-G72 PolarHBondContact O-N 3.04Å; G72-F75 PolarHBondContact O-N 3.22Å; G72-C76 WeakPolarHBondContact O-CB 3.34Å; G72-C76 PolarHBondContact O-N 2.84Å; G72-C76 PolarHBondContact O-SG 3.38Å
73	L	88.1	Confident	84.7	Confident	91 Å²	91	84.5 Å²	84.5	48%	0.476	44%	0.436	S	S	.	.	H	α-helix	trans	-61.9	-45.2	176.6	-169.4	154.5	0	0	0	112.2	F69 L70 C76 F77	F69-L73 PolarHBondContact O-N 3.47Å; L70-L73 PolarHBondContact O-N 3.02Å; L73-C76 PolarHBondContact O-N 2.81Å; L73-F77 WeakPolarHBondContact O-CB 3.39Å; L73-F77 PolarHBondContact O-N 2.96Å
74	W	84.3	Confident	85.8	Confident	54 Å²	54	83.9 Å²	83.9	21%	0.205	44%	0.441	C	S	.	.	H	α-helix	trans	-65.4	-39	175.9	-80.4	106.9	0	0	0	112.7	R62 M63 L70 R71 F77 V78	R62-W74 HydrophobicContact CB-CB 4.41Å; R62-W74 HydrophobicContact CB-CD2 3.77Å; R62-W74 HydrophobicContact CB-CE3 4.38Å; R62-W74 HydrophobicContact CB-CG 3.71Å; R62-W74 VanDerWaalsContact CD-CZ2 3.42Å; R62-W74 HydrophobicContact CG-CD2 4.46Å; M63-W74 HydrophobicContact CG-CB 4.4Å; L70-W74 PolarHBondContact O-N 3.14Å; R71-W74 PolarHBondContact O-N 3.01Å; W74-F77 HydrophobicContact CE3-CD1 4.11Å; W74-F77 AromaticContact CZ3-CD1 4Å; W74-F77 HydrophobicContact CZ3-CD1 4Å; W74-F77 HydrophobicContact CZ3-CE1 4.28Å; W74-F77 PolarHBondContact O-N 3.07Å; W74-V78 WeakPolarHBondContact O-CB 3.44Å; W74-V78 WeakPolarHBondContact O-CG2 3.44Å; W74-V78 PolarHBondContact O-N 2.96Å
75	F	85.4	Confident	87.1	Confident	106 Å²	106	86.1 Å²	86.1	47%	0.465	46%	0.455	S	S	.	.	H	α-helix	trans	-62.7	-48.9	174.3	176	-104.7	0	0	0	111.4	M63 R71 G72 F77 V78 L79	M63-F75 HydrophobicContact CE-CB 4.5Å; M63-F75 HydrophobicContact CE-CD2 3.57Å; M63-F75 HydrophobicContact CE-CE2 4.32Å; M63-F75 HydrophobicContact SD-CD2 4.33Å; R71-F75 WeakPolarHBondContact O-CB 3.43Å; R71-F75 PolarHBondContact O-N 3.35Å; G72-F75 PolarHBondContact O-N 3.22Å; F75-F77 VanDerWaalsContact C-N 3.31Å; F75-F77 PolarHBondContact O-N 3.41Å; F75-V78 PolarHBondContact O-N 3.34Å; F75-L79 HydrophobicContact CE1-CD2 4.41Å; F75-L79 VanDerWaalsContact O-CB 3.24Å; F75-L79 WeakPolarHBondContact O-CB 3.25Å; F75-L79 PolarHBondContact O-N 3.2Å
76	C	90.1	Very high	88.5	Confident	67 Å²	67	82.7 Å²	82.7	45%	0.453	45%	0.451	S	S	.	.	H	α-helix	trans	-59.4	-42	174.9	-69.3	0	0	0	0	111.4	G72 L73 L79 I80	G72-C76 WeakPolarHBondContact O-CB 3.34Å; G72-C76 PolarHBondContact O-N 2.84Å; G72-C76 PolarHBondContact O-SG 3.38Å; L73-C76 PolarHBondContact O-N 2.81Å; C76-L79 PolarHBondContact O-N 2.04Å; C76-I80 WeakPolarHBondContact O-CB 3.34Å; C76-I80 WeakPolarHBondContact O-CD1 3.04Å; C76-I80 WeakPolarHBondContact O-CG1 3.27Å; C76-I80 PolarHBondContact O-N 3.17Å
77	F	89.6	Confident	89.6	Confident	96 Å²	96	85.8 Å²	85.8	42%	0.421	46%	0.459	S	S	.	.	H	α-helix	trans	-62	-49.9	176.6	178	-96.9	0	0	0	112.1	L73 W74 F75 L79 I80 M81	L73-F77 WeakPolarHBondContact O-CB 3.39Å; L73-F77 PolarHBondContact O-N 2.96Å; W74-F77 HydrophobicContact CE3-CD1 4.11Å; W74-F77 AromaticContact CZ3-CD1 4Å; W74-F77 HydrophobicContact CZ3-CD1 4Å; W74-F77 HydrophobicContact CZ3-CE1 4.28Å; W74-F77 PolarHBondContact O-N 3.07Å; F75-F77 VanDerWaalsContact C-N 3.31Å; F75-F77 PolarHBondContact O-N 3.41Å; F77-L79 VanDerWaalsContact C-N 3.33Å; F77-L79 PolarHBondContact O-N 3.42Å; F77-I80 PolarHBondContact O-N 3.32Å; F77-M81 HydrophobicContact CD1-CG 4.27Å; F77-M81 HydrophobicContact CD2-CG 4.36Å; F77-M81 HydrophobicContact CE1-CG 3.87Å; F77-M81 HydrophobicContact CE2-CE 4.22Å; F77-M81 HydrophobicContact CE2-CG 3.98Å; F77-M81 HydrophobicContact CE2-SD 4.3Å; F77-M81 HydrophobicContact CZ-CG 3.71Å; F77-M81 HydrophobicContact CZ-SD 4.18Å; F77-M81 WeakPolarHBondContact O-CB 3.37Å; F77-M81 VanDerWaalsContact O-CG 3.23Å; F77-M81 WeakPolarHBondContact O-CG 3.31Å; F77-M81 PolarHBondContact O-N 2.96Å
78	V	88.8	Confident	90.3	Very high	22 Å²	22	86.4 Å²	86.4	13%	0.133	46%	0.461	C	S	.	.	H	α-helix	trans	-61.3	-43.2	177.3	171.6	0	0	0	0	110.4	V60 M63 W74 F75 M81 T82	V60-V78 HydrophobicContact CG2-CG1 4.03Å; V60-V78 HydrophobicContact CG2-CG2 4.24Å; M63-V78 HydrophobicContact SD-CG2 4.41Å; W74-V78 WeakPolarHBondContact O-CB 3.44Å; W74-V78 WeakPolarHBondContact O-CG2 3.44Å; W74-V78 PolarHBondContact O-N 2.96Å; F75-V78 PolarHBondContact O-N 3.34Å; V78-M81 PolarHBondContact O-N 3.13Å; V78-T82 HydrophobicContact CG1-CG2 4.18Å; V78-T82 WeakPolarHBondContact O-CB 3.44Å; V78-T82 VanDerWaalsContact O-CG2 3.28Å; V78-T82 WeakPolarHBondContact O-CG2 3.38Å; V78-T82 PolarHBondContact O-N 2.99Å; V78-T82 PolarHBondContact O-OG1 3.12Å
79	L	91.2	Very high	91	Very high	85 Å²	85	84.4 Å²	84.4	45%	0.445	45%	0.447	S	S	.	.	H	α-helix	trans	-62	-45.7	177.4	-173.8	73.6	0	0	0	112.2	F75 C76 F77 T82 V83	F75-L79 HydrophobicContact CE1-CD2 4.41Å; F75-L79 VanDerWaalsContact O-CB 3.24Å; F75-L79 WeakPolarHBondContact O-CB 3.25Å; F75-L79 PolarHBondContact O-N 3.2Å; C76-L79 PolarHBondContact O-N 2.04Å; F77-L79 VanDerWaalsContact C-N 3.33Å; F77-L79 PolarHBondContact O-N 3.42Å; L79-T82 WeakPolarHBondContact CA-OG1 3.36Å; L79-T82 PolarHBondContact O-N 3.43Å; L79-T82 PolarHBondContact O-OG1 3.02Å; L79-V83 WeakPolarHBondContact O-CB 3.28Å; L79-V83 WeakPolarHBondContact O-CG2 3.47Å; L79-V83 PolarHBondContact O-N 3.49Å
80	I	94.1	Very high	91.6	Very high	107 Å²	107	83.8 Å²	83.8	55%	0.549	44%	0.441	S	S	.	.	H	α-helix	trans	-64.1	-43	177.7	-69.2	163.6	0	0	0	110.1	C76 F77 G84	C76-I80 WeakPolarHBondContact O-CB 3.34Å; C76-I80 WeakPolarHBondContact O-CD1 3.04Å; C76-I80 WeakPolarHBondContact O-CG1 3.27Å; C76-I80 PolarHBondContact O-N 3.17Å; F77-I80 PolarHBondContact O-N 3.32Å; I80-G84 PolarHBondContact O-N 3.47Å
81	M	92.6	Very high	92.2	Very high	102 Å²	102	84.5 Å²	84.5	50%	0.502	45%	0.445	S	S	.	.	H	α-helix	trans	-67.5	-39.4	178.3	-69	-65.2	113	0	0	112.4	F77 V78 G84 L85	F77-M81 HydrophobicContact CD1-CG 4.27Å; F77-M81 HydrophobicContact CD2-CG 4.36Å; F77-M81 HydrophobicContact CE1-CG 3.87Å; F77-M81 HydrophobicContact CE2-CE 4.22Å; F77-M81 HydrophobicContact CE2-CG 3.98Å; F77-M81 HydrophobicContact CE2-SD 4.3Å; F77-M81 HydrophobicContact CZ-CG 3.71Å; F77-M81 HydrophobicContact CZ-SD 4.18Å; F77-M81 WeakPolarHBondContact O-CB 3.37Å; F77-M81 VanDerWaalsContact O-CG 3.23Å; F77-M81 WeakPolarHBondContact O-CG 3.31Å; F77-M81 PolarHBondContact O-N 2.96Å; V78-M81 PolarHBondContact O-N 3.13Å; M81-G84 PolarHBondContact O-N 2.9Å; M81-L85 WeakPolarHBondContact O-CB 3.46Å; M81-L85 PolarHBondContact O-N 3.49Å
82	T	91.7	Very high	92.9	Very high	61 Å²	61	85 Å²	85	37%	0.374	46%	0.456	S	S	.	.	H	α-helix	trans	-69.5	-41.7	176.8	53.4	0	0	0	0	111.7	V78 L79 G84 L85 L86	V78-T82 HydrophobicContact CG1-CG2 4.18Å; V78-T82 WeakPolarHBondContact O-CB 3.44Å; V78-T82 VanDerWaalsContact O-CG2 3.28Å; V78-T82 WeakPolarHBondContact O-CG2 3.38Å; V78-T82 PolarHBondContact O-N 2.99Å; V78-T82 PolarHBondContact O-OG1 3.12Å; L79-T82 WeakPolarHBondContact CA-OG1 3.36Å; L79-T82 PolarHBondContact O-N 3.43Å; L79-T82 PolarHBondContact O-OG1 3.02Å; T82-G84 VanDerWaalsContact C-N 3.34Å; T82-L85 PolarHBondContact O-N 3.37Å; T82-L86 WeakPolarHBondContact O-CB 3.39Å; T82-L86 VanDerWaalsContact O-CG 3.3Å; T82-L86 WeakPolarHBondContact O-CG 3.06Å; T82-L86 PolarHBondContact O-N 2.96Å
83	V	96.4	Very high	93.4	Very high	71 Å²	71	86.9 Å²	86.9	43%	0.43	46%	0.46	S	S	.	.	H	α-helix	trans	-60.9	-45.3	172.5	170.4	0	0	0	0	110.3	L79 L85 L86 L87	L79-V83 WeakPolarHBondContact O-CB 3.28Å; L79-V83 WeakPolarHBondContact O-CG2 3.47Å; L79-V83 PolarHBondContact O-N 3.49Å; V83-L85 PolarHBondContact O-N 3.19Å; V83-L86 PolarHBondContact O-N 3.18Å; V83-L87 HydrophobicContact CG1-CD1 3.85Å; V83-L87 HydrophobicContact CG1-CG 4.37Å; V83-L87 WeakPolarHBondContact O-CB 3.38Å; V83-L87 VanDerWaalsContact O-CG 3.3Å; V83-L87 WeakPolarHBondContact O-CG 3.29Å; V83-L87 PolarHBondContact O-N 2.95Å
84	G	96.7	Very high	93.7	Very high	31 Å²	31	86.8 Å²	86.8	32%	0.32	46%	0.457	S	S	.	.	H	α-helix	trans	-58	-46.1	175.2	0	0	0	0	0	112.7	I80 M81 T82 L87 T88	I80-G84 PolarHBondContact O-N 3.47Å; M81-G84 PolarHBondContact O-N 2.9Å; T82-G84 VanDerWaalsContact C-N 3.34Å; G84-L87 PolarHBondContact O-N 3.36Å; G84-T88 WeakPolarHBondContact O-CG2 3.48Å; G84-T88 PolarHBondContact O-N 3.43Å; G84-T88 PolarHBondContact O-OG1 3.4Å; G84-T88 VanDerWaalsContact O-OG1 3.12Å
85	L	95.9	Very high	94.2	Very high	111 Å²	111	89.2 Å²	89.2	58%	0.581	47%	0.474	S	S	*	.	H	α-helix	trans	-63.3	-43.3	177	180	65.9	0	0	0	112.5	M81 T82 V83 T88 T89	M81-L85 WeakPolarHBondContact O-CB 3.46Å; M81-L85 PolarHBondContact O-N 3.49Å; T82-L85 PolarHBondContact O-N 3.37Å; V83-L85 PolarHBondContact O-N 3.19Å; L85-T88 PolarHBondContact O-OG1 3.28Å; L85-T88 VanDerWaalsContact O-OG1 3.13Å; L85-T89 VanDerWaalsContact O-CB 3.26Å; L85-T89 WeakPolarHBondContact O-CB 3.14Å; L85-T89 PolarHBondContact O-N 2.84Å; L85-T89 PolarHBondContact O-OG1 2.91Å
86	L	97.2	Very high	94.5	Very high	127 Å²	127	92.3 Å²	92.3	67%	0.665	48%	0.484	S	S	*	.	H	α-helix	trans	-64.1	-42.4	177.9	-72.6	172.5	0	0	0	111.2	T82 V83 Y90	T82-L86 WeakPolarHBondContact O-CB 3.39Å; T82-L86 VanDerWaalsContact O-CG 3.3Å; T82-L86 WeakPolarHBondContact O-CG 3.06Å; T82-L86 PolarHBondContact O-N 2.96Å; V83-L86 PolarHBondContact O-N 3.18Å; L86-Y90 VanDerWaalsContact O-CB 3.28Å; L86-Y90 WeakPolarHBondContact O-CB 3.38Å; L86-Y90 PolarHBondContact O-N 2.99Å
87	L	97.6	Very high	94.7	Very high	102 Å²	102	93.7 Å²	93.7	53%	0.534	49%	0.486	S	S	.	.	H	α-helix	trans	-64.8	-48.2	177.1	-72.7	171.8	0	0	0	112	V83 G84 T89 Y90 L91	V83-L87 HydrophobicContact CG1-CD1 3.85Å; V83-L87 HydrophobicContact CG1-CG 4.37Å; V83-L87 WeakPolarHBondContact O-CB 3.38Å; V83-L87 VanDerWaalsContact O-CG 3.3Å; V83-L87 WeakPolarHBondContact O-CG 3.29Å; V83-L87 PolarHBondContact O-N 2.95Å; G84-L87 PolarHBondContact O-N 3.36Å; L87-T89 VanDerWaalsContact C-N 3.33Å; L87-T89 PolarHBondContact O-N 2.89Å; L87-Y90 PolarHBondContact O-N 3.33Å; L87-L91 WeakPolarHBondContact O-CG 3.44Å; L87-L91 PolarHBondContact O-N 3.12Å
88	T	97.3	Very high	94.8	Very high	83 Å²	83	91.8 Å²	91.8	51%	0.509	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-37.5	179.3	55	0	0	0	0	112.1	G84 L85 L91 L92	G84-T88 WeakPolarHBondContact O-CG2 3.48Å; G84-T88 PolarHBondContact O-N 3.43Å; G84-T88 PolarHBondContact O-OG1 3.4Å; G84-T88 VanDerWaalsContact O-OG1 3.12Å; L85-T88 PolarHBondContact O-OG1 3.28Å; L85-T88 VanDerWaalsContact O-OG1 3.13Å; T88-L91 PolarHBondContact O-N 3.37Å; T88-L92 WeakPolarHBondContact O-CB 3.35Å; T88-L92 PolarHBondContact O-N 3.07Å
89	T	97.5	Very high	94.9	Very high	69 Å²	69	95.8 Å²	95.8	42%	0.423	50%	0.495	S	S	.	.	H	α-helix	trans	-65.3	-43.6	174.8	-54.6	0	0	0	0	111	L85 L87 L91 L92 V93	L85-T89 VanDerWaalsContact O-CB 3.26Å; L85-T89 WeakPolarHBondContact O-CB 3.14Å; L85-T89 PolarHBondContact O-N 2.84Å; L85-T89 PolarHBondContact O-OG1 2.91Å; L87-T89 VanDerWaalsContact C-N 3.33Å; L87-T89 PolarHBondContact O-N 2.89Å; T89-L91 PolarHBondContact O-N 2.93Å; T89-L92 PolarHBondContact O-N 3.45Å; T89-V93 HydrophobicContact CG2-CG2 4.43Å; T89-V93 WeakPolarHBondContact O-CB 3.41Å; T89-V93 VanDerWaalsContact O-CG2 3.28Å; T89-V93 WeakPolarHBondContact O-CG2 3.47Å; T89-V93 PolarHBondContact O-N 3.25Å
90	Y	97.3	Very high	94.9	Very high	147 Å²	147	98.6 Å²	98.6	58%	0.576	51%	0.511	S	S	*	.	H	α-helix	trans	-58.6	-47	175.6	170.4	-93.2	0	0	0	111.6	L86 L87 V93 Q94	L86-Y90 VanDerWaalsContact O-CB 3.28Å; L86-Y90 WeakPolarHBondContact O-CB 3.38Å; L86-Y90 PolarHBondContact O-N 2.99Å; L87-Y90 PolarHBondContact O-N 3.33Å; Y90-V93 PolarHBondContact O-N 3.15Å; Y90-Q94 VanDerWaalsContact CE1-OE1 3.24Å; Y90-Q94 WeakPolarHBondContact O-CB 3.45Å; Y90-Q94 PolarHBondContact O-N 2.83Å; Y90-Q94 PolarHBondContact OH-OE1 3.27Å
91	L	96.9	Very high	94.8	Very high	94 Å²	94	96.6 Å²	96.6	49%	0.492	50%	0.504	S	S	.	.	H	α-helix	trans	-61.9	-45	177.3	-68.1	173.9	0	0	0	111.7	L87 T88 T89 V93 Q94 D95	L87-L91 WeakPolarHBondContact O-CG 3.44Å; L87-L91 PolarHBondContact O-N 3.12Å; T88-L91 PolarHBondContact O-N 3.37Å; T89-L91 PolarHBondContact O-N 2.93Å; L91-V93 VanDerWaalsContact C-N 3.33Å; L91-V93 PolarHBondContact O-N 3.12Å; L91-Q94 WeakPolarHBondContact O-CB 3.31Å; L91-Q94 PolarHBondContact O-N 2.95Å; L91-Q94 VanDerWaalsContact O-N 3.16Å; L91-D95 PolarHBondContact O-N 3.37Å
92	L	96.8	Very high	94.8	Very high	125 Å²	125	96.3 Å²	96.3	65%	0.654	51%	0.512	S	S	*	.	H	α-helix	trans	-62.2	-39.8	178.2	-171.2	66.8	0	0	0	112.5	T88 T89 Y96	T88-L92 WeakPolarHBondContact O-CB 3.35Å; T88-L92 PolarHBondContact O-N 3.07Å; T89-L92 PolarHBondContact O-N 3.45Å; L92-Y96 WeakPolarHBondContact O-CB 3.45Å; L92-Y96 PolarHBondContact O-N 3.5Å
93	V	96.2	Very high	94.9	Very high	74 Å²	74	99.2 Å²	99.2	45%	0.448	53%	0.529	S	S	.	.	H	α-helix	trans	-67.4	-41.4	175.5	171.3	0	0	0	0	110.5	T89 Y90 L91 Y96 L97	T89-V93 HydrophobicContact CG2-CG2 4.43Å; T89-V93 WeakPolarHBondContact O-CB 3.41Å; T89-V93 VanDerWaalsContact O-CG2 3.28Å; T89-V93 WeakPolarHBondContact O-CG2 3.47Å; T89-V93 PolarHBondContact O-N 3.25Å; Y90-V93 PolarHBondContact O-N 3.15Å; L91-V93 VanDerWaalsContact C-N 3.33Å; L91-V93 PolarHBondContact O-N 3.12Å; V93-Y96 PolarHBondContact O-N 3.5Å; V93-L97 HydrophobicContact CG1-CD1 3.85Å; V93-L97 HydrophobicContact CG1-CG 4.33Å; V93-L97 WeakPolarHBondContact O-CB 3.42Å; V93-L97 VanDerWaalsContact O-CG 3.26Å; V93-L97 WeakPolarHBondContact O-CG 3.45Å; V93-L97 PolarHBondContact O-N 3.26Å
94	Q	95.2	Very high	94.8	Very high	89 Å²	89	101.3 Å²	101.3	42%	0.416	54%	0.538	S	S	.	.	H	α-helix	trans	-60.4	-48.3	175.9	-173.7	178	-27.4	0	0	110.8	Y90 L91 Y96 L97 V98	Y90-Q94 VanDerWaalsContact CE1-OE1 3.24Å; Y90-Q94 WeakPolarHBondContact O-CB 3.45Å; Y90-Q94 PolarHBondContact O-N 2.83Å; Y90-Q94 PolarHBondContact OH-OE1 3.27Å; L91-Q94 WeakPolarHBondContact O-CB 3.31Å; L91-Q94 PolarHBondContact O-N 2.95Å; L91-Q94 VanDerWaalsContact O-N 3.16Å; Q94-Y96 VanDerWaalsContact C-N 3.33Å; Q94-Y96 PolarHBondContact O-N 2.94Å; Q94-L97 PolarHBondContact O-N 3.11Å; Q94-L97 VanDerWaalsContact O-N 3.16Å; Q94-V98 WeakPolarHBondContact O-CG2 3.42Å; Q94-V98 PolarHBondContact O-N 3.09Å; Q94-V98 VanDerWaalsContact O-N 3.08Å
95	D	93.8	Very high	94.7	Very high	104 Å²	104	106.8 Å²	106.8	56%	0.556	56%	0.558	S	S	*	*	H	α-helix	trans	-61	-41	177.1	-69.2	-14.3	0	0	0	111.7	L91 L97 V98	L91-D95 PolarHBondContact O-N 3.37Å; D95-L97 VanDerWaalsContact C-N 3.34Å; D95-L97 PolarHBondContact O-N 3.5Å; D95-V98 PolarHBondContact O-N 2.99Å
96	Y	92.4	Very high	94.6	Very high	171 Å²	171	108.5 Å²	108.5	67%	0.671	56%	0.563	S	S	*	*	H	α-helix	trans	-61.8	-40.3	175	179	-99.3	0	0	0	112.5	L92 V93 Q94 V98 Y99	L92-Y96 WeakPolarHBondContact O-CB 3.45Å; L92-Y96 PolarHBondContact O-N 3.5Å; V93-Y96 PolarHBondContact O-N 3.5Å; Q94-Y96 VanDerWaalsContact C-N 3.33Å; Q94-Y96 PolarHBondContact O-N 2.94Å; Y96-V98 VanDerWaalsContact C-N 3.3Å; Y96-V98 PolarHBondContact O-N 3.29Å; Y96-Y99 PolarHBondContact O-N 2.64Å
97	L	93.4	Very high	94.4	Very high	97 Å²	97	107.9 Å²	107.9	51%	0.508	56%	0.564	S	S	.	*	H	α-helix	trans	-78.5	-10.5	-179.7	-67.7	175.2	0	0	0	113.8	V93 Q94 D95 Y99	V93-L97 HydrophobicContact CG1-CD1 3.85Å; V93-L97 HydrophobicContact CG1-CG 4.33Å; V93-L97 WeakPolarHBondContact O-CB 3.42Å; V93-L97 VanDerWaalsContact O-CG 3.26Å; V93-L97 WeakPolarHBondContact O-CG 3.45Å; V93-L97 PolarHBondContact O-N 3.26Å; Q94-L97 PolarHBondContact O-N 3.11Å; Q94-L97 VanDerWaalsContact O-N 3.16Å; D95-L97 VanDerWaalsContact C-N 3.34Å; D95-L97 PolarHBondContact O-N 3.5Å; L97-Y99 WeakPolarHBondContact O-CD2 3.43Å; L97-Y99 WeakPolarHBondContact O-CE2 3.4Å
98	V	92	Very high	94.1	Very high	55 Å²	55	109.4 Å²	109.4	33%	0.333	57%	0.569	S	S	.	*	H	α-helix	trans	-71.7	-20.9	170.1	170	0	0	0	0	111.2	Q94 D95 Y96 D100 Q321	Q94-V98 WeakPolarHBondContact O-CG2 3.42Å; Q94-V98 PolarHBondContact O-N 3.09Å; Q94-V98 VanDerWaalsContact O-N 3.08Å; D95-V98 PolarHBondContact O-N 2.99Å; Y96-V98 VanDerWaalsContact C-N 3.3Å; Y96-V98 PolarHBondContact O-N 3.29Å; V98-D100 HydrophobicContact CG1-CB 4.28Å; V98-D100 PolarHBondContact O-N 2.51Å; V98-Q321 PolarHBondContact O-NE2 3.45Å; V98-Q321 PolarHBondContact O-OE1 3.27Å
99	Y	91.4	Very high	93.6	Very high	106 Å²	106	112.1 Å²	112.1	42%	0.416	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	54.9	40.2	-175.2	-61.4	-89	0	0	0	112.7	Y96 L97 P320	Y96-Y99 PolarHBondContact O-N 2.64Å; L97-Y99 WeakPolarHBondContact O-CD2 3.43Å; L97-Y99 WeakPolarHBondContact O-CE2 3.4Å; Y99-P320 HydrophobicContact CD2-CG 4.11Å; Y99-P320 HydrophobicContact CE2-CG 4.01Å; Y99-P320 HydrophobicContact CG-CG 4.45Å
100	D	91.2	Very high	92.8	Very high	144 Å²	144	117 Å²	117	77%	0.77	60%	0.603	S	S	*	*			trans	-63.3	143.7	177	-164.7	16.6	0	0	0	110.9	V98	V98-D100 HydrophobicContact CG1-CB 4.28Å; V98-D100 PolarHBondContact O-N 2.51Å
101	V	90.5	Very high	92.1	Very high	65 Å²	65	112.4 Å²	112.4	39%	0.394	60%	0.595	S	S	.	*			trans	-123.3	132.9	-173.2	-67.9	0	0	0	0	110.4	L317 T319	V101-L317 HydrophobicContact CG1-CB 4.35Å; V101-L317 HydrophobicContact CG1-CD1 4.06Å; V101-T319 HydrophobicContact CG1-CG2 3.75Å
102	S	92.6	Very high	91.4	Very high	96 Å²	96	113.8 Å²	113.8	67%	0.671	60%	0.597	S	S	*	*			trans	-91.9	141.6	173.7	60.8	0	0	0	0	111.4
103	V	94	Very high	90.9	Very high	123 Å²	123	110 Å²	110	75%	0.745	58%	0.581	S	S	*	*			trans	-86	119.6	174.1	-179.5	0	0	0	0	108.7	I105	V103-I105 HydrophobicContact CG1-CG1 4.28Å
104	N	94.6	Very high	90.7	Very high	114 Å²	114	107.1 Å²	107.1	61%	0.61	56%	0.564	S	S	*	*			trans	-110.4	120.8	174.4	-63.8	-67.6	0	0	0	109.4
105	I	94.5	Very high	90.7	Very high	147 Å²	147	103.6 Å²	103.6	75%	0.754	55%	0.547	S	S	*	.			trans	-100.4	122.7	178.6	-57.1	172.9	0	0	0	107.6	V103	V103-I105 HydrophobicContact CG1-CG1 4.28Å
106	H	93.3	Very high	90.8	Very high	146 Å²	146	98.9 Å²	98.9	68%	0.676	52%	0.522	S	S	*	.			trans	-123.2	131	175.9	-60.9	-71.9	0	0	0	109
107	V	93.3	Very high	90.9	Very high	114 Å²	114	90.7 Å²	90.7	69%	0.691	49%	0.49	S	S	*	.			trans	-101.6	107.8	173.3	-178.5	0	0	0	0	107.1	L109	V107-L109 HydrophobicContact CG1-CD2 3.92Å; V107-L109 HydrophobicContact CG1-CG 4.38Å; V107-L109 PolarHBondContact O-N 3.3Å
108	E	91.2	Very high	91.1	Very high	134 Å²	134	87.6 Å²	87.6	63%	0.626	47%	0.474	S	S	*	.			trans	-90.1	98.5	174.9	-65.8	-179.9	-164.1	0	0	108.1	A111	E108-A111 HydrophobicContact CB-CB 3.81Å
109	L	87.1	Confident	91.4	Very high	141 Å²	141	85 Å²	85	74%	0.738	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	144.2	173.7	-59.6	173.9	0	0	0	109.6	V107 A111	V107-L109 HydrophobicContact CG1-CD2 3.92Å; V107-L109 HydrophobicContact CG1-CG 4.38Å; V107-L109 PolarHBondContact O-N 3.3Å; L109-A111 PolarHBondContact O-N 2.92Å
110	D	81.2	Confident	91.7	Very high	172 Å²	172	80.2 Å²	80.2	92%	0.92	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	5.4	179.5	-52.1	-39.4	0	0	0	116.2	K112	D110-K112 PolarHBondContact O-N 2.91Å
111	A	82.7	Confident	91.9	Very high	49 Å²	49	73.3 Å²	73.3	41%	0.405	40%	0.403	S	S	.	.			trans	-70.6	127.6	171.8	0	0	0	0	0	110	E108 L109 S113	E108-A111 HydrophobicContact CB-CB 3.81Å; L109-A111 PolarHBondContact O-N 2.92Å; A111-S113 PolarHBondContact O-N 2.78Å
112	K	82.7	Confident	92.2	Very high	123 Å²	123	70.4 Å²	70.4	54%	0.535	39%	0.385	S	S	.	.			trans	-59.1	125.5	171	-73	-167	171.8	-166.9	0	109	D110 E244 D245	D110-K112 PolarHBondContact O-N 2.91Å; K112-E244 HydrophobicContact CB-CB 4.43Å; K112-E244 HydrophobicContact CD-CB 4.3Å; K112-D245 IonicContact NZ-OD1 2.74Å; K112-D245 PolarHBondContact NZ-OD1 3.35Å
113	S	85.9	Confident	92.2	Very high	46 Å²	46	66.7 Å²	66.7	32%	0.322	36%	0.357	S	S	.	.			trans	-113.1	142.1	175.8	64	0	0	0	0	109.2	A111 F115 P311	A111-S113 PolarHBondContact O-N 2.78Å; S113-F115 PolarHBondContact O-N 3.01Å; S113-P311 WeakPolarHBondContact OG-CG 3.3Å
114	P	91.5	Very high	92.1	Very high	14 Å²	14	62.4 Å²	62.4	9%	0.091	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-70.6	125.8	-177.8	27.7	-33.1	0	0	0	110.4	A243 Y447 Y449	P114-A243 HydrophobicContact CB-CB 3.86Å; P114-Y447 HydrophobicContact CG-CD1 4.33Å; P114-Y447 HydrophobicContact CG-CD2 4.18Å; P114-Y447 HydrophobicContact CG-CE1 3.98Å; P114-Y447 HydrophobicContact CG-CE2 3.84Å; P114-Y447 HydrophobicContact CG-CG 4.41Å; P114-Y449 WeakPolarHBondContact O-CE1 3.46Å; P114-Y449 PolarHBondContact O-OH 3.44Å
115	F	94.7	Very high	92	Very high	15 Å²	15	57.2 Å²	57.2	7%	0.066	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-54.5	132.2	172.7	-163.5	-87.7	0	0	0	110.7	S113 F219 A243 T246 I249 Y309	S113-F115 PolarHBondContact O-N 3.01Å; F115-F219 HydrophobicContact CD1-CE1 4.09Å; F115-F219 AromaticContact CD1-CZ 3.72Å; F115-F219 HydrophobicContact CD1-CZ 3.72Å; F115-F219 HydrophobicContact CE1-CE1 4.35Å; F115-F219 HydrophobicContact CE1-CZ 4.22Å; F115-F219 HydrophobicContact CG-CZ 4.43Å; F115-A243 WeakPolarHBondContact CB-O 3.48Å; F115-A243 PolarHBondContact N-O 3.44Å; F115-T246 HydrophobicContact CB-CG2 4.39Å; F115-T246 HydrophobicContact CD1-CG2 4.29Å; F115-T246 HydrophobicContact CD2-CG2 3.7Å; F115-T246 WeakPolarHBondContact CD2-O 3.5Å; F115-T246 HydrophobicContact CE2-CG2 4.03Å; F115-T246 HydrophobicContact CG-CG2 3.86Å; F115-T246 HydrophobicContact CZ-CG2 4.47Å; F115-I249 HydrophobicContact CD1-CD1 4.29Å; F115-I249 HydrophobicContact CE1-CB 4.41Å; F115-I249 HydrophobicContact CE1-CD1 3.61Å; F115-I249 HydrophobicContact CE1-CG1 3.95Å; F115-I249 HydrophobicContact CZ-CB 4.01Å; F115-I249 HydrophobicContact CZ-CD1 4.03Å; F115-I249 HydrophobicContact CZ-CG1 3.82Å; F115-Y309 WeakPolarHBondContact CD2-OH 3.07Å; F115-Y309 HydrophobicContact CE2-CE1 4.25Å; F115-Y309 WeakPolarHBondContact CE2-OH 3.25Å
116	P	96.1	Very high	91.9	Very high	4 Å²	4	50.3 Å²	50.3	3%	0.026	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-70.3	168.9	-176.7	26.6	-32.6	0	0	0	113	V283 H284 Y309 Y449	P116-V283 HydrophobicContact CB-CG1 3.44Å; P116-V283 VanDerWaalsContact CB-CG1 3.44Å; P116-V283 HydrophobicContact CG-CG1 3.37Å; P116-H284 WeakPolarHBondContact CB-O 3.38Å; P116-Y309 HydrophobicContact CG-CD1 4.39Å; P116-Y309 HydrophobicContact CG-CD2 4.39Å; P116-Y309 HydrophobicContact CG-CE1 4.16Å; P116-Y309 HydrophobicContact CG-CE2 4.17Å; P116-Y309 HydrophobicContact CG-CG 4.5Å; P116-Y449 HydrophobicContact CB-CD1 3.7Å; P116-Y449 HydrophobicContact CB-CD2 4.02Å; P116-Y449 HydrophobicContact CB-CE1 3.59Å; P116-Y449 HydrophobicContact CB-CE2 3.96Å; P116-Y449 HydrophobicContact CB-CG 3.9Å; P116-Y449 HydrophobicContact CG-CD1 3.92Å; P116-Y449 HydrophobicContact CG-CE1 3.97Å; P116-Y449 HydrophobicContact CG-CG 4.44Å
117	A	96.1	Very high	91.9	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	141.3	159.7	0	0	0	0	0	110.4	T234 F235 E236 H284 P286	A117-T234 HydrophobicContact CB-CG2 3.95Å; A117-F235 CarbonylContact C-O 3.58Å; A117-F235 VanDerWaalsContact CA-O 3.27Å; A117-F235 WeakPolarHBondContact CA-O 3.48Å; A117-E236 HydrophobicContact CB-CB 3.84Å; A117-H284 PolarHBondContact N-O 2.74Å; A117-H284 PolarHBondContact O-N 3.29Å; A117-P286 HydrophobicContact CB-CG 4.49Å
118	L	96.8	Very high	91.8	Very high	32 Å²	32	44.3 Å²	44.3	17%	0.168	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	108.5	179.4	-173.9	69.5	0	0	0	109.5	I120 T234 F235 L251 V281 V283	L118-I120 HydrophobicContact CD2-CD1 3.88Å; L118-I120 HydrophobicContact CD2-CG1 4.25Å; L118-I120 HydrophobicContact CG-CD1 4.2Å; L118-I120 HydrophobicContact CG-CG1 4.04Å; L118-T234 CarbonylContact O-C 3.51Å; L118-T234 WeakPolarHBondContact O-CA 3.26Å; L118-F235 HydrophobicContact CB-CB 4.38Å; L118-F235 PolarHBondContact N-O 2.86Å; L118-F235 PolarHBondContact O-N 3.15Å; L118-L251 HydrophobicContact CD2-CD1 4.04Å; L118-V281 HydrophobicContact CD1-CG1 3.27Å; L118-V281 HydrophobicContact CG-CG1 4.02Å; L118-V283 HydrophobicContact CD1-CG2 3.95Å
119	T	97.6	Very high	91.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	128.2	174.5	-78.5	0	0	0	0	110.3	F224 T234 V281 V282 H284 P290 L292	T119-F224 HydrophobicContact CG2-CE1 3.36Å; T119-F224 HydrophobicContact CG2-CZ 3.67Å; T119-T234 WeakPolarHBondContact OG1-CB 3.39Å; T119-T234 WeakPolarHBondContact OG1-CG2 3.28Å; T119-T234 PolarHBondContact OG1-OG1 2.95Å; T119-V281 CarbonylContact O-C 3.6Å; T119-V281 VanDerWaalsContact O-CA 3.24Å; T119-V281 WeakPolarHBondContact O-CA 3.16Å; T119-V282 PolarHBondContact N-O 3.28Å; T119-V282 PolarHBondContact O-N 2.91Å; T119-H284 PolarHBondContact OG1-NE2 3.33Å; T119-P290 HydrophobicContact CG2-CB 3.66Å; T119-P290 HydrophobicContact CG2-CG 3.89Å; T119-P290 WeakPolarHBondContact OG1-CB 3.17Å; T119-L292 HydrophobicContact CG2-CD2 4.07Å
120	I	97.4	Very high	92.2	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.026	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	129.6	-177.4	-55.2	171.1	0	0	0	109.8	L118 F196 C232 H233 F235 L251 L279 V281	L118-I120 HydrophobicContact CD2-CD1 3.88Å; L118-I120 HydrophobicContact CD2-CG1 4.25Å; L118-I120 HydrophobicContact CG-CD1 4.2Å; L118-I120 HydrophobicContact CG-CG1 4.04Å; I120-F196 HydrophobicContact CB-CE1 4.34Å; I120-F196 HydrophobicContact CB-CZ 4.39Å; I120-F196 HydrophobicContact CD1-CE1 3.89Å; I120-F196 HydrophobicContact CG2-CE1 4.19Å; I120-F196 HydrophobicContact CG2-CZ 4.45Å; I120-C232 WeakPolarHBondContact O-CA 3.39Å; I120-H233 PolarHBondContact N-O 3.06Å; I120-H233 PolarHBondContact O-N 2.87Å; I120-F235 HydrophobicContact CD1-CD2 4.08Å; I120-F235 HydrophobicContact CD1-CE2 4.04Å; I120-L251 HydrophobicContact CD1-CD1 3.22Å; I120-L279 HydrophobicContact CG2-CB 4.31Å; I120-L279 HydrophobicContact CG2-CD1 3.93Å; I120-L279 HydrophobicContact CG2-CD2 4.29Å; I120-L279 HydrophobicContact CG2-CG 4.41Å; I120-V281 HydrophobicContact CG1-CG1 4.35Å; I120-V281 HydrophobicContact CG1-CG2 4.19Å; I120-V281 HydrophobicContact CG2-CG2 4.24Å
121	C	97.1	Very high	92.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	142.2	178.4	-59.5	0	0	0	0	109.7	Y229 C232 L279 R280 L292	C121-Y229 HydrophobicContact CB-CD1 4.39Å; C121-Y229 HydrophobicContact CB-CD2 4.16Å; C121-Y229 HydrophobicContact CB-CG 3.83Å; C121-C232 HydrophobicContact CB-CB 4.16Å; C121-C232 WeakPolarHBondContact CB-SG 3.39Å; C121-C232 WeakPolarHBondContact SG-CB 3.35Å; C121-C232 CovalentContact SG-SG 2.02Å; C121-C232 PolarHBondContact SG-SG 2.76Å; C121-L279 CarbonylContact O-C 3.52Å; C121-L279 WeakPolarHBondContact O-CA 3.26Å; C121-L279 WeakPolarHBondContact O-CB 3.38Å; C121-R280 HydrophobicContact CB-CB 4.25Å; C121-R280 PolarHBondContact N-O 2.88Å; C121-R280 PolarHBondContact O-N 2.04Å; C121-L292 HydrophobicContact CB-CD2 4.49Å; C121-L292 VanDerWaalsContact SG-CD2 3.51Å
122	H	95.2	Very high	93.2	Very high	3 Å²	3	29.4 Å²	29.4	1%	0.014	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.3	171.5	-68.7	66.6	0	0	0	110	H124 H191 Y229 S254 L279	H122-H124 VanDerWaalsContact C-N 3.33Å; H122-H124 VanDerWaalsContact CB-O 3.25Å; H122-H124 WeakPolarHBondContact CB-O 3.41Å; H122-H191 VanDerWaalsContact CB-CD2 3.47Å; H122-H191 WeakPolarHBondContact CB-CD2 3.36Å; H122-H191 AromaticContact CD2-CD2 3.79Å; H122-H191 AromaticContact CD2-NE2 3.72Å; H122-H191 AromaticContact CG-CD2 3.37Å; H122-H191 AromaticContact CG-CG 3.9Å; H122-H191 AromaticContact CG-NE2 3.68Å; H122-H191 AromaticContact ND1-CD2 3.71Å; H122-H191 AromaticContact ND1-CG 3.89Å; H122-Y229 WeakPolarHBondContact O-CD1 3.34Å; H122-S254 PolarHBondContact NE2-O 3.4Å; H122-L279 HydrophobicContact CB-CD2 4.31Å
123	H	92.7	Very high	93.8	Very high	18 Å²	18	23.9 Å²	23.9	8%	0.083	12%	0.122	C	C	.	.	S	Bend	trans	-63	-41.8	172.8	-85.4	-63.8	0	0	0	112	P125 Y229 A276 G278 H298	H123-P125 WeakPolarHBondContact O-CD 3.4Å; H123-Y229 AromaticContact ND1-CE1 3.62Å; H123-A276 HydrophobicContact CB-CB 4.48Å; H123-A276 WeakPolarHBondContact CB-O 3.26Å; H123-G278 PolarHBondContact N-O 2.91Å; H123-H298 AromaticContact CE1-CE1 3.45Å; H123-H298 PolarHBondContact CE1-CE1 3.18Å; H123-H298 VanDerWaalsContact CE1-CE1 3.45Å; H123-H298 AromaticContact CE1-ND1 3.16Å; H123-H298 PolarHBondContact CE1-ND1 2.75Å; H123-H298 AromaticContact NE2-CE1 3.67Å; H123-H298 AromaticContact NE2-CG 3.99Å; H123-H298 AromaticContact NE2-ND1 2.89Å; H123-H298 PolarHBondContact NE2-ND1 3.45Å
124	H	91.7	Very high	94.2	Very high	34 Å²	34	22.4 Å²	22.4	16%	0.157	11%	0.11	C	C	.	.	S	Bend	trans	-85.1	108.6	167.8	177.6	64.4	0	0	0	108.3	H122 F126 Y131 H191 E265	H122-H124 VanDerWaalsContact C-N 3.33Å; H122-H124 VanDerWaalsContact CB-O 3.25Å; H122-H124 WeakPolarHBondContact CB-O 3.41Å; H124-F126 VanDerWaalsContact C-N 3.29Å; H124-F126 PolarHBondContact CD2-O 3.48Å; H124-F126 AromaticContact CE1-CD2 3.72Å; H124-F126 PolarHBondContact NE2-O 3.41Å; H124-F126 PolarHBondContact O-N 3.23Å; H124-Y131 PolarHBondContact NE2-OH 2.98Å; H124-H191 PolarHBondContact O-CD2 3.49Å; H124-H191 PolarHBondContact O-NE2 3.24Å; H124-E265 IonicContact CE1-OE1 2.81Å; H124-E265 PolarHBondContact CE1-OE1 3.38Å; H124-E265 IonicContact CE1-OE2 2.83Å; H124-E265 PolarHBondContact CE1-OE2 3.15Å; H124-E265 VanDerWaalsContact CE1-OE2 3.24Å; H124-E265 IonicContact ND1-OE1 2.69Å; H124-E265 PolarHBondContact ND1-OE1 3.26Å
125	P	92.7	Very high	94.2	Very high	4 Å²	4	29.9 Å²	29.9	3%	0.026	14%	0.136	C	C	.	.			trans	-71.9	-24.1	-167.9	31	-40.1	0	0	0	113.1	H123 L174 G190 H191 F230	H123-P125 WeakPolarHBondContact O-CD 3.4Å; P125-L174 HydrophobicContact CG-CD1 4.17Å; P125-L174 HydrophobicContact CG-CD2 3.92Å; P125-G190 VanDerWaalsContact O-CA 3.24Å; P125-G190 WeakPolarHBondContact O-CA 3.14Å; P125-H191 PolarHBondContact O-CD2 3.34Å; P125-H191 VanDerWaalsContact O-CD2 3.32Å; P125-H191 PolarHBondContact O-N 3.31Å; P125-F230 HydrophobicContact CB-CB 3.85Å; P125-F230 HydrophobicContact CB-CD2 3.46Å; P125-F230 VanDerWaalsContact CB-CD2 3.46Å; P125-F230 HydrophobicContact CB-CE2 4.28Å; P125-F230 HydrophobicContact CB-CG 3.81Å; P125-F230 HydrophobicContact CG-CD2 4.02Å; P125-F230 HydrophobicContact CG-CE2 4.38Å
126	F	93.1	Very high	94.2	Very high	3 Å²	3	34.5 Å²	34.5	1%	0.013	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-88.2	131.3	-165	-53.7	-55.7	0	0	0	112.6	H124 A130 W134 P142 L174 Y177 L189 H191 F230 E265	H124-F126 VanDerWaalsContact C-N 3.29Å; H124-F126 PolarHBondContact CD2-O 3.48Å; H124-F126 AromaticContact CE1-CD2 3.72Å; H124-F126 PolarHBondContact NE2-O 3.41Å; H124-F126 PolarHBondContact O-N 3.23Å; F126-A130 HydrophobicContact CB-CB 3.89Å; F126-W134 HydrophobicContact CB-CH2 3.94Å; F126-W134 AromaticContact CD1-CH2 3.89Å; F126-W134 HydrophobicContact CD1-CH2 3.89Å; F126-W134 AromaticContact CD1-CZ2 3.79Å; F126-W134 HydrophobicContact CD1-CZ2 3.79Å; F126-W134 AromaticContact CD2-CH2 3.57Å; F126-W134 HydrophobicContact CD2-CH2 3.57Å; F126-W134 HydrophobicContact CD2-CZ2 4.21Å; F126-W134 HydrophobicContact CE1-CH2 4.27Å; F126-W134 AromaticContact CE1-CZ2 3.94Å; F126-W134 HydrophobicContact CE1-CZ2 3.94Å; F126-W134 AromaticContact CE2-CH2 3.97Å; F126-W134 HydrophobicContact CE2-CH2 3.97Å; F126-W134 HydrophobicContact CE2-CZ2 4.33Å; F126-W134 AromaticContact CG-CH2 3.51Å; F126-W134 HydrophobicContact CG-CH2 3.51Å; F126-W134 AromaticContact CG-CZ2 3.94Å; F126-W134 HydrophobicContact CG-CZ2 3.94Å; F126-W134 HydrophobicContact CZ-CH2 4.3Å; F126-W134 HydrophobicContact CZ-CZ2 4.19Å; F126-P142 HydrophobicContact CE2-CG 4Å; F126-P142 HydrophobicContact CZ-CG 3.93Å; F126-L174 HydrophobicContact CE1-CD1 4.32Å; F126-L174 HydrophobicContact CE2-CD1 4.09Å; F126-L174 HydrophobicContact CZ-CD1 3.48Å; F126-L174 VanDerWaalsContact CZ-CD1 3.48Å; F126-Y177 AromaticContact CE1-CE1 3.88Å; F126-Y177 HydrophobicContact CE1-CE1 3.88Å; F126-Y177 HydrophobicContact CZ-CD1 4.27Å; F126-Y177 AromaticContact CZ-CE1 3.82Å; F126-Y177 HydrophobicContact CZ-CE1 3.82Å; F126-L189 HydrophobicContact CD1-CB 4.23Å; F126-L189 HydrophobicContact CE1-CD1 4.45Å; F126-H191 PolarHBondContact O-CE1 3.01Å; F126-H191 PolarHBondContact O-NE2 3.4Å; F126-F230 HydrophobicContact CE1-CD1 4.43Å; F126-F230 AromaticContact CE1-CE1 3.94Å; F126-F230 HydrophobicContact CE1-CE1 3.94Å; F126-F230 HydrophobicContact CE1-CE2 4.07Å; F126-F230 AromaticContact CE1-CZ 3.75Å; F126-F230 HydrophobicContact CE1-CZ 3.75Å; F126-F230 HydrophobicContact CZ-CE2 4.49Å; F126-F230 HydrophobicContact CZ-CZ 4.37Å; F126-E265 WeakPolarHBondContact CD2-OE1 3.42Å; F126-E265 HydrophobicContact CE2-CG 4.45Å
127	S	93.3	Very high	94.1	Very high	14 Å²	14	37.2 Å²	37.2	10%	0.098	19%	0.19	C	C	.	.			trans	-80.3	167.9	174.1	67.4	0	0	0	0	111.7	N129 A130 L189	S127-N129 PolarHBondContact O-N 3.49Å; S127-N129 PolarHBondContact OG-N 3Å; S127-A130 WeakPolarHBondContact O-CB 3.41Å; S127-A130 PolarHBondContact O-N 3.37Å; S127-A130 PolarHBondContact OG-N 3.06Å; S127-L189 PolarHBondContact N-O 3.02Å; S127-L189 PolarHBondContact OG-O 3.48Å
128	Q	90.6	Very high	94	Very high	119 Å²	119	41.3 Å²	41.3	56%	0.556	21%	0.212	S	C	*	.	H	α-helix	trans	-56.8	-33.7	171.1	-171	174.1	25	0	0	112.2	A130 Y131 H132 T257	Q128-A130 VanDerWaalsContact C-N 3.26Å; Q128-A130 PolarHBondContact O-N 2.86Å; Q128-Y131 PolarHBondContact O-N 2.7Å; Q128-H132 PolarHBondContact O-CD2 3.43Å; Q128-H132 VanDerWaalsContact O-CD2 3.3Å; Q128-T257 HydrophobicContact CB-CG2 4.42Å; Q128-T257 HydrophobicContact CG-CG2 4.19Å
129	N	92.7	Very high	93.9	Very high	78 Å²	78	40.2 Å²	40.2	42%	0.417	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-30.2	176.4	-174.5	57.2	0	0	0	112.6	S127 Y131 H132 L133 R188	S127-N129 PolarHBondContact O-N 3.49Å; S127-N129 PolarHBondContact OG-N 3Å; N129-Y131 VanDerWaalsContact C-N 3.33Å; N129-Y131 PolarHBondContact O-N 3.24Å; N129-H132 WeakPolarHBondContact O-CB 3.24Å; N129-H132 PolarHBondContact O-N 3.41Å; N129-H132 VanDerWaalsContact O-N 3.14Å; N129-L133 WeakPolarHBondContact O-CG 3.43Å; N129-L133 PolarHBondContact O-N 3.43Å; N129-R188 PolarHBondContact ND2-O 3.1Å
130	A	94	Very high	93.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-57	-45.2	176.3	0	0	0	0	0	112.3	F126 S127 Q128 H132 L133 W134 L189	F126-A130 HydrophobicContact CB-CB 3.89Å; S127-A130 WeakPolarHBondContact O-CB 3.41Å; S127-A130 PolarHBondContact O-N 3.37Å; S127-A130 PolarHBondContact OG-N 3.06Å; Q128-A130 VanDerWaalsContact C-N 3.26Å; Q128-A130 PolarHBondContact O-N 2.86Å; A130-H132 VanDerWaalsContact C-N 3.28Å; A130-H132 PolarHBondContact O-N 3.14Å; A130-L133 PolarHBondContact O-N 3.1Å; A130-L133 VanDerWaalsContact O-N 3.16Å; A130-W134 HydrophobicContact CB-CH2 4.02Å; A130-W134 HydrophobicContact CB-CZ2 3.99Å; A130-W134 HydrophobicContact CB-CZ3 4.28Å; A130-W134 VanDerWaalsContact O-CD2 3.28Å; A130-W134 VanDerWaalsContact O-CG 3.24Å; A130-W134 PolarHBondContact O-N 3.42Å; A130-L189 HydrophobicContact CB-CB 4.29Å; A130-L189 HydrophobicContact CB-CD2 3.7Å
131	Y	92.2	Very high	93.4	Very high	18 Å²	18	42.9 Å²	42.9	7%	0.071	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-34.3	178.5	-64.4	-85.8	0	0	0	112.8	H124 Q128 N129 W134 R135 P259 N260 Q264 E265	H124-Y131 PolarHBondContact NE2-OH 2.98Å; Q128-Y131 PolarHBondContact O-N 2.7Å; N129-Y131 VanDerWaalsContact C-N 3.33Å; N129-Y131 PolarHBondContact O-N 3.24Å; Y131-W134 AromaticContact CD1-CE3 3.96Å; Y131-W134 HydrophobicContact CD1-CE3 3.96Å; Y131-W134 AromaticContact CD1-CZ3 3.84Å; Y131-W134 HydrophobicContact CD1-CZ3 3.84Å; Y131-W134 HydrophobicContact CE1-CE3 4.38Å; Y131-W134 AromaticContact CE1-CZ3 3.83Å; Y131-W134 HydrophobicContact CE1-CZ3 3.83Å; Y131-W134 HydrophobicContact CG-CE3 4.3Å; Y131-W134 HydrophobicContact CG-CZ3 4.25Å; Y131-R135 WeakPolarHBondContact O-CB 3.08Å; Y131-R135 PolarHBondContact O-N 2.9Å; Y131-P259 WeakPolarHBondContact OH-CA 2.99Å; Y131-N260 HydrophobicContact CE1-CB 3.99Å; Y131-N260 PolarHBondContact OH-N 3.12Å; Y131-Q264 PolarHBondContact O-NE2 3.22Å; Y131-Q264 VanDerWaalsContact O-NE2 3.1Å; Y131-Q264 PolarHBondContact O-OE1 3.46Å; Y131-E265 PolarHBondContact OH-OE2 2.98Å
132	H	92.8	Very high	93.3	Very high	87 Å²	87	42.9 Å²	42.9	40%	0.403	22%	0.221	S	C	.	.	H	α-helix	trans	-66.4	-47	173.3	-71.1	-73.5	0	0	0	111.2	Q128 N129 A130 W134 R135 N136	Q128-H132 PolarHBondContact O-CD2 3.43Å; Q128-H132 VanDerWaalsContact O-CD2 3.3Å; N129-H132 WeakPolarHBondContact O-CB 3.24Å; N129-H132 PolarHBondContact O-N 3.41Å; N129-H132 VanDerWaalsContact O-N 3.14Å; A130-H132 VanDerWaalsContact C-N 3.28Å; A130-H132 PolarHBondContact O-N 3.14Å; H132-W134 PolarHBondContact O-N 3.22Å; H132-R135 PolarHBondContact O-N 3.15Å; H132-N136 VanDerWaalsContact O-CG 3.3Å; H132-N136 PolarHBondContact O-N 3.3Å
133	L	95	Very high	93.1	Very high	7 Å²	7	43.3 Å²	43.3	4%	0.037	22%	0.224	C	C	.	.	H	α-helix	trans	-61	-42.6	178.4	-65.3	173.9	0	0	0	112.4	N129 A130 N136 G137 D138 V139 R188 L189	N129-L133 WeakPolarHBondContact O-CG 3.43Å; N129-L133 PolarHBondContact O-N 3.43Å; A130-L133 PolarHBondContact O-N 3.1Å; A130-L133 VanDerWaalsContact O-N 3.16Å; L133-N136 PolarHBondContact O-N 3.4Å; L133-G137 PolarHBondContact O-N 3.05Å; L133-G137 VanDerWaalsContact O-N 3.13Å; L133-D138 HydrophobicContact CD2-CB 4.07Å; L133-D138 PolarHBondContact O-N 3.44Å; L133-V139 HydrophobicContact CB-CB 4.43Å; L133-V139 HydrophobicContact CB-CG2 4.18Å; L133-V139 HydrophobicContact CD1-CG2 4.32Å; L133-R188 HydrophobicContact CD1-CB 3.83Å; L133-L189 HydrophobicContact CB-CD2 4.42Å; L133-L189 HydrophobicContact CD1-CD2 4.05Å
134	W	94.8	Very high	93	Very high	16 Å²	16	47.4 Å²	47.4	6%	0.061	25%	0.246	C	C	.	.	H	α-helix	trans	-67.1	-35.7	176.2	-62.6	-29.6	0	0	0	112.9	F126 A130 Y131 H132 N136 G137 M140 P142 Y177 L189 Q264 E265	F126-W134 HydrophobicContact CB-CH2 3.94Å; F126-W134 AromaticContact CD1-CH2 3.89Å; F126-W134 HydrophobicContact CD1-CH2 3.89Å; F126-W134 AromaticContact CD1-CZ2 3.79Å; F126-W134 HydrophobicContact CD1-CZ2 3.79Å; F126-W134 AromaticContact CD2-CH2 3.57Å; F126-W134 HydrophobicContact CD2-CH2 3.57Å; F126-W134 HydrophobicContact CD2-CZ2 4.21Å; F126-W134 HydrophobicContact CE1-CH2 4.27Å; F126-W134 AromaticContact CE1-CZ2 3.94Å; F126-W134 HydrophobicContact CE1-CZ2 3.94Å; F126-W134 AromaticContact CE2-CH2 3.97Å; F126-W134 HydrophobicContact CE2-CH2 3.97Å; F126-W134 HydrophobicContact CE2-CZ2 4.33Å; F126-W134 AromaticContact CG-CH2 3.51Å; F126-W134 HydrophobicContact CG-CH2 3.51Å; F126-W134 AromaticContact CG-CZ2 3.94Å; F126-W134 HydrophobicContact CG-CZ2 3.94Å; F126-W134 HydrophobicContact CZ-CH2 4.3Å; F126-W134 HydrophobicContact CZ-CZ2 4.19Å; A130-W134 HydrophobicContact CB-CH2 4.02Å; A130-W134 HydrophobicContact CB-CZ2 3.99Å; A130-W134 HydrophobicContact CB-CZ3 4.28Å; A130-W134 VanDerWaalsContact O-CD2 3.28Å; A130-W134 VanDerWaalsContact O-CG 3.24Å; A130-W134 PolarHBondContact O-N 3.42Å; Y131-W134 AromaticContact CD1-CE3 3.96Å; Y131-W134 HydrophobicContact CD1-CE3 3.96Å; Y131-W134 AromaticContact CD1-CZ3 3.84Å; Y131-W134 HydrophobicContact CD1-CZ3 3.84Å; Y131-W134 HydrophobicContact CE1-CE3 4.38Å; Y131-W134 AromaticContact CE1-CZ3 3.83Å; Y131-W134 HydrophobicContact CE1-CZ3 3.83Å; Y131-W134 HydrophobicContact CG-CE3 4.3Å; Y131-W134 HydrophobicContact CG-CZ3 4.25Å; H132-W134 PolarHBondContact O-N 3.22Å; W134-N136 VanDerWaalsContact C-N 3.32Å; W134-G137 PolarHBondContact O-N 3.3Å; W134-M140 PolarHBondContact NE1-O 3.07Å; W134-P142 VanDerWaalsContact CE2-CD 3.43Å; W134-P142 HydrophobicContact CH2-CG 3.91Å; W134-P142 HydrophobicContact CZ2-CG 3.71Å; W134-Y177 PolarHBondContact NE1-OH 2.87Å; W134-L189 HydrophobicContact CZ2-CD1 4.49Å; W134-L189 HydrophobicContact CZ2-CD2 4.19Å; W134-Q264 HydrophobicContact CB-CB 4.41Å; W134-Q264 HydrophobicContact CB-CG 4.38Å; W134-Q264 HydrophobicContact CD2-CB 4.45Å; W134-Q264 HydrophobicContact CE3-CB 3.69Å; W134-Q264 HydrophobicContact CZ3-CB 4.34Å; W134-E265 HydrophobicContact CZ3-CB 4.43Å
135	R	92.4	Very high	93	Very high	171 Å²	171	45.8 Å²	45.8	65%	0.645	24%	0.238	S	C	*	.	H	α-helix	trans	-69.1	-36.4	179.8	-169.1	179.2	-61.1	165.6	4.6	111.3	Y131 H132 G137 Q264	Y131-R135 WeakPolarHBondContact O-CB 3.08Å; Y131-R135 PolarHBondContact O-N 2.9Å; H132-R135 PolarHBondContact O-N 3.15Å; R135-G137 VanDerWaalsContact C-N 3.28Å; R135-Q264 VanDerWaalsContact CA-NE2 3.28Å
136	N	94.2	Very high	92.9	Very high	112 Å²	112	45.6 Å²	45.6	60%	0.599	24%	0.237	S	C	*	.	H	α-helix	trans	-79.1	-13.6	178.4	-65.4	-8	0	0	0	112.7	H132 L133 W134 D138	H132-N136 VanDerWaalsContact O-CG 3.3Å; H132-N136 PolarHBondContact O-N 3.3Å; L133-N136 PolarHBondContact O-N 3.4Å; W134-N136 VanDerWaalsContact C-N 3.32Å; N136-D138 VanDerWaalsContact C-N 3.27Å; N136-D138 WeakPolarHBondContact CB-OD2 3.35Å
137	G	93.1	Very high	92.8	Very high	60 Å²	60	51.8 Å²	51.8	62%	0.619	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	15.3	-175.2	0	0	0	0	0	113.7	L133 W134 R135 V139	L133-G137 PolarHBondContact O-N 3.05Å; L133-G137 VanDerWaalsContact O-N 3.13Å; W134-G137 PolarHBondContact O-N 3.3Å; R135-G137 VanDerWaalsContact C-N 3.28Å; G137-V139 VanDerWaalsContact C-N 3.28Å; G137-V139 PolarHBondContact O-N 3.23Å
138	D	94.5	Very high	92.6	Very high	87 Å²	87	54.6 Å²	54.6	47%	0.465	28%	0.275	S	S	.	.	S	Bend	trans	-69.1	-30.7	179.3	-66.2	-38	0	0	0	111.8	L133 N136	L133-D138 HydrophobicContact CD2-CB 4.07Å; L133-D138 PolarHBondContact O-N 3.44Å; N136-D138 VanDerWaalsContact C-N 3.27Å; N136-D138 WeakPolarHBondContact CB-OD2 3.35Å
139	V	93.9	Very high	92.6	Very high	8 Å²	8	49 Å²	49	5%	0.048	25%	0.249	C	C	.	.	S	Bend	trans	-135.6	140.4	178.5	-174.3	0	0	0	0	108.1	L133 G137 S141 L181 D185 L189	L133-V139 HydrophobicContact CB-CB 4.43Å; L133-V139 HydrophobicContact CB-CG2 4.18Å; L133-V139 HydrophobicContact CD1-CG2 4.32Å; G137-V139 VanDerWaalsContact C-N 3.28Å; G137-V139 PolarHBondContact O-N 3.23Å; V139-S141 PolarHBondContact O-N 3.3Å; V139-L181 HydrophobicContact CG1-CD2 3.79Å; V139-D185 HydrophobicContact CG1-CB 3.95Å; V139-D185 HydrophobicContact CG2-CB 3.93Å; V139-L189 HydrophobicContact CB-CD2 4.39Å; V139-L189 HydrophobicContact CG1-CD1 3.99Å; V139-L189 HydrophobicContact CG1-CD2 4.22Å; V139-L189 HydrophobicContact CG1-CG 4.32Å
140	M	92.3	Very high	92.4	Very high	53 Å²	53	49.7 Å²	49.7	26%	0.261	25%	0.246	S	C	.	.			trans	-57.8	131.4	173.5	175.3	174.3	47.7	0	0	110	W134 I144 F145 Y177 L181 L406	W134-M140 PolarHBondContact NE1-O 3.07Å; M140-I144 HydrophobicContact CG-CB 4.12Å; M140-I144 HydrophobicContact CG-CG2 3.99Å; M140-I144 HydrophobicContact SD-CG2 4.43Å; M140-F145 HydrophobicContact CE-CD2 4.14Å; M140-F145 HydrophobicContact CG-CB 4.39Å; M140-F145 HydrophobicContact SD-CB 4.07Å; M140-F145 HydrophobicContact SD-CD2 4.31Å; M140-Y177 PolarHBondContact O-OH 3.32Å; M140-L181 HydrophobicContact CE-CD2 4.48Å; M140-L406 HydrophobicContact CE-CD1 3.58Å; M140-L406 HydrophobicContact SD-CD1 3.76Å
141	S	93.8	Very high	92.3	Very high	9 Å²	9	54 Å²	54	6%	0.063	27%	0.269	C	S	.	.			trans	-82.7	156	176.6	75.9	0	0	0	0	111.9	V139 S143 I144 F145 Q264	V139-S141 PolarHBondContact O-N 3.3Å; S141-S143 VanDerWaalsContact C-N 3.28Å; S141-S143 PolarHBondContact O-N 3.21Å; S141-I144 PolarHBondContact O-N 2.86Å; S141-I144 VanDerWaalsContact O-N 3.08Å; S141-I144 WeakPolarHBondContact OG-CG1 3.44Å; S141-I144 PolarHBondContact OG-N 2.97Å; S141-F145 PolarHBondContact O-N 3.33Å; S141-F145 VanDerWaalsContact O-N 3.08Å; S141-Q264 WeakPolarHBondContact CB-O 3.47Å; S141-Q264 PolarHBondContact OG-O 2.88Å
142	P	93.3	Very high	92.1	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-49.4	-49	170.9	-29.4	34.8	0	0	0	111.9	F126 W134 I144 F145 N146 Y177 Q264 F268	F126-P142 HydrophobicContact CE2-CG 4Å; F126-P142 HydrophobicContact CZ-CG 3.93Å; W134-P142 VanDerWaalsContact CE2-CD 3.43Å; W134-P142 HydrophobicContact CH2-CG 3.91Å; W134-P142 HydrophobicContact CZ2-CG 3.71Å; P142-I144 VanDerWaalsContact C-N 3.25Å; P142-I144 PolarHBondContact O-N 2.96Å; P142-I144 VanDerWaalsContact O-N 3.12Å; P142-F145 CarbonylContact O-C 3.54Å; P142-F145 WeakPolarHBondContact O-CA 3.35Å; P142-F145 WeakPolarHBondContact O-CB 3.48Å; P142-F145 PolarHBondContact O-N 2.83Å; P142-N146 PolarHBondContact O-N 2.96Å; P142-N146 PolarHBondContact O-OD1 3.44Å; P142-Y177 HydrophobicContact CG-CE1 4.12Å; P142-Q264 WeakPolarHBondContact CD-O 3.23Å; P142-F268 HydrophobicContact CB-CE2 3.94Å; P142-F268 HydrophobicContact CB-CZ 3.73Å; P142-F268 HydrophobicContact CG-CE2 4.4Å; P142-F268 HydrophobicContact CG-CZ 4.34Å
143	S	91.4	Very high	92	Very high	12 Å²	12	50.8 Å²	50.8	8%	0.084	26%	0.256	C	S	.	.	H	α-helix	trans	-53	-39.7	178.6	-61.5	0	0	0	0	114	S141 K147 N263 Q264 E265 Q266	S141-S143 VanDerWaalsContact C-N 3.28Å; S141-S143 PolarHBondContact O-N 3.21Å; S143-K147 VanDerWaalsContact O-CB 3.28Å; S143-K147 WeakPolarHBondContact O-CB 3.4Å; S143-K147 PolarHBondContact O-N 3.07Å; S143-K147 VanDerWaalsContact O-N 3.08Å; S143-N263 PolarHBondContact OG-O 2.92Å; S143-Q264 PolarHBondContact N-O 3.38Å; S143-Q264 VanDerWaalsContact N-O 3.1Å; S143-Q264 PolarHBondContact OG-O 3.48Å; S143-E265 PolarHBondContact OG-N 3.27Å; S143-Q266 PolarHBondContact OG-N 2.86Å
144	I	91.8	Very high	91.9	Very high	104 Å²	104	55.4 Å²	55.4	53%	0.533	28%	0.278	S	S	.	.	H	α-helix	trans	-69.7	-45.2	178.4	-67.4	169.8	0	0	0	109.7	M140 S141 P142 K147 H148	M140-I144 HydrophobicContact CG-CB 4.12Å; M140-I144 HydrophobicContact CG-CG2 3.99Å; M140-I144 HydrophobicContact SD-CG2 4.43Å; S141-I144 PolarHBondContact O-N 2.86Å; S141-I144 VanDerWaalsContact O-N 3.08Å; S141-I144 WeakPolarHBondContact OG-CG1 3.44Å; S141-I144 PolarHBondContact OG-N 2.97Å; P142-I144 VanDerWaalsContact C-N 3.25Å; P142-I144 PolarHBondContact O-N 2.96Å; P142-I144 VanDerWaalsContact O-N 3.12Å; I144-K147 PolarHBondContact O-N 3.46Å; I144-H148 PolarHBondContact O-N 3.18Å
145	F	92.1	Very high	91.8	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60	-52.3	176.3	177.5	-91.9	0	0	0	111.8	M140 S141 P142 K147 H148 M149 I176 Y177 N180 F268 L406	M140-F145 HydrophobicContact CE-CD2 4.14Å; M140-F145 HydrophobicContact CG-CB 4.39Å; M140-F145 HydrophobicContact SD-CB 4.07Å; M140-F145 HydrophobicContact SD-CD2 4.31Å; S141-F145 PolarHBondContact O-N 3.33Å; S141-F145 VanDerWaalsContact O-N 3.08Å; P142-F145 CarbonylContact O-C 3.54Å; P142-F145 WeakPolarHBondContact O-CA 3.35Å; P142-F145 WeakPolarHBondContact O-CB 3.48Å; P142-F145 PolarHBondContact O-N 2.83Å; F145-K147 VanDerWaalsContact C-N 3.3Å; F145-K147 PolarHBondContact O-N 3.43Å; F145-H148 WeakPolarHBondContact O-CA 3.39Å; F145-H148 WeakPolarHBondContact O-CB 3.28Å; F145-H148 PolarHBondContact O-N 3.07Å; F145-M149 HydrophobicContact CD1-CG 4.14Å; F145-M149 HydrophobicContact CE1-CG 3.6Å; F145-M149 HydrophobicContact CE1-SD 4.44Å; F145-M149 HydrophobicContact CE2-CG 4.25Å; F145-M149 HydrophobicContact CE2-SD 4.26Å; F145-M149 HydrophobicContact CZ-CG 3.63Å; F145-M149 HydrophobicContact CZ-SD 3.86Å; F145-M149 WeakPolarHBondContact O-CG 3.4Å; F145-M149 PolarHBondContact O-N 3.49Å; F145-I176 HydrophobicContact CZ-CB 4.39Å; F145-I176 HydrophobicContact CZ-CG2 3.73Å; F145-Y177 HydrophobicContact CB-CD2 3.69Å; F145-Y177 HydrophobicContact CB-CE2 4.13Å; F145-Y177 HydrophobicContact CD1-CD2 4.03Å; F145-Y177 HydrophobicContact CD1-CG 4.41Å; F145-Y177 HydrophobicContact CD2-CD2 4.04Å; F145-Y177 AromaticContact CG-CD2 3.63Å; F145-Y177 HydrophobicContact CG-CD2 3.63Å; F145-Y177 HydrophobicContact CG-CG 4.43Å; F145-N180 HydrophobicContact CD2-CB 4.47Å; F145-N180 HydrophobicContact CE2-CB 3.99Å; F145-F268 AromaticContact CD1-CE1 3.91Å; F145-F268 HydrophobicContact CD1-CE1 3.91Å; F145-F268 HydrophobicContact CE1-CE1 4.23Å; F145-L406 HydrophobicContact CD2-CD1 3.62Å; F145-L406 HydrophobicContact CE2-CD1 3.83Å
146	N	90.5	Very high	91.7	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.3	-43.9	178.5	-56.3	118.1	0	0	0	110.9	P142 H148 M149 R150 D172 Q266 F268	P142-N146 PolarHBondContact O-N 2.96Å; P142-N146 PolarHBondContact O-OD1 3.44Å; N146-H148 VanDerWaalsContact C-N 3.31Å; N146-H148 PolarHBondContact O-N 3.26Å; N146-M149 PolarHBondContact O-N 3.4Å; N146-R150 WeakPolarHBondContact O-CB 3.19Å; N146-R150 VanDerWaalsContact O-CG 3.25Å; N146-R150 WeakPolarHBondContact O-CG 3.39Å; N146-R150 PolarHBondContact O-N 2.96Å; N146-D172 WeakPolarHBondContact CA-OD1 3.41Å; N146-D172 WeakPolarHBondContact CB-OD1 3.46Å; N146-D172 PolarHBondContact ND2-OD1 2.85Å; N146-Q266 PolarHBondContact OD1-O 3.07Å; N146-F268 WeakPolarHBondContact ND2-CD1 3.33Å; N146-F268 WeakPolarHBondContact ND2-CE1 3.33Å
147	K	90.2	Very high	91.7	Very high	133 Å²	133	52 Å²	52	58%	0.578	27%	0.267	S	S	*	.	H	α-helix	trans	-62.4	-39.7	177.2	-174	179.4	-178.3	-179.2	0	111.6	S143 I144 F145 N151	S143-K147 VanDerWaalsContact O-CB 3.28Å; S143-K147 WeakPolarHBondContact O-CB 3.4Å; S143-K147 PolarHBondContact O-N 3.07Å; S143-K147 VanDerWaalsContact O-N 3.08Å; I144-K147 PolarHBondContact O-N 3.46Å; F145-K147 VanDerWaalsContact C-N 3.3Å; F145-K147 PolarHBondContact O-N 3.43Å; K147-N151 WeakPolarHBondContact O-CB 3.28Å; K147-N151 PolarHBondContact O-N 3.33Å; K147-N151 PolarHBondContact O-ND2 3.2Å
148	H	89.5	Confident	91.8	Very high	73 Å²	73	55.8 Å²	55.8	34%	0.338	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-48.9	175.7	-169.8	84.6	0	0	0	111	I144 F145 N146 R150 N151 L152 L406	I144-H148 PolarHBondContact O-N 3.18Å; F145-H148 WeakPolarHBondContact O-CA 3.39Å; F145-H148 WeakPolarHBondContact O-CB 3.28Å; F145-H148 PolarHBondContact O-N 3.07Å; N146-H148 VanDerWaalsContact C-N 3.31Å; N146-H148 PolarHBondContact O-N 3.26Å; H148-R150 PolarHBondContact O-N 2.83Å; H148-N151 PolarHBondContact O-N 3.16Å; H148-L152 VanDerWaalsContact CD2-CD1 3.46Å; H148-L152 WeakPolarHBondContact CD2-CD1 3.46Å; H148-L152 WeakPolarHBondContact NE2-CD1 3.46Å; H148-L152 WeakPolarHBondContact O-CG 3.45Å; H148-L152 PolarHBondContact O-N 3.13Å; H148-L406 VanDerWaalsContact CD2-CD2 3.41Å; H148-L406 WeakPolarHBondContact CD2-CD2 3.43Å; H148-L406 WeakPolarHBondContact NE2-CD2 3.27Å
149	M	89.3	Confident	91.7	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-57.5	-47	176.7	-66.5	-52.9	-56.8	0	0	112.1	F145 N146 N151 L152 T153 L168 Y171 D172 I405	F145-M149 HydrophobicContact CD1-CG 4.14Å; F145-M149 HydrophobicContact CE1-CG 3.6Å; F145-M149 HydrophobicContact CE1-SD 4.44Å; F145-M149 HydrophobicContact CE2-CG 4.25Å; F145-M149 HydrophobicContact CE2-SD 4.26Å; F145-M149 HydrophobicContact CZ-CG 3.63Å; F145-M149 HydrophobicContact CZ-SD 3.86Å; F145-M149 WeakPolarHBondContact O-CG 3.4Å; F145-M149 PolarHBondContact O-N 3.49Å; N146-M149 PolarHBondContact O-N 3.4Å; M149-N151 PolarHBondContact O-N 2.8Å; M149-L152 WeakPolarHBondContact O-CB 3.2Å; M149-L152 PolarHBondContact O-N 3.32Å; M149-L152 HydrophobicContact SD-CD1 4.42Å; M149-T153 PolarHBondContact O-N 3.04Å; M149-T153 PolarHBondContact O-OG1 3.3Å; M149-L168 HydrophobicContact CE-CB 4.42Å; M149-L168 HydrophobicContact CE-CD2 3.8Å; M149-Y171 VanDerWaalsContact CE-CB 3.43Å; M149-D172 HydrophobicContact CB-CB 4.49Å; M149-I405 HydrophobicContact CE-CD1 4.22Å; M149-I405 HydrophobicContact SD-CD1 4.32Å
150	R	90.2	Very high	91.7	Very high	92 Å²	92	63 Å²	63	35%	0.347	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-38.9	178	-69	169.9	-169.4	168	6	113	N146 H148 L152 T153 H154 D172 A267	N146-R150 WeakPolarHBondContact O-CB 3.19Å; N146-R150 VanDerWaalsContact O-CG 3.25Å; N146-R150 WeakPolarHBondContact O-CG 3.39Å; N146-R150 PolarHBondContact O-N 2.96Å; H148-R150 PolarHBondContact O-N 2.83Å; R150-L152 VanDerWaalsContact C-N 3.34Å; R150-T153 PolarHBondContact O-N 3.27Å; R150-H154 VanDerWaalsContact O-CB 3.31Å; R150-H154 WeakPolarHBondContact O-CB 3.31Å; R150-H154 PolarHBondContact O-N 3.22Å; R150-D172 IonicContact CZ-OD2 3.15Å; R150-D172 IonicContact NE-OD2 3.18Å; R150-D172 PolarHBondContact NE-OD2 3.46Å; R150-D172 IonicContact NH2-OD2 3.33Å; R150-A267 PolarHBondContact NH2-O 3.1Å
151	N	90.9	Very high	91.6	Very high	92 Å²	92	63.7 Å²	63.7	49%	0.492	31%	0.313	S	S	.	.	H	α-helix	trans	-65.8	-38.5	175.8	-76.2	-13.6	0	0	0	111.7	K147 H148 M149 H154 K155	K147-N151 WeakPolarHBondContact O-CB 3.28Å; K147-N151 PolarHBondContact O-N 3.33Å; K147-N151 PolarHBondContact O-ND2 3.2Å; H148-N151 PolarHBondContact O-N 3.16Å; M149-N151 PolarHBondContact O-N 2.8Å; N151-H154 PolarHBondContact O-N 3.03Å; N151-K155 PolarHBondContact O-N 3Å
152	L	88.6	Confident	91.5	Very high	18 Å²	18	67.1 Å²	67.1	9%	0.094	33%	0.333	C	S	.	.	H	α-helix	trans	-64.6	-51.5	174.1	-69.3	172.2	0	0	0	110.8	H148 M149 R150 H154 K155 F156 L168 F410	H148-L152 VanDerWaalsContact CD2-CD1 3.46Å; H148-L152 WeakPolarHBondContact CD2-CD1 3.46Å; H148-L152 WeakPolarHBondContact NE2-CD1 3.46Å; H148-L152 WeakPolarHBondContact O-CG 3.45Å; H148-L152 PolarHBondContact O-N 3.13Å; M149-L152 WeakPolarHBondContact O-CB 3.2Å; M149-L152 PolarHBondContact O-N 3.32Å; M149-L152 HydrophobicContact SD-CD1 4.42Å; R150-L152 VanDerWaalsContact C-N 3.34Å; L152-H154 VanDerWaalsContact C-N 3.26Å; L152-H154 PolarHBondContact O-N 3.17Å; L152-K155 WeakPolarHBondContact O-CB 3.44Å; L152-K155 PolarHBondContact O-N 3.11Å; L152-F156 VanDerWaalsContact O-CD2 3.22Å; L152-F156 WeakPolarHBondContact O-CD2 3.49Å; L152-F156 PolarHBondContact O-N 2.94Å; L152-L168 HydrophobicContact CB-CD1 4.38Å; L152-F410 HydrophobicContact CB-CZ 4.42Å; L152-F410 HydrophobicContact CD1-CD1 4.45Å; L152-F410 HydrophobicContact CD1-CD2 3.81Å; L152-F410 HydrophobicContact CD1-CE1 4.02Å; L152-F410 HydrophobicContact CD1-CE2 3.37Å; L152-F410 HydrophobicContact CD1-CG 4.36Å; L152-F410 HydrophobicContact CD1-CZ 3.54Å; L152-F410 HydrophobicContact CD2-CD1 3.69Å; L152-F410 HydrophobicContact CD2-CD2 4.45Å; L152-F410 HydrophobicContact CD2-CE1 3.5Å; L152-F410 HydrophobicContact CD2-CE2 4.35Å; L152-F410 HydrophobicContact CD2-CG 4.18Å; L152-F410 HydrophobicContact CD2-CZ 3.93Å; L152-F410 HydrophobicContact CG-CE1 4.24Å; L152-F410 HydrophobicContact CG-CE2 4.41Å; L152-F410 HydrophobicContact CG-CZ 4.17Å
153	T	90.6	Very high	91.3	Very high	19 Å²	19	72.9 Å²	72.9	12%	0.117	36%	0.364	C	S	.	.	H	α-helix	trans	-52.6	-46	174.5	-59.2	0	0	0	0	111.2	M149 R150 K155 F156 L157 A165	M149-T153 PolarHBondContact O-N 3.04Å; M149-T153 PolarHBondContact O-OG1 3.3Å; R150-T153 PolarHBondContact O-N 3.27Å; T153-K155 PolarHBondContact O-N 3.01Å; T153-F156 PolarHBondContact O-N 3.23Å; T153-L157 HydrophobicContact CG2-CD1 4.23Å; T153-L157 WeakPolarHBondContact O-CG 3.36Å; T153-L157 PolarHBondContact O-N 3.15Å; T153-A165 HydrophobicContact CG2-CB 4.11Å
154	H	92.9	Very high	91.1	Very high	104 Å²	104	73 Å²	73	48%	0.481	37%	0.366	S	S	.	.	H	α-helix	trans	-61.2	-40.7	176.9	179.1	-122.9	0	0	0	112.8	R150 N151 L152 L157 M158	R150-H154 VanDerWaalsContact O-CB 3.31Å; R150-H154 WeakPolarHBondContact O-CB 3.31Å; R150-H154 PolarHBondContact O-N 3.22Å; N151-H154 PolarHBondContact O-N 3.03Å; L152-H154 VanDerWaalsContact C-N 3.26Å; L152-H154 PolarHBondContact O-N 3.17Å; H154-L157 PolarHBondContact O-N 3.33Å; H154-M158 WeakPolarHBondContact O-CG 3.43Å; H154-M158 PolarHBondContact O-N 3.46Å
155	K	91.6	Very high	91	Very high	122 Å²	122	68.2 Å²	68.2	53%	0.53	34%	0.342	S	S	.	.	H	α-helix	trans	-59.7	-46.6	175.6	-176.9	-175.6	173.3	-172.9	0	111.4	N151 L152 T153 L157 M158 D159	N151-K155 PolarHBondContact O-N 3Å; L152-K155 WeakPolarHBondContact O-CB 3.44Å; L152-K155 PolarHBondContact O-N 3.11Å; T153-K155 PolarHBondContact O-N 3.01Å; K155-L157 VanDerWaalsContact C-N 3.33Å; K155-L157 PolarHBondContact O-N 3.08Å; K155-M158 WeakPolarHBondContact O-CB 3.31Å; K155-M158 PolarHBondContact O-N 2.97Å; K155-M158 VanDerWaalsContact O-N 3.09Å; K155-D159 PolarHBondContact O-N 3.39Å
156	F	90.7	Very high	90.8	Very high	15 Å²	15	73.6 Å²	73.6	7%	0.066	37%	0.367	C	S	.	.	H	α-helix	trans	-64.6	-36.4	177.6	-79.7	-75.8	0	0	0	113.8	L152 T153 M158 D159 N160 D161 A164 A165 L168 F410 I412	L152-F156 VanDerWaalsContact O-CD2 3.22Å; L152-F156 WeakPolarHBondContact O-CD2 3.49Å; L152-F156 PolarHBondContact O-N 2.94Å; T153-F156 PolarHBondContact O-N 3.23Å; F156-M158 VanDerWaalsContact C-N 3.29Å; F156-M158 PolarHBondContact O-N 3.43Å; F156-D159 CarbonylContact O-C 3.55Å; F156-D159 PolarHBondContact O-N 3.08Å; F156-N160 PolarHBondContact O-N 2.94Å; F156-N160 VanDerWaalsContact O-N 3.1Å; F156-D161 HydrophobicContact CD1-CB 4.04Å; F156-D161 PolarHBondContact O-N 3.04Å; F156-A164 HydrophobicContact CD1-CB 3.54Å; F156-A164 HydrophobicContact CE1-CB 3.59Å; F156-A164 HydrophobicContact CG-CB 4Å; F156-A164 HydrophobicContact CZ-CB 4.13Å; F156-A165 HydrophobicContact CB-CB 3.92Å; F156-L168 HydrophobicContact CD2-CD1 3.28Å; F156-L168 HydrophobicContact CE2-CD1 3.1Å; F156-L168 HydrophobicContact CG-CD1 4.34Å; F156-L168 HydrophobicContact CZ-CD1 4Å; F156-F410 AromaticContact CE2-CE1 3.94Å; F156-F410 HydrophobicContact CE2-CE1 3.94Å; F156-F410 HydrophobicContact CE2-CZ 4.21Å; F156-F410 HydrophobicContact CZ-CE1 4.38Å; F156-I412 HydrophobicContact CE1-CD1 3.85Å; F156-I412 HydrophobicContact CE1-CG1 4.46Å; F156-I412 HydrophobicContact CE1-CG2 4.22Å; F156-I412 HydrophobicContact CE2-CD1 3.77Å; F156-I412 HydrophobicContact CE2-CG1 4Å; F156-I412 HydrophobicContact CZ-CB 4.12Å; F156-I412 HydrophobicContact CZ-CD1 3.07Å; F156-I412 HydrophobicContact CZ-CG1 3.42Å; F156-I412 VanDerWaalsContact CZ-CG1 3.42Å; F156-I412 HydrophobicContact CZ-CG2 3.65Å
157	L	93.8	Very high	90.6	Very high	91 Å²	91	76.3 Å²	76.3	48%	0.476	38%	0.383	S	S	.	.	H	α-helix	trans	-62.3	-38.6	171.9	-69.2	171.4	0	0	0	111.5	T153 H154 K155 D159 N160 A165	T153-L157 HydrophobicContact CG2-CD1 4.23Å; T153-L157 WeakPolarHBondContact O-CG 3.36Å; T153-L157 PolarHBondContact O-N 3.15Å; H154-L157 PolarHBondContact O-N 3.33Å; K155-L157 VanDerWaalsContact C-N 3.33Å; K155-L157 PolarHBondContact O-N 3.08Å; L157-D159 VanDerWaalsContact C-N 3.33Å; L157-N160 PolarHBondContact O-N 3.32Å; L157-A165 HydrophobicContact CD2-CB 3.61Å; L157-A165 HydrophobicContact CG-CB 3.71Å
158	M	95.2	Very high	90.4	Very high	139 Å²	139	70.2 Å²	70.2	69%	0.685	36%	0.357	S	S	*	.	H	α-helix	trans	-68.9	-30.9	174.8	-67.9	-57.4	-147.2	0	0	113	H154 K155 F156 N160	H154-M158 WeakPolarHBondContact O-CG 3.43Å; H154-M158 PolarHBondContact O-N 3.46Å; K155-M158 WeakPolarHBondContact O-CB 3.31Å; K155-M158 PolarHBondContact O-N 2.97Å; K155-M158 VanDerWaalsContact O-N 3.09Å; F156-M158 VanDerWaalsContact C-N 3.29Å; F156-M158 PolarHBondContact O-N 3.43Å; M158-N160 PolarHBondContact O-N 2.98Å
159	D	92.8	Very high	90.2	Very high	108 Å²	108	72.1 Å²	72.1	58%	0.578	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	1.6	174.4	-64.6	-24.1	0	0	0	112.6	K155 F156 L157 D161	K155-D159 PolarHBondContact O-N 3.39Å; F156-D159 CarbonylContact O-C 3.55Å; F156-D159 PolarHBondContact O-N 3.08Å; L157-D159 VanDerWaalsContact C-N 3.33Å; D159-D161 VanDerWaalsContact C-N 3.25Å; D159-D161 PolarHBondContact O-N 3.12Å
160	N	93.7	Very high	90.1	Very high	139 Å²	139	77.5 Å²	77.5	74%	0.743	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	27.5	-178.8	-159.1	44.9	0	0	0	114.3	F156 L157 M158	F156-N160 PolarHBondContact O-N 2.94Å; F156-N160 VanDerWaalsContact O-N 3.1Å; L157-N160 PolarHBondContact O-N 3.32Å; M158-N160 PolarHBondContact O-N 2.98Å
161	D	90.6	Very high	90.1	Very high	67 Å²	67	74.7 Å²	74.7	36%	0.358	38%	0.377	S	S	.	.			trans	-100.9	83.4	174.1	-173	-12.1	0	0	0	109.5	F156 D159 D163 A164 A165	F156-D161 HydrophobicContact CD1-CB 4.04Å; F156-D161 PolarHBondContact O-N 3.04Å; D159-D161 VanDerWaalsContact C-N 3.25Å; D159-D161 PolarHBondContact O-N 3.12Å; D161-D163 VanDerWaalsContact C-N 3.35Å; D161-A164 HydrophobicContact CB-CB 4.31Å; D161-A164 WeakPolarHBondContact OD1-CB 3.38Å; D161-A164 PolarHBondContact OD1-N 2.91Å; D161-A164 WeakPolarHBondContact OD2-CB 3.46Å; D161-A165 WeakPolarHBondContact O-CB 3.42Å; D161-A165 PolarHBondContact O-N 3.26Å; D161-A165 VanDerWaalsContact O-N 3.14Å
162	V	92.3	Very high	90	Very high	80 Å²	80	70.5 Å²	70.5	49%	0.485	36%	0.355	S	S	.	.	H	α-helix	trans	-68	-36.6	-175.7	-178.9	0	0	0	0	111.4	A165 E166	V162-A165 PolarHBondContact O-N 3.1Å; V162-E166 WeakPolarHBondContact O-CB 3.48Å; V162-E166 PolarHBondContact O-N 3.34Å
163	D	88.9	Confident	90.1	Very high	121 Å²	121	70.2 Å²	70.2	65%	0.647	35%	0.354	S	S	*	.	H	α-helix	trans	-65.7	-42.9	-177.9	-63.8	-27.6	0	0	0	111	D161 T167	D161-D163 VanDerWaalsContact C-N 3.35Å; D163-T167 WeakPolarHBondContact O-CB 3.37Å; D163-T167 PolarHBondContact O-N 3.38Å; D163-T167 PolarHBondContact O-OG1 3.34Å
164	A	86.4	Confident	90.2	Very high	16 Å²	16	70 Å²	70	13%	0.132	35%	0.352	C	S	.	.	H	α-helix	trans	-67	-39.9	174	0	0	0	0	0	112	F156 D161 T167 L168	F156-A164 HydrophobicContact CD1-CB 3.54Å; F156-A164 HydrophobicContact CE1-CB 3.59Å; F156-A164 HydrophobicContact CG-CB 4Å; F156-A164 HydrophobicContact CZ-CB 4.13Å; D161-A164 HydrophobicContact CB-CB 4.31Å; D161-A164 WeakPolarHBondContact OD1-CB 3.38Å; D161-A164 PolarHBondContact OD1-N 2.91Å; D161-A164 WeakPolarHBondContact OD2-CB 3.46Å; A164-T167 PolarHBondContact O-N 3.42Å; A164-L168 WeakPolarHBondContact O-CB 3.47Å; A164-L168 WeakPolarHBondContact O-CG 3.43Å; A164-L168 PolarHBondContact O-N 2.98Å
165	A	90.1	Very high	90.2	Very high	3 Å²	3	65.6 Å²	65.6	3%	0.025	33%	0.333	C	S	.	.	H	α-helix	trans	-62.8	-45.1	177.3	0	0	0	0	0	112.3	T153 F156 L157 D161 V162 L168 Y169	T153-A165 HydrophobicContact CG2-CB 4.11Å; F156-A165 HydrophobicContact CB-CB 3.92Å; L157-A165 HydrophobicContact CD2-CB 3.61Å; L157-A165 HydrophobicContact CG-CB 3.71Å; D161-A165 WeakPolarHBondContact O-CB 3.42Å; D161-A165 PolarHBondContact O-N 3.26Å; D161-A165 VanDerWaalsContact O-N 3.14Å; V162-A165 PolarHBondContact O-N 3.1Å; A165-L168 PolarHBondContact O-N 3.01Å; A165-Y169 WeakPolarHBondContact O-CB 3.4Å; A165-Y169 PolarHBondContact O-N 3.22Å
166	E	88.6	Confident	90.3	Very high	112 Å²	112	60.5 Å²	60.5	52%	0.523	31%	0.311	S	S	.	.	H	α-helix	trans	-62.1	-44.8	176	-177.9	177.7	-169.6	0	0	111.2	V162 L168 Y169 Q170	V162-E166 WeakPolarHBondContact O-CB 3.48Å; V162-E166 PolarHBondContact O-N 3.34Å; E166-L168 VanDerWaalsContact C-N 3.34Å; E166-L168 PolarHBondContact O-N 3.08Å; E166-Y169 WeakPolarHBondContact O-CB 3.36Å; E166-Y169 PolarHBondContact O-N 3.4Å; E166-Q170 PolarHBondContact O-N 2.94Å
167	T	85.3	Confident	90.5	Very high	57 Å²	57	59.8 Å²	59.8	35%	0.35	31%	0.308	S	S	.	.	H	α-helix	trans	-58.6	-47.6	176.5	-59	0	0	0	0	110.6	D163 A164 Y169 Q170 Y171 I419	D163-T167 WeakPolarHBondContact O-CB 3.37Å; D163-T167 PolarHBondContact O-N 3.38Å; D163-T167 PolarHBondContact O-OG1 3.34Å; A164-T167 PolarHBondContact O-N 3.42Å; T167-Y169 VanDerWaalsContact C-N 3.34Å; T167-Y169 PolarHBondContact O-N 2.91Å; T167-Q170 PolarHBondContact O-N 2.91Å; T167-Y171 HydrophobicContact CG2-CD2 4.5Å; T167-Y171 HydrophobicContact CG2-CE2 4.1Å; T167-Y171 WeakPolarHBondContact O-CD2 3.3Å; T167-I419 HydrophobicContact CG2-CD1 4.18Å
168	L	87	Confident	90.5	Very high	6 Å²	6	55.7 Å²	55.7	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-69.9	-29	-179.6	-75	167.4	0	0	0	113.8	M149 L152 F156 A164 A165 E166 Q170 Y171 F410 L415	M149-L168 HydrophobicContact CE-CB 4.42Å; M149-L168 HydrophobicContact CE-CD2 3.8Å; L152-L168 HydrophobicContact CB-CD1 4.38Å; F156-L168 HydrophobicContact CD2-CD1 3.28Å; F156-L168 HydrophobicContact CE2-CD1 3.1Å; F156-L168 HydrophobicContact CG-CD1 4.34Å; F156-L168 HydrophobicContact CZ-CD1 4Å; A164-L168 WeakPolarHBondContact O-CB 3.47Å; A164-L168 WeakPolarHBondContact O-CG 3.43Å; A164-L168 PolarHBondContact O-N 2.98Å; A165-L168 PolarHBondContact O-N 3.01Å; E166-L168 VanDerWaalsContact C-N 3.34Å; E166-L168 PolarHBondContact O-N 3.08Å; L168-Q170 PolarHBondContact O-N 2.67Å; L168-Y171 WeakPolarHBondContact O-CB 3.28Å; L168-Y171 PolarHBondContact O-N 2.86Å; L168-F410 HydrophobicContact CD1-CZ 4.18Å; L168-F410 HydrophobicContact CD2-CE2 4.48Å; L168-F410 HydrophobicContact CD2-CZ 4.16Å; L168-L415 HydrophobicContact CD2-CD2 4.29Å
169	Y	85.8	Confident	90.5	Very high	113 Å²	113	49.6 Å²	49.6	44%	0.443	26%	0.256	S	S	.	.	H	α-helix	trans	-58.9	-39.7	172.7	171.1	-97.4	0	0	0	111.2	A165 E166 T167 Y171 D172 L269 V270	A165-Y169 WeakPolarHBondContact O-CB 3.4Å; A165-Y169 PolarHBondContact O-N 3.22Å; E166-Y169 WeakPolarHBondContact O-CB 3.36Å; E166-Y169 PolarHBondContact O-N 3.4Å; T167-Y169 VanDerWaalsContact C-N 3.34Å; T167-Y169 PolarHBondContact O-N 2.91Å; Y169-Y171 PolarHBondContact O-N 3.33Å; Y169-D172 WeakPolarHBondContact O-CB 3.48Å; Y169-D172 PolarHBondContact O-N 3.23Å; Y169-L269 HydrophobicContact CE2-CD1 3.75Å; Y169-V270 HydrophobicContact CE1-CG1 4.34Å
170	Q	86.7	Confident	90.5	Very high	114 Å²	114	45.5 Å²	45.5	53%	0.533	23%	0.234	S	C	.	.	H	α-helix	trans	-69.3	-18.7	176.3	-62.5	-179.3	0.5	0	0	113.6	E166 T167 L168 D172	E166-Q170 PolarHBondContact O-N 2.94Å; T167-Q170 PolarHBondContact O-N 2.91Å; L168-Q170 PolarHBondContact O-N 2.67Å; Q170-D172 VanDerWaalsContact C-N 3.27Å
171	Y	88.9	Confident	90.5	Very high	33 Å²	33	39.6 Å²	39.6	13%	0.129	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-4.5	177.1	-83.4	-119.2	0	0	0	113.1	M149 T167 L168 Y169 S173 I176 I405 L415 I419	M149-Y171 VanDerWaalsContact CE-CB 3.43Å; T167-Y171 HydrophobicContact CG2-CD2 4.5Å; T167-Y171 HydrophobicContact CG2-CE2 4.1Å; T167-Y171 WeakPolarHBondContact O-CD2 3.3Å; L168-Y171 WeakPolarHBondContact O-CB 3.28Å; L168-Y171 PolarHBondContact O-N 2.86Å; Y169-Y171 PolarHBondContact O-N 3.33Å; Y171-S173 PolarHBondContact O-N 2.91Å; Y171-I176 HydrophobicContact CD1-CB 4.33Å; Y171-I176 HydrophobicContact CD1-CD1 3.76Å; Y171-I176 HydrophobicContact CD1-CG1 3.66Å; Y171-I176 HydrophobicContact CD1-CG2 3.67Å; Y171-I176 HydrophobicContact CE1-CD1 3.83Å; Y171-I176 HydrophobicContact CE1-CG1 4.26Å; Y171-I176 HydrophobicContact CG-CD1 4.36Å; Y171-I176 HydrophobicContact CG-CG1 3.93Å; Y171-I176 HydrophobicContact CG-CG2 4.35Å; Y171-I176 WeakPolarHBondContact O-CB 3.46Å; Y171-I405 HydrophobicContact CD1-CD1 3.4Å; Y171-I405 HydrophobicContact CD1-CG1 4.38Å; Y171-I405 HydrophobicContact CE1-CD1 3.93Å; Y171-I405 HydrophobicContact CG-CD1 4.32Å; Y171-L415 HydrophobicContact CE1-CD1 3.84Å; Y171-L415 HydrophobicContact CE1-CD2 4.07Å; Y171-L415 HydrophobicContact CE1-CG 4.5Å; Y171-I419 HydrophobicContact CE2-CD1 4.21Å; Y171-I419 WeakPolarHBondContact OH-CD1 2.94Å; Y171-I419 VanDerWaalsContact OH-CG1 3.29Å; Y171-I419 WeakPolarHBondContact OH-CG1 3.38Å
172	D	89	Confident	90.6	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.021	22%	0.216	C	C	.	.			trans	-75.2	57	170.1	-160.6	20.7	0	0	0	111	N146 M149 R150 Y169 Q170 L269	N146-D172 WeakPolarHBondContact CA-OD1 3.41Å; N146-D172 WeakPolarHBondContact CB-OD1 3.46Å; N146-D172 PolarHBondContact ND2-OD1 2.85Å; M149-D172 HydrophobicContact CB-CB 4.49Å; R150-D172 IonicContact CZ-OD2 3.15Å; R150-D172 IonicContact NE-OD2 3.18Å; R150-D172 PolarHBondContact NE-OD2 3.46Å; R150-D172 IonicContact NH2-OD2 3.33Å; Y169-D172 WeakPolarHBondContact O-CB 3.48Å; Y169-D172 PolarHBondContact O-N 3.23Å; Q170-D172 VanDerWaalsContact C-N 3.27Å; D172-L269 PolarHBondContact O-N 3.45Å
173	S	91.5	Very high	90.6	Very high	12 Å²	12	40.9 Å²	40.9	8%	0.084	20%	0.203	C	C	.	.	S	Bend	trans	-128.9	155.4	-175.2	83.1	0	0	0	0	113.2	Y171 S175 I176 Y177 D271	Y171-S173 PolarHBondContact O-N 2.91Å; S173-S175 VanDerWaalsContact C-N 3.3Å; S173-S175 PolarHBondContact O-N 3.37Å; S173-I176 PolarHBondContact O-N 2.84Å; S173-I176 WeakPolarHBondContact OG-CG1 3.38Å; S173-I176 PolarHBondContact OG-N 2.84Å; S173-Y177 PolarHBondContact O-N 3.41Å; S173-D271 WeakPolarHBondContact CB-OD1 3.36Å
174	L	92.4	Very high	90.8	Very high	14 Å²	14	40.1 Å²	40.1	7%	0.073	20%	0.198	C	C	.	.	H	α-helix	trans	-63.3	-36.3	178.1	-177.9	64.3	0	0	0	112	P125 F126 Y177 Y178 T228 F230 F268 D271	P125-L174 HydrophobicContact CG-CD1 4.17Å; P125-L174 HydrophobicContact CG-CD2 3.92Å; F126-L174 HydrophobicContact CE1-CD1 4.32Å; F126-L174 HydrophobicContact CE2-CD1 4.09Å; F126-L174 HydrophobicContact CZ-CD1 3.48Å; F126-L174 VanDerWaalsContact CZ-CD1 3.48Å; L174-Y177 HydrophobicContact CD1-CD1 4.12Å; L174-Y177 PolarHBondContact O-N 3.34Å; L174-Y178 WeakPolarHBondContact O-CB 3.25Å; L174-Y178 PolarHBondContact O-N 3.38Å; L174-T228 HydrophobicContact CD2-CG2 4.26Å; L174-T228 WeakPolarHBondContact CD2-O 3.5Å; L174-F230 HydrophobicContact CD1-CE2 3.71Å; L174-F230 HydrophobicContact CD1-CZ 4.33Å; L174-F230 HydrophobicContact CG-CE2 4.1Å; L174-F268 HydrophobicContact CB-CD2 3.88Å; L174-F268 HydrophobicContact CB-CE2 4.04Å; L174-F268 HydrophobicContact CB-CG 4.28Å; L174-F268 HydrophobicContact CD1-CD2 4.15Å; L174-F268 HydrophobicContact CD1-CE2 3.58Å; L174-F268 HydrophobicContact CD1-CZ 4.17Å; L174-F268 HydrophobicContact CG-CE2 4.42Å; L174-D271 WeakPolarHBondContact CB-OD2 3.21Å; L174-D271 PolarHBondContact N-OD2 3.27Å
175	S	93.5	Very high	91.2	Very high	11 Å²	11	40.4 Å²	40.4	8%	0.077	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-40.8	175.8	-178.2	0	0	0	0	112.1	S173 Q179 H227	S173-S175 VanDerWaalsContact C-N 3.3Å; S173-S175 PolarHBondContact O-N 3.37Å; S175-Q179 VanDerWaalsContact O-CG 3.31Å; S175-Q179 WeakPolarHBondContact O-CG 3.44Å; S175-Q179 PolarHBondContact O-N 3.35Å; S175-Q179 VanDerWaalsContact O-N 3.17Å; S175-Q179 PolarHBondContact O-NE2 3.45Å; S175-Q179 VanDerWaalsContact O-NE2 3.1Å; S175-H227 WeakPolarHBondContact CB-ND1 3.28Å; S175-H227 PolarHBondContact OG-ND1 3.44Å
176	I	93.6	Very high	91.5	Very high	15 Å²	15	40.3 Å²	40.3	8%	0.077	20%	0.197	C	C	.	.	H	α-helix	trans	-71.7	-40.2	174.6	-62.3	-48.4	0	0	0	110.3	F145 Y171 S173 Y178 Q179 N180 I405	F145-I176 HydrophobicContact CZ-CB 4.39Å; F145-I176 HydrophobicContact CZ-CG2 3.73Å; Y171-I176 HydrophobicContact CD1-CB 4.33Å; Y171-I176 HydrophobicContact CD1-CD1 3.76Å; Y171-I176 HydrophobicContact CD1-CG1 3.66Å; Y171-I176 HydrophobicContact CD1-CG2 3.67Å; Y171-I176 HydrophobicContact CE1-CD1 3.83Å; Y171-I176 HydrophobicContact CE1-CG1 4.26Å; Y171-I176 HydrophobicContact CG-CD1 4.36Å; Y171-I176 HydrophobicContact CG-CG1 3.93Å; Y171-I176 HydrophobicContact CG-CG2 4.35Å; Y171-I176 WeakPolarHBondContact O-CB 3.46Å; S173-I176 PolarHBondContact O-N 2.84Å; S173-I176 WeakPolarHBondContact OG-CG1 3.38Å; S173-I176 PolarHBondContact OG-N 2.84Å; I176-Y178 VanDerWaalsContact C-N 3.31Å; I176-Y178 PolarHBondContact O-N 3.46Å; I176-Q179 WeakPolarHBondContact O-CA 3.42Å; I176-Q179 WeakPolarHBondContact O-CB 3.3Å; I176-Q179 PolarHBondContact O-N 3.5Å; I176-N180 WeakPolarHBondContact CG2-ND2 3.35Å; I176-N180 PolarHBondContact O-N 2.86Å; I176-N180 VanDerWaalsContact O-N 3.13Å; I176-N180 PolarHBondContact O-ND2 2.96Å; I176-I405 HydrophobicContact CG2-CD1 4.3Å
177	Y	94.2	Very high	91.7	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-55.5	-47.1	173.9	169.7	-109.7	0	0	0	111.3	F126 W134 M140 P142 F145 S173 L174 Q179 N180 L181 L189 F230 F268	F126-Y177 AromaticContact CE1-CE1 3.88Å; F126-Y177 HydrophobicContact CE1-CE1 3.88Å; F126-Y177 HydrophobicContact CZ-CD1 4.27Å; F126-Y177 AromaticContact CZ-CE1 3.82Å; F126-Y177 HydrophobicContact CZ-CE1 3.82Å; W134-Y177 PolarHBondContact NE1-OH 2.87Å; M140-Y177 PolarHBondContact O-OH 3.32Å; P142-Y177 HydrophobicContact CG-CE1 4.12Å; F145-Y177 HydrophobicContact CB-CD2 3.69Å; F145-Y177 HydrophobicContact CB-CE2 4.13Å; F145-Y177 HydrophobicContact CD1-CD2 4.03Å; F145-Y177 HydrophobicContact CD1-CG 4.41Å; F145-Y177 HydrophobicContact CD2-CD2 4.04Å; F145-Y177 AromaticContact CG-CD2 3.63Å; F145-Y177 HydrophobicContact CG-CD2 3.63Å; F145-Y177 HydrophobicContact CG-CG 4.43Å; S173-Y177 PolarHBondContact O-N 3.41Å; L174-Y177 HydrophobicContact CD1-CD1 4.12Å; L174-Y177 PolarHBondContact O-N 3.34Å; Y177-Q179 VanDerWaalsContact C-N 3.29Å; Y177-Q179 PolarHBondContact O-N 3.41Å; Y177-N180 PolarHBondContact O-N 3.44Å; Y177-L181 HydrophobicContact CD1-CD1 4.19Å; Y177-L181 HydrophobicContact CE1-CD1 3.68Å; Y177-L181 HydrophobicContact CE1-CG 4.41Å; Y177-L181 HydrophobicContact CE2-CD1 4.39Å; Y177-L181 HydrophobicContact CE2-CD2 3.98Å; Y177-L181 HydrophobicContact CE2-CG 4.29Å; Y177-L181 WeakPolarHBondContact O-CG 3.16Å; Y177-L181 PolarHBondContact O-N 3.34Å; Y177-L189 HydrophobicContact CE1-CD1 4.27Å; Y177-L189 WeakPolarHBondContact OH-CD1 3.02Å; Y177-F230 AromaticContact CD1-CZ 3.92Å; Y177-F230 HydrophobicContact CD1-CZ 3.92Å; Y177-F230 HydrophobicContact CE1-CE1 4.49Å; Y177-F230 AromaticContact CE1-CZ 3.9Å; Y177-F230 HydrophobicContact CE1-CZ 3.9Å; Y177-F268 AromaticContact CD1-CZ 3.98Å; Y177-F268 HydrophobicContact CD1-CZ 3.98Å; Y177-F268 HydrophobicContact CD2-CZ 4.47Å; Y177-F268 HydrophobicContact CG-CE1 4.3Å; Y177-F268 AromaticContact CG-CZ 3.78Å; Y177-F268 HydrophobicContact CG-CZ 3.78Å
178	Y	95.1	Very high	92.2	Very high	5 Å²	5	42.9 Å²	42.9	2%	0.02	20%	0.196	C	C	.	.	H	α-helix	trans	-54.3	-44.3	173.1	179.1	-80.6	0	0	0	112.3	L174 I176 N180 L181 A186 S225 H227 F230 I387 R391 Y401	L174-Y178 WeakPolarHBondContact O-CB 3.25Å; L174-Y178 PolarHBondContact O-N 3.38Å; I176-Y178 VanDerWaalsContact C-N 3.31Å; I176-Y178 PolarHBondContact O-N 3.46Å; Y178-N180 PolarHBondContact O-N 2.87Å; Y178-L181 PolarHBondContact O-N 3.01Å; Y178-L181 VanDerWaalsContact O-N 3.16Å; Y178-A186 HydrophobicContact CD2-CB 4Å; Y178-A186 HydrophobicContact CE2-CB 3.69Å; Y178-S225 WeakPolarHBondContact CE2-OG 3.26Å; Y178-S225 WeakPolarHBondContact OH-CB 3.47Å; Y178-S225 PolarHBondContact OH-OG 3.03Å; Y178-H227 WeakPolarHBondContact CB-O 3.47Å; Y178-H227 HydrophobicContact CD1-CB 4Å; Y178-H227 HydrophobicContact CE1-CB 4.49Å; Y178-H227 HydrophobicContact CG-CB 4.16Å; Y178-F230 HydrophobicContact CD2-CD1 4.25Å; Y178-F230 HydrophobicContact CD2-CD2 4.13Å; Y178-F230 HydrophobicContact CD2-CE1 4.07Å; Y178-F230 AromaticContact CD2-CE2 3.93Å; Y178-F230 HydrophobicContact CD2-CE2 3.93Å; Y178-F230 HydrophobicContact CD2-CG 4.26Å; Y178-F230 AromaticContact CD2-CZ 3.9Å; Y178-F230 HydrophobicContact CD2-CZ 3.9Å; Y178-I387 HydrophobicContact CD1-CD1 3.87Å; Y178-I387 HydrophobicContact CE1-CD1 3.72Å; Y178-R391 PolarHBondContact OH-NH1 2.77Å; Y178-Y401 HydrophobicContact CD1-CE2 4.47Å; Y178-Y401 HydrophobicContact CE1-CE2 4.07Å
179	Q	94.6	Very high	92.6	Very high	12 Å²	12	42.6 Å²	42.6	6%	0.056	20%	0.195	C	C	.	.	H	α-helix	trans	-67.3	-15	-180	-72.9	173.8	78.3	0	0	114.1	S175 I176 Y177 I387 Y401 G403	S175-Q179 VanDerWaalsContact O-CG 3.31Å; S175-Q179 WeakPolarHBondContact O-CG 3.44Å; S175-Q179 PolarHBondContact O-N 3.35Å; S175-Q179 VanDerWaalsContact O-N 3.17Å; S175-Q179 PolarHBondContact O-NE2 3.45Å; S175-Q179 VanDerWaalsContact O-NE2 3.1Å; I176-Q179 WeakPolarHBondContact O-CA 3.42Å; I176-Q179 WeakPolarHBondContact O-CB 3.3Å; I176-Q179 PolarHBondContact O-N 3.5Å; Y177-Q179 VanDerWaalsContact C-N 3.29Å; Y177-Q179 PolarHBondContact O-N 3.41Å; Q179-I387 HydrophobicContact CG-CB 4.15Å; Q179-I387 HydrophobicContact CG-CD1 4.03Å; Q179-I387 HydrophobicContact CG-CG1 3.97Å; Q179-Y401 HydrophobicContact CB-CD2 3.99Å; Q179-Y401 HydrophobicContact CB-CG 4.16Å; Q179-Y401 HydrophobicContact CG-CD2 3.97Å; Q179-Y401 HydrophobicContact CG-CG 3.85Å; Q179-G403 VanDerWaalsContact OE1-CA 3.27Å
180	N	93.1	Very high	93	Very high	21 Å²	21	37.4 Å²	37.4	11%	0.112	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	5.6	177.7	-74.2	-85.1	0	0	0	113.2	F145 I176 Y177 Y178 G403 I405 L406	F145-N180 HydrophobicContact CD2-CB 4.47Å; F145-N180 HydrophobicContact CE2-CB 3.99Å; I176-N180 WeakPolarHBondContact CG2-ND2 3.35Å; I176-N180 PolarHBondContact O-N 2.86Å; I176-N180 VanDerWaalsContact O-N 3.13Å; I176-N180 PolarHBondContact O-ND2 2.96Å; Y177-N180 PolarHBondContact O-N 3.44Å; Y178-N180 PolarHBondContact O-N 2.87Å; N180-G403 PolarHBondContact ND2-O 2.81Å; N180-G403 VanDerWaalsContact ND2-O 3.15Å; N180-I405 PolarHBondContact OD1-N 2.88Å; N180-L406 HydrophobicContact CB-CD1 4.05Å; N180-L406 HydrophobicContact CB-CG 4.39Å; N180-L406 PolarHBondContact OD1-N 2.91Å
181	L	93.4	Very high	93.4	Very high	15 Å²	15	32.4 Å²	32.4	8%	0.079	15%	0.152	C	C	.	.	S	Bend	trans	-96.5	151.7	171	-66.7	174.9	0	0	0	110.8	V139 M140 Y177 Y178 A186 L189 F230	V139-L181 HydrophobicContact CG1-CD2 3.79Å; M140-L181 HydrophobicContact CE-CD2 4.48Å; Y177-L181 HydrophobicContact CD1-CD1 4.19Å; Y177-L181 HydrophobicContact CE1-CD1 3.68Å; Y177-L181 HydrophobicContact CE1-CG 4.41Å; Y177-L181 HydrophobicContact CE2-CD1 4.39Å; Y177-L181 HydrophobicContact CE2-CD2 3.98Å; Y177-L181 HydrophobicContact CE2-CG 4.29Å; Y177-L181 WeakPolarHBondContact O-CG 3.16Å; Y177-L181 PolarHBondContact O-N 3.34Å; Y178-L181 PolarHBondContact O-N 3.01Å; Y178-L181 VanDerWaalsContact O-N 3.16Å; L181-A186 HydrophobicContact CB-CB 4.41Å; L181-A186 HydrophobicContact CD1-CB 4.33Å; L181-L189 HydrophobicContact CD1-CD1 3.59Å; L181-F230 HydrophobicContact CD1-CE1 3.78Å; L181-F230 HydrophobicContact CD1-CZ 4.03Å
182	K	93.1	Very high	93.7	Very high	148 Å²	148	34.4 Å²	34.4	64%	0.643	17%	0.165	S	C	*	.			trans	-65.1	144	163.1	-61.5	177.3	-178.9	171.8	0	108.6	I184 D185 A186	K182-I184 HydrophobicContact CB-CG2 4.14Å; K182-I184 PolarHBondContact O-N 3.45Å; K182-I184 VanDerWaalsContact O-N 3.13Å; K182-D185 HydrophobicContact CB-CB 4.45Å; K182-D185 WeakPolarHBondContact CB-OD2 3.24Å; K182-D185 PolarHBondContact O-N 3.28Å; K182-A186 PolarHBondContact O-N 3Å
183	A	91.6	Very high	93.9	Very high	26 Å²	26	35.9 Å²	35.9	22%	0.215	17%	0.174	C	C	.	.	H	α-helix	trans	-55.2	-37	-178.7	0	0	0	0	0	113.2	D185 Y187 Y394 P395	A183-D185 VanDerWaalsContact C-N 3.35Å; A183-Y187 PolarHBondContact O-N 3.48Å; A183-Y187 VanDerWaalsContact O-N 3.1Å; A183-Y394 HydrophobicContact CB-CD1 3.53Å; A183-Y394 HydrophobicContact CB-CE1 4.08Å; A183-Y394 HydrophobicContact CB-CG 4.4Å; A183-P395 HydrophobicContact CB-CG 4.44Å
184	I	93.3	Very high	94	Very high	106 Å²	106	40.1 Å²	40.1	54%	0.544	20%	0.2	S	C	.	.	H	α-helix	trans	-66.5	-35.3	175.9	-172.6	58.5	0	0	0	112.6	K182 Y187 R188	K182-I184 HydrophobicContact CB-CG2 4.14Å; K182-I184 PolarHBondContact O-N 3.45Å; K182-I184 VanDerWaalsContact O-N 3.13Å; I184-Y187 WeakPolarHBondContact O-CB 3.37Å; I184-Y187 PolarHBondContact O-N 2.75Å; I184-R188 VanDerWaalsContact O-CG 3.25Å; I184-R188 WeakPolarHBondContact O-CG 3.4Å; I184-R188 PolarHBondContact O-N 2.82Å
185	D	95.1	Very high	94	Very high	22 Å²	22	39.9 Å²	39.9	12%	0.118	20%	0.2	C	C	.	.	H	α-helix	trans	-74.3	-42.9	-179.8	-65.5	-34.6	0	0	0	110.2	V139 K182 A183 Y187 R188 L189	V139-D185 HydrophobicContact CG1-CB 3.95Å; V139-D185 HydrophobicContact CG2-CB 3.93Å; K182-D185 HydrophobicContact CB-CB 4.45Å; K182-D185 WeakPolarHBondContact CB-OD2 3.24Å; K182-D185 PolarHBondContact O-N 3.28Å; A183-D185 VanDerWaalsContact C-N 3.35Å; D185-Y187 PolarHBondContact O-N 3.4Å; D185-R188 PolarHBondContact O-N 3.14Å; D185-R188 IonicContact OD1-NH1 3.83Å; D185-R188 PolarHBondContact OD1-NH1 3.13Å; D185-L189 VanDerWaalsContact O-CG 3.3Å; D185-L189 WeakPolarHBondContact O-CG 3.2Å; D185-L189 PolarHBondContact O-N 3.05Å
186	A	94.8	Very high	94.1	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-54.1	-43.2	170.6	0	0	0	0	0	111.5	Y178 L181 K182 R188 L189 G190 F230	Y178-A186 HydrophobicContact CD2-CB 4Å; Y178-A186 HydrophobicContact CE2-CB 3.69Å; L181-A186 HydrophobicContact CB-CB 4.41Å; L181-A186 HydrophobicContact CD1-CB 4.33Å; K182-A186 PolarHBondContact O-N 3Å; A186-R188 PolarHBondContact O-N 3.13Å; A186-L189 PolarHBondContact O-N 2.86Å; A186-G190 PolarHBondContact O-N 3.45Å; A186-F230 HydrophobicContact CB-CD1 4.3Å; A186-F230 HydrophobicContact CB-CE1 4.19Å; A186-F230 WeakPolarHBondContact O-CD1 3.4Å
187	Y	94.3	Very high	93.9	Very high	127 Å²	127	42 Å²	42	50%	0.498	21%	0.21	S	C	.	.	H	α-helix	trans	-62.9	-37	175.6	-174.5	-86.1	0	0	0	113.5	A183 I184 D185 K223 N231	A183-Y187 PolarHBondContact O-N 3.48Å; A183-Y187 VanDerWaalsContact O-N 3.1Å; I184-Y187 WeakPolarHBondContact O-CB 3.37Å; I184-Y187 PolarHBondContact O-N 2.75Å; D185-Y187 PolarHBondContact O-N 3.4Å; Y187-K223 HydrophobicContact CD2-CD 4.26Å; Y187-K223 HydrophobicContact CE2-CD 3.37Å; Y187-K223 HydrophobicContact CE2-CG 4.15Å; Y187-K223 WeakPolarHBondContact OH-CD 3.45Å; Y187-K223 PolarHBondContact OH-NZ 3.47Å; Y187-N231 PolarHBondContact O-ND2 3.34Å
188	R	95.6	Very high	93.8	Very high	95 Å²	95	42.2 Å²	42.2	36%	0.358	21%	0.211	S	C	.	.	H	α-helix	trans	-77.3	-26.6	-179.3	-70.9	167.5	71.6	-155.9	8.5	113.6	N129 L133 I184 D185 A186	N129-R188 PolarHBondContact ND2-O 3.1Å; L133-R188 HydrophobicContact CD1-CB 3.83Å; I184-R188 VanDerWaalsContact O-CG 3.25Å; I184-R188 WeakPolarHBondContact O-CG 3.4Å; I184-R188 PolarHBondContact O-N 2.82Å; D185-R188 PolarHBondContact O-N 3.14Å; D185-R188 IonicContact OD1-NH1 3.83Å; D185-R188 PolarHBondContact OD1-NH1 3.13Å; A186-R188 PolarHBondContact O-N 3.13Å
189	L	95	Very high	93.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-75.6	-38.6	178.3	-68	-179.7	0	0	0	111.8	F126 S127 A130 L133 W134 V139 Y177 L181 D185 A186 F230	F126-L189 HydrophobicContact CD1-CB 4.23Å; F126-L189 HydrophobicContact CE1-CD1 4.45Å; S127-L189 PolarHBondContact N-O 3.02Å; S127-L189 PolarHBondContact OG-O 3.48Å; A130-L189 HydrophobicContact CB-CB 4.29Å; A130-L189 HydrophobicContact CB-CD2 3.7Å; L133-L189 HydrophobicContact CB-CD2 4.42Å; L133-L189 HydrophobicContact CD1-CD2 4.05Å; W134-L189 HydrophobicContact CZ2-CD1 4.49Å; W134-L189 HydrophobicContact CZ2-CD2 4.19Å; V139-L189 HydrophobicContact CB-CD2 4.39Å; V139-L189 HydrophobicContact CG1-CD1 3.99Å; V139-L189 HydrophobicContact CG1-CD2 4.22Å; V139-L189 HydrophobicContact CG1-CG 4.32Å; Y177-L189 HydrophobicContact CE1-CD1 4.27Å; Y177-L189 WeakPolarHBondContact OH-CD1 3.02Å; L181-L189 HydrophobicContact CD1-CD1 3.59Å; D185-L189 VanDerWaalsContact O-CG 3.3Å; D185-L189 WeakPolarHBondContact O-CG 3.2Å; D185-L189 PolarHBondContact O-N 3.05Å; A186-L189 PolarHBondContact O-N 2.86Å; L189-F230 HydrophobicContact CB-CD1 4.19Å; L189-F230 HydrophobicContact CB-CE1 4.2Å; L189-F230 HydrophobicContact CD1-CE1 4.06Å
190	G	94.8	Very high	93.8	Very high	4 Å²	4	44.1 Å²	44.1	4%	0.041	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-71.1	165.5	-176	0	0	0	0	0	114.7	P125 A186 N231	P125-G190 VanDerWaalsContact O-CA 3.24Å; P125-G190 WeakPolarHBondContact O-CA 3.14Å; A186-G190 PolarHBondContact O-N 3.45Å; G190-N231 WeakPolarHBondContact CA-ND2 3.45Å; G190-N231 PolarHBondContact O-ND2 3.1Å; G190-N231 VanDerWaalsContact O-ND2 3.12Å
191	H	95.3	Very high	93.8	Very high	10 Å²	10	43.4 Å²	43.4	5%	0.046	22%	0.217	C	C	.	.			trans	-56.8	150.7	174	-63	-78	0	0	0	113	H122 H124 P125 F126 A195 N231 H233	H122-H191 VanDerWaalsContact CB-CD2 3.47Å; H122-H191 WeakPolarHBondContact CB-CD2 3.36Å; H122-H191 AromaticContact CD2-CD2 3.79Å; H122-H191 AromaticContact CD2-NE2 3.72Å; H122-H191 AromaticContact CG-CD2 3.37Å; H122-H191 AromaticContact CG-CG 3.9Å; H122-H191 AromaticContact CG-NE2 3.68Å; H122-H191 AromaticContact ND1-CD2 3.71Å; H122-H191 AromaticContact ND1-CG 3.89Å; H124-H191 PolarHBondContact O-CD2 3.49Å; H124-H191 PolarHBondContact O-NE2 3.24Å; P125-H191 PolarHBondContact O-CD2 3.34Å; P125-H191 VanDerWaalsContact O-CD2 3.32Å; P125-H191 PolarHBondContact O-N 3.31Å; F126-H191 PolarHBondContact O-CE1 3.01Å; F126-H191 PolarHBondContact O-NE2 3.4Å; H191-A195 HydrophobicContact CB-CB 4.5Å; H191-N231 WeakPolarHBondContact O-CB 3.37Å; H191-N231 PolarHBondContact O-ND2 3.32Å; H191-H233 PolarHBondContact O-CE1 3.03Å
192	D	93.7	Very high	93.8	Very high	74 Å²	74	47.4 Å²	47.4	40%	0.396	23%	0.231	S	C	.	.			trans	-108.4	-175.8	173	69.2	9.6	0	0	0	110.9	T194 A195	D192-T194 PolarHBondContact O-N 3.02Å; D192-T194 WeakPolarHBondContact OD1-CA 3.35Å; D192-T194 VanDerWaalsContact OD1-CB 3.26Å; D192-T194 WeakPolarHBondContact OD1-CB 3.37Å; D192-T194 PolarHBondContact OD1-N 2.79Å; D192-T194 PolarHBondContact OD1-OG1 2.66Å; D192-A195 WeakPolarHBondContact O-CB 3.47Å; D192-A195 PolarHBondContact O-N 2.89Å
193	T	93.6	Very high	93.7	Very high	35 Å²	35	41.1 Å²	41.1	22%	0.215	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-69.2	-12.1	-179.4	49.6	0	0	0	0	113.6	A195 F196 M214 I221	T193-A195 PolarHBondContact O-N 3.23Å; T193-F196 WeakPolarHBondContact O-CD2 3.31Å; T193-F196 PolarHBondContact O-N 2.75Å; T193-F196 VanDerWaalsContact O-N 3.14Å; T193-M214 HydrophobicContact CG2-CG 4.06Å; T193-M214 HydrophobicContact CG2-SD 4.04Å; T193-M214 PolarHBondContact OG1-SD 3.08Å; T193-I221 HydrophobicContact CG2-CG2 4.34Å
194	T	92.9	Very high	93.4	Very high	102 Å²	102	43.9 Å²	43.9	63%	0.626	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-71.4	-14.5	176.8	75.6	0	0	0	0	112.4	D192 F196	D192-T194 PolarHBondContact O-N 3.02Å; D192-T194 WeakPolarHBondContact OD1-CA 3.35Å; D192-T194 VanDerWaalsContact OD1-CB 3.26Å; D192-T194 WeakPolarHBondContact OD1-CB 3.37Å; D192-T194 PolarHBondContact OD1-N 2.79Å; D192-T194 PolarHBondContact OD1-OG1 2.66Å; T194-F196 PolarHBondContact O-N 3.34Å
195	A	93.4	Very high	92.8	Very high	8 Å²	8	46.3 Å²	46.3	7%	0.066	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-62.6	-24.7	169.7	0	0	0	0	0	112.5	H191 D192 T193 L197 V253 S254	H191-A195 HydrophobicContact CB-CB 4.5Å; D192-A195 WeakPolarHBondContact O-CB 3.47Å; D192-A195 PolarHBondContact O-N 2.89Å; T193-A195 PolarHBondContact O-N 3.23Å; A195-L197 PolarHBondContact O-N 2.84Å; A195-V253 CarbonylContact O-C 3.56Å; A195-V253 WeakPolarHBondContact O-CA 3.28Å; A195-S254 PolarHBondContact O-N 3.37Å
196	F	94.5	Very high	92.5	Very high	5 Å²	5	49 Å²	49	2%	0.022	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	92.9	175.1	-55.7	-75.1	0	0	0	109.7	I120 T193 T194 C213 H233 F235 V253	I120-F196 HydrophobicContact CB-CE1 4.34Å; I120-F196 HydrophobicContact CB-CZ 4.39Å; I120-F196 HydrophobicContact CD1-CE1 3.89Å; I120-F196 HydrophobicContact CG2-CE1 4.19Å; I120-F196 HydrophobicContact CG2-CZ 4.45Å; T193-F196 WeakPolarHBondContact O-CD2 3.31Å; T193-F196 PolarHBondContact O-N 2.75Å; T193-F196 VanDerWaalsContact O-N 3.14Å; T194-F196 PolarHBondContact O-N 3.34Å; F196-C213 HydrophobicContact CB-CB 4.11Å; F196-H233 HydrophobicContact CE2-CB 3.65Å; F196-H233 AromaticContact CE2-CG 3.58Å; F196-H233 AromaticContact CE2-ND1 3.78Å; F196-H233 HydrophobicContact CZ-CB 3.71Å; F196-H233 AromaticContact CZ-CG 3.99Å; F196-F235 HydrophobicContact CB-CZ 4.47Å; F196-F235 AromaticContact CD1-CE2 3.85Å; F196-F235 HydrophobicContact CD1-CE2 3.85Å; F196-F235 AromaticContact CD1-CZ 3.74Å; F196-F235 HydrophobicContact CD1-CZ 3.74Å; F196-F235 HydrophobicContact CD2-CE2 4.31Å; F196-F235 HydrophobicContact CD2-CZ 4.08Å; F196-F235 AromaticContact CE1-CE2 3.6Å; F196-F235 HydrophobicContact CE1-CE2 3.6Å; F196-F235 HydrophobicContact CE1-CZ 4.01Å; F196-F235 HydrophobicContact CE2-CE2 4.09Å; F196-F235 HydrophobicContact CE2-CZ 4.32Å; F196-F235 HydrophobicContact CG-CE2 4.22Å; F196-F235 AromaticContact CG-CZ 3.81Å; F196-F235 HydrophobicContact CG-CZ 3.81Å; F196-F235 AromaticContact CZ-CE2 3.75Å; F196-F235 HydrophobicContact CZ-CE2 3.75Å; F196-F235 HydrophobicContact CZ-CZ 4.3Å; F196-V253 HydrophobicContact CD1-CG1 4.21Å; F196-V253 HydrophobicContact CD1-CG2 3.89Å; F196-V253 HydrophobicContact CE1-CG1 4.11Å; F196-V253 HydrophobicContact CE1-CG2 4.07Å
197	L	91.2	Very high	92.2	Very high	65 Å²	65	54.8 Å²	54.8	34%	0.34	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	-37.3	-172.2	-64.6	-176.3	0	0	0	113.1	A195 I252 R469	A195-L197 PolarHBondContact O-N 2.84Å; L197-I252 HydrophobicContact CB-CB 4.44Å; L197-I252 HydrophobicContact CB-CG2 4.19Å; L197-I252 WeakPolarHBondContact CB-O 3.5Å; L197-I252 HydrophobicContact CD1-CG2 4.19Å; L197-I252 PolarHBondContact N-O 3.47Å; L197-R469 PolarHBondContact O-NH2 3.31Å
198	N	91.8	Very high	91.9	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.027	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	152.3	176.6	-77.6	96.9	0	0	0	110	E210 D211 C213 I252 R469	N198-E210 WeakPolarHBondContact CA-O 3.06Å; N198-E210 PolarHBondContact ND2-O 2.59Å; N198-D211 PolarHBondContact ND2-OD1 3.4Å; N198-C213 VanDerWaalsContact C-SG 3.55Å; N198-I252 HydrophobicContact CB-CB 4.26Å; N198-I252 HydrophobicContact CB-CD1 4.16Å; N198-I252 HydrophobicContact CB-CG1 4.35Å; N198-I252 PolarHBondContact N-O 3.46Å; N198-I252 PolarHBondContact O-N 3.32Å; N198-R469 PolarHBondContact OD1-NE 2.89Å; N198-R469 PolarHBondContact OD1-NH2 3.1Å
199	C	95.1	Very high	91.7	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.02	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	150.1	171.5	33.2	0	0	0	0	110	I209 E210 C213 M216 A250 L251	C199-I209 WeakPolarHBondContact O-CA 3.38Å; C199-E210 PolarHBondContact N-O 2.91Å; C199-E210 PolarHBondContact O-N 3.31Å; C199-E210 VanDerWaalsContact SG-CB 3.59Å; C199-C213 HydrophobicContact CB-CB 4.02Å; C199-C213 WeakPolarHBondContact CB-SG 3.45Å; C199-C213 PolarHBondContact N-SG 3.08Å; C199-C213 VanDerWaalsContact N-SG 3.37Å; C199-C213 WeakPolarHBondContact SG-CA 3.09Å; C199-C213 WeakPolarHBondContact SG-CB 3.39Å; C199-C213 CovalentContact SG-SG 2.04Å; C199-C213 PolarHBondContact SG-SG 3.37Å; C199-M216 HydrophobicContact CB-SD 3.98Å; C199-A250 CarbonylContact C-O 3.31Å; C199-A250 VanDerWaalsContact CA-O 3.26Å; C199-A250 WeakPolarHBondContact CA-O 3.49Å; C199-L251 HydrophobicContact CB-CD2 3.5Å; C199-L251 VanDerWaalsContact CB-CD2 3.5Å
200	M	93.6	Very high	91.5	Very high	54 Å²	54	50 Å²	50	27%	0.266	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	132.6	173.4	-179.4	-167.4	-63.2	0	0	108.2	M207 Q208 I209 I249 A250	M200-M207 HydrophobicContact CE-SD 4.41Å; M200-M207 HydrophobicContact CG-CB 4.45Å; M200-M207 HydrophobicContact SD-CB 4.43Å; M200-M207 HydrophobicContact SD-CG 4.24Å; M200-M207 HydrophobicContact SD-SD 3.76Å; M200-Q208 CarbonylContact C-O 3.58Å; M200-Q208 VanDerWaalsContact CA-O 3.23Å; M200-Q208 WeakPolarHBondContact CA-O 3.26Å; M200-I209 HydrophobicContact CB-CG1 4.24Å; M200-I209 HydrophobicContact CE-CD1 4.08Å; M200-I209 HydrophobicContact CE-CG1 3.94Å; M200-I209 HydrophobicContact CG-CG1 3.91Å; M200-I249 CarbonylContact O-C 3.48Å; M200-I249 VanDerWaalsContact O-CA 3.31Å; M200-I249 WeakPolarHBondContact O-CA 3.4Å; M200-A250 HydrophobicContact CB-CB 4.32Å; M200-A250 PolarHBondContact N-O 3.42Å; M200-A250 PolarHBondContact O-N 2.05Å
201	R	94.5	Very high	91.2	Very high	6 Å²	6	51.3 Å²	51.3	2%	0.023	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.4	169.8	-169.4	176.4	84.8	130.7	-14.9	109.2	V203 Q208 M216 D217 E242 T246 T248 I249	R201-V203 HydrophobicContact CG-CG2 4.01Å; R201-V203 VanDerWaalsContact NE-CG2 3.25Å; R201-Q208 PolarHBondContact N-O 3.5Å; R201-Q208 PolarHBondContact O-N 3.28Å; R201-M216 HydrophobicContact CB-CG 4.37Å; R201-M216 HydrophobicContact CB-SD 4.01Å; R201-D217 PolarHBondContact NE-O 3.47Å; R201-E242 IonicContact CZ-OE2 2.77Å; R201-E242 IonicContact NH1-OE2 3.21Å; R201-E242 PolarHBondContact NH1-OE2 3.45Å; R201-E242 IonicContact NH2-OE2 2.85Å; R201-E242 PolarHBondContact NH2-OE2 2.96Å; R201-T246 HydrophobicContact CG-CG2 3.83Å; R201-T246 PolarHBondContact NH1-OG1 2.93Å; R201-T248 WeakPolarHBondContact CA-O 3.34Å; R201-I249 HydrophobicContact CG-CG1 4.28Å
202	R	93.6	Very high	91	Very high	99 Å²	99	53.9 Å²	53.9	37%	0.374	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	127.9	171.5	-171.2	178.7	-179.6	147.8	6.1	109.9	T206 D247 T248	R202-T206 CarbonylContact C-O 3.54Å; R202-T206 VanDerWaalsContact CA-O 3.28Å; R202-T206 WeakPolarHBondContact CA-O 3.15Å; R202-D247 HydrophobicContact CB-CB 4.29Å; R202-D247 HydrophobicContact CG-CB 4.23Å; R202-D247 PolarHBondContact O-N 3.28Å; R202-T248 WeakPolarHBondContact CB-OG1 3.45Å; R202-T248 PolarHBondContact N-O 3.48Å
203	V	90.4	Very high	91.1	Very high	17 Å²	17	50.5 Å²	50.5	10%	0.103	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	119.8	-178.7	177.5	0	0	0	0	108.9	R201 H205 T206 D245	R201-V203 HydrophobicContact CG-CG2 4.01Å; R201-V203 VanDerWaalsContact NE-CG2 3.25Å; V203-H205 PolarHBondContact O-N 2.96Å; V203-H205 VanDerWaalsContact O-N 3.12Å; V203-T206 PolarHBondContact N-O 3.26Å; V203-T206 PolarHBondContact O-N 3.3Å; V203-T206 PolarHBondContact O-OG1 2.62Å; V203-D245 WeakPolarHBondContact CA-O 3.29Å; V203-D245 HydrophobicContact CG1-CB 4.07Å
204	N	84.1	Confident	91.1	Very high	83 Å²	83	54 Å²	54	44%	0.444	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.7	47.5	176.1	-65.7	-38.7	0	0	0	112.4	T206 D247	N204-T206 VanDerWaalsContact C-N 3.26Å; N204-T206 PolarHBondContact O-N 3.18Å; N204-D247 PolarHBondContact N-OD2 3.39Å
205	H	82	Confident	91	Very high	157 Å²	157	54.9 Å²	54.9	73%	0.727	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	-1.3	-175.7	-42.8	-68.2	0	0	0	118	V203	V203-H205 PolarHBondContact O-N 2.96Å; V203-H205 VanDerWaalsContact O-N 3.12Å
206	T	88.3	Confident	90.9	Very high	80 Å²	80	54.7 Å²	54.7	49%	0.491	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	148.8	170.2	67.7	0	0	0	0	110.6	R202 V203 N204	R202-T206 CarbonylContact C-O 3.54Å; R202-T206 VanDerWaalsContact CA-O 3.28Å; R202-T206 WeakPolarHBondContact CA-O 3.15Å; V203-T206 PolarHBondContact N-O 3.26Å; V203-T206 PolarHBondContact O-N 3.3Å; V203-T206 PolarHBondContact O-OG1 2.62Å; N204-T206 VanDerWaalsContact C-N 3.26Å; N204-T206 PolarHBondContact O-N 3.18Å
207	M	88.3	Confident	90.8	Very high	121 Å²	121	59 Å²	59	60%	0.596	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	125.5	176.2	-66.2	-175.8	-65.8	0	0	109.6	M200	M200-M207 HydrophobicContact CE-SD 4.41Å; M200-M207 HydrophobicContact CG-CB 4.45Å; M200-M207 HydrophobicContact SD-CB 4.43Å; M200-M207 HydrophobicContact SD-CG 4.24Å; M200-M207 HydrophobicContact SD-SD 3.76Å
208	Q	88.3	Confident	90.8	Very high	63 Å²	63	56.1 Å²	56.1	29%	0.294	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123.4	172.7	-63.8	178.1	-27.1	0	0	107.6	M200 R201	M200-Q208 CarbonylContact C-O 3.58Å; M200-Q208 VanDerWaalsContact CA-O 3.23Å; M200-Q208 WeakPolarHBondContact CA-O 3.26Å; R201-Q208 PolarHBondContact N-O 3.5Å; R201-Q208 PolarHBondContact O-N 3.28Å
209	I	90.9	Very high	90.8	Very high	34 Å²	34	56.1 Å²	56.1	17%	0.174	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137.6	-179.7	-60.3	156.8	0	0	0	108.7	C199 M200 L468 N472	C199-I209 WeakPolarHBondContact O-CA 3.38Å; M200-I209 HydrophobicContact CB-CG1 4.24Å; M200-I209 HydrophobicContact CE-CD1 4.08Å; M200-I209 HydrophobicContact CE-CG1 3.94Å; M200-I209 HydrophobicContact CG-CG1 3.91Å; I209-L468 HydrophobicContact CD1-CD1 3.86Å; I209-N472 VanDerWaalsContact C-ND2 3.28Å; I209-N472 WeakPolarHBondContact CG2-ND2 3.3Å; I209-N472 PolarHBondContact O-ND2 3.4Å; I209-N472 PolarHBondContact O-OD1 3.35Å
210	E	91.8	Very high	90.7	Very high	26 Å²	26	59.2 Å²	59.2	12%	0.121	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	139.4	178	-73.1	-60.6	149.4	0	0	110.9	N198 C199 M216 K476	N198-E210 WeakPolarHBondContact CA-O 3.06Å; N198-E210 PolarHBondContact ND2-O 2.59Å; C199-E210 PolarHBondContact N-O 2.91Å; C199-E210 PolarHBondContact O-N 3.31Å; C199-E210 VanDerWaalsContact SG-CB 3.59Å; E210-M216 HydrophobicContact CG-CB 4.26Å; E210-K476 WeakPolarHBondContact OE1-CE 3.42Å; E210-K476 IonicContact OE1-NZ 2.57Å; E210-K476 PolarHBondContact OE1-NZ 3.27Å; E210-K476 IonicContact OE2-NZ 2.57Å; E210-K476 PolarHBondContact OE2-NZ 3.45Å
211	D	88.6	Confident	90.8	Very high	31 Å²	31	58.5 Å²	58.5	17%	0.166	29%	0.29	C	S	.	.	S	Bend	trans	-85.9	-28.1	169.9	-74.5	2.1	0	0	0	111.3	N198 R469 R473	N198-D211 PolarHBondContact ND2-OD1 3.4Å; D211-R469 WeakPolarHBondContact OD1-CG 3.47Å; D211-R473 IonicContact OD2-CZ 3.2Å; D211-R473 IonicContact OD2-NE 2.71Å; D211-R473 PolarHBondContact OD2-NE 2.82Å; D211-R473 IonicContact OD2-NH2 2.67Å; D211-R473 PolarHBondContact OD2-NH2 3.34Å
212	N	91.3	Very high	90.7	Very high	63 Å²	63	59.7 Å²	59.7	34%	0.337	29%	0.294	S	S	.	.	S	Bend	trans	-118.4	108.9	173.1	179.6	-1.4	0	0	0	108.6	M214 H215	N212-M214 PolarHBondContact O-N 3.41Å; N212-M214 VanDerWaalsContact O-N 3.12Å; N212-M214 WeakPolarHBondContact OD1-CB 3.28Å; N212-M214 WeakPolarHBondContact OD1-CG 3.37Å; N212-M214 PolarHBondContact OD1-N 3.11Å; N212-M214 VanDerWaalsContact OD1-N 3.1Å; N212-H215 PolarHBondContact ND2-CD2 3.4Å; N212-H215 PolarHBondContact ND2-NE2 3.4Å; N212-H215 PolarHBondContact O-N 3.34Å
213	C	94.3	Very high	90.7	Very high	4 Å²	4	57 Å²	57	3%	0.027	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-68.6	-13.1	-173.9	-61.4	0	0	0	0	115.2	F196 N198 C199 H215 M216 I221 F235	F196-C213 HydrophobicContact CB-CB 4.11Å; N198-C213 VanDerWaalsContact C-SG 3.55Å; C199-C213 HydrophobicContact CB-CB 4.02Å; C199-C213 WeakPolarHBondContact CB-SG 3.45Å; C199-C213 PolarHBondContact N-SG 3.08Å; C199-C213 VanDerWaalsContact N-SG 3.37Å; C199-C213 WeakPolarHBondContact SG-CA 3.09Å; C199-C213 WeakPolarHBondContact SG-CB 3.39Å; C199-C213 CovalentContact SG-SG 2.04Å; C199-C213 PolarHBondContact SG-SG 3.37Å; C213-H215 PolarHBondContact O-N 3.4Å; C213-M216 WeakPolarHBondContact O-CB 3.43Å; C213-M216 PolarHBondContact O-N 3.33Å; C213-I221 HydrophobicContact CB-CD1 4Å; C213-I221 WeakPolarHBondContact O-CD1 3.49Å; C213-F235 HydrophobicContact CB-CE1 3.93Å; C213-F235 HydrophobicContact CB-CZ 4.2Å
214	M	93.2	Very high	90.7	Very high	109 Å²	109	56.5 Å²	56.5	54%	0.537	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-66.1	-19.5	168.9	-61.5	-174.7	63.8	0	0	113.1	T193 N212 I221	T193-M214 HydrophobicContact CG2-CG 4.06Å; T193-M214 HydrophobicContact CG2-SD 4.04Å; T193-M214 PolarHBondContact OG1-SD 3.08Å; N212-M214 PolarHBondContact O-N 3.41Å; N212-M214 VanDerWaalsContact O-N 3.12Å; N212-M214 WeakPolarHBondContact OD1-CB 3.28Å; N212-M214 WeakPolarHBondContact OD1-CG 3.37Å; N212-M214 PolarHBondContact OD1-N 3.11Å; N212-M214 VanDerWaalsContact OD1-N 3.1Å; M214-I221 HydrophobicContact CG-CD1 4.33Å
215	H	91.8	Very high	91.2	Very high	120 Å²	120	53.4 Å²	53.4	56%	0.556	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-99.9	9.7	179.2	-59.1	-43.8	0	0	0	113.3	N212 C213 D217	N212-H215 PolarHBondContact ND2-CD2 3.4Å; N212-H215 PolarHBondContact ND2-NE2 3.4Å; N212-H215 PolarHBondContact O-N 3.34Å; C213-H215 PolarHBondContact O-N 3.4Å; H215-D217 PolarHBondContact O-N 3.08Å
216	M	91.9	Very high	91.8	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.015	24%	0.235	C	C	.	.			trans	-66.6	117.2	177.6	-169.6	168.1	71.4	0	0	111	C199 R201 E210 C213 F219 F235 I249	C199-M216 HydrophobicContact CB-SD 3.98Å; R201-M216 HydrophobicContact CB-CG 4.37Å; R201-M216 HydrophobicContact CB-SD 4.01Å; E210-M216 HydrophobicContact CG-CB 4.26Å; C213-M216 WeakPolarHBondContact O-CB 3.43Å; C213-M216 PolarHBondContact O-N 3.33Å; M216-F219 HydrophobicContact CE-CB 3.43Å; M216-F219 VanDerWaalsContact CE-CB 3.43Å; M216-F219 HydrophobicContact CE-CD1 3.99Å; M216-F219 HydrophobicContact CE-CD2 4.07Å; M216-F219 HydrophobicContact CE-CG 3.54Å; M216-F219 PolarHBondContact O-N 3.29Å; M216-F219 VanDerWaalsContact O-O 3.14Å; M216-F235 HydrophobicContact CE-CD1 3.91Å; M216-F235 HydrophobicContact CE-CE1 4.38Å; M216-I249 HydrophobicContact CE-CD1 3.97Å
217	D	90.7	Very high	92.1	Very high	95 Å²	95	42.9 Å²	42.9	51%	0.508	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	144.3	178.9	-74.5	-27.9	0	0	0	111.5	R201 H215 F219	R201-D217 PolarHBondContact NE-O 3.47Å; H215-D217 PolarHBondContact O-N 3.08Å; D217-F219 PolarHBondContact O-N 2.96Å; D217-F219 VanDerWaalsContact O-N 3.15Å
218	G	91.3	Very high	92.3	Very high	5 Å²	5	37.8 Å²	37.8	5%	0.052	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	-13.3	-177.6	0	0	0	0	0	115.9	K238 E242	G218-K238 PolarHBondContact O-N 2.94Å; G218-E242 WeakPolarHBondContact CA-OE1 3.43Å; G218-E242 WeakPolarHBondContact CA-OE2 3.35Å
219	F	93.4	Very high	92.6	Very high	6 Å²	6	35.5 Å²	35.5	3%	0.026	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	149.5	-176.6	-84.9	-105.1	0	0	0	113.2	F115 M216 D217 F235 E236 P237 K238 T246 I249	F115-F219 HydrophobicContact CD1-CE1 4.09Å; F115-F219 AromaticContact CD1-CZ 3.72Å; F115-F219 HydrophobicContact CD1-CZ 3.72Å; F115-F219 HydrophobicContact CE1-CE1 4.35Å; F115-F219 HydrophobicContact CE1-CZ 4.22Å; F115-F219 HydrophobicContact CG-CZ 4.43Å; M216-F219 HydrophobicContact CE-CB 3.43Å; M216-F219 VanDerWaalsContact CE-CB 3.43Å; M216-F219 HydrophobicContact CE-CD1 3.99Å; M216-F219 HydrophobicContact CE-CD2 4.07Å; M216-F219 HydrophobicContact CE-CG 3.54Å; M216-F219 PolarHBondContact O-N 3.29Å; M216-F219 VanDerWaalsContact O-O 3.14Å; D217-F219 PolarHBondContact O-N 2.96Å; D217-F219 VanDerWaalsContact O-N 3.15Å; F219-F235 HydrophobicContact CD1-CB 4.41Å; F219-E236 CarbonylContact C-O 3.51Å; F219-E236 WeakPolarHBondContact CA-O 3.12Å; F219-E236 WeakPolarHBondContact CD1-O 3.04Å; F219-P237 HydrophobicContact CE1-CB 4.22Å; F219-P237 HydrophobicContact CE2-CB 4.25Å; F219-P237 HydrophobicContact CZ-CB 3.92Å; F219-P237 HydrophobicContact CZ-CG 4.48Å; F219-K238 VanDerWaalsContact C-CE 3.49Å; F219-K238 WeakPolarHBondContact O-CE 3.38Å; F219-T246 HydrophobicContact CE2-CG2 4.1Å; F219-T246 WeakPolarHBondContact CE2-OG1 3.48Å; F219-T246 HydrophobicContact CZ-CG2 4.18Å; F219-I249 HydrophobicContact CD1-CD1 3.79Å; F219-I249 HydrophobicContact CD2-CD1 4.29Å; F219-I249 HydrophobicContact CE1-CD1 3.32Å; F219-I249 HydrophobicContact CE2-CD1 3.9Å; F219-I249 HydrophobicContact CG-CD1 4.27Å; F219-I249 HydrophobicContact CZ-CD1 3.41Å; F219-I249 VanDerWaalsContact CZ-CD1 3.41Å
220	Q	92.8	Very high	92.8	Very high	68 Å²	68	33.9 Å²	33.9	32%	0.318	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	148.8	168.5	63.5	-173.6	-5.1	0	0	110.2	E236 K238	Q220-E236 HydrophobicContact CG-CG 3.54Å; Q220-E236 WeakPolarHBondContact CG-OE1 3.34Å; Q220-E236 PolarHBondContact N-O 3.45Å; Q220-E236 PolarHBondContact NE2-OE1 2.89Å; Q220-E236 PolarHBondContact O-N 3.16Å; Q220-K238 HydrophobicContact CB-CG 4.17Å; Q220-K238 HydrophobicContact CG-CG 4.32Å
221	I	94.7	Very high	93	Very high	39 Å²	39	32.7 Å²	32.7	20%	0.2	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	112.7	175.6	-56.1	177.3	0	0	0	107.6	T193 C213 M214 H233 T234 F235	T193-I221 HydrophobicContact CG2-CG2 4.34Å; C213-I221 HydrophobicContact CB-CD1 4Å; C213-I221 WeakPolarHBondContact O-CD1 3.49Å; M214-I221 HydrophobicContact CG-CD1 4.33Å; I221-H233 HydrophobicContact CG2-CB 3.87Å; I221-T234 CarbonylContact C-O 3.48Å; I221-T234 VanDerWaalsContact CA-O 3.32Å; I221-T234 WeakPolarHBondContact CA-O 3.36Å; I221-F235 HydrophobicContact CD1-CD1 4.16Å; I221-F235 HydrophobicContact CD1-CE1 3.49Å; I221-F235 VanDerWaalsContact CD1-CE1 3.49Å; I221-F235 HydrophobicContact CD1-CE2 4.35Å; I221-F235 HydrophobicContact CD1-CZ 3.59Å; I221-F235 HydrophobicContact CG1-CD1 3.9Å; I221-F235 HydrophobicContact CG1-CE1 3.77Å; I221-F235 HydrophobicContact CG1-CG 4.37Å; I221-F235 HydrophobicContact CG1-CZ 4.1Å
222	R	92.2	Very high	93.4	Very high	31 Å²	31	31.2 Å²	31.2	12%	0.117	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	137	170.3	-78.5	172	59.3	-149	-1.5	109.6	H233 T234 E236 S361 Y362	R222-H233 CarbonylContact O-C 3.42Å; R222-H233 WeakPolarHBondContact O-CA 3.37Å; R222-T234 PolarHBondContact N-O 3.42Å; R222-T234 PolarHBondContact O-N 3.16Å; R222-E236 WeakPolarHBondContact CD-OE1 3.38Å; R222-E236 IonicContact CZ-OE2 3.23Å; R222-E236 IonicContact NH1-OE1 2.8Å; R222-E236 IonicContact NH1-OE2 3.96Å; R222-E236 PolarHBondContact NH1-OE2 3.4Å; R222-S361 PolarHBondContact NH2-O 3.1Å; R222-Y362 VanDerWaalsContact NH2-CD1 3.3Å
223	K	93.6	Very high	93.7	Very high	41 Å²	41	28.3 Å²	28.3	18%	0.178	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	133.6	173.5	-175.7	166	172	176.1	0	109.1	Y187 N231 C232	Y187-K223 HydrophobicContact CD2-CD 4.26Å; Y187-K223 HydrophobicContact CE2-CD 3.37Å; Y187-K223 HydrophobicContact CE2-CG 4.15Å; Y187-K223 WeakPolarHBondContact OH-CD 3.45Å; Y187-K223 PolarHBondContact OH-NZ 3.47Å; K223-N231 VanDerWaalsContact CE-ND2 3.3Å; K223-N231 WeakPolarHBondContact CE-ND2 3.22Å; K223-N231 WeakPolarHBondContact CE-OD1 3.21Å; K223-N231 PolarHBondContact NZ-ND2 3.34Å; K223-C232 WeakPolarHBondContact CA-O 3.35Å
224	F	91.2	Very high	93.8	Very high	8 Å²	8	28.2 Å²	28.2	4%	0.035	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	161	169.3	80.6	-81.6	0	0	0	110.1	T119 H226 C232 P290 L292 Y362	T119-F224 HydrophobicContact CG2-CE1 3.36Å; T119-F224 HydrophobicContact CG2-CZ 3.67Å; F224-H226 HydrophobicContact CE2-CB 4.19Å; F224-C232 HydrophobicContact CD1-CB 3.64Å; F224-C232 HydrophobicContact CD2-CB 4.45Å; F224-C232 HydrophobicContact CE1-CB 3.06Å; F224-C232 HydrophobicContact CE2-CB 3.97Å; F224-C232 HydrophobicContact CG-CB 4.29Å; F224-C232 HydrophobicContact CZ-CB 3.24Å; F224-C232 PolarHBondContact N-O 3Å; F224-C232 PolarHBondContact O-N 2.73Å; F224-P290 HydrophobicContact CD1-CG 4.02Å; F224-P290 HydrophobicContact CD2-CG 4.39Å; F224-P290 HydrophobicContact CE1-CB 4.47Å; F224-P290 HydrophobicContact CE1-CG 3.44Å; F224-P290 VanDerWaalsContact CE1-CG 3.44Å; F224-P290 HydrophobicContact CE2-CG 3.88Å; F224-P290 HydrophobicContact CG-CG 4.46Å; F224-P290 HydrophobicContact CZ-CB 4.31Å; F224-P290 HydrophobicContact CZ-CG 3.38Å; F224-L292 HydrophobicContact CE2-CD1 4.02Å; F224-L292 HydrophobicContact CZ-CD1 3.8Å; F224-L292 HydrophobicContact CZ-CG 4.4Å; F224-Y362 WeakPolarHBondContact CB-OH 3.14Å
225	S	94.5	Very high	94	Very high	17 Å²	17	23.1 Å²	23.1	12%	0.119	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.8	-175.3	-163.2	0	0	0	0	111.7	Y178 F230 R391	Y178-S225 WeakPolarHBondContact CE2-OG 3.26Å; Y178-S225 WeakPolarHBondContact OH-CB 3.47Å; Y178-S225 PolarHBondContact OH-OG 3.03Å; S225-F230 CarbonylContact C-O 3.51Å; S225-F230 WeakPolarHBondContact CA-O 3.42Å; S225-F230 PolarHBondContact OG-O 3.47Å; S225-R391 PolarHBondContact O-NH2 3.5Å
226	H	95.4	Very high	94.1	Very high	13 Å²	13	17.6 Å²	17.6	6%	0.06	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	145.2	172	-162.6	-102	0	0	0	110.2	F224 T228 Y229 F230 L292 E293	F224-H226 HydrophobicContact CE2-CB 4.19Å; H226-T228 VanDerWaalsContact C-N 3.35Å; H226-T228 PolarHBondContact ND1-N 3.06Å; H226-T228 PolarHBondContact O-N 3.4Å; H226-Y229 HydrophobicContact CB-CD2 4.25Å; H226-Y229 AromaticContact CE1-CD2 3.89Å; H226-Y229 AromaticContact CE1-CE2 3.99Å; H226-Y229 AromaticContact CG-CD2 3.83Å; H226-Y229 AromaticContact ND1-CD2 3.27Å; H226-Y229 VanDerWaalsContact ND1-CD2 3.27Å; H226-Y229 WeakPolarHBondContact ND1-CD2 3.33Å; H226-Y229 AromaticContact ND1-CE2 3.82Å; H226-F230 PolarHBondContact N-O 3.49Å; H226-F230 WeakPolarHBondContact O-CA 3.42Å; H226-F230 PolarHBondContact O-N 3.15Å; H226-L292 HydrophobicContact CB-CD1 3.96Å; H226-L292 WeakPolarHBondContact CD2-CD1 3.45Å; H226-E293 IonicContact CE1-OE1 3.8Å; H226-E293 PolarHBondContact CE1-OE1 2.68Å; H226-E293 VanDerWaalsContact CE1-OE1 3.31Å; H226-E293 IonicContact NE2-OE1 2.79Å
227	H	94.2	Very high	94.2	Very high	4 Å²	4	17.7 Å²	17.7	2%	0.019	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-33	-177.6	61.8	79.3	0	0	0	113.4	S175 Y178 I387 Y388	S175-H227 WeakPolarHBondContact CB-ND1 3.28Å; S175-H227 PolarHBondContact OG-ND1 3.44Å; Y178-H227 WeakPolarHBondContact CB-O 3.47Å; Y178-H227 HydrophobicContact CD1-CB 4Å; Y178-H227 HydrophobicContact CE1-CB 4.49Å; Y178-H227 HydrophobicContact CG-CB 4.16Å; H227-I387 HydrophobicContact CB-CD1 3.96Å; H227-I387 HydrophobicContact CB-CG1 3.35Å; H227-Y388 AromaticContact CE1-CE1 3.39Å; H227-Y388 WeakPolarHBondContact CE1-CE1 3.21Å; H227-Y388 AromaticContact CE1-CZ 3.73Å; H227-Y388 AromaticContact NE2-CD1 3.35Å; H227-Y388 WeakPolarHBondContact NE2-CD1 3.28Å; H227-Y388 AromaticContact NE2-CE1 3.21Å; H227-Y388 WeakPolarHBondContact NE2-CE1 3.46Å; H227-Y388 AromaticContact NE2-CZ 3.85Å
228	T	92.8	Very high	94.1	Very high	13 Å²	13	17.6 Å²	17.6	8%	0.08	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-40.7	176.4	-51.5	0	0	0	0	112.1	L174 H226	L174-T228 HydrophobicContact CD2-CG2 4.26Å; L174-T228 WeakPolarHBondContact CD2-O 3.5Å; H226-T228 VanDerWaalsContact C-N 3.35Å; H226-T228 PolarHBondContact ND1-N 3.06Å; H226-T228 PolarHBondContact O-N 3.4Å
229	Y	94.2	Very high	94	Very high	16 Å²	16	19.8 Å²	19.8	6%	0.063	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-0	-171.4	-53	-66.2	0	0	0	114.2	C121 H122 H123 H226 N231 R280 L292	C121-Y229 HydrophobicContact CB-CD1 4.39Å; C121-Y229 HydrophobicContact CB-CD2 4.16Å; C121-Y229 HydrophobicContact CB-CG 3.83Å; H122-Y229 WeakPolarHBondContact O-CD1 3.34Å; H123-Y229 AromaticContact ND1-CE1 3.62Å; H226-Y229 HydrophobicContact CB-CD2 4.25Å; H226-Y229 AromaticContact CE1-CD2 3.89Å; H226-Y229 AromaticContact CE1-CE2 3.99Å; H226-Y229 AromaticContact CG-CD2 3.83Å; H226-Y229 AromaticContact ND1-CD2 3.27Å; H226-Y229 VanDerWaalsContact ND1-CD2 3.27Å; H226-Y229 WeakPolarHBondContact ND1-CD2 3.33Å; H226-Y229 AromaticContact ND1-CE2 3.82Å; Y229-N231 PolarHBondContact O-N 3.02Å; Y229-R280 HydrophobicContact CE1-CB 4.11Å; Y229-R280 HydrophobicContact CE2-CB 4.37Å; Y229-R280 HydrophobicContact CE2-CG 4.09Å; Y229-L292 HydrophobicContact CD2-CD1 3.66Å; Y229-L292 HydrophobicContact CE2-CB 4.23Å; Y229-L292 HydrophobicContact CE2-CD1 4.07Å
230	F	95.3	Very high	93.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	56.8	-99.3	-177	-76.5	-123.2	0	0	0	112.1	P125 F126 L174 Y177 Y178 L181 A186 L189 S225 H226	P125-F230 HydrophobicContact CB-CB 3.85Å; P125-F230 HydrophobicContact CB-CD2 3.46Å; P125-F230 VanDerWaalsContact CB-CD2 3.46Å; P125-F230 HydrophobicContact CB-CE2 4.28Å; P125-F230 HydrophobicContact CB-CG 3.81Å; P125-F230 HydrophobicContact CG-CD2 4.02Å; P125-F230 HydrophobicContact CG-CE2 4.38Å; F126-F230 HydrophobicContact CE1-CD1 4.43Å; F126-F230 AromaticContact CE1-CE1 3.94Å; F126-F230 HydrophobicContact CE1-CE1 3.94Å; F126-F230 HydrophobicContact CE1-CE2 4.07Å; F126-F230 AromaticContact CE1-CZ 3.75Å; F126-F230 HydrophobicContact CE1-CZ 3.75Å; F126-F230 HydrophobicContact CZ-CE2 4.49Å; F126-F230 HydrophobicContact CZ-CZ 4.37Å; L174-F230 HydrophobicContact CD1-CE2 3.71Å; L174-F230 HydrophobicContact CD1-CZ 4.33Å; L174-F230 HydrophobicContact CG-CE2 4.1Å; Y177-F230 AromaticContact CD1-CZ 3.92Å; Y177-F230 HydrophobicContact CD1-CZ 3.92Å; Y177-F230 HydrophobicContact CE1-CE1 4.49Å; Y177-F230 AromaticContact CE1-CZ 3.9Å; Y177-F230 HydrophobicContact CE1-CZ 3.9Å; Y178-F230 HydrophobicContact CD2-CD1 4.25Å; Y178-F230 HydrophobicContact CD2-CD2 4.13Å; Y178-F230 HydrophobicContact CD2-CE1 4.07Å; Y178-F230 AromaticContact CD2-CE2 3.93Å; Y178-F230 HydrophobicContact CD2-CE2 3.93Å; Y178-F230 HydrophobicContact CD2-CG 4.26Å; Y178-F230 AromaticContact CD2-CZ 3.9Å; Y178-F230 HydrophobicContact CD2-CZ 3.9Å; L181-F230 HydrophobicContact CD1-CE1 3.78Å; L181-F230 HydrophobicContact CD1-CZ 4.03Å; A186-F230 HydrophobicContact CB-CD1 4.3Å; A186-F230 HydrophobicContact CB-CE1 4.19Å; A186-F230 WeakPolarHBondContact O-CD1 3.4Å; L189-F230 HydrophobicContact CB-CD1 4.19Å; L189-F230 HydrophobicContact CB-CE1 4.2Å; L189-F230 HydrophobicContact CD1-CE1 4.06Å; S225-F230 CarbonylContact C-O 3.51Å; S225-F230 WeakPolarHBondContact CA-O 3.42Å; S225-F230 PolarHBondContact OG-O 3.47Å; H226-F230 PolarHBondContact N-O 3.49Å; H226-F230 WeakPolarHBondContact O-CA 3.42Å; H226-F230 PolarHBondContact O-N 3.15Å
231	N	95.9	Very high	93.6	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	112.1	-174	-72.7	-21.2	0	0	0	110.3	Y187 G190 H191 K223 Y229	Y187-N231 PolarHBondContact O-ND2 3.34Å; G190-N231 WeakPolarHBondContact CA-ND2 3.45Å; G190-N231 PolarHBondContact O-ND2 3.1Å; G190-N231 VanDerWaalsContact O-ND2 3.12Å; H191-N231 WeakPolarHBondContact O-CB 3.37Å; H191-N231 PolarHBondContact O-ND2 3.32Å; K223-N231 VanDerWaalsContact CE-ND2 3.3Å; K223-N231 WeakPolarHBondContact CE-ND2 3.22Å; K223-N231 WeakPolarHBondContact CE-OD1 3.21Å; K223-N231 PolarHBondContact NZ-ND2 3.34Å; Y229-N231 PolarHBondContact O-N 3.02Å
232	C	97.3	Very high	93.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	150.8	173.8	-65.4	0	0	0	0	110.6	I120 C121 K223 F224	I120-C232 WeakPolarHBondContact O-CA 3.39Å; C121-C232 HydrophobicContact CB-CB 4.16Å; C121-C232 WeakPolarHBondContact CB-SG 3.39Å; C121-C232 WeakPolarHBondContact SG-CB 3.35Å; C121-C232 CovalentContact SG-SG 2.02Å; C121-C232 PolarHBondContact SG-SG 2.76Å; K223-C232 WeakPolarHBondContact CA-O 3.35Å; F224-C232 HydrophobicContact CD1-CB 3.64Å; F224-C232 HydrophobicContact CD2-CB 4.45Å; F224-C232 HydrophobicContact CE1-CB 3.06Å; F224-C232 HydrophobicContact CE2-CB 3.97Å; F224-C232 HydrophobicContact CG-CB 4.29Å; F224-C232 HydrophobicContact CZ-CB 3.24Å; F224-C232 PolarHBondContact N-O 3Å; F224-C232 PolarHBondContact O-N 2.73Å
233	H	97	Very high	93.4	Very high	1 Å²	1	25 Å²	25	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	122.7	-174.9	-57.5	84.2	0	0	0	110.1	I120 H191 F196 I221 R222	I120-H233 PolarHBondContact N-O 3.06Å; I120-H233 PolarHBondContact O-N 2.87Å; H191-H233 PolarHBondContact O-CE1 3.03Å; F196-H233 HydrophobicContact CE2-CB 3.65Å; F196-H233 AromaticContact CE2-CG 3.58Å; F196-H233 AromaticContact CE2-ND1 3.78Å; F196-H233 HydrophobicContact CZ-CB 3.71Å; F196-H233 AromaticContact CZ-CG 3.99Å; I221-H233 HydrophobicContact CG2-CB 3.87Å; R222-H233 CarbonylContact O-C 3.42Å; R222-H233 WeakPolarHBondContact O-CA 3.37Å
234	T	96.9	Very high	93.3	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.018	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	112.8	179.7	-52.4	0	0	0	0	109.5	A117 L118 T119 I221 R222 E236	A117-T234 HydrophobicContact CB-CG2 3.95Å; L118-T234 CarbonylContact O-C 3.51Å; L118-T234 WeakPolarHBondContact O-CA 3.26Å; T119-T234 WeakPolarHBondContact OG1-CB 3.39Å; T119-T234 WeakPolarHBondContact OG1-CG2 3.28Å; T119-T234 PolarHBondContact OG1-OG1 2.95Å; I221-T234 CarbonylContact C-O 3.48Å; I221-T234 VanDerWaalsContact CA-O 3.32Å; I221-T234 WeakPolarHBondContact CA-O 3.36Å; R222-T234 PolarHBondContact N-O 3.42Å; R222-T234 PolarHBondContact O-N 3.16Å; T234-E236 HydrophobicContact CG2-CB 4.49Å
235	F	96.4	Very high	93.3	Very high	1 Å²	1	27.4 Å²	27.4	0%	0.004	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	114.4	168.7	-72	-103.6	0	0	0	108.3	A117 L118 I120 F196 C213 M216 F219 I221 L251	A117-F235 CarbonylContact C-O 3.58Å; A117-F235 VanDerWaalsContact CA-O 3.27Å; A117-F235 WeakPolarHBondContact CA-O 3.48Å; L118-F235 HydrophobicContact CB-CB 4.38Å; L118-F235 PolarHBondContact N-O 2.86Å; L118-F235 PolarHBondContact O-N 3.15Å; I120-F235 HydrophobicContact CD1-CD2 4.08Å; I120-F235 HydrophobicContact CD1-CE2 4.04Å; F196-F235 HydrophobicContact CB-CZ 4.47Å; F196-F235 AromaticContact CD1-CE2 3.85Å; F196-F235 HydrophobicContact CD1-CE2 3.85Å; F196-F235 AromaticContact CD1-CZ 3.74Å; F196-F235 HydrophobicContact CD1-CZ 3.74Å; F196-F235 HydrophobicContact CD2-CE2 4.31Å; F196-F235 HydrophobicContact CD2-CZ 4.08Å; F196-F235 AromaticContact CE1-CE2 3.6Å; F196-F235 HydrophobicContact CE1-CE2 3.6Å; F196-F235 HydrophobicContact CE1-CZ 4.01Å; F196-F235 HydrophobicContact CE2-CE2 4.09Å; F196-F235 HydrophobicContact CE2-CZ 4.32Å; F196-F235 HydrophobicContact CG-CE2 4.22Å; F196-F235 AromaticContact CG-CZ 3.81Å; F196-F235 HydrophobicContact CG-CZ 3.81Å; F196-F235 AromaticContact CZ-CE2 3.75Å; F196-F235 HydrophobicContact CZ-CE2 3.75Å; F196-F235 HydrophobicContact CZ-CZ 4.3Å; C213-F235 HydrophobicContact CB-CE1 3.93Å; C213-F235 HydrophobicContact CB-CZ 4.2Å; M216-F235 HydrophobicContact CE-CD1 3.91Å; M216-F235 HydrophobicContact CE-CE1 4.38Å; F219-F235 HydrophobicContact CD1-CB 4.41Å; I221-F235 HydrophobicContact CD1-CD1 4.16Å; I221-F235 HydrophobicContact CD1-CE1 3.49Å; I221-F235 VanDerWaalsContact CD1-CE1 3.49Å; I221-F235 HydrophobicContact CD1-CE2 4.35Å; I221-F235 HydrophobicContact CD1-CZ 3.59Å; I221-F235 HydrophobicContact CG1-CD1 3.9Å; I221-F235 HydrophobicContact CG1-CE1 3.77Å; I221-F235 HydrophobicContact CG1-CG 4.37Å; I221-F235 HydrophobicContact CG1-CZ 4.1Å; F235-L251 HydrophobicContact CD2-CD1 4.26Å; F235-L251 HydrophobicContact CE1-CD2 3.99Å; F235-L251 HydrophobicContact CE2-CD1 4.04Å; F235-L251 HydrophobicContact CZ-CD1 4.19Å; F235-L251 HydrophobicContact CZ-CD2 4.15Å
236	E	93.8	Very high	93.2	Very high	4 Å²	4	27 Å²	27	2%	0.019	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	144.2	-179.9	60.4	176.1	-158.5	0	0	111.4	A117 F219 Q220 R222 T234 G287	A117-E236 HydrophobicContact CB-CB 3.84Å; F219-E236 CarbonylContact C-O 3.51Å; F219-E236 WeakPolarHBondContact CA-O 3.12Å; F219-E236 WeakPolarHBondContact CD1-O 3.04Å; Q220-E236 HydrophobicContact CG-CG 3.54Å; Q220-E236 WeakPolarHBondContact CG-OE1 3.34Å; Q220-E236 PolarHBondContact N-O 3.45Å; Q220-E236 PolarHBondContact NE2-OE1 2.89Å; Q220-E236 PolarHBondContact O-N 3.16Å; R222-E236 WeakPolarHBondContact CD-OE1 3.38Å; R222-E236 IonicContact CZ-OE2 3.23Å; R222-E236 IonicContact NH1-OE1 2.8Å; R222-E236 IonicContact NH1-OE2 3.96Å; R222-E236 PolarHBondContact NH1-OE2 3.4Å; T234-E236 HydrophobicContact CG2-CB 4.49Å; E236-G287 PolarHBondContact OE2-N 3.35Å
237	P	93.6	Very high	93	Very high	5 Å²	5	29.8 Å²	29.8	3%	0.032	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	137.6	174.3	27.1	-33.3	0	0	0	110.2	F219 T239 E242 A243 P286	F219-P237 HydrophobicContact CE1-CB 4.22Å; F219-P237 HydrophobicContact CE2-CB 4.25Å; F219-P237 HydrophobicContact CZ-CB 3.92Å; F219-P237 HydrophobicContact CZ-CG 4.48Å; P237-T239 VanDerWaalsContact C-N 3.34Å; P237-E242 HydrophobicContact CB-CB 4.37Å; P237-A243 HydrophobicContact CB-CB 3.79Å; P237-A243 HydrophobicContact CG-CB 3.6Å; P237-P286 HydrophobicContact CG-CB 4.21Å; P237-P286 HydrophobicContact CG-CG 3.78Å
238	K	90.4	Very high	93	Very high	93 Å²	93	32.8 Å²	32.8	40%	0.404	17%	0.17	S	C	.	.	S	Bend	trans	-68.3	-34	-179.6	-68.4	-179.1	-169.5	175.4	0	112.4	G218 F219 Q220	G218-K238 PolarHBondContact O-N 2.94Å; F219-K238 VanDerWaalsContact C-CE 3.49Å; F219-K238 WeakPolarHBondContact O-CE 3.38Å; Q220-K238 HydrophobicContact CB-CG 4.17Å; Q220-K238 HydrophobicContact CG-CG 4.32Å
239	T	89.2	Confident	93.1	Very high	52 Å²	52	33.7 Å²	33.7	32%	0.319	17%	0.174	S	C	.	.	S	Bend	trans	-137.2	162.9	-177.6	74.1	0	0	0	0	110.5	P237 V241 E242 A243	P237-T239 VanDerWaalsContact C-N 3.34Å; T239-V241 VanDerWaalsContact C-N 3.28Å; T239-V241 PolarHBondContact O-N 3.34Å; T239-V241 PolarHBondContact OG1-N 2.96Å; T239-E242 PolarHBondContact O-N 3.49Å; T239-E242 WeakPolarHBondContact OG1-CG 3.49Å; T239-E242 PolarHBondContact OG1-N 3.45Å; T239-A243 PolarHBondContact O-N 2.95Å; T239-A243 VanDerWaalsContact O-N 3.07Å
240	K	87.6	Confident	93.1	Very high	106 Å²	106	35.4 Å²	35.4	46%	0.461	19%	0.191	S	C	.	.	H	α-helix	trans	-62.2	-36.1	174.7	-177.5	174.9	170.4	-175.4	0	112.6	A243 E244 D350	K240-A243 WeakPolarHBondContact O-CB 3.48Å; K240-A243 PolarHBondContact O-N 3.32Å; K240-E244 WeakPolarHBondContact CE-OE1 3.41Å; K240-E244 HydrophobicContact CG-CG 4.49Å; K240-E244 IonicContact NZ-OE1 3.93Å; K240-E244 WeakPolarHBondContact O-CG 3.23Å; K240-E244 PolarHBondContact O-N 3.12Å; K240-D350 WeakPolarHBondContact CD-OD2 3.3Å; K240-D350 IonicContact NZ-OD2 2.75Å
241	V	89.4	Confident	93.1	Very high	88 Å²	88	37.4 Å²	37.4	53%	0.533	20%	0.202	S	C	.	.	H	α-helix	trans	-62.9	-46.4	177	-179.3	0	0	0	0	110.4	T239 A243 E244 D245	T239-V241 VanDerWaalsContact C-N 3.28Å; T239-V241 PolarHBondContact O-N 3.34Å; T239-V241 PolarHBondContact OG1-N 2.96Å; V241-A243 PolarHBondContact O-N 3.13Å; V241-E244 PolarHBondContact O-N 3.2Å; V241-E244 VanDerWaalsContact O-N 3.13Å; V241-D245 WeakPolarHBondContact O-CB 3.35Å; V241-D245 PolarHBondContact O-N 2.87Å
242	E	91.2	Very high	93	Very high	55 Å²	55	39.3 Å²	39.3	26%	0.257	21%	0.212	S	C	.	.	H	α-helix	trans	-62.4	-34.2	176.4	-66.9	-74	-171.5	0	0	112.1	R201 G218 P237 T239 T246	R201-E242 IonicContact CZ-OE2 2.77Å; R201-E242 IonicContact NH1-OE2 3.21Å; R201-E242 PolarHBondContact NH1-OE2 3.45Å; R201-E242 IonicContact NH2-OE2 2.85Å; R201-E242 PolarHBondContact NH2-OE2 2.96Å; G218-E242 WeakPolarHBondContact CA-OE1 3.43Å; G218-E242 WeakPolarHBondContact CA-OE2 3.35Å; P237-E242 HydrophobicContact CB-CB 4.37Å; T239-E242 PolarHBondContact O-N 3.49Å; T239-E242 WeakPolarHBondContact OG1-CG 3.49Å; T239-E242 PolarHBondContact OG1-N 3.45Å; E242-T246 WeakPolarHBondContact O-CB 3.33Å; E242-T246 PolarHBondContact O-N 3.29Å; E242-T246 PolarHBondContact O-OG1 2.68Å
243	A	92.1	Very high	92.9	Very high	4 Å²	4	40.9 Å²	40.9	3%	0.033	22%	0.221	C	C	.	.	H	α-helix	trans	-66.7	-44	173.4	0	0	0	0	0	111.8	P114 F115 P237 T239 K240 V241	P114-A243 HydrophobicContact CB-CB 3.86Å; F115-A243 WeakPolarHBondContact CB-O 3.48Å; F115-A243 PolarHBondContact N-O 3.44Å; P237-A243 HydrophobicContact CB-CB 3.79Å; P237-A243 HydrophobicContact CG-CB 3.6Å; T239-A243 PolarHBondContact O-N 2.95Å; T239-A243 VanDerWaalsContact O-N 3.07Å; K240-A243 WeakPolarHBondContact O-CB 3.48Å; K240-A243 PolarHBondContact O-N 3.32Å; V241-A243 PolarHBondContact O-N 3.13Å
244	E	90.9	Very high	92.7	Very high	64 Å²	64	42.9 Å²	42.9	30%	0.299	24%	0.235	S	C	.	.	H	α-helix	trans	-72.5	-25.9	-178.6	-73.9	175.8	-176.2	0	0	113.7	K112 K240 V241	K112-E244 HydrophobicContact CB-CB 4.43Å; K112-E244 HydrophobicContact CD-CB 4.3Å; K240-E244 WeakPolarHBondContact CE-OE1 3.41Å; K240-E244 HydrophobicContact CG-CG 4.49Å; K240-E244 IonicContact NZ-OE1 3.93Å; K240-E244 WeakPolarHBondContact O-CG 3.23Å; K240-E244 PolarHBondContact O-N 3.12Å; V241-E244 PolarHBondContact O-N 3.2Å; V241-E244 VanDerWaalsContact O-N 3.13Å
245	D	91.3	Very high	92.5	Very high	36 Å²	36	44.7 Å²	44.7	19%	0.193	25%	0.245	C	C	.	.	H	α-helix	trans	-91.4	-12.9	-178.6	-75.5	-20.1	0	0	0	113.8	K112 V203 V241	K112-D245 IonicContact NZ-OD1 2.74Å; K112-D245 PolarHBondContact NZ-OD1 3.35Å; V203-D245 WeakPolarHBondContact CA-O 3.29Å; V203-D245 HydrophobicContact CG1-CB 4.07Å; V241-D245 WeakPolarHBondContact O-CB 3.35Å; V241-D245 PolarHBondContact O-N 2.87Å
246	T	93.3	Very high	92	Very high	8 Å²	8	46.5 Å²	46.5	5%	0.049	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	121.5	-179.1	-59	0	0	0	0	111.2	F115 R201 F219 E242 I249	F115-T246 HydrophobicContact CB-CG2 4.39Å; F115-T246 HydrophobicContact CD1-CG2 4.29Å; F115-T246 HydrophobicContact CD2-CG2 3.7Å; F115-T246 WeakPolarHBondContact CD2-O 3.5Å; F115-T246 HydrophobicContact CE2-CG2 4.03Å; F115-T246 HydrophobicContact CG-CG2 3.86Å; F115-T246 HydrophobicContact CZ-CG2 4.47Å; R201-T246 HydrophobicContact CG-CG2 3.83Å; R201-T246 PolarHBondContact NH1-OG1 2.93Å; F219-T246 HydrophobicContact CE2-CG2 4.1Å; F219-T246 WeakPolarHBondContact CE2-OG1 3.48Å; F219-T246 HydrophobicContact CZ-CG2 4.18Å; E242-T246 WeakPolarHBondContact O-CB 3.33Å; E242-T246 PolarHBondContact O-N 3.29Å; E242-T246 PolarHBondContact O-OG1 2.68Å; T246-I249 HydrophobicContact CG2-CD1 4.48Å; T246-I249 HydrophobicContact CG2-CG1 4.11Å
247	D	90.3	Very high	91.4	Very high	71 Å²	71	48.9 Å²	48.9	38%	0.38	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-49.7	177	-59.3	-39.2	0	0	0	111.2	R202 N204	R202-D247 HydrophobicContact CB-CB 4.29Å; R202-D247 HydrophobicContact CG-CB 4.23Å; R202-D247 PolarHBondContact O-N 3.28Å; N204-D247 PolarHBondContact N-OD2 3.39Å
248	T	93.2	Very high	90.7	Very high	67 Å²	67	53.6 Å²	53.6	41%	0.411	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	150.9	-174.4	69	0	0	0	0	112.4	R201 R202	R201-T248 WeakPolarHBondContact CA-O 3.34Å; R202-T248 WeakPolarHBondContact CB-OG1 3.45Å; R202-T248 PolarHBondContact N-O 3.48Å
249	I	94.8	Very high	90.2	Very high	32 Å²	32	50.9 Å²	50.9	16%	0.164	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.9	165.5	-67.6	-177	0	0	0	108.5	F115 M200 R201 M216 F219 T246 L251	F115-I249 HydrophobicContact CD1-CD1 4.29Å; F115-I249 HydrophobicContact CE1-CB 4.41Å; F115-I249 HydrophobicContact CE1-CD1 3.61Å; F115-I249 HydrophobicContact CE1-CG1 3.95Å; F115-I249 HydrophobicContact CZ-CB 4.01Å; F115-I249 HydrophobicContact CZ-CD1 4.03Å; F115-I249 HydrophobicContact CZ-CG1 3.82Å; M200-I249 CarbonylContact O-C 3.48Å; M200-I249 VanDerWaalsContact O-CA 3.31Å; M200-I249 WeakPolarHBondContact O-CA 3.4Å; R201-I249 HydrophobicContact CG-CG1 4.28Å; M216-I249 HydrophobicContact CE-CD1 3.97Å; F219-I249 HydrophobicContact CD1-CD1 3.79Å; F219-I249 HydrophobicContact CD2-CD1 4.29Å; F219-I249 HydrophobicContact CE1-CD1 3.32Å; F219-I249 HydrophobicContact CE2-CD1 3.9Å; F219-I249 HydrophobicContact CG-CD1 4.27Å; F219-I249 HydrophobicContact CZ-CD1 3.41Å; F219-I249 VanDerWaalsContact CZ-CD1 3.41Å; T246-I249 HydrophobicContact CG2-CD1 4.48Å; T246-I249 HydrophobicContact CG2-CG1 4.11Å; I249-L251 HydrophobicContact CG2-CD2 3.75Å; I249-L251 HydrophobicContact CG2-CG 3.93Å
250	A	95.1	Very high	89.5	Confident	52 Å²	52	51.7 Å²	51.7	43%	0.43	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135	171.1	0	0	0	0	0	109.6	C199 M200	C199-A250 CarbonylContact C-O 3.31Å; C199-A250 VanDerWaalsContact CA-O 3.26Å; C199-A250 WeakPolarHBondContact CA-O 3.49Å; M200-A250 HydrophobicContact CB-CB 4.32Å; M200-A250 PolarHBondContact N-O 3.42Å; M200-A250 PolarHBondContact O-N 2.05Å
251	L	95.4	Very high	88.8	Confident	43 Å²	43	52.5 Å²	52.5	23%	0.225	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	135.9	-177.9	-55.8	176.1	0	0	0	109.6	L118 I120 C199 F235 I249 V253	L118-L251 HydrophobicContact CD2-CD1 4.04Å; I120-L251 HydrophobicContact CD1-CD1 3.22Å; C199-L251 HydrophobicContact CB-CD2 3.5Å; C199-L251 VanDerWaalsContact CB-CD2 3.5Å; F235-L251 HydrophobicContact CD2-CD1 4.26Å; F235-L251 HydrophobicContact CE1-CD2 3.99Å; F235-L251 HydrophobicContact CE2-CD1 4.04Å; F235-L251 HydrophobicContact CZ-CD1 4.19Å; F235-L251 HydrophobicContact CZ-CD2 4.15Å; I249-L251 HydrophobicContact CG2-CD2 3.75Å; I249-L251 HydrophobicContact CG2-CG 3.93Å; L251-V253 HydrophobicContact CB-CG2 3.94Å
252	I	93.9	Very high	87.9	Confident	40 Å²	40	52.1 Å²	52.1	21%	0.205	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	111.8	165.2	-58.2	179.4	0	0	0	106.6	L197 N198 W458 L465	L197-I252 HydrophobicContact CB-CB 4.44Å; L197-I252 HydrophobicContact CB-CG2 4.19Å; L197-I252 WeakPolarHBondContact CB-O 3.5Å; L197-I252 HydrophobicContact CD1-CG2 4.19Å; L197-I252 PolarHBondContact N-O 3.47Å; N198-I252 HydrophobicContact CB-CB 4.26Å; N198-I252 HydrophobicContact CB-CD1 4.16Å; N198-I252 HydrophobicContact CB-CG1 4.35Å; N198-I252 PolarHBondContact N-O 3.46Å; N198-I252 PolarHBondContact O-N 3.32Å; I252-W458 HydrophobicContact CD1-CZ2 4.33Å; I252-W458 HydrophobicContact CG2-CH2 4.12Å; I252-W458 HydrophobicContact CG2-CZ2 4.27Å; I252-L465 HydrophobicContact CD1-CD1 3.58Å; I252-L465 HydrophobicContact CD1-CD2 4.39Å
253	V	94.9	Very high	87.1	Confident	33 Å²	33	55.1 Å²	55.1	20%	0.2	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.7	-174.1	-168.4	0	0	0	0	109.5	A195 F196 L251 L279	A195-V253 CarbonylContact O-C 3.56Å; A195-V253 WeakPolarHBondContact O-CA 3.28Å; F196-V253 HydrophobicContact CD1-CG1 4.21Å; F196-V253 HydrophobicContact CD1-CG2 3.89Å; F196-V253 HydrophobicContact CE1-CG1 4.11Å; F196-V253 HydrophobicContact CE1-CG2 4.07Å; L251-V253 HydrophobicContact CB-CG2 3.94Å; V253-L279 HydrophobicContact CB-CD1 3.81Å; V253-L279 HydrophobicContact CG1-CD1 3.8Å; V253-L279 HydrophobicContact CG1-CD2 4.11Å; V253-L279 HydrophobicContact CG2-CD1 3.99Å
254	S	93.1	Very high	86.5	Confident	43 Å²	43	56 Å²	56	30%	0.301	32%	0.321	S	S	.	.			trans	-74.2	134.2	168.5	-178.1	0	0	0	0	109.6	H122 A195 G256	H122-S254 PolarHBondContact NE2-O 3.4Å; A195-S254 PolarHBondContact O-N 3.37Å; S254-G256 VanDerWaalsContact C-N 3.26Å; S254-G256 PolarHBondContact OG-N 2.75Å
255	L	92.2	Very high	86	Confident	42 Å²	42	53.7 Å²	53.7	22%	0.22	31%	0.31	C	S	.	.			trans	-84.6	-0.9	174.1	-62	-179.1	0	0	0	113.3	L279 P301	L255-L279 HydrophobicContact CD2-CD2 3.58Å; L255-L279 HydrophobicContact CD2-CG 3.81Å; L255-P301 HydrophobicContact CD1-CB 3.5Å; L255-P301 VanDerWaalsContact CD1-CB 3.5Å; L255-P301 HydrophobicContact CD1-CG 4.28Å
256	G	86.1	Confident	85.2	Confident	39 Å²	39	55.3 Å²	55.3	40%	0.402	32%	0.317	S	S	.	.			trans	82.3	-164.3	-175.5	0	0	0	0	0	113	S254	S254-G256 VanDerWaalsContact C-N 3.26Å; S254-G256 PolarHBondContact OG-N 2.75Å
257	T	80.5	Confident	84.3	Confident	53 Å²	53	56.9 Å²	56.9	33%	0.325	33%	0.331	S	S	.	.	S	Bend	trans	-78.2	150.7	177.7	49.4	0	0	0	0	111.1	Q128	Q128-T257 HydrophobicContact CB-CG2 4.42Å; Q128-T257 HydrophobicContact CG-CG2 4.19Å
258	D	79.9	Confident	83.9	Confident	104 Å²	104	54.1 Å²	54.1	56%	0.556	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-59	140.9	171.2	-72.5	-49.5	0	0	0	110.9	N260 R277	D258-N260 PolarHBondContact O-N 2.94Å; D258-R277 IonicContact OD1-CZ 4Å; D258-R277 IonicContact OD1-NH1 3.34Å; D258-R277 PolarHBondContact OD1-NH1 3.47Å; D258-R277 IonicContact OD1-NH2 3.07Å; D258-R277 PolarHBondContact OD1-NH2 3.43Å
259	P	78.9	Confident	83.1	Confident	37 Å²	37	54.4 Å²	54.4	24%	0.24	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-63.7	135.3	-177.5	24.7	-33.3	0	0	0	111.5	Y131 Y261	Y131-P259 WeakPolarHBondContact OH-CA 2.99Å; P259-Y261 HydrophobicContact CB-CD2 4.43Å; P259-Y261 HydrophobicContact CB-CE1 4.05Å; P259-Y261 HydrophobicContact CB-CE2 3.84Å; P259-Y261 HydrophobicContact CG-CD2 4.41Å; P259-Y261 HydrophobicContact CG-CE1 4.46Å; P259-Y261 HydrophobicContact CG-CE2 3.53Å; P259-Y261 WeakPolarHBondContact CG-OH 3.27Å
260	N	75.6	Confident	82.4	Confident	69 Å²	69	55 Å²	55	37%	0.369	32%	0.319	S	S	.	.			trans	-101.4	87.9	177.6	-173.5	-4.1	0	0	0	111.5	Y131 D258 S262	Y131-N260 HydrophobicContact CE1-CB 3.99Å; Y131-N260 PolarHBondContact OH-N 3.12Å; D258-N260 PolarHBondContact O-N 2.94Å; N260-S262 PolarHBondContact O-N 2.88Å; N260-S262 VanDerWaalsContact O-N 3.15Å; N260-S262 PolarHBondContact OD1-N 2.83Å; N260-S262 PolarHBondContact OD1-OG 3.36Å
261	Y	73.6	Confident	81.8	Confident	123 Å²	123	53.7 Å²	53.7	48%	0.482	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-6.9	-176.7	-60.5	-67.3	0	0	0	115.7	P259 E265	P259-Y261 HydrophobicContact CB-CD2 4.43Å; P259-Y261 HydrophobicContact CB-CE1 4.05Å; P259-Y261 HydrophobicContact CB-CE2 3.84Å; P259-Y261 HydrophobicContact CG-CD2 4.41Å; P259-Y261 HydrophobicContact CG-CE1 4.46Å; P259-Y261 HydrophobicContact CG-CE2 3.53Å; P259-Y261 WeakPolarHBondContact CG-OH 3.27Å; Y261-E265 WeakPolarHBondContact CA-O 3.49Å; Y261-E265 HydrophobicContact CD1-CG 4.4Å; Y261-E265 WeakPolarHBondContact CD1-O 3.28Å; Y261-E265 HydrophobicContact CE1-CG 4.44Å
262	S	68.5	Low	81.2	Confident	79 Å²	79	56.7 Å²	56.7	55%	0.552	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-35.6	-171.8	63.4	0	0	0	0	113.6	N260	N260-S262 PolarHBondContact O-N 2.88Å; N260-S262 VanDerWaalsContact O-N 3.15Å; N260-S262 PolarHBondContact OD1-N 2.83Å; N260-S262 PolarHBondContact OD1-OG 3.36Å
263	N	75.9	Confident	80.4	Confident	118 Å²	118	63.7 Å²	63.7	63%	0.631	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.4	-53.2	-165.4	-67.8	-26	0	0	0	113.2	S143	S143-N263 PolarHBondContact OG-O 2.92Å
264	Q	79.4	Confident	79.6	Confident	24 Å²	24	67.2 Å²	67.2	11%	0.112	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-28.2	-163.7	-62.3	177.1	-53.5	0	0	113.4	Y131 W134 R135 S141 P142 S143	Y131-Q264 PolarHBondContact O-NE2 3.22Å; Y131-Q264 VanDerWaalsContact O-NE2 3.1Å; Y131-Q264 PolarHBondContact O-OE1 3.46Å; W134-Q264 HydrophobicContact CB-CB 4.41Å; W134-Q264 HydrophobicContact CB-CG 4.38Å; W134-Q264 HydrophobicContact CD2-CB 4.45Å; W134-Q264 HydrophobicContact CE3-CB 3.69Å; W134-Q264 HydrophobicContact CZ3-CB 4.34Å; R135-Q264 VanDerWaalsContact CA-NE2 3.28Å; S141-Q264 WeakPolarHBondContact CB-O 3.47Å; S141-Q264 PolarHBondContact OG-O 2.88Å; P142-Q264 WeakPolarHBondContact CD-O 3.23Å; S143-Q264 PolarHBondContact N-O 3.38Å; S143-Q264 VanDerWaalsContact N-O 3.1Å; S143-Q264 PolarHBondContact OG-O 3.48Å
265	E	79.8	Confident	78.9	Confident	14 Å²	14	69.9 Å²	69.9	7%	0.065	37%	0.373	C	S	.	.			trans	-119.5	93.8	-178.6	-174.8	-178.9	-168	0	0	109.6	H124 F126 Y131 W134 S143 Y261	H124-E265 IonicContact CE1-OE1 2.81Å; H124-E265 PolarHBondContact CE1-OE1 3.38Å; H124-E265 IonicContact CE1-OE2 2.83Å; H124-E265 PolarHBondContact CE1-OE2 3.15Å; H124-E265 VanDerWaalsContact CE1-OE2 3.24Å; H124-E265 IonicContact ND1-OE1 2.69Å; H124-E265 PolarHBondContact ND1-OE1 3.26Å; F126-E265 WeakPolarHBondContact CD2-OE1 3.42Å; F126-E265 HydrophobicContact CE2-CG 4.45Å; Y131-E265 PolarHBondContact OH-OE2 2.98Å; W134-E265 HydrophobicContact CZ3-CB 4.43Å; S143-E265 PolarHBondContact OG-N 3.27Å; Y261-E265 WeakPolarHBondContact CA-O 3.49Å; Y261-E265 HydrophobicContact CD1-CG 4.4Å; Y261-E265 WeakPolarHBondContact CD1-O 3.28Å; Y261-E265 HydrophobicContact CE1-CG 4.44Å
266	Q	75	Confident	78.5	Confident	70 Å²	70	70 Å²	70	33%	0.327	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-80.7	151.9	165.7	-75.5	-175.7	4.7	0	0	109.6	S143 N146 F268	S143-Q266 PolarHBondContact OG-N 2.86Å; N146-Q266 PolarHBondContact OD1-O 3.07Å; Q266-F268 PolarHBondContact O-N 3.35Å
267	A	73.6	Confident	78.6	Confident	42 Å²	42	75.6 Å²	75.6	35%	0.347	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-63.1	130.6	175.7	0	0	0	0	0	110.4	R150	R150-A267 PolarHBondContact NH2-O 3.1Å
268	F	83.4	Confident	79.3	Confident	13 Å²	13	73.2 Å²	73.2	6%	0.057	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-71.3	119.8	164.2	-68.6	-75.9	0	0	0	108.4	P142 F145 N146 L174 Y177 Q266 V270 D271	P142-F268 HydrophobicContact CB-CE2 3.94Å; P142-F268 HydrophobicContact CB-CZ 3.73Å; P142-F268 HydrophobicContact CG-CE2 4.4Å; P142-F268 HydrophobicContact CG-CZ 4.34Å; F145-F268 AromaticContact CD1-CE1 3.91Å; F145-F268 HydrophobicContact CD1-CE1 3.91Å; F145-F268 HydrophobicContact CE1-CE1 4.23Å; N146-F268 WeakPolarHBondContact ND2-CD1 3.33Å; N146-F268 WeakPolarHBondContact ND2-CE1 3.33Å; L174-F268 HydrophobicContact CB-CD2 3.88Å; L174-F268 HydrophobicContact CB-CE2 4.04Å; L174-F268 HydrophobicContact CB-CG 4.28Å; L174-F268 HydrophobicContact CD1-CD2 4.15Å; L174-F268 HydrophobicContact CD1-CE2 3.58Å; L174-F268 HydrophobicContact CD1-CZ 4.17Å; L174-F268 HydrophobicContact CG-CE2 4.42Å; Y177-F268 AromaticContact CD1-CZ 3.98Å; Y177-F268 HydrophobicContact CD1-CZ 3.98Å; Y177-F268 HydrophobicContact CD2-CZ 4.47Å; Y177-F268 HydrophobicContact CG-CE1 4.3Å; Y177-F268 AromaticContact CG-CZ 3.78Å; Y177-F268 HydrophobicContact CG-CZ 3.78Å; Q266-F268 PolarHBondContact O-N 3.35Å; F268-V270 PolarHBondContact O-N 2.97Å; F268-D271 HydrophobicContact CB-CB 4.04Å; F268-D271 WeakPolarHBondContact CB-OD2 3.18Å; F268-D271 PolarHBondContact O-N 3.19Å
269	L	76.3	Confident	80	Confident	73 Å²	73	68.9 Å²	68.9	38%	0.382	35%	0.352	S	S	.	.	S	Bend	trans	-67.2	-40.3	-164.8	-70.3	172.7	0	0	0	112.8	Y169 D172 D271 L272	Y169-L269 HydrophobicContact CE2-CD1 3.75Å; D172-L269 PolarHBondContact O-N 3.45Å; L269-D271 VanDerWaalsContact C-N 3.34Å; L269-L272 WeakPolarHBondContact O-CB 3.35Å
270	V	78.8	Confident	80.8	Confident	44 Å²	44	68.3 Å²	68.3	27%	0.267	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-76.7	-23.8	-178	-66.6	0	0	0	0	113.2	Y169 F268 L272	Y169-V270 HydrophobicContact CE1-CG1 4.34Å; F268-V270 PolarHBondContact O-N 2.97Å; V270-L272 PolarHBondContact O-N 2.74Å; V270-L272 VanDerWaalsContact O-N 3.15Å
271	D	83.3	Confident	81.8	Confident	24 Å²	24	65.3 Å²	65.3	13%	0.128	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-76.9	1.1	-178.8	-58.6	-16.5	0	0	0	112.2	S173 L174 F268 L269 F273 E274 M275	S173-D271 WeakPolarHBondContact CB-OD1 3.36Å; L174-D271 WeakPolarHBondContact CB-OD2 3.21Å; L174-D271 PolarHBondContact N-OD2 3.27Å; F268-D271 HydrophobicContact CB-CB 4.04Å; F268-D271 WeakPolarHBondContact CB-OD2 3.18Å; F268-D271 PolarHBondContact O-N 3.19Å; L269-D271 VanDerWaalsContact C-N 3.34Å; D271-F273 PolarHBondContact O-N 3.12Å; D271-E274 CarbonylContact O-C 3.53Å; D271-E274 WeakPolarHBondContact O-CA 3.16Å; D271-E274 PolarHBondContact O-N 2.58Å; D271-M275 WeakPolarHBondContact O-CG 3.36Å; D271-M275 PolarHBondContact O-N 2.83Å
272	L	82.3	Confident	82.9	Confident	106 Å²	106	59.4 Å²	59.4	56%	0.555	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-50.8	-32.8	177	178.2	64.8	0	0	0	113.5	L269 V270 M275	L269-L272 WeakPolarHBondContact O-CB 3.35Å; V270-L272 PolarHBondContact O-N 2.74Å; V270-L272 VanDerWaalsContact O-N 3.15Å; L272-M275 VanDerWaalsContact CA-CE 3.48Å; L272-M275 HydrophobicContact CB-CE 3.95Å; L272-M275 HydrophobicContact CD1-CE 3.46Å; L272-M275 VanDerWaalsContact CD1-CE 3.46Å; L272-M275 HydrophobicContact CG-CE 4.31Å
273	F	77.9	Confident	84.3	Confident	188 Å²	188	56 Å²	56	83%	0.825	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-81.2	-15.8	179.1	-56.7	-74	0	0	0	113.6	D271	D271-F273 PolarHBondContact O-N 3.12Å
274	E	77.3	Confident	85.3	Confident	106 Å²	106	50.7 Å²	50.7	50%	0.495	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-4.8	178.9	-62.4	-176	-175.8	0	0	112.4	D271 A276	D271-E274 CarbonylContact O-C 3.53Å; D271-E274 WeakPolarHBondContact O-CA 3.16Å; D271-E274 PolarHBondContact O-N 2.58Å; E274-A276 PolarHBondContact O-N 3.1Å
275	M	78.1	Confident	86	Confident	99 Å²	99	50.1 Å²	50.1	49%	0.488	25%	0.251	S	S	.	.			trans	-65.2	98.6	177.8	-76.7	-156.8	-94.4	0	0	111.1	D271 L272	D271-M275 WeakPolarHBondContact O-CG 3.36Å; D271-M275 PolarHBondContact O-N 2.83Å; L272-M275 VanDerWaalsContact CA-CE 3.48Å; L272-M275 HydrophobicContact CB-CE 3.95Å; L272-M275 HydrophobicContact CD1-CE 3.46Å; L272-M275 VanDerWaalsContact CD1-CE 3.46Å; L272-M275 HydrophobicContact CG-CE 4.31Å
276	A	85	Confident	86.6	Confident	46 Å²	46	50.4 Å²	50.4	38%	0.38	25%	0.254	S	S	.	.			trans	-121.3	159.5	170.9	0	0	0	0	0	110.6	H123 E274	H123-A276 HydrophobicContact CB-CB 4.48Å; H123-A276 WeakPolarHBondContact CB-O 3.26Å; E274-A276 PolarHBondContact O-N 3.1Å
277	R	88.2	Confident	87.4	Confident	155 Å²	155	47.3 Å²	47.3	59%	0.585	24%	0.241	S	C	*	.	S	Bend	trans	-114.8	131.1	171.9	-171	-178.5	172.6	137	3.5	108.5	D258 P301	D258-R277 IonicContact OD1-CZ 4Å; D258-R277 IonicContact OD1-NH1 3.34Å; D258-R277 PolarHBondContact OD1-NH1 3.47Å; D258-R277 IonicContact OD1-NH2 3.07Å; D258-R277 PolarHBondContact OD1-NH2 3.43Å; R277-P301 HydrophobicContact CB-CG 4.5Å; R277-P301 HydrophobicContact CG-CG 4.17Å; R277-P301 VanDerWaalsContact O-CD 3.25Å; R277-P301 WeakPolarHBondContact O-CD 3.16Å
278	G	93.6	Very high	88.3	Confident	4 Å²	4	45.8 Å²	45.8	4%	0.041	23%	0.227	C	C	.	.	S	Bend	trans	132.5	-146.7	-177.6	0	0	0	0	0	111.8	H123 V299	H123-G278 PolarHBondContact N-O 2.91Å; G278-V299 WeakPolarHBondContact CA-O 3.22Å
279	L	95.8	Very high	88.9	Confident	12 Å²	12	46.4 Å²	46.4	6%	0.063	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	149	178.2	-50.7	168.5	0	0	0	110.9	I120 C121 H122 V253 L255 V281 V299	I120-L279 HydrophobicContact CG2-CB 4.31Å; I120-L279 HydrophobicContact CG2-CD1 3.93Å; I120-L279 HydrophobicContact CG2-CD2 4.29Å; I120-L279 HydrophobicContact CG2-CG 4.41Å; C121-L279 CarbonylContact O-C 3.52Å; C121-L279 WeakPolarHBondContact O-CA 3.26Å; C121-L279 WeakPolarHBondContact O-CB 3.38Å; H122-L279 HydrophobicContact CB-CD2 4.31Å; V253-L279 HydrophobicContact CB-CD1 3.81Å; V253-L279 HydrophobicContact CG1-CD1 3.8Å; V253-L279 HydrophobicContact CG1-CD2 4.11Å; V253-L279 HydrophobicContact CG2-CD1 3.99Å; L255-L279 HydrophobicContact CD2-CD2 3.58Å; L255-L279 HydrophobicContact CD2-CG 3.81Å; L279-V281 HydrophobicContact CB-CG2 4.09Å; L279-V299 HydrophobicContact CB-CB 4.09Å; L279-V299 HydrophobicContact CD1-CG1 4.48Å; L279-V299 PolarHBondContact N-O 3.08Å; L279-V299 PolarHBondContact O-N 3.28Å
280	R	95.9	Very high	89.8	Confident	26 Å²	26	43 Å²	43	10%	0.098	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.9	164.9	-172	78.5	170.7	167.5	5.3	107.6	C121 Y229 L292 G296 L297 H298	C121-R280 HydrophobicContact CB-CB 4.25Å; C121-R280 PolarHBondContact N-O 2.88Å; C121-R280 PolarHBondContact O-N 2.04Å; Y229-R280 HydrophobicContact CE1-CB 4.11Å; Y229-R280 HydrophobicContact CE2-CB 4.37Å; Y229-R280 HydrophobicContact CE2-CG 4.09Å; R280-L292 HydrophobicContact CG-CD2 4.07Å; R280-L292 PolarHBondContact NE-O 2.77Å; R280-L292 VanDerWaalsContact NE-O 3.07Å; R280-L292 PolarHBondContact NH2-O 3.5Å; R280-G296 VanDerWaalsContact CZ-CA 3.49Å; R280-G296 PolarHBondContact NH1-O 2.95Å; R280-G296 PolarHBondContact NH2-O 3.43Å; R280-G296 VanDerWaalsContact NH2-O 3.09Å; R280-L297 CarbonylContact C-O 3.58Å; R280-L297 WeakPolarHBondContact CA-O 3.41Å; R280-H298 PolarHBondContact NH1-CD2 3.24Å; R280-H298 VanDerWaalsContact NH1-CD2 3.31Å; R280-H298 PolarHBondContact NH1-CE1 2.86Å; R280-H298 PolarHBondContact NH1-NE2 3.49Å
281	V	96.9	Very high	90.6	Very high	5 Å²	5	42 Å²	42	3%	0.03	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	136.1	-172.4	-179.9	0	0	0	0	110.8	L118 T119 I120 L279 L297 V299 I307	L118-V281 HydrophobicContact CD1-CG1 3.27Å; L118-V281 HydrophobicContact CG-CG1 4.02Å; T119-V281 CarbonylContact O-C 3.6Å; T119-V281 VanDerWaalsContact O-CA 3.24Å; T119-V281 WeakPolarHBondContact O-CA 3.16Å; I120-V281 HydrophobicContact CG1-CG1 4.35Å; I120-V281 HydrophobicContact CG1-CG2 4.19Å; I120-V281 HydrophobicContact CG2-CG2 4.24Å; L279-V281 HydrophobicContact CB-CG2 4.09Å; V281-L297 PolarHBondContact N-O 2.79Å; V281-L297 PolarHBondContact O-N 3.3Å; V281-V299 HydrophobicContact CB-CG2 4.08Å; V281-V299 HydrophobicContact CG2-CB 4.46Å; V281-V299 HydrophobicContact CG2-CG2 3.58Å; V281-I307 HydrophobicContact CB-CD1 4.3Å; V281-I307 HydrophobicContact CG1-CD1 3.74Å
282	V	96.6	Very high	91	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134.4	176.4	176.1	0	0	0	0	109.6	T119 H284 L292 E295	T119-V282 PolarHBondContact N-O 3.28Å; T119-V282 PolarHBondContact O-N 2.91Å; V282-H284 HydrophobicContact CG1-CB 4.18Å; V282-L292 HydrophobicContact CG2-CD2 3.71Å; V282-L292 HydrophobicContact CG2-CG 4.37Å; V282-E295 HydrophobicContact CG1-CB 3.88Å
283	V	97	Very high	91.4	Very high	7 Å²	7	40.1 Å²	40.1	4%	0.042	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	117	172.4	-174.1	0	0	0	0	108.1	P116 L118 I307 Y449	P116-V283 HydrophobicContact CB-CG1 3.44Å; P116-V283 VanDerWaalsContact CB-CG1 3.44Å; P116-V283 HydrophobicContact CG-CG1 3.37Å; L118-V283 HydrophobicContact CD1-CG2 3.95Å; V283-I307 HydrophobicContact CG2-CG2 3.84Å; V283-Y449 HydrophobicContact CG1-CG 4.1Å
284	H	96.2	Very high	92	Very high	6 Å²	6	40.4 Å²	40.4	3%	0.028	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	170.4	-174.8	65.2	93.2	0	0	0	112.4	P116 A117 T119 V282 T288	P116-H284 WeakPolarHBondContact CB-O 3.38Å; A117-H284 PolarHBondContact N-O 2.74Å; A117-H284 PolarHBondContact O-N 3.29Å; T119-H284 PolarHBondContact OG1-NE2 3.33Å; V282-H284 HydrophobicContact CG1-CB 4.18Å; H284-T288 PolarHBondContact CE1-O 3.36Å; H284-T288 VanDerWaalsContact CE1-O 3.25Å; H284-T288 PolarHBondContact ND1-O 3.1Å; H284-T288 PolarHBondContact ND1-OG1 2.78Å; H284-T288 VanDerWaalsContact ND1-OG1 3.08Å
285	E	94.3	Very high	92.7	Very high	13 Å²	13	40.1 Å²	40.1	6%	0.061	19%	0.186	C	C	.	.			trans	-64	137.6	178.3	-169.1	-175	163.9	0	0	111.4	G287 T288 R363 R443 Y447 Y449	E285-G287 PolarHBondContact O-N 3.06Å; E285-T288 HydrophobicContact CB-CG2 3.89Å; E285-T288 HydrophobicContact CG-CG2 4.45Å; E285-T288 PolarHBondContact O-N 3.42Å; E285-T288 VanDerWaalsContact O-N 3.12Å; E285-T288 PolarHBondContact O-OG1 2.96Å; E285-R363 IonicContact OE1-CZ 3.7Å; E285-R363 VanDerWaalsContact OE1-CZ 3.23Å; E285-R363 IonicContact OE1-NH1 3.24Å; E285-R363 PolarHBondContact OE1-NH1 3.3Å; E285-R363 IonicContact OE1-NH2 3.31Å; E285-R363 PolarHBondContact OE1-NH2 3.35Å; E285-R443 IonicContact OE1-NH1 3.8Å; E285-R443 PolarHBondContact OE1-NH1 2.95Å; E285-R443 VanDerWaalsContact OE1-NH1 3.15Å; E285-R443 IonicContact OE2-CZ 3.06Å; E285-R443 VanDerWaalsContact OE2-CZ 3.3Å; E285-R443 IonicContact OE2-NH1 3.96Å; E285-R443 PolarHBondContact OE2-NH1 2.75Å; E285-R443 IonicContact OE2-NH2 2.68Å; E285-R443 PolarHBondContact OE2-NH2 2.99Å; E285-Y447 PolarHBondContact OE2-N 3.01Å; E285-Y449 HydrophobicContact CB-CE2 4.2Å
286	P	93.2	Very high	93.5	Very high	20 Å²	20	36 Å²	36	13%	0.13	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	133.2	178.4	-28.4	35.6	0	0	0	113.3	A117 P237 T288 R363	A117-P286 HydrophobicContact CB-CG 4.49Å; P237-P286 HydrophobicContact CG-CB 4.21Å; P237-P286 HydrophobicContact CG-CG 3.78Å; P286-T288 VanDerWaalsContact C-N 3.31Å; P286-T288 PolarHBondContact O-N 3.41Å; P286-R363 VanDerWaalsContact O-CD 3.28Å; P286-R363 WeakPolarHBondContact O-CD 3.13Å; P286-R363 PolarHBondContact O-NH1 3.28Å
287	G	91	Very high	94	Very high	5 Å²	5	35.5 Å²	35.5	5%	0.052	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	-6.8	-178.9	0	0	0	0	0	116.2	E236 E285 Y362 R363	E236-G287 PolarHBondContact OE2-N 3.35Å; E285-G287 PolarHBondContact O-N 3.06Å; G287-Y362 WeakPolarHBondContact O-CA 3.18Å; G287-R363 PolarHBondContact O-N 3.33Å
288	T	94.1	Very high	94.3	Very high	9 Å²	9	33.1 Å²	33.1	6%	0.055	16%	0.155	C	C	.	.	S	Bend	trans	-82.4	162.7	174.3	67	0	0	0	0	111.8	H284 E285 P286 R363 T365	H284-T288 PolarHBondContact CE1-O 3.36Å; H284-T288 VanDerWaalsContact CE1-O 3.25Å; H284-T288 PolarHBondContact ND1-O 3.1Å; H284-T288 PolarHBondContact ND1-OG1 2.78Å; H284-T288 VanDerWaalsContact ND1-OG1 3.08Å; E285-T288 HydrophobicContact CB-CG2 3.89Å; E285-T288 HydrophobicContact CG-CG2 4.45Å; E285-T288 PolarHBondContact O-N 3.42Å; E285-T288 VanDerWaalsContact O-N 3.12Å; E285-T288 PolarHBondContact O-OG1 2.96Å; P286-T288 VanDerWaalsContact C-N 3.31Å; P286-T288 PolarHBondContact O-N 3.41Å; T288-R363 HydrophobicContact CG2-CB 4.34Å; T288-T365 HydrophobicContact CG2-CG2 3.61Å
289	Y	95.2	Very high	94.3	Very high	26 Å²	26	34 Å²	34	10%	0.102	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-75.1	130.5	175.7	-174.3	-81.3	0	0	0	110.2	D291 Y355 D357 Y362 Q368	Y289-D291 PolarHBondContact O-N 2.73Å; Y289-Y355 WeakPolarHBondContact CB-OH 3.43Å; Y289-D357 HydrophobicContact CD2-CB 4.48Å; Y289-D357 HydrophobicContact CE2-CB 4.03Å; Y289-Y362 VanDerWaalsContact CA-CD1 3.47Å; Y289-Y362 HydrophobicContact CD2-CD1 4.26Å; Y289-Y362 HydrophobicContact CD2-CD2 4.09Å; Y289-Y362 AromaticContact CD2-CE1 3.98Å; Y289-Y362 HydrophobicContact CD2-CE1 3.98Å; Y289-Y362 AromaticContact CD2-CE2 3.86Å; Y289-Y362 HydrophobicContact CD2-CE2 3.86Å; Y289-Y362 HydrophobicContact CD2-CG 4.29Å; Y289-Y362 AromaticContact CD2-CZ 3.76Å; Y289-Y362 HydrophobicContact CE2-CE2 4.43Å; Y289-Y362 HydrophobicContact CG-CE1 4.39Å; Y289-Q368 HydrophobicContact CG-CG 4.42Å
290	P	95.9	Very high	94.2	Very high	1 Å²	1	38 Å²	38	1%	0.006	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-75.5	119.6	179.6	28.1	-31.8	0	0	0	111.4	T119 F224 L292	T119-P290 HydrophobicContact CG2-CB 3.66Å; T119-P290 HydrophobicContact CG2-CG 3.89Å; T119-P290 WeakPolarHBondContact OG1-CB 3.17Å; F224-P290 HydrophobicContact CD1-CG 4.02Å; F224-P290 HydrophobicContact CD2-CG 4.39Å; F224-P290 HydrophobicContact CE1-CB 4.47Å; F224-P290 HydrophobicContact CE1-CG 3.44Å; F224-P290 VanDerWaalsContact CE1-CG 3.44Å; F224-P290 HydrophobicContact CE2-CG 3.88Å; F224-P290 HydrophobicContact CG-CG 4.46Å; F224-P290 HydrophobicContact CZ-CB 4.31Å; F224-P290 HydrophobicContact CZ-CG 3.38Å; P290-L292 PolarHBondContact O-N 3.49Å
291	D	94.1	Very high	94.1	Very high	25 Å²	25	38.8 Å²	38.8	13%	0.134	19%	0.186	C	C	.	.			trans	-89	86.7	175.5	-165.9	-27.1	0	0	0	110.5	Y289 E293 R294 E295	Y289-D291 PolarHBondContact O-N 2.73Å; D291-E293 PolarHBondContact O-N 2.04Å; D291-E293 PolarHBondContact OD1-N 3.41Å; D291-R294 PolarHBondContact OD1-N 3.4Å; D291-R294 VanDerWaalsContact OD2-CD 3.3Å; D291-R294 WeakPolarHBondContact OD2-CD 3.43Å; D291-R294 IonicContact OD2-NE 3.45Å; D291-E295 HydrophobicContact CB-CG 4.49Å; D291-E295 WeakPolarHBondContact O-CB 3.38Å; D291-E295 PolarHBondContact O-N 3.4Å
292	L	93.4	Very high	93.8	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.6	-178.6	-67.9	164.3	0	0	0	113.8	T119 C121 F224 H226 Y229 R280 V282 P290 G296	T119-L292 HydrophobicContact CG2-CD2 4.07Å; C121-L292 HydrophobicContact CB-CD2 4.49Å; C121-L292 VanDerWaalsContact SG-CD2 3.51Å; F224-L292 HydrophobicContact CE2-CD1 4.02Å; F224-L292 HydrophobicContact CZ-CD1 3.8Å; F224-L292 HydrophobicContact CZ-CG 4.4Å; H226-L292 HydrophobicContact CB-CD1 3.96Å; H226-L292 WeakPolarHBondContact CD2-CD1 3.45Å; Y229-L292 HydrophobicContact CD2-CD1 3.66Å; Y229-L292 HydrophobicContact CE2-CB 4.23Å; Y229-L292 HydrophobicContact CE2-CD1 4.07Å; R280-L292 HydrophobicContact CG-CD2 4.07Å; R280-L292 PolarHBondContact NE-O 2.77Å; R280-L292 VanDerWaalsContact NE-O 3.07Å; R280-L292 PolarHBondContact NH2-O 3.5Å; V282-L292 HydrophobicContact CG2-CD2 3.71Å; V282-L292 HydrophobicContact CG2-CG 4.37Å; P290-L292 PolarHBondContact O-N 3.49Å; L292-G296 WeakPolarHBondContact O-CA 3.25Å; L292-G296 PolarHBondContact O-N 3.35Å
293	E	89.6	Confident	93.6	Very high	87 Å²	87	45 Å²	45	41%	0.407	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-43.8	-176.3	-61.1	-54.1	139.6	0	0	110.5	H226 D291	H226-E293 IonicContact CE1-OE1 3.8Å; H226-E293 PolarHBondContact CE1-OE1 2.68Å; H226-E293 VanDerWaalsContact CE1-OE1 3.31Å; H226-E293 IonicContact NE2-OE1 2.79Å; D291-E293 PolarHBondContact O-N 2.04Å; D291-E293 PolarHBondContact OD1-N 3.41Å
294	R	90.9	Very high	93.5	Very high	195 Å²	195	49 Å²	49	74%	0.736	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-39	-177.4	-61.6	-174.3	177.7	-174.4	-5.5	114.1	D291	D291-R294 PolarHBondContact OD1-N 3.4Å; D291-R294 VanDerWaalsContact OD2-CD 3.3Å; D291-R294 WeakPolarHBondContact OD2-CD 3.43Å; D291-R294 IonicContact OD2-NE 3.45Å
295	E	92.7	Very high	93.5	Very high	100 Å²	100	50.4 Å²	50.4	47%	0.467	26%	0.258	S	S	.	.	S	Bend	trans	-110.9	1.6	-168.7	-59.7	179.9	173.3	0	0	112.7	V282 D291	V282-E295 HydrophobicContact CG1-CB 3.88Å; D291-E295 HydrophobicContact CB-CG 4.49Å; D291-E295 WeakPolarHBondContact O-CB 3.38Å; D291-E295 PolarHBondContact O-N 3.4Å
296	G	93.8	Very high	93.6	Very high	12 Å²	12	54.8 Å²	54.8	12%	0.124	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-73.1	133.4	-176.3	0	0	0	0	0	113.8	R280 L292	R280-G296 VanDerWaalsContact CZ-CA 3.49Å; R280-G296 PolarHBondContact NH1-O 2.95Å; R280-G296 PolarHBondContact NH2-O 3.43Å; R280-G296 VanDerWaalsContact NH2-O 3.09Å; L292-G296 WeakPolarHBondContact O-CA 3.25Å; L292-G296 PolarHBondContact O-N 3.35Å
297	L	94.9	Very high	93.7	Very high	35 Å²	35	55.8 Å²	55.8	18%	0.183	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	143.2	172.1	-58	176.3	0	0	0	110	R280 V281 I307	R280-L297 CarbonylContact C-O 3.58Å; R280-L297 WeakPolarHBondContact CA-O 3.41Å; V281-L297 PolarHBondContact N-O 2.79Å; V281-L297 PolarHBondContact O-N 3.3Å; L297-I307 HydrophobicContact CD1-CG2 4.08Å
298	H	94.3	Very high	93.9	Very high	106 Å²	106	59 Å²	59	49%	0.491	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	134.2	172.2	-63.9	-77	0	0	0	110.5	H123 R280 I453	H123-H298 AromaticContact CE1-CE1 3.45Å; H123-H298 PolarHBondContact CE1-CE1 3.18Å; H123-H298 VanDerWaalsContact CE1-CE1 3.45Å; H123-H298 AromaticContact CE1-ND1 3.16Å; H123-H298 PolarHBondContact CE1-ND1 2.75Å; H123-H298 AromaticContact NE2-CE1 3.67Å; H123-H298 AromaticContact NE2-CG 3.99Å; H123-H298 AromaticContact NE2-ND1 2.89Å; H123-H298 PolarHBondContact NE2-ND1 3.45Å; R280-H298 PolarHBondContact NH1-CD2 3.24Å; R280-H298 VanDerWaalsContact NH1-CD2 3.31Å; R280-H298 PolarHBondContact NH1-CE1 2.86Å; R280-H298 PolarHBondContact NH1-NE2 3.49Å; H298-I453 VanDerWaalsContact O-CD1 3.23Å; H298-I453 WeakPolarHBondContact O-CD1 3.3Å
299	V	94.9	Very high	93.9	Very high	21 Å²	21	61.9 Å²	61.9	13%	0.127	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	123.4	180	172.4	0	0	0	0	109.3	G278 L279 V281 N305 I453	G278-V299 WeakPolarHBondContact CA-O 3.22Å; L279-V299 HydrophobicContact CB-CB 4.09Å; L279-V299 HydrophobicContact CD1-CG1 4.48Å; L279-V299 PolarHBondContact N-O 3.08Å; L279-V299 PolarHBondContact O-N 3.28Å; V281-V299 HydrophobicContact CB-CG2 4.08Å; V281-V299 HydrophobicContact CG2-CB 4.46Å; V281-V299 HydrophobicContact CG2-CG2 3.58Å; V299-N305 HydrophobicContact CG1-CB 3.79Å; V299-N305 VanDerWaalsContact CG1-CG 3.48Å; V299-N305 WeakPolarHBondContact CG1-ND2 3.49Å; V299-I453 HydrophobicContact CG2-CD1 4.22Å
300	E	93.3	Very high	93.7	Very high	98 Å²	98	66.2 Å²	66.2	46%	0.458	33%	0.329	S	S	.	.			trans	-77.8	135	-173.3	-166.5	-173.4	156.1	0	0	112.1	K303 N305	E300-K303 HydrophobicContact CB-CB 4.46Å; E300-K303 HydrophobicContact CB-CG 4.17Å; E300-K303 HydrophobicContact CG-CG 4.03Å; E300-K303 VanDerWaalsContact OE1-CE 3.25Å; E300-K303 WeakPolarHBondContact OE1-CE 3.38Å; E300-N305 PolarHBondContact N-OD1 3.19Å; E300-N305 VanDerWaalsContact N-OD1 3.1Å; E300-N305 PolarHBondContact O-ND2 3.32Å
301	P	93	Very high	93.6	Very high	41 Å²	41	68 Å²	68	27%	0.266	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	144.2	171.7	5.6	-14.6	0	0	0	113.8	L255 R277 K303	L255-P301 HydrophobicContact CD1-CB 3.5Å; L255-P301 VanDerWaalsContact CD1-CB 3.5Å; L255-P301 HydrophobicContact CD1-CG 4.28Å; R277-P301 HydrophobicContact CB-CG 4.5Å; R277-P301 HydrophobicContact CG-CG 4.17Å; R277-P301 VanDerWaalsContact O-CD 3.25Å; R277-P301 WeakPolarHBondContact O-CD 3.16Å; P301-K303 PolarHBondContact O-N 3.13Å; P301-K303 VanDerWaalsContact O-N 3.14Å
302	G	90.9	Very high	93.7	Very high	57 Å²	57	68.6 Å²	68.6	59%	0.588	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	13.3	168.4	0	0	0	0	0	114.8
303	K	93.3	Very high	93.8	Very high	79 Å²	79	71.2 Å²	71.2	34%	0.343	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	158.4	178	-58.4	-64.1	-176	172.8	0	110.9	E300 P301 N305 V455 T456	E300-K303 HydrophobicContact CB-CB 4.46Å; E300-K303 HydrophobicContact CB-CG 4.17Å; E300-K303 HydrophobicContact CG-CG 4.03Å; E300-K303 VanDerWaalsContact OE1-CE 3.25Å; E300-K303 WeakPolarHBondContact OE1-CE 3.38Å; P301-K303 PolarHBondContact O-N 3.13Å; P301-K303 VanDerWaalsContact O-N 3.14Å; K303-N305 PolarHBondContact O-ND2 3.46Å; K303-N305 VanDerWaalsContact O-ND2 3.15Å; K303-V455 HydrophobicContact CB-CG1 3.64Å; K303-V455 HydrophobicContact CG-CG1 3.88Å; K303-T456 WeakPolarHBondContact CB-O 3.11Å
304	L	94.4	Very high	94	Very high	90 Å²	90	71.9 Å²	71.9	47%	0.471	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	112.5	166.1	175.4	64.5	0	0	0	106.6	T456 W458	L304-T456 HydrophobicContact CB-CG2 3.8Å; L304-T456 HydrophobicContact CD2-CG2 3.82Å; L304-T456 HydrophobicContact CG-CG2 4.08Å; L304-T456 PolarHBondContact N-O 2.77Å; L304-T456 PolarHBondContact O-N 3.06Å; L304-W458 HydrophobicContact CB-CB 4.42Å
305	N	96.2	Very high	94.2	Very high	37 Å²	37	68.2 Å²	68.2	20%	0.198	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	118.5	177.5	-63.2	-98	0	0	0	107.5	V299 E300 K303 I453 V455	V299-N305 HydrophobicContact CG1-CB 3.79Å; V299-N305 VanDerWaalsContact CG1-CG 3.48Å; V299-N305 WeakPolarHBondContact CG1-ND2 3.49Å; E300-N305 PolarHBondContact N-OD1 3.19Å; E300-N305 VanDerWaalsContact N-OD1 3.1Å; E300-N305 PolarHBondContact O-ND2 3.32Å; K303-N305 PolarHBondContact O-ND2 3.46Å; K303-N305 VanDerWaalsContact O-ND2 3.15Å; N305-I453 HydrophobicContact CB-CD1 4.26Å; N305-V455 WeakPolarHBondContact OD1-CG2 3.45Å
306	E	96.1	Very high	94.3	Very high	105 Å²	105	68.4 Å²	68.4	49%	0.491	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	120	177.8	-177.2	173.2	-157.2	0	0	108.6	I453 S454	E306-I453 WeakPolarHBondContact O-CA 3.43Å; E306-S454 PolarHBondContact N-O 3.46Å; E306-S454 PolarHBondContact O-N 2.97Å
307	I	96.3	Very high	94.3	Very high	40 Å²	40	73.9 Å²	73.9	21%	0.205	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	105.3	177.4	-59.4	171.3	0	0	0	107.4	V281 V283 L297 T452	V281-I307 HydrophobicContact CB-CD1 4.3Å; V281-I307 HydrophobicContact CG1-CD1 3.74Å; V283-I307 HydrophobicContact CG2-CG2 3.84Å; L297-I307 HydrophobicContact CD1-CG2 4.08Å; I307-T452 CarbonylContact C-O 3.52Å; I307-T452 WeakPolarHBondContact CA-O 3.27Å
308	N	94.3	Very high	94.2	Very high	74 Å²	74	77.1 Å²	77.1	40%	0.396	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	134.4	172.9	-67.6	-53.2	0	0	0	108.6	S451 T452	N308-S451 CarbonylContact O-C 3.57Å; N308-S451 WeakPolarHBondContact O-CA 3.47Å; N308-T452 PolarHBondContact N-O 3.06Å; N308-T452 PolarHBondContact O-N 3.37Å; N308-T452 PolarHBondContact O-OG1 3.44Å
309	Y	93.5	Very high	94.1	Very high	69 Å²	69	72.7 Å²	72.7	27%	0.271	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	149	179.7	64	-92.5	0	0	0	111.9	F115 P116 Y449 E450	F115-Y309 WeakPolarHBondContact CD2-OH 3.07Å; F115-Y309 HydrophobicContact CE2-CE1 4.25Å; F115-Y309 WeakPolarHBondContact CE2-OH 3.25Å; P116-Y309 HydrophobicContact CG-CD1 4.39Å; P116-Y309 HydrophobicContact CG-CD2 4.39Å; P116-Y309 HydrophobicContact CG-CE1 4.16Å; P116-Y309 HydrophobicContact CG-CE2 4.17Å; P116-Y309 HydrophobicContact CG-CG 4.5Å; Y309-Y449 AromaticContact CD2-CD1 3.81Å; Y309-Y449 HydrophobicContact CD2-CD1 3.81Å; Y309-Y449 HydrophobicContact CD2-CE1 4.49Å; Y309-Y449 HydrophobicContact CE2-CD1 4.23Å; Y309-Y449 HydrophobicContact CE2-CE1 4.48Å; Y309-E450 CarbonylContact C-O 3.56Å; Y309-E450 VanDerWaalsContact CA-O 3.25Å; Y309-E450 WeakPolarHBondContact CA-O 3.26Å
310	Q	92.7	Very high	93.9	Very high	116 Å²	116	76.4 Å²	76.4	54%	0.542	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	114	170.9	-176.9	169.7	-2.1	0	0	109.4	E450	Q310-E450 HydrophobicContact CB-CB 4.5Å; Q310-E450 PolarHBondContact N-O 3.02Å; Q310-E450 PolarHBondContact O-N 2.93Å
311	P	93.8	Very high	93.6	Very high	40 Å²	40	77.1 Å²	77.1	26%	0.26	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	128.3	175.8	28.5	-29.4	0	0	0	110.4	S113 T448 Y449	S113-P311 WeakPolarHBondContact OG-CG 3.3Å; P311-T448 WeakPolarHBondContact CA-O 3.23Å; P311-Y449 HydrophobicContact CB-CD1 4.04Å; P311-Y449 HydrophobicContact CB-CE1 3.92Å
312	V	95.2	Very high	93.5	Very high	37 Å²	37	80.2 Å²	80.2	22%	0.224	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	115.2	177.1	-179.7	0	0	0	0	108.7	W314 Y447 T448	V312-W314 HydrophobicContact CG1-CZ2 4.35Å; V312-Y447 WeakPolarHBondContact O-CA 3.4Å; V312-T448 PolarHBondContact N-O 2.87Å; V312-T448 PolarHBondContact O-N 2.84Å
313	L	95	Very high	93.6	Very high	56 Å²	56	79.4 Å²	79.4	29%	0.293	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	111.6	173.5	175.2	62.6	0	0	0	110	K315 Y447	L313-K315 HydrophobicContact CD2-CG 4.42Å; L313-K315 HydrophobicContact CG-CG 4.24Å; L313-Y447 HydrophobicContact CB-CD1 4.1Å; L313-Y447 HydrophobicContact CB-CE1 3.72Å; L313-Y447 HydrophobicContact CD1-CD1 4.4Å; L313-Y447 HydrophobicContact CD1-CD2 4.18Å; L313-Y447 HydrophobicContact CD1-CE1 4.07Å; L313-Y447 HydrophobicContact CD1-CE2 3.81Å; L313-Y447 HydrophobicContact CD1-CG 4.46Å; L313-Y447 HydrophobicContact CG-CE1 4.33Å
314	W	95.3	Very high	93.7	Very high	101 Å²	101	76 Å²	76	38%	0.383	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	130.9	172.7	-66.6	86.7	0	0	0	110.3	V312 R445 Y446 T448	V312-W314 HydrophobicContact CG1-CZ2 4.35Å; W314-R445 VanDerWaalsContact O-CA 3.29Å; W314-R445 WeakPolarHBondContact O-CA 3.46Å; W314-Y446 HydrophobicContact CB-CD1 3.99Å; W314-Y446 HydrophobicContact CB-CD2 4.23Å; W314-Y446 HydrophobicContact CB-CE1 3.57Å; W314-Y446 HydrophobicContact CB-CE2 3.83Å; W314-Y446 HydrophobicContact CB-CG 4.28Å; W314-Y446 VanDerWaalsContact CB-CZ 3.46Å; W314-Y446 AromaticContact CD1-CD2 3.87Å; W314-Y446 AromaticContact CD1-CE2 3.3Å; W314-Y446 AromaticContact CD1-CZ 3.72Å; W314-Y446 HydrophobicContact CD2-CE2 4.39Å; W314-Y446 HydrophobicContact CG-CD2 4.25Å; W314-Y446 HydrophobicContact CG-CE1 4.1Å; W314-Y446 AromaticContact CG-CE2 3.55Å; W314-Y446 HydrophobicContact CG-CE2 3.55Å; W314-Y446 AromaticContact CG-CZ 3.43Å; W314-Y446 VanDerWaalsContact CG-CZ 3.43Å; W314-Y446 PolarHBondContact N-O 2.88Å; W314-Y446 AromaticContact NE1-CE2 3.98Å; W314-Y446 PolarHBondContact O-N 3.35Å; W314-T448 PolarHBondContact NE1-OG1 2.84Å
315	K	95.2	Very high	93.6	Very high	119 Å²	119	73.4 Å²	73.4	52%	0.517	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	96.3	171.9	-62.9	177.2	-169.3	164.3	0	108.6	L313 C444	L313-K315 HydrophobicContact CD2-CG 4.42Å; L313-K315 HydrophobicContact CG-CG 4.24Å; K315-C444 CarbonylContact C-O 3.58Å; K315-C444 WeakPolarHBondContact CA-O 3.5Å
316	R	94.7	Very high	93.4	Very high	104 Å²	104	72.8 Å²	72.8	39%	0.392	36%	0.364	S	S	.	.			trans	-90.3	139.4	177.8	-58.8	-178.1	177.4	-156.8	1.5	110	C324 C444 Y446	R316-C324 HydrophobicContact CB-CB 4.39Å; R316-C444 PolarHBondContact N-O 3.46Å; R316-Y446 PolarHBondContact NE-OH 3.16Å; R316-Y446 PolarHBondContact NH2-OH 3.34Å
317	L	93.1	Very high	93	Very high	127 Å²	127	70.8 Å²	70.8	67%	0.665	36%	0.355	S	S	*	.			trans	-81.2	137.6	170.2	-67.3	174.7	0	0	0	109.3	V101 T319	V101-L317 HydrophobicContact CG1-CB 4.35Å; V101-L317 HydrophobicContact CG1-CD1 4.06Å; L317-T319 HydrophobicContact CB-CG2 4.29Å; L317-T319 PolarHBondContact O-N 3.42Å
318	N	92.9	Very high	92.5	Very high	102 Å²	102	75.4 Å²	75.4	55%	0.545	37%	0.374	S	S	.	.			trans	-81.3	102.7	174.7	-172.6	26.1	0	0	0	109	P323 C324	N318-P323 VanDerWaalsContact OD1-CA 3.28Å; N318-P323 WeakPolarHBondContact OD1-CA 3.2Å; N318-C324 VanDerWaalsContact CA-SG 3.53Å; N318-C324 PolarHBondContact N-SG 3.31Å; N318-C324 PolarHBondContact OD1-N 3.42Å; N318-C324 PolarHBondContact OD1-O 3.19Å
319	T	91.7	Very high	92.1	Very high	14 Å²	14	73.9 Å²	73.9	9%	0.086	37%	0.365	C	S	.	.			trans	-112.4	157.8	178.5	72	0	0	0	0	111.3	V101 L317 Q321 N322 P323	V101-T319 HydrophobicContact CG1-CG2 3.75Å; L317-T319 HydrophobicContact CB-CG2 4.29Å; L317-T319 PolarHBondContact O-N 3.42Å; T319-Q321 PolarHBondContact O-N 2.8Å; T319-N322 PolarHBondContact N-O 3.33Å; T319-N322 CarbonylContact O-C 3.5Å; T319-N322 VanDerWaalsContact O-C 3.23Å; T319-N322 PolarHBondContact O-N 2.82Å; T319-N322 PolarHBondContact OG1-N 3.44Å; T319-N322 VanDerWaalsContact OG1-N 3.08Å; T319-P323 WeakPolarHBondContact O-CA 3.29Å; T319-P323 VanDerWaalsContact O-N 3.14Å
320	P	90.1	Very high	91.6	Very high	99 Å²	99	71 Å²	71	64%	0.643	35%	0.354	S	S	*	.	S	Bend	trans	-59.2	-32.7	177.1	-26	35.5	0	0	0	114	Y99	Y99-P320 HydrophobicContact CD2-CG 4.11Å; Y99-P320 HydrophobicContact CE2-CG 4.01Å; Y99-P320 HydrophobicContact CG-CG 4.45Å
321	Q	88.5	Confident	91.1	Very high	112 Å²	112	71.6 Å²	71.6	52%	0.523	35%	0.352	S	S	.	.	S	Bend	trans	-81.3	-35.2	178.9	-63.1	-168.4	1.6	0	0	112.7	V98 T319	V98-Q321 PolarHBondContact O-NE2 3.45Å; V98-Q321 PolarHBondContact O-OE1 3.27Å; T319-Q321 PolarHBondContact O-N 2.8Å
322	N	90.3	Very high	90.7	Very high	107 Å²	107	72.6 Å²	72.6	57%	0.572	36%	0.355	S	S	*	.	S	Bend	trans	-129.8	74.5	-177.6	-65.3	-62	0	0	0	109.6	T319	T319-N322 PolarHBondContact N-O 3.33Å; T319-N322 CarbonylContact O-C 3.5Å; T319-N322 VanDerWaalsContact O-C 3.23Å; T319-N322 PolarHBondContact O-N 2.82Å; T319-N322 PolarHBondContact OG1-N 3.44Å; T319-N322 VanDerWaalsContact OG1-N 3.08Å
323	P	93.3	Very high	90.1	Very high	40 Å²	40	73.9 Å²	73.9	26%	0.26	36%	0.364	S	S	.	.			trans	-66.1	146.5	-177.9	26.9	-35	0	0	0	111.2	N318 T319 H441	N318-P323 VanDerWaalsContact OD1-CA 3.28Å; N318-P323 WeakPolarHBondContact OD1-CA 3.2Å; T319-P323 WeakPolarHBondContact O-CA 3.29Å; T319-P323 VanDerWaalsContact O-N 3.14Å; P323-H441 VanDerWaalsContact CG-CE1 3.45Å; P323-H441 WeakPolarHBondContact CG-CE1 3.39Å
324	C	94.8	Very high	89.6	Confident	7 Å²	7	78.6 Å²	78.6	5%	0.047	39%	0.385	C	S	.	.			trans	-129.6	150.8	171.3	68	0	0	0	0	111.1	R316 N318 A326 P442 C444	R316-C324 HydrophobicContact CB-CB 4.39Å; N318-C324 VanDerWaalsContact CA-SG 3.53Å; N318-C324 PolarHBondContact N-SG 3.31Å; N318-C324 PolarHBondContact OD1-N 3.42Å; N318-C324 PolarHBondContact OD1-O 3.19Å; C324-A326 PolarHBondContact O-N 3.01Å; C324-P442 CarbonylContact C-O 3.52Å; C324-P442 VanDerWaalsContact CA-O 3.22Å; C324-P442 WeakPolarHBondContact CA-O 3.44Å; C324-P442 HydrophobicContact CB-CG 4.39Å; C324-P442 WeakPolarHBondContact CB-O 3.47Å; C324-C444 HydrophobicContact CB-CB 4.02Å; C324-C444 WeakPolarHBondContact CB-SG 3.5Å; C324-C444 PolarHBondContact O-SG 3.31Å; C324-C444 VanDerWaalsContact O-SG 3.35Å; C324-C444 VanDerWaalsContact SG-CA 3.51Å; C324-C444 WeakPolarHBondContact SG-CB 3.22Å; C324-C444 CovalentContact SG-SG 2.04Å; C324-C444 PolarHBondContact SG-SG 3.34Å
325	R	93.4	Very high	89.1	Confident	35 Å²	35	77.9 Å²	77.9	13%	0.132	39%	0.388	C	S	.	.	B	Isolated β-bridge	trans	-74.5	114.4	179.4	-172.9	175.9	-179.1	113.1	7.3	109.8	I329 D330 L335 A336 P442 C444	R325-I329 HydrophobicContact CG-CB 4.18Å; R325-I329 HydrophobicContact CG-CD1 4.17Å; R325-I329 HydrophobicContact CG-CG2 4.2Å; R325-D330 WeakPolarHBondContact CD-OD1 3.08Å; R325-D330 IonicContact CZ-OD1 2.92Å; R325-D330 IonicContact NE-OD1 3.23Å; R325-D330 PolarHBondContact NE-OD1 3.34Å; R325-L335 PolarHBondContact NH2-O 3.22Å; R325-A336 PolarHBondContact NH2-O 2.82Å; R325-P442 PolarHBondContact N-O 2.74Å; R325-C444 VanDerWaalsContact C-SG 3.53Å; R325-C444 PolarHBondContact O-N 2.74Å; R325-C444 PolarHBondContact O-SG 3.34Å
326	A	91.5	Very high	88.5	Confident	24 Å²	24	72.3 Å²	72.3	20%	0.198	36%	0.364	C	S	.	.			trans	-69.7	148.1	-178.5	0	0	0	0	0	112	C324 F328 I329	C324-A326 PolarHBondContact O-N 3.01Å; A326-F328 VanDerWaalsContact C-N 3.31Å; A326-F328 HydrophobicContact CB-CD1 3.61Å; A326-F328 HydrophobicContact CB-CE1 3.38Å; A326-F328 HydrophobicContact CB-CZ 4.37Å; A326-F328 PolarHBondContact O-N 3.09Å; A326-I329 HydrophobicContact CB-CD1 4.39Å; A326-I329 HydrophobicContact CB-CG1 4.49Å; A326-I329 VanDerWaalsContact O-CB 3.28Å; A326-I329 WeakPolarHBondContact O-CB 3.32Å; A326-I329 WeakPolarHBondContact O-CG1 3.22Å; A326-I329 PolarHBondContact O-N 2.98Å
327	E	86.7	Confident	88.1	Confident	63 Å²	63	69 Å²	69	29%	0.294	36%	0.356	S	S	.	.	H	α-helix	trans	-59.2	-37.1	-171.5	-173	173.1	-173	0	0	113.5	I329 D330 R331	E327-I329 PolarHBondContact O-N 3.15Å; E327-I329 VanDerWaalsContact O-N 3.12Å; E327-D330 PolarHBondContact O-N 3.07Å; E327-R331 HydrophobicContact CG-CG 4.27Å; E327-R331 WeakPolarHBondContact O-CG 3.39Å; E327-R331 PolarHBondContact O-N 2.92Å; E327-R331 IonicContact OE1-CZ 2.78Å; E327-R331 IonicContact OE1-NE 2.74Å; E327-R331 PolarHBondContact OE1-NE 2.81Å; E327-R331 IonicContact OE1-NH2 3.17Å; E327-R331 PolarHBondContact OE1-NH2 2.83Å
328	F	85.7	Confident	87.9	Confident	138 Å²	138	64.1 Å²	64.1	61%	0.605	33%	0.331	S	S	*	.	H	α-helix	trans	-59	-27.8	178.8	74.9	-92.9	0	0	0	113.2	A326 N332 L335	A326-F328 VanDerWaalsContact C-N 3.31Å; A326-F328 HydrophobicContact CB-CD1 3.61Å; A326-F328 HydrophobicContact CB-CE1 3.38Å; A326-F328 HydrophobicContact CB-CZ 4.37Å; A326-F328 PolarHBondContact O-N 3.09Å; F328-N332 PolarHBondContact O-N 3.33Å; F328-L335 HydrophobicContact CD2-CD1 4.32Å; F328-L335 HydrophobicContact CE2-CD1 4.28Å
329	I	85.7	Confident	87.5	Confident	41 Å²	41	60.1 Å²	60.1	21%	0.21	31%	0.31	C	S	.	.	H	α-helix	trans	-69.8	-42.3	175.9	-53.1	178.7	0	0	0	109.4	R325 A326 E327 R331 N332 L335 A336	R325-I329 HydrophobicContact CG-CB 4.18Å; R325-I329 HydrophobicContact CG-CD1 4.17Å; R325-I329 HydrophobicContact CG-CG2 4.2Å; A326-I329 HydrophobicContact CB-CD1 4.39Å; A326-I329 HydrophobicContact CB-CG1 4.49Å; A326-I329 VanDerWaalsContact O-CB 3.28Å; A326-I329 WeakPolarHBondContact O-CB 3.32Å; A326-I329 WeakPolarHBondContact O-CG1 3.22Å; A326-I329 PolarHBondContact O-N 2.98Å; E327-I329 PolarHBondContact O-N 3.15Å; E327-I329 VanDerWaalsContact O-N 3.12Å; I329-R331 VanDerWaalsContact C-N 3.28Å; I329-R331 PolarHBondContact O-N 2.9Å; I329-N332 PolarHBondContact O-N 3.24Å; I329-L335 HydrophobicContact CG2-CB 3.78Å; I329-A336 PolarHBondContact O-N 3.43Å
330	D	82.9	Confident	86.8	Confident	9 Å²	9	66.5 Å²	66.5	5%	0.048	34%	0.344	C	S	.	.	H	α-helix	trans	-73.6	-20.1	-179.7	-65	-20.5	0	0	0	113	R325 E327 F351 A352 R443	R325-D330 WeakPolarHBondContact CD-OD1 3.08Å; R325-D330 IonicContact CZ-OD1 2.92Å; R325-D330 IonicContact NE-OD1 3.23Å; R325-D330 PolarHBondContact NE-OD1 3.34Å; E327-D330 PolarHBondContact O-N 3.07Å; D330-F351 HydrophobicContact CB-CD1 4.25Å; D330-A352 PolarHBondContact O-N 2.67Å; D330-R443 WeakPolarHBondContact OD2-CD 3.34Å; D330-R443 VanDerWaalsContact OD2-CG 3.3Å; D330-R443 WeakPolarHBondContact OD2-CG 3.08Å
331	R	82.7	Confident	86.2	Confident	128 Å²	128	67.7 Å²	67.7	48%	0.483	34%	0.341	S	S	.	.	H	α-helix	trans	-85.5	-25	176.5	-60.5	-160.8	173	164.2	-8.6	113.6	E327 I329 P333 D350	E327-R331 HydrophobicContact CG-CG 4.27Å; E327-R331 WeakPolarHBondContact O-CG 3.39Å; E327-R331 PolarHBondContact O-N 2.92Å; E327-R331 IonicContact OE1-CZ 2.78Å; E327-R331 IonicContact OE1-NE 2.74Å; E327-R331 PolarHBondContact OE1-NE 2.81Å; E327-R331 IonicContact OE1-NH2 3.17Å; E327-R331 PolarHBondContact OE1-NH2 2.83Å; I329-R331 VanDerWaalsContact C-N 3.28Å; I329-R331 PolarHBondContact O-N 2.9Å; R331-P333 WeakPolarHBondContact O-CD 3.15Å; R331-D350 VanDerWaalsContact CG-O 3.25Å; R331-D350 WeakPolarHBondContact CG-O 3.34Å
332	N	85	Confident	85.6	Confident	61 Å²	61	72.5 Å²	72.5	33%	0.326	36%	0.36	S	S	.	.	S	Bend	trans	-91.8	116.5	-178.1	-176.7	-24.1	0	0	0	110.2	F328 I329 E334 L335 A336	F328-N332 PolarHBondContact O-N 3.33Å; I329-N332 PolarHBondContact O-N 3.24Å; N332-E334 PolarHBondContact O-N 3.06Å; N332-E334 VanDerWaalsContact O-N 3.12Å; N332-E334 PolarHBondContact OD1-N 3.12Å; N332-L335 HydrophobicContact CB-CB 4.11Å; N332-L335 HydrophobicContact CB-CD1 4.01Å; N332-L335 HydrophobicContact CB-CG 4.1Å; N332-L335 PolarHBondContact O-N 3.04Å; N332-L335 VanDerWaalsContact O-N 3.1Å; N332-A336 VanDerWaalsContact O-CB 3.23Å; N332-A336 WeakPolarHBondContact O-CB 3.12Å; N332-A336 PolarHBondContact O-N 2.93Å
333	P	83.3	Confident	85	Confident	65 Å²	65	68.8 Å²	68.8	42%	0.422	34%	0.34	S	S	.	.	H	α-helix	trans	-54.8	-31.2	-179.7	-26.4	35.1	0	0	0	115.5	R331 A352	R331-P333 WeakPolarHBondContact O-CD 3.15Å; P333-A352 HydrophobicContact CB-CB 4.19Å; P333-A352 HydrophobicContact CG-CB 4.05Å
334	E	83.8	Confident	84	Confident	155 Å²	155	70.8 Å²	70.8	72%	0.724	35%	0.353	S	S	*	.	H	α-helix	trans	-76.7	-37.2	-179.9	-63	-178.2	175	0	0	111.8	N332	N332-E334 PolarHBondContact O-N 3.06Å; N332-E334 VanDerWaalsContact O-N 3.12Å; N332-E334 PolarHBondContact OD1-N 3.12Å
335	L	85	Confident	82.7	Confident	86 Å²	86	80.2 Å²	80.2	45%	0.45	39%	0.387	S	S	.	.	H	α-helix	trans	-82.8	-30.7	179.3	-60.3	177.5	0	0	0	112.2	R325 F328 I329 N332 S337	R325-L335 PolarHBondContact NH2-O 3.22Å; F328-L335 HydrophobicContact CD2-CD1 4.32Å; F328-L335 HydrophobicContact CE2-CD1 4.28Å; I329-L335 HydrophobicContact CG2-CB 3.78Å; N332-L335 HydrophobicContact CB-CB 4.11Å; N332-L335 HydrophobicContact CB-CD1 4.01Å; N332-L335 HydrophobicContact CB-CG 4.1Å; N332-L335 PolarHBondContact O-N 3.04Å; N332-L335 VanDerWaalsContact O-N 3.1Å; L335-S337 VanDerWaalsContact C-N 3.33Å
336	A	83.6	Confident	81.2	Confident	1 Å²	1	81.2 Å²	81.2	1%	0.008	40%	0.395	C	S	.	.	H	α-helix	trans	-63.9	-37.3	179	0	0	0	0	0	112.6	R325 I329 N332 I338 A352 A354	R325-A336 PolarHBondContact NH2-O 2.82Å; I329-A336 PolarHBondContact O-N 3.43Å; N332-A336 VanDerWaalsContact O-CB 3.23Å; N332-A336 WeakPolarHBondContact O-CB 3.12Å; N332-A336 PolarHBondContact O-N 2.93Å; A336-I338 PolarHBondContact O-N 2.95Å; A336-A352 HydrophobicContact CB-CB 3.54Å; A336-A354 WeakPolarHBondContact O-CA 3.19Å; A336-A354 WeakPolarHBondContact O-CB 3.36Å
337	S	86.9	Confident	79.5	Confident	34 Å²	34	86.8 Å²	86.8	24%	0.238	43%	0.426	C	S	.	.			trans	-62.4	130.5	-175	-164.2	0	0	0	0	112.7	L335 T339 A354	L335-S337 VanDerWaalsContact C-N 3.33Å; S337-T339 WeakPolarHBondContact OG-CG2 3.5Å; S337-T339 PolarHBondContact OG-N 2.85Å; S337-T339 PolarHBondContact OG-O 2.75Å; S337-A354 WeakPolarHBondContact CA-O 3.08Å
338	I	88.2	Confident	78.2	Confident	25 Å²	25	86.7 Å²	86.7	13%	0.128	44%	0.442	C	S	.	.			trans	-107.6	1.8	166.8	62.9	169.7	0	0	0	111.7	A336 A354 Y355 Y364 C369 F372 K376	A336-I338 PolarHBondContact O-N 2.95Å; I338-A354 HydrophobicContact CG1-CB 4.46Å; I338-A354 VanDerWaalsContact CG1-O 3.28Å; I338-A354 WeakPolarHBondContact CG1-O 3.35Å; I338-A354 PolarHBondContact N-O 3.25Å; I338-Y355 HydrophobicContact CD1-CD1 3.98Å; I338-Y355 HydrophobicContact CD1-CG 4.3Å; I338-Y355 HydrophobicContact CG1-CD1 4.38Å; I338-Y364 HydrophobicContact CG2-CD2 4.26Å; I338-Y364 HydrophobicContact CG2-CE2 4.33Å; I338-C369 HydrophobicContact CD1-CB 4.27Å; I338-F372 HydrophobicContact CD1-CB 4.17Å; I338-F372 HydrophobicContact CD1-CD1 3.67Å; I338-F372 HydrophobicContact CD1-CE1 4.39Å; I338-F372 HydrophobicContact CD1-CG 4.16Å; I338-F372 HydrophobicContact CG1-CD1 3.96Å; I338-F372 HydrophobicContact CG1-CE1 4.19Å; I338-K376 PolarHBondContact O-NZ 3.44Å
339	T	83.7	Confident	77.1	Confident	18 Å²	18	82.7 Å²	82.7	11%	0.11	43%	0.427	C	S	.	.	S	Bend	trans	-107.3	151.4	173.2	-176.2	0	0	0	0	110.5	S337 H341 L343	S337-T339 WeakPolarHBondContact OG-CG2 3.5Å; S337-T339 PolarHBondContact OG-N 2.85Å; S337-T339 PolarHBondContact OG-O 2.75Å; T339-H341 PolarHBondContact O-N 2.97Å; T339-H341 PolarHBondContact OG1-N 3.25Å; T339-L343 HydrophobicContact CG2-CD1 3.97Å; T339-L343 HydrophobicContact CG2-CD2 3.93Å; T339-L343 HydrophobicContact CG2-CG 3.91Å
340	D	77.8	Confident	76.3	Confident	149 Å²	149	84.1 Å²	84.1	80%	0.797	44%	0.435	S	S	*	.	S	Bend	trans	-77.4	-15.6	178.1	-54.5	-54.8	0	0	0	111.7	K376	D340-K376 IonicContact OD2-NZ 3.3Å
341	H	76.7	Confident	76	Confident	124 Å²	124	86.2 Å²	86.2	57%	0.574	44%	0.444	S	S	*	.	S	Bend	trans	-82.7	143.3	179.5	-62.6	-59.1	0	0	0	112.4	T339 L343	T339-H341 PolarHBondContact O-N 2.97Å; T339-H341 PolarHBondContact OG1-N 3.25Å; H341-L343 PolarHBondContact O-N 3.48Å
342	K	76.9	Confident	76	Confident	212 Å²	212	80.6 Å²	80.6	92%	0.922	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-64.9	119.3	172.9	-71.3	-174.5	179.6	179.1	0	109.9
343	L	78.3	Confident	76.1	Confident	29 Å²	29	78.8 Å²	78.8	15%	0.152	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-82.2	149.6	173.9	-65.1	172.1	0	0	0	110.7	T339 H341 R345 Y353 N356	T339-L343 HydrophobicContact CG2-CD1 3.97Å; T339-L343 HydrophobicContact CG2-CD2 3.93Å; T339-L343 HydrophobicContact CG2-CG 3.91Å; H341-L343 PolarHBondContact O-N 3.48Å; L343-R345 PolarHBondContact O-N 3.41Å; L343-Y353 VanDerWaalsContact CD1-O 3.27Å; L343-Y353 WeakPolarHBondContact CD1-O 3.34Å; L343-N356 WeakPolarHBondContact CD2-ND2 3.45Å; L343-N356 WeakPolarHBondContact CD2-OD1 3.14Å
344	P	72.2	Confident	76.4	Confident	82 Å²	82	75.7 Å²	75.7	53%	0.532	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-53.2	132.5	170.1	-22.4	32.6	0	0	0	110.6	S361	P344-S361 WeakPolarHBondContact CD-OG 3.19Å
345	R	67	Low	76.9	Confident	205 Å²	205	68.3 Å²	68.3	77%	0.774	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-77.4	129.7	171.3	-66.5	-179.4	178.9	175	-3.3	108.3	L343	L343-R345 PolarHBondContact O-N 3.41Å
346	L	61.6	Low	77.2	Confident	57 Å²	57	65.3 Å²	65.3	30%	0.298	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-94.7	125.8	169.7	-69.2	90.4	0	0	0	109.6	L349 Y353	L346-L349 HydrophobicContact CB-CB 4.45Å; L346-L349 HydrophobicContact CB-CD1 3.99Å; L346-L349 HydrophobicContact CD2-CD1 3.26Å; L346-L349 HydrophobicContact CG-CD1 4.17Å; L346-Y353 HydrophobicContact CD1-CD1 4.27Å; L346-Y353 HydrophobicContact CD1-CD2 3.02Å; L346-Y353 HydrophobicContact CD1-CE1 4.11Å; L346-Y353 HydrophobicContact CD1-CE2 2.88Å; L346-Y353 HydrophobicContact CD1-CG 3.79Å; L346-Y353 VanDerWaalsContact CD1-CZ 3.45Å; L346-Y353 HydrophobicContact CD2-CE1 4.42Å; L346-Y353 HydrophobicContact CD2-CE2 3.65Å; L346-Y353 VanDerWaalsContact CD2-CZ 3.49Å; L346-Y353 WeakPolarHBondContact CD2-OH 3.27Å; L346-Y353 HydrophobicContact CG-CD2 4.32Å; L346-Y353 HydrophobicContact CG-CE2 3.77Å
347	T	56.2	Low	77.7	Confident	140 Å²	140	65.3 Å²	65.3	86%	0.859	34%	0.344	S	S	*	.	S	Bend	trans	-85.5	126.6	165.7	50.8	0	0	0	0	108.1
348	G	58.6	Low	77.9	Confident	61 Å²	61	64.2 Å²	64.2	63%	0.629	34%	0.335	S	S	*	.	S	Bend	trans	96.3	5	170.2	0	0	0	0	0	116.7
349	L	62.7	Low	77.8	Confident	55 Å²	55	67.9 Å²	67.9	29%	0.288	36%	0.355	S	S	.	.			trans	-109.4	142.1	170.3	-78.3	154.1	0	0	0	110.5	L346 F351	L346-L349 HydrophobicContact CB-CB 4.45Å; L346-L349 HydrophobicContact CB-CD1 3.99Å; L346-L349 HydrophobicContact CD2-CD1 3.26Å; L346-L349 HydrophobicContact CG-CD1 4.17Å; L349-F351 PolarHBondContact O-N 3.12Å; L349-F351 VanDerWaalsContact O-N 3.07Å
350	D	70.4	Confident	78.1	Confident	71 Å²	71	68.6 Å²	68.6	38%	0.38	36%	0.359	S	S	.	.	S	Bend	trans	-69.3	-0.4	178.9	-77	-14.6	0	0	0	113.6	K240 R331	K240-D350 WeakPolarHBondContact CD-OD2 3.3Å; K240-D350 IonicContact NZ-OD2 2.75Å; R331-D350 VanDerWaalsContact CG-O 3.25Å; R331-D350 WeakPolarHBondContact CG-O 3.34Å
351	F	76.4	Confident	78.7	Confident	52 Å²	52	61.9 Å²	61.9	23%	0.228	32%	0.324	C	S	.	.	S	Bend	trans	-142.8	153.3	-171.4	-56.2	-82.4	0	0	0	111.7	D330 L349 R363	D330-F351 HydrophobicContact CB-CD1 4.25Å; L349-F351 PolarHBondContact O-N 3.12Å; L349-F351 VanDerWaalsContact O-N 3.07Å; F351-R363 VanDerWaalsContact CD1-NH2 3.29Å; F351-R363 VanDerWaalsContact CG-CZ 3.44Å
352	A	82.4	Confident	79.5	Confident	11 Å²	11	56.1 Å²	56.1	9%	0.091	30%	0.297	C	S	.	.			trans	-99.5	157.2	176	0	0	0	0	0	112.7	D330 P333 A336	D330-A352 PolarHBondContact O-N 2.67Å; P333-A352 HydrophobicContact CB-CB 4.19Å; P333-A352 HydrophobicContact CG-CB 4.05Å; A336-A352 HydrophobicContact CB-CB 3.54Å
353	Y	86.1	Confident	80.2	Confident	22 Å²	22	46.9 Å²	46.9	9%	0.086	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	149.9	170.6	-65.5	-35.6	0	0	0	111.6	L343 L346 S361 Y362 R363	L343-Y353 VanDerWaalsContact CD1-O 3.27Å; L343-Y353 WeakPolarHBondContact CD1-O 3.34Å; L346-Y353 HydrophobicContact CD1-CD1 4.27Å; L346-Y353 HydrophobicContact CD1-CD2 3.02Å; L346-Y353 HydrophobicContact CD1-CE1 4.11Å; L346-Y353 HydrophobicContact CD1-CE2 2.88Å; L346-Y353 HydrophobicContact CD1-CG 3.79Å; L346-Y353 VanDerWaalsContact CD1-CZ 3.45Å; L346-Y353 HydrophobicContact CD2-CE1 4.42Å; L346-Y353 HydrophobicContact CD2-CE2 3.65Å; L346-Y353 VanDerWaalsContact CD2-CZ 3.49Å; L346-Y353 WeakPolarHBondContact CD2-OH 3.27Å; L346-Y353 HydrophobicContact CG-CD2 4.32Å; L346-Y353 HydrophobicContact CG-CE2 3.77Å; Y353-S361 VanDerWaalsContact CE2-CB 3.44Å; Y353-S361 VanDerWaalsContact CG-CB 3.49Å; Y353-Y362 CarbonylContact C-O 3.23Å; Y353-Y362 WeakPolarHBondContact CA-O 3.24Å; Y353-R363 HydrophobicContact CD1-CG 3.97Å; Y353-R363 HydrophobicContact CE1-CG 4.23Å
354	A	90.7	Very high	80.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-33.2	-174.3	0	0	0	0	0	113.5	A336 S337 I338 Y362 Y364	A336-A354 WeakPolarHBondContact O-CA 3.19Å; A336-A354 WeakPolarHBondContact O-CB 3.36Å; S337-A354 WeakPolarHBondContact CA-O 3.08Å; I338-A354 HydrophobicContact CG1-CB 4.46Å; I338-A354 VanDerWaalsContact CG1-O 3.28Å; I338-A354 WeakPolarHBondContact CG1-O 3.35Å; I338-A354 PolarHBondContact N-O 3.25Å; A354-Y362 PolarHBondContact N-O 3.14Å; A354-Y364 HydrophobicContact CB-CD2 4.35Å
355	Y	92.7	Very high	82	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	173.4	-179.2	62.5	-81.4	0	0	0	111.1	Y289 I338 S361 Y362 R363 Q368 F372 P390	Y289-Y355 WeakPolarHBondContact CB-OH 3.43Å; I338-Y355 HydrophobicContact CD1-CD1 3.98Å; I338-Y355 HydrophobicContact CD1-CG 4.3Å; I338-Y355 HydrophobicContact CG1-CD1 4.38Å; Y355-S361 WeakPolarHBondContact O-CA 3.37Å; Y355-Y362 HydrophobicContact CE2-CD2 4.07Å; Y355-Y362 HydrophobicContact CE2-CG 4.23Å; Y355-Y362 PolarHBondContact N-O 3.37Å; Y355-Y362 PolarHBondContact O-N 2.96Å; Y355-R363 WeakPolarHBondContact CE1-O 3.47Å; Y355-Q368 HydrophobicContact CE1-CB 3.92Å; Y355-Q368 HydrophobicContact CE2-CB 4.33Å; Y355-Q368 WeakPolarHBondContact OH-CB 2.95Å; Y355-Q368 VanDerWaalsContact OH-CG 3.29Å; Y355-Q368 WeakPolarHBondContact OH-CG 3.49Å; Y355-F372 HydrophobicContact CD2-CD2 4.27Å; Y355-F372 HydrophobicContact CG-CD2 4.47Å; Y355-P390 HydrophobicContact CD2-CB 4.07Å; Y355-P390 HydrophobicContact CE2-CB 3.92Å; Y355-P390 HydrophobicContact CE2-CG 4.03Å
356	N	91.5	Very high	83.3	Confident	23 Å²	23	35.2 Å²	35.2	12%	0.123	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.1	174.8	-71.5	-19.8	0	0	0	111.5	L343 V360 S361	L343-N356 WeakPolarHBondContact CD2-ND2 3.45Å; L343-N356 WeakPolarHBondContact CD2-OD1 3.14Å; N356-V360 CarbonylContact C-O 3.54Å; N356-V360 WeakPolarHBondContact CA-O 3.16Å; N356-S361 WeakPolarHBondContact OD1-CA 3.43Å; N356-S361 VanDerWaalsContact OD1-CB 3.22Å; N356-S361 WeakPolarHBondContact OD1-CB 3.1Å; N356-S361 PolarHBondContact OD1-OG 3.02Å
357	D	93.8	Very high	84.8	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.011	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	116.6	157.6	176.8	40.2	0	0	0	108.5	Y289 N359 V360 Y362 P390 R391	Y289-D357 HydrophobicContact CD2-CB 4.48Å; Y289-D357 HydrophobicContact CE2-CB 4.03Å; D357-N359 VanDerWaalsContact C-N 3.33Å; D357-N359 PolarHBondContact O-N 2.77Å; D357-V360 PolarHBondContact N-O 3.46Å; D357-V360 WeakPolarHBondContact O-CB 3.3Å; D357-V360 PolarHBondContact O-N 2.95Å; D357-Y362 HydrophobicContact CB-CD2 4.36Å; D357-Y362 HydrophobicContact CB-CE2 3.84Å; D357-P390 HydrophobicContact CB-CB 4.18Å; D357-R391 CarbonylContact C-O 2.98Å; D357-R391 VanDerWaalsContact CA-O 3.31Å; D357-R391 WeakPolarHBondContact CA-O 3.5Å; D357-R391 WeakPolarHBondContact OD1-CA 3.13Å; D357-R391 VanDerWaalsContact OD1-CB 3.26Å; D357-R391 WeakPolarHBondContact OD1-CB 3.24Å; D357-R391 IonicContact OD1-CZ 3.87Å; D357-R391 PolarHBondContact OD1-N 3.06Å; D357-R391 IonicContact OD1-NE 3.92Å; D357-R391 PolarHBondContact OD1-NE 2.81Å; D357-R391 IonicContact OD1-NH2 2.65Å; D357-R391 PolarHBondContact OD1-NH2 3.15Å; D357-R391 IonicContact OD2-CZ 3.15Å; D357-R391 IonicContact OD2-NE 3.57Å; D357-R391 IonicContact OD2-NH2 3.72Å; D357-R391 PolarHBondContact OD2-NH2 3.2Å
358	L	91.4	Very high	86.7	Confident	11 Å²	11	28.2 Å²	28.2	6%	0.058	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.7	50.1	-178.5	-59.3	-173.1	0	0	0	113.9	V360 R391 Y394	L358-V360 PolarHBondContact O-N 3.3Å; L358-R391 HydrophobicContact CD2-CB 3.77Å; L358-R391 HydrophobicContact CG-CB 4.19Å; L358-R391 PolarHBondContact N-O 3.43Å; L358-Y394 HydrophobicContact CB-CD1 4.25Å; L358-Y394 HydrophobicContact CB-CE1 3.76Å; L358-Y394 HydrophobicContact CD1-CD1 4.47Å; L358-Y394 HydrophobicContact CD1-CE1 4.29Å; L358-Y394 HydrophobicContact CD2-CD1 3.73Å; L358-Y394 HydrophobicContact CD2-CE1 4.13Å; L358-Y394 HydrophobicContact CD2-CG 4.37Å; L358-Y394 HydrophobicContact CG-CD1 4.38Å; L358-Y394 HydrophobicContact CG-CE1 4.29Å; L358-Y394 PolarHBondContact O-OH 2.84Å; L358-Y394 VanDerWaalsContact O-OH 3.08Å
359	N	86.8	Confident	88.4	Confident	102 Å²	102	25.4 Å²	25.4	55%	0.545	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	3.7	-175.7	-65.7	-12.9	0	0	0	116.6	D357 Y394	D357-N359 VanDerWaalsContact C-N 3.33Å; D357-N359 PolarHBondContact O-N 2.77Å; N359-Y394 HydrophobicContact CB-CE2 4.39Å; N359-Y394 VanDerWaalsContact ND2-CE2 3.29Å; N359-Y394 WeakPolarHBondContact ND2-CE2 3.3Å
360	V	89.5	Confident	90	Very high	33 Å²	33	23.7 Å²	23.7	20%	0.2	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	122.5	172	-176.4	0	0	0	0	108.7	N356 D357 L358 Y362	N356-V360 CarbonylContact C-O 3.54Å; N356-V360 WeakPolarHBondContact CA-O 3.16Å; D357-V360 PolarHBondContact N-O 3.46Å; D357-V360 WeakPolarHBondContact O-CB 3.3Å; D357-V360 PolarHBondContact O-N 2.95Å; L358-V360 PolarHBondContact O-N 3.3Å; V360-Y362 HydrophobicContact CB-CE2 3.82Å; V360-Y362 HydrophobicContact CG1-CD2 4.46Å; V360-Y362 HydrophobicContact CG1-CE1 4.4Å; V360-Y362 HydrophobicContact CG1-CE2 3.64Å; V360-Y362 WeakPolarHBondContact O-CD2 3.35Å; V360-Y362 WeakPolarHBondContact O-CE2 3.49Å
361	S	91	Very high	91.2	Very high	8 Å²	8	21.8 Å²	21.8	6%	0.056	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	141.9	-177.4	-55.1	0	0	0	0	112.7	R222 P344 Y353 Y355 N356	R222-S361 PolarHBondContact NH2-O 3.1Å; P344-S361 WeakPolarHBondContact CD-OG 3.19Å; Y353-S361 VanDerWaalsContact CE2-CB 3.44Å; Y353-S361 VanDerWaalsContact CG-CB 3.49Å; Y355-S361 WeakPolarHBondContact O-CA 3.37Å; N356-S361 WeakPolarHBondContact OD1-CA 3.43Å; N356-S361 VanDerWaalsContact OD1-CB 3.22Å; N356-S361 WeakPolarHBondContact OD1-CB 3.1Å; N356-S361 PolarHBondContact OD1-OG 3.02Å
362	Y	92.8	Very high	92.1	Very high	3 Å²	3	19.4 Å²	19.4	1%	0.012	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.3	-176.3	-66.1	-86.2	0	0	0	112.3	R222 F224 G287 Y289 Y353 A354 Y355 D357 V360	R222-Y362 VanDerWaalsContact NH2-CD1 3.3Å; F224-Y362 WeakPolarHBondContact CB-OH 3.14Å; G287-Y362 WeakPolarHBondContact O-CA 3.18Å; Y289-Y362 VanDerWaalsContact CA-CD1 3.47Å; Y289-Y362 HydrophobicContact CD2-CD1 4.26Å; Y289-Y362 HydrophobicContact CD2-CD2 4.09Å; Y289-Y362 AromaticContact CD2-CE1 3.98Å; Y289-Y362 HydrophobicContact CD2-CE1 3.98Å; Y289-Y362 AromaticContact CD2-CE2 3.86Å; Y289-Y362 HydrophobicContact CD2-CE2 3.86Å; Y289-Y362 HydrophobicContact CD2-CG 4.29Å; Y289-Y362 AromaticContact CD2-CZ 3.76Å; Y289-Y362 HydrophobicContact CE2-CE2 4.43Å; Y289-Y362 HydrophobicContact CG-CE1 4.39Å; Y353-Y362 CarbonylContact C-O 3.23Å; Y353-Y362 WeakPolarHBondContact CA-O 3.24Å; A354-Y362 PolarHBondContact N-O 3.14Å; Y355-Y362 HydrophobicContact CE2-CD2 4.07Å; Y355-Y362 HydrophobicContact CE2-CG 4.23Å; Y355-Y362 PolarHBondContact N-O 3.37Å; Y355-Y362 PolarHBondContact O-N 2.96Å; D357-Y362 HydrophobicContact CB-CD2 4.36Å; D357-Y362 HydrophobicContact CB-CE2 3.84Å; V360-Y362 HydrophobicContact CB-CE2 3.82Å; V360-Y362 HydrophobicContact CG1-CD2 4.46Å; V360-Y362 HydrophobicContact CG1-CE1 4.4Å; V360-Y362 HydrophobicContact CG1-CE2 3.64Å; V360-Y362 WeakPolarHBondContact O-CD2 3.35Å; V360-Y362 WeakPolarHBondContact O-CE2 3.49Å
363	R	92.6	Very high	92.7	Very high	18 Å²	18	20 Å²	20	7%	0.068	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	153.6	172.1	-69.1	175.1	67.1	-152.7	-4.1	110.7	E285 P286 G287 T288 F351 Y353 Y355 T365	E285-R363 IonicContact OE1-CZ 3.7Å; E285-R363 VanDerWaalsContact OE1-CZ 3.23Å; E285-R363 IonicContact OE1-NH1 3.24Å; E285-R363 PolarHBondContact OE1-NH1 3.3Å; E285-R363 IonicContact OE1-NH2 3.31Å; E285-R363 PolarHBondContact OE1-NH2 3.35Å; P286-R363 VanDerWaalsContact O-CD 3.28Å; P286-R363 WeakPolarHBondContact O-CD 3.13Å; P286-R363 PolarHBondContact O-NH1 3.28Å; G287-R363 PolarHBondContact O-N 3.33Å; T288-R363 HydrophobicContact CG2-CB 4.34Å; F351-R363 VanDerWaalsContact CD1-NH2 3.29Å; F351-R363 VanDerWaalsContact CG-CZ 3.44Å; Y353-R363 HydrophobicContact CD1-CG 3.97Å; Y353-R363 HydrophobicContact CE1-CG 4.23Å; Y355-R363 WeakPolarHBondContact CE1-O 3.47Å; R363-T365 PolarHBondContact O-N 3.43Å
364	Y	93.7	Very high	93.1	Very high	6 Å²	6	19 Å²	19	2%	0.024	10%	0.103	C	C	.	.			trans	-61.9	129.8	178.9	-178.9	-90	0	0	0	111.8	I338 A354 C369 C440 H441 R443	I338-Y364 HydrophobicContact CG2-CD2 4.26Å; I338-Y364 HydrophobicContact CG2-CE2 4.33Å; A354-Y364 HydrophobicContact CB-CD2 4.35Å; Y364-C369 HydrophobicContact CD2-CB 4.29Å; Y364-C369 HydrophobicContact CE2-CB 3.49Å; Y364-C369 VanDerWaalsContact CE2-CB 3.49Å; Y364-C440 WeakPolarHBondContact OH-CA 3.39Å; Y364-H441 WeakPolarHBondContact CE1-O 3.17Å; Y364-H441 PolarHBondContact OH-N 3.33Å; Y364-H441 PolarHBondContact OH-O 2.87Å; Y364-R443 HydrophobicContact CD1-CG 3.67Å; Y364-R443 HydrophobicContact CE1-CG 4.12Å; Y364-R443 WeakPolarHBondContact O-CD 3.05Å; Y364-R443 PolarHBondContact O-NE 2.95Å
365	T	94.1	Very high	93.3	Very high	20 Å²	20	19.1 Å²	19.1	12%	0.123	10%	0.103	C	C	.	.			trans	-133.1	152.7	160.4	65.5	0	0	0	0	108.4	T288 R363 S367 Q368 C369	T288-T365 HydrophobicContact CG2-CG2 3.61Å; R363-T365 PolarHBondContact O-N 3.43Å; T365-S367 PolarHBondContact O-N 2.98Å; T365-S367 PolarHBondContact OG1-OG 3.12Å; T365-Q368 PolarHBondContact O-N 3.39Å; T365-Q368 VanDerWaalsContact OG1-CB 3.27Å; T365-Q368 WeakPolarHBondContact OG1-CB 3.4Å; T365-Q368 WeakPolarHBondContact OG1-CG 3.38Å; T365-Q368 PolarHBondContact OG1-N 3.06Å; T365-C369 WeakPolarHBondContact O-CB 3.34Å; T365-C369 PolarHBondContact O-N 2.95Å
366	Q	94.2	Very high	93.4	Very high	45 Å²	45	21.9 Å²	21.9	21%	0.21	12%	0.115	C	C	.	.	H	α-helix	trans	-62	-46.7	-177.6	-165.6	-174.5	7.7	0	0	111.5	Q368 C369 I370 C440	Q366-Q368 VanDerWaalsContact C-N 3.31Å; Q366-Q368 PolarHBondContact O-N 3.47Å; Q366-C369 WeakPolarHBondContact O-CB 3.48Å; Q366-C369 PolarHBondContact O-N 2.02Å; Q366-I370 HydrophobicContact CG-CD1 4.25Å; Q366-I370 WeakPolarHBondContact O-CG1 3.43Å; Q366-I370 PolarHBondContact O-N 3.08Å; Q366-I370 VanDerWaalsContact O-N 3.1Å; Q366-C440 WeakPolarHBondContact CG-O 3.46Å; Q366-C440 PolarHBondContact NE2-O 2.85Å; Q366-C440 VanDerWaalsContact NE2-O 3.11Å
367	S	94	Very high	93.5	Very high	46 Å²	46	22.3 Å²	22.3	32%	0.322	12%	0.118	S	C	.	.	H	α-helix	trans	-56.3	-46.6	179	50.7	0	0	0	0	111.6	T365 I370 L371	T365-S367 PolarHBondContact O-N 2.98Å; T365-S367 PolarHBondContact OG1-OG 3.12Å; S367-I370 PolarHBondContact O-N 3.27Å; S367-L371 WeakPolarHBondContact O-CG 3.34Å; S367-L371 PolarHBondContact O-N 3.37Å; S367-L371 VanDerWaalsContact O-N 3.08Å
368	Q	95	Very high	93.6	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.019	12%	0.117	C	C	.	.	H	α-helix	trans	-76.5	-29.9	-176.6	-58.7	-64.2	-19.8	0	0	112.8	Y289 Y355 T365 Q366 I370 L371 F372	Y289-Q368 HydrophobicContact CG-CG 4.42Å; Y355-Q368 HydrophobicContact CE1-CB 3.92Å; Y355-Q368 HydrophobicContact CE2-CB 4.33Å; Y355-Q368 WeakPolarHBondContact OH-CB 2.95Å; Y355-Q368 VanDerWaalsContact OH-CG 3.29Å; Y355-Q368 WeakPolarHBondContact OH-CG 3.49Å; T365-Q368 PolarHBondContact O-N 3.39Å; T365-Q368 VanDerWaalsContact OG1-CB 3.27Å; T365-Q368 WeakPolarHBondContact OG1-CB 3.4Å; T365-Q368 WeakPolarHBondContact OG1-CG 3.38Å; T365-Q368 PolarHBondContact OG1-N 3.06Å; Q366-Q368 VanDerWaalsContact C-N 3.31Å; Q366-Q368 PolarHBondContact O-N 3.47Å; Q368-I370 VanDerWaalsContact C-N 3.34Å; Q368-L371 PolarHBondContact O-N 2.94Å; Q368-F372 WeakPolarHBondContact O-CB 3.17Å; Q368-F372 PolarHBondContact O-N 3.17Å
369	C	95.5	Very high	93.8	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.014	12%	0.124	C	C	.	.	H	α-helix	trans	-57.8	-48.3	168.3	177.8	0	0	0	0	111.1	I338 Y364 T365 Q366 L371 F372 H373 C440	I338-C369 HydrophobicContact CD1-CB 4.27Å; Y364-C369 HydrophobicContact CD2-CB 4.29Å; Y364-C369 HydrophobicContact CE2-CB 3.49Å; Y364-C369 VanDerWaalsContact CE2-CB 3.49Å; T365-C369 WeakPolarHBondContact O-CB 3.34Å; T365-C369 PolarHBondContact O-N 2.95Å; Q366-C369 WeakPolarHBondContact O-CB 3.48Å; Q366-C369 PolarHBondContact O-N 2.02Å; C369-L371 PolarHBondContact O-N 3.28Å; C369-F372 PolarHBondContact O-N 3.33Å; C369-H373 PolarHBondContact O-CD2 2.63Å; C369-H373 PolarHBondContact O-N 2.87Å; C369-C440 HydrophobicContact CB-CB 3.7Å; C369-C440 WeakPolarHBondContact CB-SG 3.25Å; C369-C440 VanDerWaalsContact SG-CA 3.54Å; C369-C440 WeakPolarHBondContact SG-CB 3.33Å; C369-C440 CovalentContact SG-SG 2.05Å; C369-C440 PolarHBondContact SG-SG 3.45Å
370	I	95.2	Very high	94.2	Very high	18 Å²	18	27 Å²	27	9%	0.092	13%	0.134	C	C	.	.	H	α-helix	trans	-61.3	-48	179.9	-64.6	163.5	0	0	0	110.4	Q366 S367 Q368 F372 H373 Q374 K432 E436 C440	Q366-I370 HydrophobicContact CG-CD1 4.25Å; Q366-I370 WeakPolarHBondContact O-CG1 3.43Å; Q366-I370 PolarHBondContact O-N 3.08Å; Q366-I370 VanDerWaalsContact O-N 3.1Å; S367-I370 PolarHBondContact O-N 3.27Å; Q368-I370 VanDerWaalsContact C-N 3.34Å; I370-F372 VanDerWaalsContact C-N 3.35Å; I370-F372 PolarHBondContact O-N 3.32Å; I370-H373 PolarHBondContact O-N 3.47Å; I370-Q374 WeakPolarHBondContact O-CB 3.13Å; I370-Q374 PolarHBondContact O-N 3.22Å; I370-K432 HydrophobicContact CG2-CB 3.81Å; I370-K432 HydrophobicContact CG2-CD 4.41Å; I370-K432 HydrophobicContact CG2-CG 3.86Å; I370-E436 HydrophobicContact CD1-CB 3.92Å; I370-E436 HydrophobicContact CD1-CG 4.21Å; I370-C440 HydrophobicContact CG1-CB 3.66Å; I370-C440 PolarHBondContact N-SG 3.35Å; I370-C440 VanDerWaalsContact N-SG 3.42Å
371	L	95	Very high	94.5	Very high	32 Å²	32	31 Å²	31	17%	0.168	15%	0.151	C	C	.	.	H	α-helix	trans	-65.2	-36.9	179.1	-63.2	179	0	0	0	112.4	S367 Q368 C369 Q375 N389	S367-L371 WeakPolarHBondContact O-CG 3.34Å; S367-L371 PolarHBondContact O-N 3.37Å; S367-L371 VanDerWaalsContact O-N 3.08Å; Q368-L371 PolarHBondContact O-N 2.94Å; C369-L371 PolarHBondContact O-N 3.28Å; L371-Q375 VanDerWaalsContact O-CB 3.28Å; L371-Q375 WeakPolarHBondContact O-CB 3.35Å; L371-Q375 PolarHBondContact O-N 3.49Å; L371-N389 HydrophobicContact CB-CB 4.42Å; L371-N389 PolarHBondContact O-ND2 3.24Å
372	F	95.2	Very high	94.7	Very high	1 Å²	1	31.4 Å²	31.4	0%	0.004	15%	0.154	C	C	.	.	H	α-helix	trans	-69.4	-40.2	178.4	-171.8	-104.6	0	0	0	112.4	I338 Y355 Q368 C369 I370 Q375 K376 P390 P392	I338-F372 HydrophobicContact CD1-CB 4.17Å; I338-F372 HydrophobicContact CD1-CD1 3.67Å; I338-F372 HydrophobicContact CD1-CE1 4.39Å; I338-F372 HydrophobicContact CD1-CG 4.16Å; I338-F372 HydrophobicContact CG1-CD1 3.96Å; I338-F372 HydrophobicContact CG1-CE1 4.19Å; Y355-F372 HydrophobicContact CD2-CD2 4.27Å; Y355-F372 HydrophobicContact CG-CD2 4.47Å; Q368-F372 WeakPolarHBondContact O-CB 3.17Å; Q368-F372 PolarHBondContact O-N 3.17Å; C369-F372 PolarHBondContact O-N 3.33Å; I370-F372 VanDerWaalsContact C-N 3.35Å; I370-F372 PolarHBondContact O-N 3.32Å; F372-Q375 WeakPolarHBondContact O-CB 2.82Å; F372-Q375 PolarHBondContact O-N 3.37Å; F372-K376 HydrophobicContact CE1-CD 4.28Å; F372-K376 VanDerWaalsContact CE1-CE 3.46Å; F372-K376 PolarHBondContact O-N 3.45Å; F372-P390 HydrophobicContact CD2-CB 4.2Å; F372-P392 HydrophobicContact CE2-CB 3.96Å; F372-P392 HydrophobicContact CZ-CB 4.21Å
373	H	95	Very high	94.7	Very high	25 Å²	25	33 Å²	33	12%	0.116	17%	0.171	C	C	.	.	H	α-helix	trans	-67.3	-43.2	173.5	-84.7	-72.9	0	0	0	112.1	C369 I370 Q375 K376 D377 Y435 L439	C369-H373 PolarHBondContact O-CD2 2.63Å; C369-H373 PolarHBondContact O-N 2.87Å; I370-H373 PolarHBondContact O-N 3.47Å; H373-Q375 PolarHBondContact O-N 2.95Å; H373-K376 WeakPolarHBondContact O-CB 3.28Å; H373-K376 PolarHBondContact O-N 3.16Å; H373-K376 VanDerWaalsContact O-N 3.09Å; H373-D377 PolarHBondContact O-N 2.83Å; H373-D377 VanDerWaalsContact O-N 3.11Å; H373-Y435 HydrophobicContact CB-CD1 3.84Å; H373-Y435 HydrophobicContact CB-CD2 3.98Å; H373-Y435 HydrophobicContact CB-CE1 3.72Å; H373-Y435 HydrophobicContact CB-CE2 3.84Å; H373-Y435 HydrophobicContact CB-CG 3.99Å; H373-L439 WeakPolarHBondContact CE1-CD2 3.48Å; H373-L439 VanDerWaalsContact NE2-CD2 3.33Å; H373-L439 WeakPolarHBondContact NE2-CD2 3.4Å
374	Q	95.1	Very high	94.9	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-56.1	-40.7	170.8	-174.4	178.9	50.9	0	0	111.3	I370 K376 D377 I378 N389 P426 K432	I370-Q374 WeakPolarHBondContact O-CB 3.13Å; I370-Q374 PolarHBondContact O-N 3.22Å; Q374-K376 PolarHBondContact O-N 3.09Å; Q374-D377 PolarHBondContact O-N 3.07Å; Q374-I378 HydrophobicContact CG-CD1 4.12Å; Q374-I378 VanDerWaalsContact O-CG1 3.26Å; Q374-I378 WeakPolarHBondContact O-CG1 3.25Å; Q374-I378 PolarHBondContact O-N 3.23Å; Q374-N389 PolarHBondContact OE1-ND2 2.84Å; Q374-P426 WeakPolarHBondContact CG-O 3.46Å; Q374-P426 PolarHBondContact NE2-O 3.48Å; Q374-K432 VanDerWaalsContact CD-CE 3.46Å; Q374-K432 VanDerWaalsContact NE2-CE 3.26Å
375	Q	95.7	Very high	95	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-38.2	176.7	-178.3	54.8	28.3	0	0	112.9	L371 F372 H373 D377 I378 I379 Y386 N389 P390	L371-Q375 VanDerWaalsContact O-CB 3.28Å; L371-Q375 WeakPolarHBondContact O-CB 3.35Å; L371-Q375 PolarHBondContact O-N 3.49Å; F372-Q375 WeakPolarHBondContact O-CB 2.82Å; F372-Q375 PolarHBondContact O-N 3.37Å; H373-Q375 PolarHBondContact O-N 2.95Å; Q375-D377 VanDerWaalsContact C-N 3.32Å; Q375-D377 PolarHBondContact O-N 3.48Å; Q375-I378 PolarHBondContact O-N 3.05Å; Q375-I379 HydrophobicContact CG-CD1 4.18Å; Q375-I379 VanDerWaalsContact O-CG1 3.25Å; Q375-I379 WeakPolarHBondContact O-CG1 3.43Å; Q375-I379 PolarHBondContact O-N 3.31Å; Q375-Y386 VanDerWaalsContact OE1-N 3.16Å; Q375-Y386 PolarHBondContact OE1-O 2.89Å; Q375-N389 HydrophobicContact CB-CB 3.82Å; Q375-N389 HydrophobicContact CG-CB 4.2Å; Q375-P390 WeakPolarHBondContact CG-O 3.47Å
376	K	94.5	Very high	95.1	Very high	58 Å²	58	33.8 Å²	33.8	25%	0.252	17%	0.172	S	C	.	.	H	α-helix	trans	-60.9	-42	173.2	-75.5	-178.2	166.7	-177.6	0	111.5	I338 D340 F372 H373 Q374 I379 K380	I338-K376 PolarHBondContact O-NZ 3.44Å; D340-K376 IonicContact OD2-NZ 3.3Å; F372-K376 HydrophobicContact CE1-CD 4.28Å; F372-K376 VanDerWaalsContact CE1-CE 3.46Å; F372-K376 PolarHBondContact O-N 3.45Å; H373-K376 WeakPolarHBondContact O-CB 3.28Å; H373-K376 PolarHBondContact O-N 3.16Å; H373-K376 VanDerWaalsContact O-N 3.09Å; Q374-K376 PolarHBondContact O-N 3.09Å; K376-I379 PolarHBondContact O-N 3.06Å; K376-K380 WeakPolarHBondContact O-CB 3.36Å; K376-K380 PolarHBondContact O-N 3.33Å
377	D	94.3	Very high	95.1	Very high	32 Å²	32	32 Å²	32	17%	0.171	16%	0.164	C	C	.	.	H	α-helix	trans	-66.1	-44.2	176.3	-64.9	-21.7	0	0	0	111.6	H373 Q374 Q375 I379 K380 E381 P426 Y435	H373-D377 PolarHBondContact O-N 2.83Å; H373-D377 VanDerWaalsContact O-N 3.11Å; Q374-D377 PolarHBondContact O-N 3.07Å; Q375-D377 VanDerWaalsContact C-N 3.32Å; Q375-D377 PolarHBondContact O-N 3.48Å; D377-I379 VanDerWaalsContact C-N 3.33Å; D377-I379 PolarHBondContact O-N 2.86Å; D377-K380 PolarHBondContact O-N 2.67Å; D377-K380 VanDerWaalsContact O-N 3.14Å; D377-E381 WeakPolarHBondContact O-CB 3.47Å; D377-E381 WeakPolarHBondContact O-CG 3.29Å; D377-E381 PolarHBondContact O-N 2.89Å; D377-P426 HydrophobicContact CB-CB 4.41Å; D377-Y435 VanDerWaalsContact CG-OH 3.23Å; D377-Y435 PolarHBondContact OD1-OH 2.82Å; D377-Y435 WeakPolarHBondContact OD2-CE2 3.43Å; D377-Y435 PolarHBondContact OD2-OH 3.2Å
378	I	95.9	Very high	95.1	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57.5	-45.7	175.8	-67.2	168.9	0	0	0	111.1	Q374 Q375 K380 C382 G383 C384 Y386 L422 P426 L427	Q374-I378 HydrophobicContact CG-CD1 4.12Å; Q374-I378 VanDerWaalsContact O-CG1 3.26Å; Q374-I378 WeakPolarHBondContact O-CG1 3.25Å; Q374-I378 PolarHBondContact O-N 3.23Å; Q375-I378 PolarHBondContact O-N 3.05Å; I378-K380 VanDerWaalsContact C-N 3.32Å; I378-K380 PolarHBondContact O-N 2.65Å; I378-C382 HydrophobicContact CG2-CB 4.4Å; I378-C382 WeakPolarHBondContact O-CA 3.26Å; I378-C382 VanDerWaalsContact O-CB 3.27Å; I378-C382 WeakPolarHBondContact O-CB 3.44Å; I378-C382 PolarHBondContact O-N 2.76Å; I378-G383 PolarHBondContact O-N 3.45Å; I378-C384 WeakPolarHBondContact CG2-O 3.35Å; I378-Y386 HydrophobicContact CD1-CD1 4.39Å; I378-Y386 HydrophobicContact CD1-CG 4.19Å; I378-L422 HydrophobicContact CB-CD2 4.42Å; I378-L422 HydrophobicContact CD1-CD2 4.09Å; I378-L422 HydrophobicContact CG1-CD2 4.03Å; I378-L422 HydrophobicContact CG2-CD2 3.51Å; I378-P426 HydrophobicContact CG1-CB 3.6Å; I378-P426 HydrophobicContact CG1-CG 3.68Å; I378-L427 HydrophobicContact CD1-CD2 3.76Å
379	I	95.7	Very high	95.1	Very high	41 Å²	41	35 Å²	35	21%	0.21	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-44	177.8	-69.9	170.4	0	0	0	110.5	Q375 K376 D377 G383 Q385 P392 L399	Q375-I379 HydrophobicContact CG-CD1 4.18Å; Q375-I379 VanDerWaalsContact O-CG1 3.25Å; Q375-I379 WeakPolarHBondContact O-CG1 3.43Å; Q375-I379 PolarHBondContact O-N 3.31Å; K376-I379 PolarHBondContact O-N 3.06Å; D377-I379 VanDerWaalsContact C-N 3.33Å; D377-I379 PolarHBondContact O-N 2.86Å; I379-G383 VanDerWaalsContact O-CA 3.25Å; I379-G383 WeakPolarHBondContact O-CA 3.32Å; I379-G383 PolarHBondContact O-N 3.07Å; I379-Q385 HydrophobicContact CD1-CG 4.14Å; I379-Q385 HydrophobicContact CG1-CG 4.08Å; I379-P392 HydrophobicContact CD1-CG 3.55Å; I379-L399 HydrophobicContact CB-CD1 4.4Å; I379-L399 HydrophobicContact CD1-CD2 4.21Å; I379-L399 HydrophobicContact CG1-CD1 4.24Å; I379-L399 HydrophobicContact CG1-CD2 4.33Å; I379-L399 HydrophobicContact CG2-CD1 3.75Å; I379-L399 HydrophobicContact CG2-CD2 4.01Å
380	K	95.2	Very high	95.1	Very high	173 Å²	173	34.9 Å²	34.9	75%	0.752	17%	0.168	S	C	*	.	H	α-helix	trans	-69.3	-42.6	-177	-177.4	-177.1	173.8	-169.9	0	112.8	K376 D377 I378	K376-K380 WeakPolarHBondContact O-CB 3.36Å; K376-K380 PolarHBondContact O-N 3.33Å; D377-K380 PolarHBondContact O-N 2.67Å; D377-K380 VanDerWaalsContact O-N 3.14Å; I378-K380 VanDerWaalsContact C-N 3.32Å; I378-K380 PolarHBondContact O-N 2.65Å
381	E	94.8	Very high	95.1	Very high	116 Å²	116	34.1 Å²	34.1	54%	0.542	16%	0.164	S	C	.	.	H	α-helix	trans	-89	-42.1	-173.9	-65.7	-179.7	-172.4	0	0	112.4	D377	D377-E381 WeakPolarHBondContact O-CB 3.47Å; D377-E381 WeakPolarHBondContact O-CG 3.29Å; D377-E381 PolarHBondContact O-N 2.89Å
382	C	95	Very high	95	Very high	18 Å²	18	33.9 Å²	33.9	12%	0.122	16%	0.164	C	C	.	.	H	α-helix	trans	-103.4	-12.2	-173.3	-52	0	0	0	0	113.9	I378 C384 C421	I378-C382 HydrophobicContact CG2-CB 4.4Å; I378-C382 WeakPolarHBondContact O-CA 3.26Å; I378-C382 VanDerWaalsContact O-CB 3.27Å; I378-C382 WeakPolarHBondContact O-CB 3.44Å; I378-C382 PolarHBondContact O-N 2.76Å; C382-C384 VanDerWaalsContact C-N 3.27Å; C382-C384 PolarHBondContact O-N 2.92Å; C382-C421 WeakPolarHBondContact CA-SG 3.48Å; C382-C421 HydrophobicContact CB-CB 3.78Å; C382-C421 WeakPolarHBondContact CB-SG 3.36Å; C382-C421 VanDerWaalsContact SG-C 3.56Å; C382-C421 WeakPolarHBondContact SG-CB 3.32Å; C382-C421 CovalentContact SG-SG 2.04Å; C382-C421 PolarHBondContact SG-SG 3.29Å
383	G	94	Very high	94.9	Very high	36 Å²	36	38 Å²	38	37%	0.371	18%	0.184	S	C	.	.	S	Bend	trans	66.2	25.8	178.2	0	0	0	0	0	114	I378 I379	I378-G383 PolarHBondContact O-N 3.45Å; I379-G383 VanDerWaalsContact O-CA 3.25Å; I379-G383 WeakPolarHBondContact O-CA 3.32Å; I379-G383 PolarHBondContact O-N 3.07Å
384	C	95.1	Very high	94.8	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	-143.7	167.4	-179.3	66.3	0	0	0	0	111.7	I378 C382 P400 C402 R418	I378-C384 WeakPolarHBondContact CG2-O 3.35Å; C382-C384 VanDerWaalsContact C-N 3.27Å; C382-C384 PolarHBondContact O-N 2.92Å; C384-P400 CarbonylContact C-O 3.49Å; C384-P400 VanDerWaalsContact CA-O 3.3Å; C384-P400 WeakPolarHBondContact CA-O 3.23Å; C384-C402 VanDerWaalsContact C-SG 3.54Å; C384-C402 HydrophobicContact CB-CB 3.88Å; C384-C402 WeakPolarHBondContact CB-SG 3.45Å; C384-C402 VanDerWaalsContact SG-CA 3.52Å; C384-C402 WeakPolarHBondContact SG-CB 3.46Å; C384-C402 CovalentContact SG-SG 2.04Å; C384-C402 PolarHBondContact SG-SG 2.99Å; C384-R418 HydrophobicContact CB-CG 4.48Å
385	Q	95.9	Very high	94.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-103.6	126.2	175.5	-61.4	-171.4	81.8	0	0	112.4	I379 Q393 L399 P400 Y401 C402	I379-Q385 HydrophobicContact CD1-CG 4.14Å; I379-Q385 HydrophobicContact CG1-CG 4.08Å; Q385-Q393 PolarHBondContact NE2-O 3.3Å; Q385-Q393 PolarHBondContact OE1-O 3.36Å; Q385-L399 HydrophobicContact CG-CD1 4.32Å; Q385-L399 HydrophobicContact CG-CD2 3.9Å; Q385-L399 HydrophobicContact CG-CG 3.85Å; Q385-P400 PolarHBondContact N-O 2.82Å; Q385-Y401 HydrophobicContact CB-CD1 3.88Å; Q385-Y401 HydrophobicContact CB-CE1 4.23Å; Q385-Y401 WeakPolarHBondContact O-CA 3.21Å; Q385-C402 PolarHBondContact O-N 2.81Å; Q385-C402 PolarHBondContact O-SG 2.88Å; Q385-C402 VanDerWaalsContact O-SG 3.4Å
386	Y	95.9	Very high	94.5	Very high	61 Å²	61	45.5 Å²	45.5	24%	0.239	22%	0.222	C	C	.	.			trans	-83.8	125	176.5	-172.5	-118.7	0	0	0	109.9	Q375 I378 Y388 N389 L422 L427	Q375-Y386 VanDerWaalsContact OE1-N 3.16Å; Q375-Y386 PolarHBondContact OE1-O 2.89Å; I378-Y386 HydrophobicContact CD1-CD1 4.39Å; I378-Y386 HydrophobicContact CD1-CG 4.19Å; Y386-Y388 VanDerWaalsContact C-N 3.3Å; Y386-Y388 AromaticContact CE1-CD2 3.75Å; Y386-Y388 HydrophobicContact CE1-CD2 3.75Å; Y386-Y388 HydrophobicContact CE1-CG 4.14Å; Y386-Y388 HydrophobicContact CE2-CD2 4.09Å; Y386-Y388 AromaticContact CZ-CD2 3.48Å; Y386-Y388 VanDerWaalsContact CZ-CD2 3.48Å; Y386-Y388 PolarHBondContact O-N 2.82Å; Y386-Y388 WeakPolarHBondContact OH-CD2 3.47Å; Y386-N389 PolarHBondContact O-N 3.35Å; Y386-L422 HydrophobicContact CD2-CD1 4.05Å; Y386-L422 HydrophobicContact CD2-CD2 4.44Å; Y386-L422 HydrophobicContact CE2-CD1 4.45Å; Y386-L427 HydrophobicContact CD1-CD2 3.99Å; Y386-L427 HydrophobicContact CE1-CD1 4.47Å; Y386-L427 HydrophobicContact CE1-CD2 3.94Å; Y386-L427 HydrophobicContact CE2-CD1 4.13Å; Y386-L427 HydrophobicContact CG-CD2 4.44Å
387	I	94.8	Very high	94.2	Very high	6 Å²	6	47 Å²	47	3%	0.031	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-24.8	-163.2	-166.8	62.1	0	0	0	114.4	Y178 Q179 H227 N389 Y401	Y178-I387 HydrophobicContact CD1-CD1 3.87Å; Y178-I387 HydrophobicContact CE1-CD1 3.72Å; Q179-I387 HydrophobicContact CG-CB 4.15Å; Q179-I387 HydrophobicContact CG-CD1 4.03Å; Q179-I387 HydrophobicContact CG-CG1 3.97Å; H227-I387 HydrophobicContact CB-CD1 3.96Å; H227-I387 HydrophobicContact CB-CG1 3.35Å; I387-N389 VanDerWaalsContact C-N 3.34Å; I387-Y401 HydrophobicContact CD1-CD1 3.88Å; I387-Y401 HydrophobicContact CD1-CE1 3.66Å; I387-Y401 HydrophobicContact CD1-CE2 4.32Å; I387-Y401 HydrophobicContact CD1-CG 4.36Å
388	Y	93.8	Very high	93.9	Very high	110 Å²	110	52.3 Å²	52.3	43%	0.431	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-10.8	179.8	-66.9	-86.9	0	0	0	113.6	H227 Y386	H227-Y388 AromaticContact CE1-CE1 3.39Å; H227-Y388 WeakPolarHBondContact CE1-CE1 3.21Å; H227-Y388 AromaticContact CE1-CZ 3.73Å; H227-Y388 AromaticContact NE2-CD1 3.35Å; H227-Y388 WeakPolarHBondContact NE2-CD1 3.28Å; H227-Y388 AromaticContact NE2-CE1 3.21Å; H227-Y388 WeakPolarHBondContact NE2-CE1 3.46Å; H227-Y388 AromaticContact NE2-CZ 3.85Å; Y386-Y388 VanDerWaalsContact C-N 3.3Å; Y386-Y388 AromaticContact CE1-CD2 3.75Å; Y386-Y388 HydrophobicContact CE1-CD2 3.75Å; Y386-Y388 HydrophobicContact CE1-CG 4.14Å; Y386-Y388 HydrophobicContact CE2-CD2 4.09Å; Y386-Y388 AromaticContact CZ-CD2 3.48Å; Y386-Y388 VanDerWaalsContact CZ-CD2 3.48Å; Y386-Y388 PolarHBondContact O-N 2.82Å; Y386-Y388 WeakPolarHBondContact OH-CD2 3.47Å
389	N	95.2	Very high	93.8	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.016	27%	0.273	C	S	.	.	S	Bend	trans	-99.5	156	177.2	-67.5	-0.1	0	0	0	110.5	L371 Q374 Q375 Y386 I387 R391	L371-N389 HydrophobicContact CB-CB 4.42Å; L371-N389 PolarHBondContact O-ND2 3.24Å; Q374-N389 PolarHBondContact OE1-ND2 2.84Å; Q375-N389 HydrophobicContact CB-CB 3.82Å; Q375-N389 HydrophobicContact CG-CB 4.2Å; Y386-N389 PolarHBondContact O-N 3.35Å; I387-N389 VanDerWaalsContact C-N 3.34Å; N389-R391 PolarHBondContact O-N 2.83Å
390	P	95.5	Very high	93.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.265	C	S	.	.			trans	-59.6	128.5	175.3	-23.1	33.4	0	0	0	111.9	Y355 D357 F372 Q375 P392	Y355-P390 HydrophobicContact CD2-CB 4.07Å; Y355-P390 HydrophobicContact CE2-CB 3.92Å; Y355-P390 HydrophobicContact CE2-CG 4.03Å; D357-P390 HydrophobicContact CB-CB 4.18Å; F372-P390 HydrophobicContact CD2-CB 4.2Å; Q375-P390 WeakPolarHBondContact CG-O 3.47Å; P390-P392 WeakPolarHBondContact O-CD 3.41Å
391	R	95.1	Very high	93.7	Very high	3 Å²	3	43.4 Å²	43.4	1%	0.011	23%	0.23	C	C	.	.			trans	-95	109.7	-170.4	-61	151.7	-66.6	-171.5	-1.2	110.3	Y178 S225 D357 L358 N389 Q393 Y401	Y178-R391 PolarHBondContact OH-NH1 2.77Å; S225-R391 PolarHBondContact O-NH2 3.5Å; D357-R391 CarbonylContact C-O 2.98Å; D357-R391 VanDerWaalsContact CA-O 3.31Å; D357-R391 WeakPolarHBondContact CA-O 3.5Å; D357-R391 WeakPolarHBondContact OD1-CA 3.13Å; D357-R391 VanDerWaalsContact OD1-CB 3.26Å; D357-R391 WeakPolarHBondContact OD1-CB 3.24Å; D357-R391 IonicContact OD1-CZ 3.87Å; D357-R391 PolarHBondContact OD1-N 3.06Å; D357-R391 IonicContact OD1-NE 3.92Å; D357-R391 PolarHBondContact OD1-NE 2.81Å; D357-R391 IonicContact OD1-NH2 2.65Å; D357-R391 PolarHBondContact OD1-NH2 3.15Å; D357-R391 IonicContact OD2-CZ 3.15Å; D357-R391 IonicContact OD2-NE 3.57Å; D357-R391 IonicContact OD2-NH2 3.72Å; D357-R391 PolarHBondContact OD2-NH2 3.2Å; L358-R391 HydrophobicContact CD2-CB 3.77Å; L358-R391 HydrophobicContact CG-CB 4.19Å; L358-R391 PolarHBondContact N-O 3.43Å; N389-R391 PolarHBondContact O-N 2.83Å; R391-Q393 PolarHBondContact O-N 2.55Å; R391-Q393 VanDerWaalsContact O-N 3.1Å; R391-Y401 VanDerWaalsContact CD-CE1 3.49Å; R391-Y401 WeakPolarHBondContact CD-OH 3.5Å; R391-Y401 HydrophobicContact CG-CE1 4.08Å
392	P	93.2	Very high	93.6	Very high	27 Å²	27	38.1 Å²	38.1	18%	0.175	21%	0.206	C	C	.	.	S	Bend	trans	-62.9	-22.8	-174.9	23.8	-34	0	0	0	113.8	F372 I379 P390	F372-P392 HydrophobicContact CE2-CB 3.96Å; F372-P392 HydrophobicContact CZ-CB 4.21Å; I379-P392 HydrophobicContact CD1-CG 3.55Å; P390-P392 WeakPolarHBondContact O-CD 3.41Å
393	Q	92.7	Very high	93.4	Very high	87 Å²	87	37.4 Å²	37.4	41%	0.407	20%	0.201	S	C	.	.	S	Bend	trans	-148.6	161.1	-179.8	60.8	179.3	69	0	0	111.7	Q385 R391 L399	Q385-Q393 PolarHBondContact NE2-O 3.3Å; Q385-Q393 PolarHBondContact OE1-O 3.36Å; R391-Q393 PolarHBondContact O-N 2.55Å; R391-Q393 VanDerWaalsContact O-N 3.1Å; Q393-L399 HydrophobicContact CG-CD2 3.94Å
394	Y	93.8	Very high	93.3	Very high	110 Å²	110	36.2 Å²	36.2	43%	0.431	19%	0.187	S	C	.	.			trans	-60.2	145.3	170.5	-69.2	-69.7	0	0	0	111.5	A183 L358 N359	A183-Y394 HydrophobicContact CB-CD1 3.53Å; A183-Y394 HydrophobicContact CB-CE1 4.08Å; A183-Y394 HydrophobicContact CB-CG 4.4Å; L358-Y394 HydrophobicContact CB-CD1 4.25Å; L358-Y394 HydrophobicContact CB-CE1 3.76Å; L358-Y394 HydrophobicContact CD1-CD1 4.47Å; L358-Y394 HydrophobicContact CD1-CE1 4.29Å; L358-Y394 HydrophobicContact CD2-CD1 3.73Å; L358-Y394 HydrophobicContact CD2-CE1 4.13Å; L358-Y394 HydrophobicContact CD2-CG 4.37Å; L358-Y394 HydrophobicContact CG-CD1 4.38Å; L358-Y394 HydrophobicContact CG-CE1 4.29Å; L358-Y394 PolarHBondContact O-OH 2.84Å; L358-Y394 VanDerWaalsContact O-OH 3.08Å; N359-Y394 HydrophobicContact CB-CE2 4.39Å; N359-Y394 VanDerWaalsContact ND2-CE2 3.29Å; N359-Y394 WeakPolarHBondContact ND2-CE2 3.3Å
395	P	93.1	Very high	92.8	Very high	29 Å²	29	36.8 Å²	36.8	19%	0.188	19%	0.19	C	C	.	.			trans	-61.4	145.3	174.4	30.8	-39.2	0	0	0	110.3	A183 L399 Y401	A183-P395 HydrophobicContact CB-CG 4.44Å; P395-L399 WeakPolarHBondContact CA-O 3.25Å; P395-Y401 HydrophobicContact CB-CD2 3.94Å; P395-Y401 HydrophobicContact CB-CE1 4.45Å; P395-Y401 HydrophobicContact CB-CE2 3.79Å; P395-Y401 HydrophobicContact CB-CG 4.42Å; P395-Y401 HydrophobicContact CG-CD2 4.1Å; P395-Y401 HydrophobicContact CG-CE2 3.47Å; P395-Y401 VanDerWaalsContact CG-CE2 3.47Å
396	S	91.3	Very high	91.8	Very high	45 Å²	45	39.2 Å²	39.2	32%	0.315	20%	0.203	S	C	.	.	B	Isolated β-bridge	trans	-143.5	169	175.4	64.9	0	0	0	0	109.3	N398 L399 P400	S396-N398 PolarHBondContact O-N 2.89Å; S396-N398 VanDerWaalsContact O-N 3.07Å; S396-L399 PolarHBondContact N-O 2.91Å; S396-L399 VanDerWaalsContact N-O 3.12Å; S396-L399 CarbonylContact O-C 3.59Å; S396-L399 PolarHBondContact O-N 2.87Å; S396-L399 PolarHBondContact OG-N 2.73Å; S396-P400 WeakPolarHBondContact O-CA 3.38Å
397	S	87	Confident	90.4	Very high	91 Å²	91	41.8 Å²	41.8	64%	0.636	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-30.9	176.8	58.7	0	0	0	0	113.8
398	N	89.4	Confident	88.8	Confident	143 Å²	143	44.6 Å²	44.6	77%	0.765	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-20.4	179.2	-64.6	-13.2	0	0	0	113.1	S396	S396-N398 PolarHBondContact O-N 2.89Å; S396-N398 VanDerWaalsContact O-N 3.07Å
399	L	92.9	Very high	87.2	Confident	18 Å²	18	47.1 Å²	47.1	9%	0.094	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-143.3	73.1	179.1	-171.9	65.9	0	0	0	109.4	I379 Q385 Q393 P395 S396	I379-L399 HydrophobicContact CB-CD1 4.4Å; I379-L399 HydrophobicContact CD1-CD2 4.21Å; I379-L399 HydrophobicContact CG1-CD1 4.24Å; I379-L399 HydrophobicContact CG1-CD2 4.33Å; I379-L399 HydrophobicContact CG2-CD1 3.75Å; I379-L399 HydrophobicContact CG2-CD2 4.01Å; Q385-L399 HydrophobicContact CG-CD1 4.32Å; Q385-L399 HydrophobicContact CG-CD2 3.9Å; Q385-L399 HydrophobicContact CG-CG 3.85Å; Q393-L399 HydrophobicContact CG-CD2 3.94Å; P395-L399 WeakPolarHBondContact CA-O 3.25Å; S396-L399 PolarHBondContact N-O 2.91Å; S396-L399 VanDerWaalsContact N-O 3.12Å; S396-L399 CarbonylContact O-C 3.59Å; S396-L399 PolarHBondContact O-N 2.87Å; S396-L399 PolarHBondContact OG-N 2.73Å
400	P	93.3	Very high	86	Confident	6 Å²	6	49.3 Å²	49.3	4%	0.039	28%	0.278	C	S	.	.			trans	-77.6	172.9	-178.5	33.4	-36.4	0	0	0	110.2	C384 Q385 S396	C384-P400 CarbonylContact C-O 3.49Å; C384-P400 VanDerWaalsContact CA-O 3.3Å; C384-P400 WeakPolarHBondContact CA-O 3.23Å; Q385-P400 PolarHBondContact N-O 2.82Å; S396-P400 WeakPolarHBondContact O-CA 3.38Å
401	Y	94.9	Very high	85	Confident	3 Å²	3	53.7 Å²	53.7	1%	0.012	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-66	150.4	163.4	-67.2	-58	0	0	0	110.9	Y178 Q179 Q385 I387 R391 P395 G403 S404	Y178-Y401 HydrophobicContact CD1-CE2 4.47Å; Y178-Y401 HydrophobicContact CE1-CE2 4.07Å; Q179-Y401 HydrophobicContact CB-CD2 3.99Å; Q179-Y401 HydrophobicContact CB-CG 4.16Å; Q179-Y401 HydrophobicContact CG-CD2 3.97Å; Q179-Y401 HydrophobicContact CG-CG 3.85Å; Q385-Y401 HydrophobicContact CB-CD1 3.88Å; Q385-Y401 HydrophobicContact CB-CE1 4.23Å; Q385-Y401 WeakPolarHBondContact O-CA 3.21Å; I387-Y401 HydrophobicContact CD1-CD1 3.88Å; I387-Y401 HydrophobicContact CD1-CE1 3.66Å; I387-Y401 HydrophobicContact CD1-CE2 4.32Å; I387-Y401 HydrophobicContact CD1-CG 4.36Å; R391-Y401 VanDerWaalsContact CD-CE1 3.49Å; R391-Y401 WeakPolarHBondContact CD-OH 3.5Å; R391-Y401 HydrophobicContact CG-CE1 4.08Å; P395-Y401 HydrophobicContact CB-CD2 3.94Å; P395-Y401 HydrophobicContact CB-CE1 4.45Å; P395-Y401 HydrophobicContact CB-CE2 3.79Å; P395-Y401 HydrophobicContact CB-CG 4.42Å; P395-Y401 HydrophobicContact CG-CD2 4.1Å; P395-Y401 HydrophobicContact CG-CE2 3.47Å; P395-Y401 VanDerWaalsContact CG-CE2 3.47Å; Y401-G403 PolarHBondContact O-N 3.36Å; Y401-S404 VanDerWaalsContact O-CB 3.24Å; Y401-S404 WeakPolarHBondContact O-CB 3.37Å; Y401-S404 PolarHBondContact O-N 2.79Å
402	C	93.9	Very high	84.2	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.034	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-30.9	-178	-61.6	0	0	0	0	112.8	C384 Q385 L422	C384-C402 VanDerWaalsContact C-SG 3.54Å; C384-C402 HydrophobicContact CB-CB 3.88Å; C384-C402 WeakPolarHBondContact CB-SG 3.45Å; C384-C402 VanDerWaalsContact SG-CA 3.52Å; C384-C402 WeakPolarHBondContact SG-CB 3.46Å; C384-C402 CovalentContact SG-SG 2.04Å; C384-C402 PolarHBondContact SG-SG 2.99Å; Q385-C402 PolarHBondContact O-N 2.81Å; Q385-C402 PolarHBondContact O-SG 2.88Å; Q385-C402 VanDerWaalsContact O-SG 3.4Å; C402-L422 HydrophobicContact CB-CD1 3.71Å
403	G	91.4	Very high	83.6	Confident	3 Å²	3	61.5 Å²	61.5	3%	0.031	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	16.3	172.9	0	0	0	0	0	114.8	Q179 N180 Y401 I405	Q179-G403 VanDerWaalsContact OE1-CA 3.27Å; N180-G403 PolarHBondContact ND2-O 2.81Å; N180-G403 VanDerWaalsContact ND2-O 3.15Å; Y401-G403 PolarHBondContact O-N 3.36Å; G403-I405 WeakPolarHBondContact O-CG1 3.36Å
404	S	90.7	Very high	83.2	Confident	10 Å²	10	58.7 Å²	58.7	7%	0.07	33%	0.332	C	S	.	.			trans	-79.4	131.7	173.1	-173.5	0	0	0	0	110.9	Y401 R418	Y401-S404 VanDerWaalsContact O-CB 3.24Å; Y401-S404 WeakPolarHBondContact O-CB 3.37Å; Y401-S404 PolarHBondContact O-N 2.79Å; S404-R418 PolarHBondContact O-NH1 2.77Å
405	I	84.9	Confident	82.9	Confident	12 Å²	12	53.9 Å²	53.9	6%	0.062	31%	0.314	C	S	.	.			trans	-134	-29.8	-168.5	-49.6	175.6	0	0	0	112.8	M149 Y171 I176 N180 G403 E407 F410 L415	M149-I405 HydrophobicContact CE-CD1 4.22Å; M149-I405 HydrophobicContact SD-CD1 4.32Å; Y171-I405 HydrophobicContact CD1-CD1 3.4Å; Y171-I405 HydrophobicContact CD1-CG1 4.38Å; Y171-I405 HydrophobicContact CE1-CD1 3.93Å; Y171-I405 HydrophobicContact CG-CD1 4.32Å; I176-I405 HydrophobicContact CG2-CD1 4.3Å; N180-I405 PolarHBondContact OD1-N 2.88Å; G403-I405 WeakPolarHBondContact O-CG1 3.36Å; I405-E407 PolarHBondContact O-N 3.13Å; I405-F410 HydrophobicContact CG2-CD2 3.1Å; I405-F410 HydrophobicContact CG2-CE2 3.03Å; I405-F410 HydrophobicContact CG2-CG 4.44Å; I405-F410 HydrophobicContact CG2-CZ 4.33Å; I405-L415 HydrophobicContact CD1-CD2 3.86Å; I405-L415 HydrophobicContact CG1-CD1 4.21Å; I405-L415 HydrophobicContact CG1-CD2 4Å
406	L	75.6	Confident	82.5	Confident	52 Å²	52	54.8 Å²	54.8	27%	0.272	32%	0.324	S	S	.	.			trans	-88.3	0.7	-172	-64.5	177.9	0	0	0	114.5	M140 F145 H148 N180 G408	M140-L406 HydrophobicContact CE-CD1 3.58Å; M140-L406 HydrophobicContact SD-CD1 3.76Å; F145-L406 HydrophobicContact CD2-CD1 3.62Å; F145-L406 HydrophobicContact CE2-CD1 3.83Å; H148-L406 VanDerWaalsContact CD2-CD2 3.41Å; H148-L406 WeakPolarHBondContact CD2-CD2 3.43Å; H148-L406 WeakPolarHBondContact NE2-CD2 3.27Å; N180-L406 HydrophobicContact CB-CD1 4.05Å; N180-L406 HydrophobicContact CB-CG 4.39Å; N180-L406 PolarHBondContact OD1-N 2.91Å; L406-G408 PolarHBondContact O-N 2.91Å
407	E	65.3	Low	82.3	Confident	114 Å²	114	60 Å²	60	53%	0.533	34%	0.341	S	S	.	.	S	Bend	trans	-81.6	97.5	174	-73.7	-167.6	161.8	0	0	110.9	I405	I405-E407 PolarHBondContact O-N 3.13Å
408	G	61.8	Low	82.5	Confident	66 Å²	66	58.4 Å²	58.4	68%	0.68	32%	0.321	S	S	*	.	S	Bend	trans	97	-161.3	175.6	0	0	0	0	0	113.6	L406 F410	L406-G408 PolarHBondContact O-N 2.91Å; G408-F410 PolarHBondContact O-N 2.81Å
409	D	60.6	Low	82.4	Confident	162 Å²	162	53.8 Å²	53.8	87%	0.866	30%	0.296	S	S	*	.	S	Bend	trans	-64.5	126.3	168.8	-76.8	-29.3	0	0	0	108.2	D411	D409-D411 PolarHBondContact O-N 2.94Å
410	F	70	Confident	82.3	Confident	50 Å²	50	59.3 Å²	59.3	22%	0.219	32%	0.321	C	S	.	.			trans	-54.1	99.4	-179.5	174.5	-108	0	0	0	110.7	L152 F156 L168 I405 G408 I412	L152-F410 HydrophobicContact CB-CZ 4.42Å; L152-F410 HydrophobicContact CD1-CD1 4.45Å; L152-F410 HydrophobicContact CD1-CD2 3.81Å; L152-F410 HydrophobicContact CD1-CE1 4.02Å; L152-F410 HydrophobicContact CD1-CE2 3.37Å; L152-F410 HydrophobicContact CD1-CG 4.36Å; L152-F410 HydrophobicContact CD1-CZ 3.54Å; L152-F410 HydrophobicContact CD2-CD1 3.69Å; L152-F410 HydrophobicContact CD2-CD2 4.45Å; L152-F410 HydrophobicContact CD2-CE1 3.5Å; L152-F410 HydrophobicContact CD2-CE2 4.35Å; L152-F410 HydrophobicContact CD2-CG 4.18Å; L152-F410 HydrophobicContact CD2-CZ 3.93Å; L152-F410 HydrophobicContact CG-CE1 4.24Å; L152-F410 HydrophobicContact CG-CE2 4.41Å; L152-F410 HydrophobicContact CG-CZ 4.17Å; F156-F410 AromaticContact CE2-CE1 3.94Å; F156-F410 HydrophobicContact CE2-CE1 3.94Å; F156-F410 HydrophobicContact CE2-CZ 4.21Å; F156-F410 HydrophobicContact CZ-CE1 4.38Å; L168-F410 HydrophobicContact CD1-CZ 4.18Å; L168-F410 HydrophobicContact CD2-CE2 4.48Å; L168-F410 HydrophobicContact CD2-CZ 4.16Å; I405-F410 HydrophobicContact CG2-CD2 3.1Å; I405-F410 HydrophobicContact CG2-CE2 3.03Å; I405-F410 HydrophobicContact CG2-CG 4.44Å; I405-F410 HydrophobicContact CG2-CZ 4.33Å; G408-F410 PolarHBondContact O-N 2.81Å; F410-I412 HydrophobicContact CD1-CD1 3.8Å; F410-I412 HydrophobicContact CD1-CG1 3.51Å; F410-I412 HydrophobicContact CE1-CB 4.4Å; F410-I412 HydrophobicContact CE1-CD1 3.39Å; F410-I412 HydrophobicContact CE1-CG1 2.96Å; F410-I412 HydrophobicContact CE2-CG1 4.41Å; F410-I412 HydrophobicContact CG-CG1 4.45Å; F410-I412 HydrophobicContact CZ-CD1 4.31Å; F410-I412 HydrophobicContact CZ-CG1 3.46Å; F410-I412 VanDerWaalsContact CZ-CG1 3.46Å
411	D	75.2	Confident	82.4	Confident	91 Å²	91	60.3 Å²	60.3	49%	0.487	33%	0.328	S	S	.	.			trans	-99.9	91	178.4	-171.7	-7.1	0	0	0	109.8	D409 L413 A414 L415	D409-D411 PolarHBondContact O-N 2.94Å; D411-L413 PolarHBondContact O-N 2.78Å; D411-L413 WeakPolarHBondContact OD1-CA 3.48Å; D411-L413 VanDerWaalsContact OD1-CB 3.22Å; D411-L413 WeakPolarHBondContact OD1-CB 3.45Å; D411-L413 PolarHBondContact OD1-N 2.69Å; D411-A414 HydrophobicContact CB-CB 3.85Å; D411-A414 WeakPolarHBondContact O-CB 3.48Å; D411-A414 PolarHBondContact O-N 3.21Å; D411-A414 VanDerWaalsContact O-N 3.12Å; D411-A414 PolarHBondContact OD1-N 2.84Å; D411-A414 VanDerWaalsContact OD1-N 3.08Å; D411-L415 PolarHBondContact O-N 2.86Å; D411-L415 VanDerWaalsContact O-N 3.09Å
412	I	78.1	Confident	82.3	Confident	58 Å²	58	60.8 Å²	60.8	30%	0.297	33%	0.331	S	S	.	.	H	α-helix	trans	-56.9	-38.6	176	-60.1	144.5	0	0	0	110.6	F156 F410 A414 L415 A416	F156-I412 HydrophobicContact CE1-CD1 3.85Å; F156-I412 HydrophobicContact CE1-CG1 4.46Å; F156-I412 HydrophobicContact CE1-CG2 4.22Å; F156-I412 HydrophobicContact CE2-CD1 3.77Å; F156-I412 HydrophobicContact CE2-CG1 4Å; F156-I412 HydrophobicContact CZ-CB 4.12Å; F156-I412 HydrophobicContact CZ-CD1 3.07Å; F156-I412 HydrophobicContact CZ-CG1 3.42Å; F156-I412 VanDerWaalsContact CZ-CG1 3.42Å; F156-I412 HydrophobicContact CZ-CG2 3.65Å; F410-I412 HydrophobicContact CD1-CD1 3.8Å; F410-I412 HydrophobicContact CD1-CG1 3.51Å; F410-I412 HydrophobicContact CE1-CB 4.4Å; F410-I412 HydrophobicContact CE1-CD1 3.39Å; F410-I412 HydrophobicContact CE1-CG1 2.96Å; F410-I412 HydrophobicContact CE2-CG1 4.41Å; F410-I412 HydrophobicContact CG-CG1 4.45Å; F410-I412 HydrophobicContact CZ-CD1 4.31Å; F410-I412 HydrophobicContact CZ-CG1 3.46Å; F410-I412 VanDerWaalsContact CZ-CG1 3.46Å; I412-A414 VanDerWaalsContact C-N 3.27Å; I412-A414 PolarHBondContact O-N 3.2Å; I412-L415 PolarHBondContact O-N 2.92Å; I412-A416 VanDerWaalsContact O-CB 3.32Å; I412-A416 WeakPolarHBondContact O-CB 3.49Å; I412-A416 PolarHBondContact O-N 2.96Å
413	L	79.8	Confident	82	Confident	136 Å²	136	65.5 Å²	65.5	71%	0.712	36%	0.359	S	S	*	.	H	α-helix	trans	-64.7	-39.7	-179	-168.7	81.4	0	0	0	109.5	D411 K417	D411-L413 PolarHBondContact O-N 2.78Å; D411-L413 WeakPolarHBondContact OD1-CA 3.48Å; D411-L413 VanDerWaalsContact OD1-CB 3.22Å; D411-L413 WeakPolarHBondContact OD1-CB 3.45Å; D411-L413 PolarHBondContact OD1-N 2.69Å; L413-K417 WeakPolarHBondContact O-CB 3.4Å; L413-K417 PolarHBondContact O-N 2.8Å
414	A	84.4	Confident	81.9	Confident	28 Å²	28	69.5 Å²	69.5	23%	0.231	39%	0.387	C	S	.	.	H	α-helix	trans	-63.5	-43.4	174	0	0	0	0	0	112.1	D411 I412 K417 R418	D411-A414 HydrophobicContact CB-CB 3.85Å; D411-A414 WeakPolarHBondContact O-CB 3.48Å; D411-A414 PolarHBondContact O-N 3.21Å; D411-A414 VanDerWaalsContact O-N 3.12Å; D411-A414 PolarHBondContact OD1-N 2.84Å; D411-A414 VanDerWaalsContact OD1-N 3.08Å; I412-A414 VanDerWaalsContact C-N 3.27Å; I412-A414 PolarHBondContact O-N 3.2Å; A414-K417 PolarHBondContact O-N 2.87Å; A414-R418 WeakPolarHBondContact O-CG 3.36Å; A414-R418 PolarHBondContact O-N 2.81Å; A414-R418 VanDerWaalsContact O-N 3.09Å
415	L	86.6	Confident	81.7	Confident	10 Å²	10	70 Å²	70	5%	0.052	39%	0.394	C	S	.	.	H	α-helix	trans	-61.8	-51.9	175.2	178.4	63.2	0	0	0	111.3	L168 Y171 I405 D411 I412 K417 R418 I419	L168-L415 HydrophobicContact CD2-CD2 4.29Å; Y171-L415 HydrophobicContact CE1-CD1 3.84Å; Y171-L415 HydrophobicContact CE1-CD2 4.07Å; Y171-L415 HydrophobicContact CE1-CG 4.5Å; I405-L415 HydrophobicContact CD1-CD2 3.86Å; I405-L415 HydrophobicContact CG1-CD1 4.21Å; I405-L415 HydrophobicContact CG1-CD2 4Å; D411-L415 PolarHBondContact O-N 2.86Å; D411-L415 VanDerWaalsContact O-N 3.09Å; I412-L415 PolarHBondContact O-N 2.92Å; L415-K417 VanDerWaalsContact C-N 3.27Å; L415-K417 PolarHBondContact O-N 3.14Å; L415-R418 PolarHBondContact O-N 2.85Å; L415-R418 VanDerWaalsContact O-N 3.07Å; L415-I419 HydrophobicContact CD1-CD1 4.16Å; L415-I419 HydrophobicContact CD1-CG1 4.32Å; L415-I419 HydrophobicContact CG-CD1 3.92Å; L415-I419 HydrophobicContact CG-CG1 4.49Å; L415-I419 WeakPolarHBondContact O-CG1 3.25Å; L415-I419 PolarHBondContact O-N 3.22Å
416	A	84.6	Confident	81.9	Confident	48 Å²	48	69.6 Å²	69.6	40%	0.397	39%	0.392	S	S	.	.	H	α-helix	trans	-57.2	-41.4	179	0	0	0	0	0	111.5	I412 R418 I419 Q420	I412-A416 VanDerWaalsContact O-CB 3.32Å; I412-A416 WeakPolarHBondContact O-CB 3.49Å; I412-A416 PolarHBondContact O-N 2.96Å; A416-R418 PolarHBondContact O-N 2.89Å; A416-I419 PolarHBondContact O-N 3.31Å; A416-Q420 VanDerWaalsContact O-CB 3.24Å; A416-Q420 WeakPolarHBondContact O-CB 3.5Å; A416-Q420 PolarHBondContact O-N 3.01Å
417	K	88.4	Confident	82.6	Confident	153 Å²	153	69.5 Å²	69.5	67%	0.665	39%	0.392	S	S	*	.	H	α-helix	trans	-62	-41.6	175.6	-174.3	-179.6	-179.5	-176.9	0	112.4	L413 A414 L415 C421	L413-K417 WeakPolarHBondContact O-CB 3.4Å; L413-K417 PolarHBondContact O-N 2.8Å; A414-K417 PolarHBondContact O-N 2.87Å; L415-K417 VanDerWaalsContact C-N 3.27Å; L415-K417 PolarHBondContact O-N 3.14Å; K417-C421 VanDerWaalsContact O-CB 3.3Å; K417-C421 WeakPolarHBondContact O-CB 3.47Å; K417-C421 PolarHBondContact O-N 3.29Å
418	R	90.2	Very high	83.8	Confident	58 Å²	58	67.9 Å²	67.9	22%	0.219	39%	0.387	C	S	.	.	H	α-helix	trans	-65.2	-46.6	176.1	-69.4	174	-164.9	162.9	7.4	111.1	C384 S404 A414 L415 A416 C421 L422	C384-R418 HydrophobicContact CB-CG 4.48Å; S404-R418 PolarHBondContact O-NH1 2.77Å; A414-R418 WeakPolarHBondContact O-CG 3.36Å; A414-R418 PolarHBondContact O-N 2.81Å; A414-R418 VanDerWaalsContact O-N 3.09Å; L415-R418 PolarHBondContact O-N 2.85Å; L415-R418 VanDerWaalsContact O-N 3.07Å; A416-R418 PolarHBondContact O-N 2.89Å; R418-C421 WeakPolarHBondContact O-CB 2.96Å; R418-C421 PolarHBondContact O-N 2.85Å; R418-L422 WeakPolarHBondContact O-CG 3.25Å; R418-L422 PolarHBondContact O-N 3.27Å
419	I	88.4	Confident	85	Confident	47 Å²	47	70.3 Å²	70.3	24%	0.241	39%	0.388	C	S	.	.	H	α-helix	trans	-60.3	-48.7	177.9	-62.7	168.3	0	0	0	110.4	T167 Y171 L415 A416 C421 L422 T423	T167-I419 HydrophobicContact CG2-CD1 4.18Å; Y171-I419 HydrophobicContact CE2-CD1 4.21Å; Y171-I419 WeakPolarHBondContact OH-CD1 2.94Å; Y171-I419 VanDerWaalsContact OH-CG1 3.29Å; Y171-I419 WeakPolarHBondContact OH-CG1 3.38Å; L415-I419 HydrophobicContact CD1-CD1 4.16Å; L415-I419 HydrophobicContact CD1-CG1 4.32Å; L415-I419 HydrophobicContact CG-CD1 3.92Å; L415-I419 HydrophobicContact CG-CG1 4.49Å; L415-I419 WeakPolarHBondContact O-CG1 3.25Å; L415-I419 PolarHBondContact O-N 3.22Å; A416-I419 PolarHBondContact O-N 3.31Å; I419-C421 VanDerWaalsContact C-N 3.3Å; I419-C421 PolarHBondContact O-N 3.14Å; I419-L422 WeakPolarHBondContact O-CB 3.13Å; I419-L422 PolarHBondContact O-N 3.43Å; I419-T423 HydrophobicContact CG2-CG2 4.43Å; I419-T423 PolarHBondContact O-N 3.31Å; I419-T423 PolarHBondContact O-OG1 3.31Å; I419-T423 VanDerWaalsContact O-OG1 3.13Å
420	Q	90.8	Very high	86.5	Confident	133 Å²	133	66.5 Å²	66.5	62%	0.621	37%	0.371	S	S	*	.	H	α-helix	trans	-60.4	-41.1	178.2	-174.2	-178.5	11.9	0	0	111.4	A416 T423 S424	A416-Q420 VanDerWaalsContact O-CB 3.24Å; A416-Q420 WeakPolarHBondContact O-CB 3.5Å; A416-Q420 PolarHBondContact O-N 3.01Å; Q420-T423 PolarHBondContact O-OG1 2.78Å; Q420-S424 WeakPolarHBondContact O-CB 3.43Å; Q420-S424 PolarHBondContact O-N 3.41Å; Q420-S424 PolarHBondContact O-OG 3.15Å
421	C	94.1	Very high	87.3	Confident	27 Å²	27	65.4 Å²	65.4	18%	0.182	37%	0.368	C	S	.	.	H	α-helix	trans	-60.2	-49	175.1	-178	0	0	0	0	111.2	C382 K417 R418 I419 T423 S424 G425 P426	C382-C421 WeakPolarHBondContact CA-SG 3.48Å; C382-C421 HydrophobicContact CB-CB 3.78Å; C382-C421 WeakPolarHBondContact CB-SG 3.36Å; C382-C421 VanDerWaalsContact SG-C 3.56Å; C382-C421 WeakPolarHBondContact SG-CB 3.32Å; C382-C421 CovalentContact SG-SG 2.04Å; C382-C421 PolarHBondContact SG-SG 3.29Å; K417-C421 VanDerWaalsContact O-CB 3.3Å; K417-C421 WeakPolarHBondContact O-CB 3.47Å; K417-C421 PolarHBondContact O-N 3.29Å; R418-C421 WeakPolarHBondContact O-CB 2.96Å; R418-C421 PolarHBondContact O-N 2.85Å; I419-C421 VanDerWaalsContact C-N 3.3Å; I419-C421 PolarHBondContact O-N 3.14Å; C421-T423 PolarHBondContact O-N 2.9Å; C421-S424 PolarHBondContact O-N 3.1Å; C421-S424 PolarHBondContact O-OG 3.15Å; C421-G425 PolarHBondContact O-N 2.84Å; C421-P426 VanDerWaalsContact O-CD 3.28Å; C421-P426 WeakPolarHBondContact O-CD 2.91Å
422	L	93.2	Very high	88.1	Confident	13 Å²	13	64.4 Å²	64.4	7%	0.068	36%	0.359	C	S	.	.	H	α-helix	trans	-57.8	-48.6	179	-73	176	0	0	0	112.8	I378 Y386 C402 R418 I419 L427	I378-L422 HydrophobicContact CB-CD2 4.42Å; I378-L422 HydrophobicContact CD1-CD2 4.09Å; I378-L422 HydrophobicContact CG1-CD2 4.03Å; I378-L422 HydrophobicContact CG2-CD2 3.51Å; Y386-L422 HydrophobicContact CD2-CD1 4.05Å; Y386-L422 HydrophobicContact CD2-CD2 4.44Å; Y386-L422 HydrophobicContact CE2-CD1 4.45Å; C402-L422 HydrophobicContact CB-CD1 3.71Å; R418-L422 WeakPolarHBondContact O-CG 3.25Å; R418-L422 PolarHBondContact O-N 3.27Å; I419-L422 WeakPolarHBondContact O-CB 3.13Å; I419-L422 PolarHBondContact O-N 3.43Å; L422-L427 HydrophobicContact CB-CD1 3.85Å; L422-L427 HydrophobicContact CB-CG 4.31Å; L422-L427 HydrophobicContact CD2-CD1 4.28Å; L422-L427 HydrophobicContact CD2-CG 4.3Å; L422-L427 HydrophobicContact CG-CD1 4.48Å; L422-L427 WeakPolarHBondContact O-CB 3.47Å; L422-L427 PolarHBondContact O-N 2.95Å
423	T	88.5	Confident	88.7	Confident	104 Å²	104	64.5 Å²	64.5	64%	0.638	37%	0.365	S	S	*	.	H	α-helix	trans	-74.2	-28.8	-175.7	55.7	0	0	0	0	113.2	I419 Q420 C421	I419-T423 HydrophobicContact CG2-CG2 4.43Å; I419-T423 PolarHBondContact O-N 3.31Å; I419-T423 PolarHBondContact O-OG1 3.31Å; I419-T423 VanDerWaalsContact O-OG1 3.13Å; Q420-T423 PolarHBondContact O-OG1 2.78Å; C421-T423 PolarHBondContact O-N 2.9Å
424	S	88.2	Confident	89.3	Confident	87 Å²	87	63.6 Å²	63.6	61%	0.608	36%	0.357	S	S	*	.	H	α-helix	trans	-81.8	-20.3	-178	59.3	0	0	0	0	114.5	Q420 C421	Q420-S424 WeakPolarHBondContact O-CB 3.43Å; Q420-S424 PolarHBondContact O-N 3.41Å; Q420-S424 PolarHBondContact O-OG 3.15Å; C421-S424 PolarHBondContact O-N 3.1Å; C421-S424 PolarHBondContact O-OG 3.15Å
425	G	86.5	Confident	89.8	Confident	22 Å²	22	63.8 Å²	63.8	23%	0.227	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	-90.6	-170	0	0	0	0	0	114.5	C421 L427 N428	C421-G425 PolarHBondContact O-N 2.84Å; G425-L427 VanDerWaalsContact C-N 3.25Å; G425-L427 PolarHBondContact O-N 3.19Å; G425-L427 VanDerWaalsContact O-N 3.12Å; G425-N428 WeakPolarHBondContact O-CB 3.46Å; G425-N428 PolarHBondContact O-N 3.33Å
426	P	89.1	Confident	90	Very high	3 Å²	3	68.3 Å²	68.3	2%	0.019	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-21.1	-159.4	27.1	-35.9	0	0	0	113.8	Q374 D377 I378 C421 N428	Q374-P426 WeakPolarHBondContact CG-O 3.46Å; Q374-P426 PolarHBondContact NE2-O 3.48Å; D377-P426 HydrophobicContact CB-CB 4.41Å; I378-P426 HydrophobicContact CG1-CB 3.6Å; I378-P426 HydrophobicContact CG1-CG 3.68Å; C421-P426 VanDerWaalsContact O-CD 3.28Å; C421-P426 WeakPolarHBondContact O-CD 2.91Å; P426-N428 VanDerWaalsContact C-N 3.31Å
427	L	90.5	Very high	90.1	Very high	49 Å²	49	70 Å²	70	26%	0.257	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.9	174.6	-64.7	-176.4	0	0	0	114.4	I378 Y386 L422 G425 V429	I378-L427 HydrophobicContact CD1-CD2 3.76Å; Y386-L427 HydrophobicContact CD1-CD2 3.99Å; Y386-L427 HydrophobicContact CE1-CD1 4.47Å; Y386-L427 HydrophobicContact CE1-CD2 3.94Å; Y386-L427 HydrophobicContact CE2-CD1 4.13Å; Y386-L427 HydrophobicContact CG-CD2 4.44Å; L422-L427 HydrophobicContact CB-CD1 3.85Å; L422-L427 HydrophobicContact CB-CG 4.31Å; L422-L427 HydrophobicContact CD2-CD1 4.28Å; L422-L427 HydrophobicContact CD2-CG 4.3Å; L422-L427 HydrophobicContact CG-CD1 4.48Å; L422-L427 WeakPolarHBondContact O-CB 3.47Å; L422-L427 PolarHBondContact O-N 2.95Å; G425-L427 VanDerWaalsContact C-N 3.25Å; G425-L427 PolarHBondContact O-N 3.19Å; G425-L427 VanDerWaalsContact O-N 3.12Å; L427-V429 PolarHBondContact O-N 3.07Å
428	N	90.1	Very high	90.1	Very high	80 Å²	80	66.9 Å²	66.9	43%	0.428	38%	0.376	S	S	.	.	S	Bend	trans	-61.6	136.9	179.2	-168.4	-27.8	0	0	0	111.2	G425 P426 T430 V431	G425-N428 WeakPolarHBondContact O-CB 3.46Å; G425-N428 PolarHBondContact O-N 3.33Å; P426-N428 VanDerWaalsContact C-N 3.31Å; N428-T430 PolarHBondContact ND2-OG1 3.32Å; N428-T430 PolarHBondContact O-N 3.12Å; N428-T430 VanDerWaalsContact O-N 3.14Å; N428-T430 PolarHBondContact OD1-N 3.43Å; N428-T430 PolarHBondContact OD1-OG1 3.32Å; N428-V431 HydrophobicContact CB-CG2 4.41Å; N428-V431 WeakPolarHBondContact O-CB 3.19Å; N428-V431 PolarHBondContact O-N 3.21Å
429	V	88.5	Confident	90.2	Very high	117 Å²	117	68.3 Å²	68.3	71%	0.709	39%	0.387	S	S	*	.	H	α-helix	trans	-56.2	-32.1	-179.6	180	0	0	0	0	111.8	L427 V431 K432 S433	L427-V429 PolarHBondContact O-N 3.07Å; V429-V431 VanDerWaalsContact C-N 3.31Å; V429-V431 PolarHBondContact O-N 2.64Å; V429-K432 PolarHBondContact O-N 2.83Å; V429-S433 PolarHBondContact O-N 3.1Å; V429-S433 VanDerWaalsContact O-N 3.1Å
430	T	90.6	Very high	90.5	Very high	83 Å²	83	66.1 Å²	66.1	51%	0.509	38%	0.376	S	S	.	.	H	α-helix	trans	-58.5	-40	177.5	52.1	0	0	0	0	112.7	N428 K432 S433 Q434	N428-T430 PolarHBondContact ND2-OG1 3.32Å; N428-T430 PolarHBondContact O-N 3.12Å; N428-T430 VanDerWaalsContact O-N 3.14Å; N428-T430 PolarHBondContact OD1-N 3.43Å; N428-T430 PolarHBondContact OD1-OG1 3.32Å; T430-K432 PolarHBondContact O-N 3.26Å; T430-S433 PolarHBondContact O-N 2.86Å; T430-S433 PolarHBondContact O-OG 3.37Å; T430-Q434 PolarHBondContact O-N 2.87Å
431	V	88.7	Confident	90.7	Very high	26 Å²	26	62.2 Å²	62.2	16%	0.158	36%	0.358	C	S	.	.	H	α-helix	trans	-61.6	-43.4	177.3	179.8	0	0	0	0	110.8	N428 V429 S433 Q434 Y435	N428-V431 HydrophobicContact CB-CG2 4.41Å; N428-V431 WeakPolarHBondContact O-CB 3.19Å; N428-V431 PolarHBondContact O-N 3.21Å; V429-V431 VanDerWaalsContact C-N 3.31Å; V429-V431 PolarHBondContact O-N 2.64Å; V431-S433 PolarHBondContact O-N 3.32Å; V431-Q434 PolarHBondContact O-N 2.91Å; V431-Y435 HydrophobicContact CG1-CD2 4.08Å; V431-Y435 HydrophobicContact CG1-CE2 3.66Å; V431-Y435 VanDerWaalsContact O-CD2 3.26Å; V431-Y435 WeakPolarHBondContact O-CD2 3.37Å; V431-Y435 PolarHBondContact O-N 3.13Å
432	K	90.9	Very high	90.7	Very high	71 Å²	71	61.7 Å²	61.7	31%	0.309	35%	0.354	S	S	.	.	H	α-helix	trans	-62.3	-44.4	176.5	-67.6	-172.4	177.3	-178.2	0	111.8	I370 Q374 V429 T430 Q434 Y435 E436	I370-K432 HydrophobicContact CG2-CB 3.81Å; I370-K432 HydrophobicContact CG2-CD 4.41Å; I370-K432 HydrophobicContact CG2-CG 3.86Å; Q374-K432 VanDerWaalsContact CD-CE 3.46Å; Q374-K432 VanDerWaalsContact NE2-CE 3.26Å; V429-K432 PolarHBondContact O-N 2.83Å; T430-K432 PolarHBondContact O-N 3.26Å; K432-Q434 VanDerWaalsContact C-N 3.29Å; K432-Q434 PolarHBondContact O-N 3.49Å; K432-Y435 PolarHBondContact O-N 2.89Å; K432-E436 PolarHBondContact O-N 2.75Å
433	S	91.1	Very high	90.8	Very high	60 Å²	60	61.8 Å²	61.8	42%	0.42	35%	0.354	S	S	.	.	H	α-helix	trans	-64.6	-33.2	179.8	73.3	0	0	0	0	112.9	V429 T430 V431 E436 S437	V429-S433 PolarHBondContact O-N 3.1Å; V429-S433 VanDerWaalsContact O-N 3.1Å; T430-S433 PolarHBondContact O-N 2.86Å; T430-S433 PolarHBondContact O-OG 3.37Å; V431-S433 PolarHBondContact O-N 3.32Å; S433-E436 PolarHBondContact O-N 2.77Å; S433-S437 PolarHBondContact O-N 2.04Å; S433-S437 VanDerWaalsContact O-N 3.11Å; S433-S437 PolarHBondContact O-OG 2.85Å
434	Q	93.3	Very high	91.1	Very high	117 Å²	117	57.5 Å²	57.5	55%	0.547	33%	0.328	S	S	.	.	H	α-helix	trans	-64.3	-46.7	174.4	-177.3	179.3	-14.3	0	0	110.9	T430 V431 K432 E436 S437 T438	T430-Q434 PolarHBondContact O-N 2.87Å; V431-Q434 PolarHBondContact O-N 2.91Å; K432-Q434 VanDerWaalsContact C-N 3.29Å; K432-Q434 PolarHBondContact O-N 3.49Å; Q434-E436 VanDerWaalsContact C-N 3.35Å; Q434-E436 PolarHBondContact O-N 3.35Å; Q434-S437 PolarHBondContact O-N 3.23Å; Q434-S437 PolarHBondContact O-OG 3.48Å; Q434-T438 WeakPolarHBondContact O-CB 2.92Å; Q434-T438 WeakPolarHBondContact O-CG2 3.31Å; Q434-T438 PolarHBondContact O-N 2.71Å; Q434-T438 VanDerWaalsContact O-N 3.07Å; Q434-T438 PolarHBondContact O-OG1 2.57Å
435	Y	93.2	Very high	91.4	Very high	32 Å²	32	58.8 Å²	58.8	13%	0.125	32%	0.319	C	S	.	.	H	α-helix	trans	-64.2	-39.6	176.9	-73.3	-55.4	0	0	0	112.9	H373 D377 V431 K432 S437 T438 L439 C440	H373-Y435 HydrophobicContact CB-CD1 3.84Å; H373-Y435 HydrophobicContact CB-CD2 3.98Å; H373-Y435 HydrophobicContact CB-CE1 3.72Å; H373-Y435 HydrophobicContact CB-CE2 3.84Å; H373-Y435 HydrophobicContact CB-CG 3.99Å; D377-Y435 VanDerWaalsContact CG-OH 3.23Å; D377-Y435 PolarHBondContact OD1-OH 2.82Å; D377-Y435 WeakPolarHBondContact OD2-CE2 3.43Å; D377-Y435 PolarHBondContact OD2-OH 3.2Å; V431-Y435 HydrophobicContact CG1-CD2 4.08Å; V431-Y435 HydrophobicContact CG1-CE2 3.66Å; V431-Y435 VanDerWaalsContact O-CD2 3.26Å; V431-Y435 WeakPolarHBondContact O-CD2 3.37Å; V431-Y435 PolarHBondContact O-N 3.13Å; K432-Y435 PolarHBondContact O-N 2.89Å; Y435-S437 VanDerWaalsContact C-N 3.32Å; Y435-S437 PolarHBondContact O-N 2.92Å; Y435-T438 PolarHBondContact O-N 3.31Å; Y435-L439 HydrophobicContact CD1-CD2 4.37Å; Y435-L439 PolarHBondContact O-N 2.93Å; Y435-C440 PolarHBondContact O-N 2.57Å
436	E	91.1	Very high	91.7	Very high	105 Å²	105	59.4 Å²	59.4	49%	0.491	32%	0.315	S	S	.	.	H	α-helix	trans	-59.9	-40.9	177.7	-172.3	172.1	-172.6	0	0	112.8	I370 K432 S433 Q434	I370-E436 HydrophobicContact CD1-CB 3.92Å; I370-E436 HydrophobicContact CD1-CG 4.21Å; K432-E436 PolarHBondContact O-N 2.75Å; S433-E436 PolarHBondContact O-N 2.77Å; Q434-E436 VanDerWaalsContact C-N 3.35Å; Q434-E436 PolarHBondContact O-N 3.35Å
437	S	87	Confident	91.9	Very high	83 Å²	83	62.5 Å²	62.5	58%	0.58	33%	0.327	S	S	*	.	H	α-helix	trans	-82.4	-26.9	-178.2	52.4	0	0	0	0	114.5	S433 Q434 Y435	S433-S437 PolarHBondContact O-N 2.04Å; S433-S437 VanDerWaalsContact O-N 3.11Å; S433-S437 PolarHBondContact O-OG 2.85Å; Q434-S437 PolarHBondContact O-N 3.23Å; Q434-S437 PolarHBondContact O-OG 3.48Å; Y435-S437 VanDerWaalsContact C-N 3.32Å; Y435-S437 PolarHBondContact O-N 2.92Å
438	T	89.2	Confident	92.2	Very high	87 Å²	87	62.2 Å²	62.2	53%	0.534	33%	0.327	S	S	.	.	H	α-helix	trans	-108.2	-39.7	-169.5	58.4	0	0	0	0	114.9	Q434 Y435	Q434-T438 WeakPolarHBondContact O-CB 2.92Å; Q434-T438 WeakPolarHBondContact O-CG2 3.31Å; Q434-T438 PolarHBondContact O-N 2.71Å; Q434-T438 VanDerWaalsContact O-N 3.07Å; Q434-T438 PolarHBondContact O-OG1 2.57Å; Y435-T438 PolarHBondContact O-N 3.31Å
439	L	91.6	Very high	92.4	Very high	89 Å²	89	59.3 Å²	59.3	47%	0.466	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	-47	-165	-174.9	62.9	0	0	0	112.8	H373 Y435 H441	H373-L439 WeakPolarHBondContact CE1-CD2 3.48Å; H373-L439 VanDerWaalsContact NE2-CD2 3.33Å; H373-L439 WeakPolarHBondContact NE2-CD2 3.4Å; Y435-L439 HydrophobicContact CD1-CD2 4.37Å; Y435-L439 PolarHBondContact O-N 2.93Å; L439-H441 PolarHBondContact O-N 2.8Å
440	C	94.6	Very high	92.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.303	C	S	.	.			trans	-90.8	78.1	-175.3	-65.8	0	0	0	0	110.6	Y364 Q366 C369 I370 Y435	Y364-C440 WeakPolarHBondContact OH-CA 3.39Å; Q366-C440 WeakPolarHBondContact CG-O 3.46Å; Q366-C440 PolarHBondContact NE2-O 2.85Å; Q366-C440 VanDerWaalsContact NE2-O 3.11Å; C369-C440 HydrophobicContact CB-CB 3.7Å; C369-C440 WeakPolarHBondContact CB-SG 3.25Å; C369-C440 VanDerWaalsContact SG-CA 3.54Å; C369-C440 WeakPolarHBondContact SG-CB 3.33Å; C369-C440 CovalentContact SG-SG 2.05Å; C369-C440 PolarHBondContact SG-SG 3.45Å; I370-C440 HydrophobicContact CG1-CB 3.66Å; I370-C440 PolarHBondContact N-SG 3.35Å; I370-C440 VanDerWaalsContact N-SG 3.42Å; Y435-C440 PolarHBondContact O-N 2.57Å
441	H	94.1	Very high	92.8	Very high	51 Å²	51	57 Å²	57	24%	0.236	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-78.9	146.4	175	-59.5	-39.4	0	0	0	112.1	P323 Y364 L439	P323-H441 VanDerWaalsContact CG-CE1 3.45Å; P323-H441 WeakPolarHBondContact CG-CE1 3.39Å; Y364-H441 WeakPolarHBondContact CE1-O 3.17Å; Y364-H441 PolarHBondContact OH-N 3.33Å; Y364-H441 PolarHBondContact OH-O 2.87Å; L439-H441 PolarHBondContact O-N 2.8Å
442	P	94.6	Very high	93.1	Very high	17 Å²	17	60.1 Å²	60.1	11%	0.11	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-63	152.6	174	28.4	-35.4	0	0	0	111.2	C324 R325	C324-P442 CarbonylContact C-O 3.52Å; C324-P442 VanDerWaalsContact CA-O 3.22Å; C324-P442 WeakPolarHBondContact CA-O 3.44Å; C324-P442 HydrophobicContact CB-CG 4.39Å; C324-P442 WeakPolarHBondContact CB-O 3.47Å; R325-P442 PolarHBondContact N-O 2.74Å
443	R	95	Very high	93.2	Very high	14 Å²	14	59.8 Å²	59.8	5%	0.053	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-66.3	142.6	170.1	-68.9	-174.7	-76.1	151.4	-0.3	110.1	E285 D330 Y364 R445 Y446	E285-R443 IonicContact OE1-NH1 3.8Å; E285-R443 PolarHBondContact OE1-NH1 2.95Å; E285-R443 VanDerWaalsContact OE1-NH1 3.15Å; E285-R443 IonicContact OE2-CZ 3.06Å; E285-R443 VanDerWaalsContact OE2-CZ 3.3Å; E285-R443 IonicContact OE2-NH1 3.96Å; E285-R443 PolarHBondContact OE2-NH1 2.75Å; E285-R443 IonicContact OE2-NH2 2.68Å; E285-R443 PolarHBondContact OE2-NH2 2.99Å; D330-R443 WeakPolarHBondContact OD2-CD 3.34Å; D330-R443 VanDerWaalsContact OD2-CG 3.3Å; D330-R443 WeakPolarHBondContact OD2-CG 3.08Å; Y364-R443 HydrophobicContact CD1-CG 3.67Å; Y364-R443 HydrophobicContact CE1-CG 4.12Å; Y364-R443 WeakPolarHBondContact O-CD 3.05Å; Y364-R443 PolarHBondContact O-NE 2.95Å; R443-R445 PolarHBondContact O-N 3.01Å; R443-Y446 HydrophobicContact CB-CD1 4.11Å; R443-Y446 WeakPolarHBondContact O-CD1 3.43Å; R443-Y446 WeakPolarHBondContact O-CE1 3.41Å
444	C	95.4	Very high	93.4	Very high	14 Å²	14	59.5 Å²	59.5	10%	0.095	31%	0.308	C	S	.	.	S	Bend	trans	-68.4	-27.9	174.3	-59.3	0	0	0	0	111.9	K315 R316 C324 R325	K315-C444 CarbonylContact C-O 3.58Å; K315-C444 WeakPolarHBondContact CA-O 3.5Å; R316-C444 PolarHBondContact N-O 3.46Å; C324-C444 HydrophobicContact CB-CB 4.02Å; C324-C444 WeakPolarHBondContact CB-SG 3.5Å; C324-C444 PolarHBondContact O-SG 3.31Å; C324-C444 VanDerWaalsContact O-SG 3.35Å; C324-C444 VanDerWaalsContact SG-CA 3.51Å; C324-C444 WeakPolarHBondContact SG-CB 3.22Å; C324-C444 CovalentContact SG-SG 2.04Å; C324-C444 PolarHBondContact SG-SG 3.34Å; R325-C444 VanDerWaalsContact C-SG 3.53Å; R325-C444 PolarHBondContact O-N 2.74Å; R325-C444 PolarHBondContact O-SG 3.34Å
445	R	94.1	Very high	93.5	Very high	115 Å²	115	57 Å²	57	43%	0.434	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	125.2	178.3	-61.5	-179.8	71.3	112.9	-6.1	110.5	W314 R443	W314-R445 VanDerWaalsContact O-CA 3.29Å; W314-R445 WeakPolarHBondContact O-CA 3.46Å; R443-R445 PolarHBondContact O-N 3.01Å
446	Y	93.4	Very high	93.6	Very high	34 Å²	34	59.1 Å²	59.1	13%	0.133	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	159.9	176.3	61.7	-85	0	0	0	110.6	W314 R316 R443 T448	W314-Y446 HydrophobicContact CB-CD1 3.99Å; W314-Y446 HydrophobicContact CB-CD2 4.23Å; W314-Y446 HydrophobicContact CB-CE1 3.57Å; W314-Y446 HydrophobicContact CB-CE2 3.83Å; W314-Y446 HydrophobicContact CB-CG 4.28Å; W314-Y446 VanDerWaalsContact CB-CZ 3.46Å; W314-Y446 AromaticContact CD1-CD2 3.87Å; W314-Y446 AromaticContact CD1-CE2 3.3Å; W314-Y446 AromaticContact CD1-CZ 3.72Å; W314-Y446 HydrophobicContact CD2-CE2 4.39Å; W314-Y446 HydrophobicContact CG-CD2 4.25Å; W314-Y446 HydrophobicContact CG-CE1 4.1Å; W314-Y446 AromaticContact CG-CE2 3.55Å; W314-Y446 HydrophobicContact CG-CE2 3.55Å; W314-Y446 AromaticContact CG-CZ 3.43Å; W314-Y446 VanDerWaalsContact CG-CZ 3.43Å; W314-Y446 PolarHBondContact N-O 2.88Å; W314-Y446 AromaticContact NE1-CE2 3.98Å; W314-Y446 PolarHBondContact O-N 3.35Å; R316-Y446 PolarHBondContact NE-OH 3.16Å; R316-Y446 PolarHBondContact NH2-OH 3.34Å; R443-Y446 HydrophobicContact CB-CD1 4.11Å; R443-Y446 WeakPolarHBondContact O-CD1 3.43Å; R443-Y446 WeakPolarHBondContact O-CE1 3.41Å; Y446-T448 HydrophobicContact CD2-CG2 4.01Å; Y446-T448 HydrophobicContact CE2-CG2 3.74Å
447	Y	93.7	Very high	93.6	Very high	68 Å²	68	57.7 Å²	57.7	27%	0.267	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	142.4	175.7	-73.6	-90	0	0	0	110.5	P114 E285 V312 L313	P114-Y447 HydrophobicContact CG-CD1 4.33Å; P114-Y447 HydrophobicContact CG-CD2 4.18Å; P114-Y447 HydrophobicContact CG-CE1 3.98Å; P114-Y447 HydrophobicContact CG-CE2 3.84Å; P114-Y447 HydrophobicContact CG-CG 4.41Å; E285-Y447 PolarHBondContact OE2-N 3.01Å; V312-Y447 WeakPolarHBondContact O-CA 3.4Å; L313-Y447 HydrophobicContact CB-CD1 4.1Å; L313-Y447 HydrophobicContact CB-CE1 3.72Å; L313-Y447 HydrophobicContact CD1-CD1 4.4Å; L313-Y447 HydrophobicContact CD1-CD2 4.18Å; L313-Y447 HydrophobicContact CD1-CE1 4.07Å; L313-Y447 HydrophobicContact CD1-CE2 3.81Å; L313-Y447 HydrophobicContact CD1-CG 4.46Å; L313-Y447 HydrophobicContact CG-CE1 4.33Å
448	T	95.3	Very high	93.7	Very high	44 Å²	44	59.4 Å²	59.4	27%	0.27	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	153.7	161.5	56.1	0	0	0	0	108.9	P311 V312 W314 Y446	P311-T448 WeakPolarHBondContact CA-O 3.23Å; V312-T448 PolarHBondContact N-O 2.87Å; V312-T448 PolarHBondContact O-N 2.84Å; W314-T448 PolarHBondContact NE1-OG1 2.84Å; Y446-T448 HydrophobicContact CD2-CG2 4.01Å; Y446-T448 HydrophobicContact CE2-CG2 3.74Å
449	Y	94.7	Very high	93.4	Very high	18 Å²	18	65.3 Å²	65.3	7%	0.071	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	94.9	-176.2	-63.3	-91.5	0	0	0	108.4	P114 P116 V283 E285 Y309 P311 S451	P114-Y449 WeakPolarHBondContact O-CE1 3.46Å; P114-Y449 PolarHBondContact O-OH 3.44Å; P116-Y449 HydrophobicContact CB-CD1 3.7Å; P116-Y449 HydrophobicContact CB-CD2 4.02Å; P116-Y449 HydrophobicContact CB-CE1 3.59Å; P116-Y449 HydrophobicContact CB-CE2 3.96Å; P116-Y449 HydrophobicContact CB-CG 3.9Å; P116-Y449 HydrophobicContact CG-CD1 3.92Å; P116-Y449 HydrophobicContact CG-CE1 3.97Å; P116-Y449 HydrophobicContact CG-CG 4.44Å; V283-Y449 HydrophobicContact CG1-CG 4.1Å; E285-Y449 HydrophobicContact CB-CE2 4.2Å; Y309-Y449 AromaticContact CD2-CD1 3.81Å; Y309-Y449 HydrophobicContact CD2-CD1 3.81Å; Y309-Y449 HydrophobicContact CD2-CE1 4.49Å; Y309-Y449 HydrophobicContact CE2-CD1 4.23Å; Y309-Y449 HydrophobicContact CE2-CE1 4.48Å; P311-Y449 HydrophobicContact CB-CD1 4.04Å; P311-Y449 HydrophobicContact CB-CE1 3.92Å; Y449-S451 PolarHBondContact O-N 2.87Å; Y449-S451 VanDerWaalsContact O-N 3.13Å
450	E	93.8	Very high	92.8	Very high	118 Å²	118	63.2 Å²	63.2	55%	0.551	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	109.9	177.1	-67.5	-178.7	-177.1	0	0	108.3	Y309 Q310	Y309-E450 CarbonylContact C-O 3.56Å; Y309-E450 VanDerWaalsContact CA-O 3.25Å; Y309-E450 WeakPolarHBondContact CA-O 3.26Å; Q310-E450 HydrophobicContact CB-CB 4.5Å; Q310-E450 PolarHBondContact N-O 3.02Å; Q310-E450 PolarHBondContact O-N 2.93Å
451	S	94.4	Very high	92.3	Very high	34 Å²	34	66 Å²	66	24%	0.238	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139.2	-170.8	55.4	0	0	0	0	112.5	N308 Y449	N308-S451 CarbonylContact O-C 3.57Å; N308-S451 WeakPolarHBondContact O-CA 3.47Å; Y449-S451 PolarHBondContact O-N 2.87Å; Y449-S451 VanDerWaalsContact O-N 3.13Å
452	T	94.2	Very high	91.7	Very high	91 Å²	91	70.6 Å²	70.6	56%	0.558	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	148.3	174.6	58.4	0	0	0	0	109.6	I307 N308	I307-T452 CarbonylContact C-O 3.52Å; I307-T452 WeakPolarHBondContact CA-O 3.27Å; N308-T452 PolarHBondContact N-O 3.06Å; N308-T452 PolarHBondContact O-N 3.37Å; N308-T452 PolarHBondContact O-OG1 3.44Å
453	I	93.8	Very high	91.4	Very high	64 Å²	64	77.1 Å²	77.1	33%	0.328	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.4	-179.6	-167.1	169.5	0	0	0	110.8	H298 V299 N305 E306 V455	H298-I453 VanDerWaalsContact O-CD1 3.23Å; H298-I453 WeakPolarHBondContact O-CD1 3.3Å; V299-I453 HydrophobicContact CG2-CD1 4.22Å; N305-I453 HydrophobicContact CB-CD1 4.26Å; E306-I453 WeakPolarHBondContact O-CA 3.43Å; I453-V455 HydrophobicContact CD1-CG2 4.31Å; I453-V455 HydrophobicContact CG1-CG2 4.12Å
454	S	95.3	Very high	91.1	Very high	55 Å²	55	81 Å²	81	39%	0.385	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133	169.7	179.3	0	0	0	0	108.6	E306	E306-S454 PolarHBondContact N-O 3.46Å; E306-S454 PolarHBondContact O-N 2.97Å
455	V	95.5	Very high	90.6	Very high	65 Å²	65	81.7 Å²	81.7	39%	0.394	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	130.6	-175.4	-173.6	0	0	0	0	109.5	K303 N305 I453	K303-V455 HydrophobicContact CB-CG1 3.64Å; K303-V455 HydrophobicContact CG-CG1 3.88Å; N305-V455 WeakPolarHBondContact OD1-CG2 3.45Å; I453-V455 HydrophobicContact CD1-CG2 4.31Å; I453-V455 HydrophobicContact CG1-CG2 4.12Å
456	T	94	Very high	90.3	Very high	75 Å²	75	80.8 Å²	80.8	46%	0.46	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	167.5	176.4	-169.4	0	0	0	0	111.8	K303 L304 W458	K303-T456 WeakPolarHBondContact CB-O 3.11Å; L304-T456 HydrophobicContact CB-CG2 3.8Å; L304-T456 HydrophobicContact CD2-CG2 3.82Å; L304-T456 HydrophobicContact CG-CG2 4.08Å; L304-T456 PolarHBondContact N-O 2.77Å; L304-T456 PolarHBondContact O-N 3.06Å; T456-W458 PolarHBondContact O-N 2.74Å
457	T	92.7	Very high	90.2	Very high	75 Å²	75	82.7 Å²	82.7	46%	0.46	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	124.7	180	59	0	0	0	0	110.6
458	W	87.4	Confident	89.9	Confident	120 Å²	120	82.5 Å²	82.5	46%	0.455	42%	0.415	S	S	.	.			trans	-79.6	122.1	170.1	-168.8	39.6	0	0	0	109.4	I252 L304 T456 A460	I252-W458 HydrophobicContact CD1-CZ2 4.33Å; I252-W458 HydrophobicContact CG2-CH2 4.12Å; I252-W458 HydrophobicContact CG2-CZ2 4.27Å; L304-W458 HydrophobicContact CB-CB 4.42Å; T456-W458 PolarHBondContact O-N 2.74Å; W458-A460 HydrophobicContact CD2-CB 4.19Å; W458-A460 VanDerWaalsContact CE2-CB 3.45Å; W458-A460 HydrophobicContact CZ2-CB 3.67Å; W458-A460 VanDerWaalsContact NE1-CB 3.34Å
459	R	83.5	Confident	89.5	Confident	211 Å²	211	83.6 Å²	83.6	80%	0.796	41%	0.414	S	S	*	.			trans	-112.8	19.6	-177.9	-65.5	-175.2	178.8	178.6	-1.5	113.1	V461	R459-V461 PolarHBondContact O-N 2.82Å
460	A	78.6	Confident	89.3	Confident	45 Å²	45	86.2 Å²	86.2	37%	0.372	43%	0.427	S	S	.	.			trans	-64.4	133.1	175.6	0	0	0	0	0	109.5	W458	W458-A460 HydrophobicContact CD2-CB 4.19Å; W458-A460 VanDerWaalsContact CE2-CB 3.45Å; W458-A460 HydrophobicContact CZ2-CB 3.67Å; W458-A460 VanDerWaalsContact NE1-CB 3.34Å
461	V	84.1	Confident	89.3	Confident	58 Å²	58	82.1 Å²	82.1	35%	0.352	41%	0.409	S	S	.	.			trans	-103.6	141.9	174.8	-70.7	0	0	0	0	108.7	R459 W463 Q464 L465	R459-V461 PolarHBondContact O-N 2.82Å; V461-W463 HydrophobicContact CG2-CD2 4.04Å; V461-W463 VanDerWaalsContact CG2-CE2 3.42Å; V461-W463 HydrophobicContact CG2-CG 4.12Å; V461-W463 HydrophobicContact CG2-CZ2 3.91Å; V461-W463 PolarHBondContact O-N 3.06Å; V461-W463 VanDerWaalsContact O-N 3.09Å; V461-Q464 HydrophobicContact CG2-CB 3.85Å; V461-Q464 HydrophobicContact CG2-CG 3.45Å; V461-Q464 VanDerWaalsContact CG2-CG 3.45Å; V461-Q464 WeakPolarHBondContact O-CB 3.31Å; V461-Q464 PolarHBondContact O-N 3.24Å; V461-L465 PolarHBondContact O-N 3.34Å
462	D	82.9	Confident	89	Confident	147 Å²	147	81.5 Å²	81.5	79%	0.786	40%	0.403	S	S	*	.	H	α-helix	trans	-54.6	-36.3	-172	-64	-30.6	0	0	0	113.2	Q464 L465 H466	D462-Q464 PolarHBondContact O-N 3.12Å; D462-L465 PolarHBondContact O-N 3.2Å; D462-H466 WeakPolarHBondContact O-CB 3.5Å; D462-H466 PolarHBondContact O-N 3.49Å
463	W	88.5	Confident	88.8	Confident	154 Å²	154	83.4 Å²	83.4	58%	0.583	40%	0.4	S	S	*	.	H	α-helix	trans	-65.8	-36.3	178	69	-98.6	0	0	0	112.7	V461 H466 W467	V461-W463 HydrophobicContact CG2-CD2 4.04Å; V461-W463 VanDerWaalsContact CG2-CE2 3.42Å; V461-W463 HydrophobicContact CG2-CG 4.12Å; V461-W463 HydrophobicContact CG2-CZ2 3.91Å; V461-W463 PolarHBondContact O-N 3.06Å; V461-W463 VanDerWaalsContact O-N 3.09Å; W463-H466 PolarHBondContact O-N 2.83Å; W463-W467 PolarHBondContact O-N 3.38Å
464	Q	87.8	Confident	88.8	Confident	95 Å²	95	80.4 Å²	80.4	44%	0.444	38%	0.384	S	S	.	.	H	α-helix	trans	-66	-43.5	176.7	-79.4	176.1	-14.1	0	0	110.8	V461 D462 H466 W467 L468	V461-Q464 HydrophobicContact CG2-CB 3.85Å; V461-Q464 HydrophobicContact CG2-CG 3.45Å; V461-Q464 VanDerWaalsContact CG2-CG 3.45Å; V461-Q464 WeakPolarHBondContact O-CB 3.31Å; V461-Q464 PolarHBondContact O-N 3.24Å; D462-Q464 PolarHBondContact O-N 3.12Å; Q464-H466 VanDerWaalsContact C-N 3.35Å; Q464-W467 PolarHBondContact O-N 3.37Å; Q464-L468 VanDerWaalsContact O-CB 3.3Å; Q464-L468 WeakPolarHBondContact O-CB 3.39Å; Q464-L468 PolarHBondContact O-N 3.27Å
465	L	85.2	Confident	88.6	Confident	29 Å²	29	82.6 Å²	82.6	15%	0.152	39%	0.387	C	S	.	.	H	α-helix	trans	-65.2	-41	176.9	-175.7	60.2	0	0	0	111.3	I252 V461 D462 L468 R469	I252-L465 HydrophobicContact CD1-CD1 3.58Å; I252-L465 HydrophobicContact CD1-CD2 4.39Å; V461-L465 PolarHBondContact O-N 3.34Å; D462-L465 PolarHBondContact O-N 3.2Å; L465-L468 HydrophobicContact CD1-CD2 4.35Å; L465-L468 PolarHBondContact O-N 2.98Å; L465-R469 VanDerWaalsContact O-CG 3.31Å; L465-R469 WeakPolarHBondContact O-CG 3.41Å; L465-R469 PolarHBondContact O-N 2.91Å
466	H	88.2	Confident	88.3	Confident	96 Å²	96	82.7 Å²	82.7	44%	0.444	38%	0.382	S	S	.	.	H	α-helix	trans	-56.9	-53.5	174.4	178.9	81.7	0	0	0	111.5	D462 W463 Q464 L468 R469 Q470	D462-H466 WeakPolarHBondContact O-CB 3.5Å; D462-H466 PolarHBondContact O-N 3.49Å; W463-H466 PolarHBondContact O-N 2.83Å; Q464-H466 VanDerWaalsContact C-N 3.35Å; H466-L468 PolarHBondContact O-N 2.92Å; H466-R469 WeakPolarHBondContact O-CB 3.23Å; H466-R469 PolarHBondContact O-N 3.48Å; H466-Q470 WeakPolarHBondContact O-CG 3.31Å; H466-Q470 PolarHBondContact O-N 3.44Å
467	W	89.7	Confident	88.2	Confident	74 Å²	74	80.8 Å²	80.8	28%	0.28	37%	0.372	S	S	.	.	H	α-helix	trans	-67.6	-36	-178.5	-75.3	116.2	0	0	0	112.9	W463 Q464 R469 Q470 L471 E502 F503	W463-W467 PolarHBondContact O-N 3.38Å; Q464-W467 PolarHBondContact O-N 3.37Å; W467-R469 VanDerWaalsContact C-N 3.28Å; W467-R469 PolarHBondContact O-N 3.33Å; W467-Q470 HydrophobicContact CE3-CB 4.19Å; W467-Q470 PolarHBondContact O-N 3.09Å; W467-L471 WeakPolarHBondContact O-CB 3.28Å; W467-L471 WeakPolarHBondContact O-CG 3.42Å; W467-L471 PolarHBondContact O-N 3.48Å; W467-E502 WeakPolarHBondContact CH2-O 3.47Å; W467-F503 HydrophobicContact CB-CD2 4.09Å; W467-F503 HydrophobicContact CB-CE2 3.88Å; W467-F503 AromaticContact CD2-CD2 3.49Å; W467-F503 HydrophobicContact CD2-CD2 3.49Å; W467-F503 VanDerWaalsContact CD2-CD2 3.49Å; W467-F503 AromaticContact CD2-CE2 4Å; W467-F503 HydrophobicContact CD2-CE2 4Å; W467-F503 HydrophobicContact CE3-CB 4.13Å; W467-F503 AromaticContact CE3-CD2 3.51Å; W467-F503 HydrophobicContact CE3-CD2 3.51Å; W467-F503 HydrophobicContact CE3-CE2 4.41Å; W467-F503 HydrophobicContact CE3-CG 4.28Å; W467-F503 AromaticContact CG-CD2 3.76Å; W467-F503 HydrophobicContact CG-CD2 3.76Å; W467-F503 AromaticContact CG-CE2 3.76Å; W467-F503 HydrophobicContact CG-CE2 3.76Å; W467-F503 HydrophobicContact CZ3-CB 3.95Å; W467-F503 HydrophobicContact CZ3-CD2 4.05Å
468	L	88.6	Confident	88.3	Confident	64 Å²	64	78 Å²	78	34%	0.335	35%	0.354	S	S	.	.	H	α-helix	trans	-53.2	-47.9	172.5	-177.9	69.7	0	0	0	111.3	I209 Q464 L465 H466 N472	I209-L468 HydrophobicContact CD1-CD1 3.86Å; Q464-L468 VanDerWaalsContact O-CB 3.3Å; Q464-L468 WeakPolarHBondContact O-CB 3.39Å; Q464-L468 PolarHBondContact O-N 3.27Å; L465-L468 HydrophobicContact CD1-CD2 4.35Å; L465-L468 PolarHBondContact O-N 2.98Å; H466-L468 PolarHBondContact O-N 2.92Å; L468-N472 VanDerWaalsContact O-CB 3.23Å; L468-N472 WeakPolarHBondContact O-CB 3.5Å; L468-N472 PolarHBondContact O-N 3.4Å
469	R	87.7	Confident	88.4	Confident	67 Å²	67	78.5 Å²	78.5	25%	0.253	36%	0.361	S	S	.	.	H	α-helix	trans	-64.5	-47.2	178.5	-66.7	173.9	173	176.3	-3.1	111.7	L197 N198 D211 L465 H466 W467 N472 R473	L197-R469 PolarHBondContact O-NH2 3.31Å; N198-R469 PolarHBondContact OD1-NE 2.89Å; N198-R469 PolarHBondContact OD1-NH2 3.1Å; D211-R469 WeakPolarHBondContact OD1-CG 3.47Å; L465-R469 VanDerWaalsContact O-CG 3.31Å; L465-R469 WeakPolarHBondContact O-CG 3.41Å; L465-R469 PolarHBondContact O-N 2.91Å; H466-R469 WeakPolarHBondContact O-CB 3.23Å; H466-R469 PolarHBondContact O-N 3.48Å; W467-R469 VanDerWaalsContact C-N 3.28Å; W467-R469 PolarHBondContact O-N 3.33Å; R469-N472 PolarHBondContact O-N 3.37Å; R469-R473 VanDerWaalsContact O-CG 3.31Å; R469-R473 WeakPolarHBondContact O-CG 3.44Å; R469-R473 PolarHBondContact O-N 3.29Å
470	Q	90.4	Very high	88.8	Confident	73 Å²	73	75.7 Å²	75.7	34%	0.341	35%	0.352	S	S	.	.	H	α-helix	trans	-62	-46.6	-179.2	-67.2	-70	31.4	0	0	111.8	H466 W467 R473 A474	H466-Q470 WeakPolarHBondContact O-CG 3.31Å; H466-Q470 PolarHBondContact O-N 3.44Å; W467-Q470 HydrophobicContact CE3-CB 4.19Å; W467-Q470 PolarHBondContact O-N 3.09Å; Q470-R473 PolarHBondContact O-N 3.08Å; Q470-A474 WeakPolarHBondContact O-CB 3.49Å; Q470-A474 PolarHBondContact O-N 3.31Å
471	L	91.9	Very high	89.5	Confident	32 Å²	32	75 Å²	75	17%	0.168	34%	0.342	C	S	.	.	H	α-helix	trans	-63.9	-42.4	178.4	-66.9	174.3	0	0	0	111.3	W467 A474 F475 W500 F503	W467-L471 WeakPolarHBondContact O-CB 3.28Å; W467-L471 WeakPolarHBondContact O-CG 3.42Å; W467-L471 PolarHBondContact O-N 3.48Å; L471-A474 WeakPolarHBondContact O-CB 3.35Å; L471-A474 PolarHBondContact O-N 3.25Å; L471-F475 WeakPolarHBondContact O-CD2 3.15Å; L471-F475 PolarHBondContact O-N 2.92Å; L471-W500 HydrophobicContact CD2-CG 4.05Å; L471-F503 HydrophobicContact CD1-CD1 4.26Å; L471-F503 HydrophobicContact CD1-CD2 4.26Å; L471-F503 HydrophobicContact CD1-CE1 4.34Å; L471-F503 HydrophobicContact CD1-CE2 4.33Å; L471-F503 HydrophobicContact CD1-CG 4.21Å; L471-F503 HydrophobicContact CD1-CZ 4.37Å; L471-F503 HydrophobicContact CD2-CB 3.81Å; L471-F503 HydrophobicContact CD2-CD1 4.29Å; L471-F503 HydrophobicContact CD2-CG 3.97Å; L471-F503 HydrophobicContact CG-CG 4.48Å
472	N	89.1	Confident	89.9	Confident	22 Å²	22	74.2 Å²	74.2	12%	0.118	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-48.1	176.2	-175.1	18.1	0	0	0	111.9	I209 L468 R469 A474 F475 K476	I209-N472 VanDerWaalsContact C-ND2 3.28Å; I209-N472 WeakPolarHBondContact CG2-ND2 3.3Å; I209-N472 PolarHBondContact O-ND2 3.4Å; I209-N472 PolarHBondContact O-OD1 3.35Å; L468-N472 VanDerWaalsContact O-CB 3.23Å; L468-N472 WeakPolarHBondContact O-CB 3.5Å; L468-N472 PolarHBondContact O-N 3.4Å; R469-N472 PolarHBondContact O-N 3.37Å; N472-A474 VanDerWaalsContact C-N 3.28Å; N472-A474 PolarHBondContact O-N 3.47Å; N472-F475 PolarHBondContact O-N 2.98Å; N472-K476 WeakPolarHBondContact O-CG 3.43Å; N472-K476 PolarHBondContact O-N 3.01Å; N472-K476 WeakPolarHBondContact OD1-CE 3.38Å
473	R	90.8	Very high	90.4	Very high	131 Å²	131	75.9 Å²	75.9	49%	0.494	34%	0.338	S	S	.	.	H	α-helix	trans	-59.1	-40.8	175.5	-70.9	173	-172.5	-171.9	-0.9	112.2	D211 R469 Q470 K476 S477	D211-R473 IonicContact OD2-CZ 3.2Å; D211-R473 IonicContact OD2-NE 2.71Å; D211-R473 PolarHBondContact OD2-NE 2.82Å; D211-R473 IonicContact OD2-NH2 2.67Å; D211-R473 PolarHBondContact OD2-NH2 3.34Å; R469-R473 VanDerWaalsContact O-CG 3.31Å; R469-R473 WeakPolarHBondContact O-CG 3.44Å; R469-R473 PolarHBondContact O-N 3.29Å; Q470-R473 PolarHBondContact O-N 3.08Å; R473-K476 PolarHBondContact O-N 2.98Å; R473-S477 PolarHBondContact O-N 3.48Å
474	A	92.9	Very high	90.6	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.9	-47	176.4	0	0	0	0	0	111.7	Q470 L471 N472 K476 S477 M478 G496 R499 W500	Q470-A474 WeakPolarHBondContact O-CB 3.49Å; Q470-A474 PolarHBondContact O-N 3.31Å; L471-A474 WeakPolarHBondContact O-CB 3.35Å; L471-A474 PolarHBondContact O-N 3.25Å; N472-A474 VanDerWaalsContact C-N 3.28Å; N472-A474 PolarHBondContact O-N 3.47Å; A474-K476 PolarHBondContact O-N 2.91Å; A474-S477 PolarHBondContact O-N 3.23Å; A474-M478 WeakPolarHBondContact O-CG 3.47Å; A474-M478 PolarHBondContact O-N 3.48Å; A474-G496 WeakPolarHBondContact CB-O 3.35Å; A474-R499 HydrophobicContact CB-CB 4.29Å; A474-W500 HydrophobicContact CB-CB 3.91Å
475	F	91.7	Very high	90.9	Very high	102 Å²	102	73 Å²	73	45%	0.447	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-42.4	176.1	-84.2	-65.7	0	0	0	113.1	L471 N472 M478 Q479 W500	L471-F475 WeakPolarHBondContact O-CD2 3.15Å; L471-F475 PolarHBondContact O-N 2.92Å; N472-F475 PolarHBondContact O-N 2.98Å; F475-M478 HydrophobicContact CD1-CE 3.62Å; F475-M478 HydrophobicContact CE1-CE 3.94Å; F475-M478 HydrophobicContact CG-CE 4.11Å; F475-M478 WeakPolarHBondContact O-CB 3.44Å; F475-M478 PolarHBondContact O-N 3.46Å; F475-Q479 WeakPolarHBondContact O-CG 3.37Å; F475-Q479 PolarHBondContact O-N 2.86Å; F475-W500 AromaticContact CE2-CD1 3.7Å; F475-W500 AromaticContact CE2-NE1 3.45Å; F475-W500 AromaticContact CZ-CD1 3.9Å; F475-W500 AromaticContact CZ-NE1 3.47Å
476	K	89.1	Confident	91.2	Very high	67 Å²	67	73.3 Å²	73.3	29%	0.291	35%	0.345	S	S	.	.	H	α-helix	trans	-64.7	-40.4	176.7	-71.3	-173.5	-176.4	-168.7	0	113.3	E210 N472 R473 A474 M478 Q479 Y480	E210-K476 WeakPolarHBondContact OE1-CE 3.42Å; E210-K476 IonicContact OE1-NZ 2.57Å; E210-K476 PolarHBondContact OE1-NZ 3.27Å; E210-K476 IonicContact OE2-NZ 2.57Å; E210-K476 PolarHBondContact OE2-NZ 3.45Å; N472-K476 WeakPolarHBondContact O-CG 3.43Å; N472-K476 PolarHBondContact O-N 3.01Å; N472-K476 WeakPolarHBondContact OD1-CE 3.38Å; R473-K476 PolarHBondContact O-N 2.98Å; A474-K476 PolarHBondContact O-N 2.91Å; K476-M478 VanDerWaalsContact C-N 3.3Å; K476-M478 PolarHBondContact O-N 3.35Å; K476-Q479 PolarHBondContact O-N 2.97Å; K476-Y480 WeakPolarHBondContact O-CB 3.34Å; K476-Y480 PolarHBondContact O-N 2.94Å
477	S	91.8	Very high	91.2	Very high	35 Å²	35	77.4 Å²	77.4	25%	0.245	37%	0.365	C	S	.	.	H	α-helix	trans	-59.4	-45.1	173.4	-172.7	0	0	0	0	110.6	R473 A474 Y480 D481	R473-S477 PolarHBondContact O-N 3.48Å; A474-S477 PolarHBondContact O-N 3.23Å; S477-Y480 PolarHBondContact O-N 3.32Å; S477-D481 PolarHBondContact O-N 3.02Å
478	M	93.7	Very high	91.1	Very high	15 Å²	15	81.9 Å²	81.9	7%	0.074	39%	0.394	C	S	.	.	H	α-helix	trans	-62	-44.8	176.6	-77.6	-172.2	-71.4	0	0	112.5	A474 F475 K476 Y480 D481 V482 I491 S494 F497 W500	A474-M478 WeakPolarHBondContact O-CG 3.47Å; A474-M478 PolarHBondContact O-N 3.48Å; F475-M478 HydrophobicContact CD1-CE 3.62Å; F475-M478 HydrophobicContact CE1-CE 3.94Å; F475-M478 HydrophobicContact CG-CE 4.11Å; F475-M478 WeakPolarHBondContact O-CB 3.44Å; F475-M478 PolarHBondContact O-N 3.46Å; K476-M478 VanDerWaalsContact C-N 3.3Å; K476-M478 PolarHBondContact O-N 3.35Å; M478-Y480 VanDerWaalsContact C-N 3.33Å; M478-Y480 PolarHBondContact O-N 3.36Å; M478-D481 PolarHBondContact O-N 3.22Å; M478-V482 WeakPolarHBondContact O-CG2 3.36Å; M478-V482 PolarHBondContact O-N 2.96Å; M478-I491 HydrophobicContact CB-CD1 3.74Å; M478-I491 HydrophobicContact CB-CG1 4.27Å; M478-I491 HydrophobicContact CG-CD1 4.01Å; M478-I491 HydrophobicContact CG-CG1 4.05Å; M478-I491 HydrophobicContact SD-CD1 4.29Å; M478-I491 HydrophobicContact SD-CG1 3.74Å; M478-S494 WeakPolarHBondContact CG-OG 3.43Å; M478-F497 HydrophobicContact CG-CB 4.36Å; M478-F497 VanDerWaalsContact SD-CA 3.58Å; M478-F497 HydrophobicContact SD-CB 3.73Å; M478-F497 HydrophobicContact SD-CD2 4.26Å; M478-W500 HydrophobicContact CE-CB 4.21Å; M478-W500 HydrophobicContact CE-CG 4.36Å
479	Q	90.3	Very high	91.1	Very high	131 Å²	131	81.6 Å²	81.6	61%	0.612	39%	0.389	S	S	*	.	H	α-helix	trans	-62.7	-39.7	176.6	-74.5	175.2	-19.4	0	0	112.4	F475 K476 K483	F475-Q479 WeakPolarHBondContact O-CG 3.37Å; F475-Q479 PolarHBondContact O-N 2.86Å; K476-Q479 PolarHBondContact O-N 2.97Å; Q479-K483 WeakPolarHBondContact O-CB 3.35Å; Q479-K483 PolarHBondContact O-N 3.26Å
480	Y	91.7	Very high	91.3	Very high	152 Å²	152	82.2 Å²	82.2	60%	0.596	40%	0.397	S	S	*	.	H	α-helix	trans	-63.1	-45	175.3	-179.8	-101.1	0	0	0	111.6	K476 S477 M478 K483 I484	K476-Y480 WeakPolarHBondContact O-CB 3.34Å; K476-Y480 PolarHBondContact O-N 2.94Å; S477-Y480 PolarHBondContact O-N 3.32Å; M478-Y480 VanDerWaalsContact C-N 3.33Å; M478-Y480 PolarHBondContact O-N 3.36Å; Y480-K483 PolarHBondContact O-N 2.91Å; Y480-I484 HydrophobicContact CD1-CD1 3.82Å; Y480-I484 HydrophobicContact CD2-CD1 4.34Å; Y480-I484 HydrophobicContact CE1-CD1 3.23Å; Y480-I484 HydrophobicContact CE1-CG1 4.47Å; Y480-I484 HydrophobicContact CE2-CD1 3.81Å; Y480-I484 HydrophobicContact CG-CD1 4.35Å; Y480-I484 WeakPolarHBondContact O-CG1 3.27Å; Y480-I484 PolarHBondContact O-N 3.35Å; Y480-I484 VanDerWaalsContact O-N 3.08Å; Y480-I484 WeakPolarHBondContact OH-CD1 3.19Å
481	D	93.5	Very high	91.4	Very high	31 Å²	31	81.5 Å²	81.5	17%	0.166	40%	0.395	C	S	.	.	H	α-helix	trans	-62.8	-43.7	178.2	-64.9	-21.7	0	0	0	111.7	S477 M478 K483 I484 N485 W489 S494	S477-D481 PolarHBondContact O-N 3.02Å; M478-D481 PolarHBondContact O-N 3.22Å; D481-K483 VanDerWaalsContact C-N 3.34Å; D481-K483 PolarHBondContact O-N 2.85Å; D481-I484 PolarHBondContact O-N 3.25Å; D481-N485 WeakPolarHBondContact O-CB 3.34Å; D481-N485 PolarHBondContact O-N 2.92Å; D481-N485 PolarHBondContact O-ND2 3.48Å; D481-W489 HydrophobicContact CB-CE3 4.14Å; D481-W489 HydrophobicContact CB-CH2 3.66Å; D481-W489 HydrophobicContact CB-CZ2 4.47Å; D481-W489 HydrophobicContact CB-CZ3 3.49Å; D481-W489 VanDerWaalsContact CB-CZ3 3.49Å; D481-S494 VanDerWaalsContact OD2-CB 3.27Å; D481-S494 WeakPolarHBondContact OD2-CB 3.19Å; D481-S494 PolarHBondContact OD2-OG 3.24Å
482	V	93	Very high	91.4	Very high	41 Å²	41	83 Å²	83	25%	0.248	41%	0.405	C	S	.	.	H	α-helix	trans	-62.2	-41.7	175.2	172.5	0	0	0	0	111.2	M478 I484 G486 W489 I491	M478-V482 WeakPolarHBondContact O-CG2 3.36Å; M478-V482 PolarHBondContact O-N 2.96Å; V482-I484 VanDerWaalsContact C-N 3.27Å; V482-I484 PolarHBondContact O-N 2.89Å; V482-G486 CarbonylContact O-C 3.58Å; V482-G486 VanDerWaalsContact O-C 3.31Å; V482-G486 WeakPolarHBondContact O-CA 3.32Å; V482-G486 PolarHBondContact O-N 3.01Å; V482-W489 HydrophobicContact CG2-CE3 4.38Å; V482-I491 HydrophobicContact CG2-CD1 3.46Å; V482-I491 VanDerWaalsContact CG2-CD1 3.46Å
483	K	92.3	Very high	91.5	Very high	183 Å²	183	88 Å²	88	80%	0.796	43%	0.428	S	S	*	.	H	α-helix	trans	-63.7	-33.4	178.8	-174.7	175	-179.5	176.8	0	112.7	Q479 Y480 D481	Q479-K483 WeakPolarHBondContact O-CB 3.35Å; Q479-K483 PolarHBondContact O-N 3.26Å; Y480-K483 PolarHBondContact O-N 2.91Å; D481-K483 VanDerWaalsContact C-N 3.34Å; D481-K483 PolarHBondContact O-N 2.85Å
484	I	94.1	Very high	91.5	Very high	100 Å²	100	81.8 Å²	81.8	51%	0.513	41%	0.405	S	S	.	.	H	α-helix	trans	-81.6	-44.1	179.3	-70.7	177.1	0	0	0	111.8	Y480 D481 V482	Y480-I484 HydrophobicContact CD1-CD1 3.82Å; Y480-I484 HydrophobicContact CD2-CD1 4.34Å; Y480-I484 HydrophobicContact CE1-CD1 3.23Å; Y480-I484 HydrophobicContact CE1-CG1 4.47Å; Y480-I484 HydrophobicContact CE2-CD1 3.81Å; Y480-I484 HydrophobicContact CG-CD1 4.35Å; Y480-I484 WeakPolarHBondContact O-CG1 3.27Å; Y480-I484 PolarHBondContact O-N 3.35Å; Y480-I484 VanDerWaalsContact O-N 3.08Å; Y480-I484 WeakPolarHBondContact OH-CD1 3.19Å; D481-I484 PolarHBondContact O-N 3.25Å; V482-I484 VanDerWaalsContact C-N 3.27Å; V482-I484 PolarHBondContact O-N 2.89Å
485	N	93.4	Very high	91.5	Very high	88 Å²	88	86.1 Å²	86.1	47%	0.471	43%	0.428	S	S	.	.	H	α-helix	trans	-93.1	-10.5	-170.4	-62.9	-38	0	0	0	113.8	D481 W489	D481-N485 WeakPolarHBondContact O-CB 3.34Å; D481-N485 PolarHBondContact O-N 2.92Å; D481-N485 PolarHBondContact O-ND2 3.48Å; N485-W489 HydrophobicContact CB-CB 3.59Å; N485-W489 HydrophobicContact CB-CD2 4.08Å; N485-W489 HydrophobicContact CB-CG 3.39Å; N485-W489 VanDerWaalsContact ND2-CE2 3.34Å; N485-W489 PolarHBondContact ND2-NE1 2.55Å
486	G	91.1	Very high	91.6	Very high	35 Å²	35	81.3 Å²	81.3	36%	0.361	41%	0.407	S	S	.	.			trans	97.1	162.9	-175.5	0	0	0	0	0	113	V482 D488 W489	V482-G486 CarbonylContact O-C 3.58Å; V482-G486 VanDerWaalsContact O-C 3.31Å; V482-G486 WeakPolarHBondContact O-CA 3.32Å; V482-G486 PolarHBondContact O-N 3.01Å; G486-D488 VanDerWaalsContact C-N 3.26Å; G486-D488 PolarHBondContact O-N 3.39Å; G486-W489 VanDerWaalsContact O-CB 3.29Å; G486-W489 WeakPolarHBondContact O-CB 3.38Å; G486-W489 PolarHBondContact O-N 3.13Å; G486-W489 VanDerWaalsContact O-N 3.16Å
487	E	87.7	Confident	91.8	Very high	182 Å²	182	80.6 Å²	80.6	85%	0.85	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-29	-173.9	-65.8	-177.4	173.4	0	0	113.4	W489	E487-W489 VanDerWaalsContact C-N 3.25Å; E487-W489 PolarHBondContact O-N 3.46Å
488	D	88.3	Confident	91.9	Very high	169 Å²	169	83.7 Å²	83.7	90%	0.904	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	1.1	180	-63.2	-37.9	0	0	0	113.8	G486	G486-D488 VanDerWaalsContact C-N 3.26Å; G486-D488 PolarHBondContact O-N 3.39Å
489	W	89.4	Confident	91.8	Very high	57 Å²	57	88.6 Å²	88.6	22%	0.216	43%	0.432	C	S	.	.	S	Bend	trans	-68.6	135.2	-178.6	-177.2	80.1	0	0	0	112	D481 V482 N485 G486 E487 I491 Q493 S494	D481-W489 HydrophobicContact CB-CE3 4.14Å; D481-W489 HydrophobicContact CB-CH2 3.66Å; D481-W489 HydrophobicContact CB-CZ2 4.47Å; D481-W489 HydrophobicContact CB-CZ3 3.49Å; D481-W489 VanDerWaalsContact CB-CZ3 3.49Å; V482-W489 HydrophobicContact CG2-CE3 4.38Å; N485-W489 HydrophobicContact CB-CB 3.59Å; N485-W489 HydrophobicContact CB-CD2 4.08Å; N485-W489 HydrophobicContact CB-CG 3.39Å; N485-W489 VanDerWaalsContact ND2-CE2 3.34Å; N485-W489 PolarHBondContact ND2-NE1 2.55Å; G486-W489 VanDerWaalsContact O-CB 3.29Å; G486-W489 WeakPolarHBondContact O-CB 3.38Å; G486-W489 PolarHBondContact O-N 3.13Å; G486-W489 VanDerWaalsContact O-N 3.16Å; E487-W489 VanDerWaalsContact C-N 3.25Å; E487-W489 PolarHBondContact O-N 3.46Å; W489-I491 HydrophobicContact CE3-CD1 4.49Å; W489-I491 HydrophobicContact CZ3-CD1 4.22Å; W489-I491 PolarHBondContact O-N 2.98Å; W489-Q493 HydrophobicContact CH2-CB 4.17Å; W489-Q493 HydrophobicContact CZ2-CB 3.68Å; W489-S494 VanDerWaalsContact CH2-CA 3.48Å; W489-S494 VanDerWaalsContact CH2-N 3.32Å
490	N	92.1	Very high	91.9	Very high	81 Å²	81	86 Å²	86	43%	0.433	42%	0.417	S	S	.	.			trans	-72.3	102.5	-176.9	-176.5	-4.3	0	0	0	111.5	T492 Q493	N490-T492 PolarHBondContact ND2-OG1 3.23Å; N490-T492 PolarHBondContact O-N 3.03Å; N490-T492 WeakPolarHBondContact OD1-CB 3.43Å; N490-T492 PolarHBondContact OD1-N 3.06Å; N490-T492 VanDerWaalsContact OD1-N 3.12Å; N490-T492 PolarHBondContact OD1-OG1 3.29Å; N490-Q493 HydrophobicContact CB-CG 4.42Å; N490-Q493 WeakPolarHBondContact O-CB 3.46Å; N490-Q493 PolarHBondContact O-N 3.26Å
491	I	90.8	Very high	91.9	Very high	58 Å²	58	84.4 Å²	84.4	30%	0.297	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-52.6	-27.6	-178.9	-152.5	71.5	0	0	0	113.8	M478 V482 W489 Q493 S494 F497	M478-I491 HydrophobicContact CB-CD1 3.74Å; M478-I491 HydrophobicContact CB-CG1 4.27Å; M478-I491 HydrophobicContact CG-CD1 4.01Å; M478-I491 HydrophobicContact CG-CG1 4.05Å; M478-I491 HydrophobicContact SD-CD1 4.29Å; M478-I491 HydrophobicContact SD-CG1 3.74Å; V482-I491 HydrophobicContact CG2-CD1 3.46Å; V482-I491 VanDerWaalsContact CG2-CD1 3.46Å; W489-I491 HydrophobicContact CE3-CD1 4.49Å; W489-I491 HydrophobicContact CZ3-CD1 4.22Å; W489-I491 PolarHBondContact O-N 2.98Å; I491-Q493 PolarHBondContact O-N 2.87Å; I491-Q493 VanDerWaalsContact O-N 3.15Å; I491-S494 WeakPolarHBondContact O-CB 3.18Å; I491-S494 PolarHBondContact O-N 3.39Å; I491-F497 HydrophobicContact CG2-CD2 4.45Å; I491-F497 WeakPolarHBondContact O-CB 3.48Å
492	T	92.7	Very high	91.7	Very high	62 Å²	62	89.5 Å²	89.5	38%	0.38	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-66.9	-14.9	-178.7	63.8	0	0	0	0	113.2	N490 S494 F497 H498	N490-T492 PolarHBondContact ND2-OG1 3.23Å; N490-T492 PolarHBondContact O-N 3.03Å; N490-T492 WeakPolarHBondContact OD1-CB 3.43Å; N490-T492 PolarHBondContact OD1-N 3.06Å; N490-T492 VanDerWaalsContact OD1-N 3.12Å; N490-T492 PolarHBondContact OD1-OG1 3.29Å; T492-S494 VanDerWaalsContact C-N 3.34Å; T492-F497 HydrophobicContact CG2-CD1 4.5Å; T492-F497 HydrophobicContact CG2-CE1 4.07Å; T492-F497 HydrophobicContact CG2-CE2 4.43Å; T492-F497 HydrophobicContact CG2-CZ 4.03Å; T492-H498 PolarHBondContact O-NE2 3.28Å
493	Q	90.6	Very high	91.4	Very high	127 Å²	127	91.9 Å²	91.9	59%	0.593	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-84.8	-8.4	173.2	-60	-178.7	-0.3	0	0	112.8	W489 N490 I491	W489-Q493 HydrophobicContact CH2-CB 4.17Å; W489-Q493 HydrophobicContact CZ2-CB 3.68Å; N490-Q493 HydrophobicContact CB-CG 4.42Å; N490-Q493 WeakPolarHBondContact O-CB 3.46Å; N490-Q493 PolarHBondContact O-N 3.26Å; I491-Q493 PolarHBondContact O-N 2.87Å; I491-Q493 VanDerWaalsContact O-N 3.15Å
494	S	92.1	Very high	91.1	Very high	1 Å²	1	91.3 Å²	91.3	1%	0.007	45%	0.448	C	S	.	.			trans	-71	135.7	179.4	-176.6	0	0	0	0	111.6	M478 D481 W489 I491 T492 G496 F497 H498	M478-S494 WeakPolarHBondContact CG-OG 3.43Å; D481-S494 VanDerWaalsContact OD2-CB 3.27Å; D481-S494 WeakPolarHBondContact OD2-CB 3.19Å; D481-S494 PolarHBondContact OD2-OG 3.24Å; W489-S494 VanDerWaalsContact CH2-CA 3.48Å; W489-S494 VanDerWaalsContact CH2-N 3.32Å; I491-S494 WeakPolarHBondContact O-CB 3.18Å; I491-S494 PolarHBondContact O-N 3.39Å; T492-S494 VanDerWaalsContact C-N 3.34Å; S494-G496 PolarHBondContact O-N 3.2Å; S494-G496 PolarHBondContact OG-N 3.46Å; S494-F497 WeakPolarHBondContact O-CB 3.39Å; S494-F497 PolarHBondContact O-N 3.47Å; S494-H498 PolarHBondContact O-CD2 3.31Å; S494-H498 VanDerWaalsContact O-CD2 3.23Å; S494-H498 PolarHBondContact O-N 3.2Å; S494-H498 VanDerWaalsContact O-N 3.13Å
495	N	91.9	Very high	91	Very high	92 Å²	92	90.9 Å²	90.9	49%	0.492	44%	0.444	S	S	.	.	H	α-helix	trans	-59.6	-31.9	166.2	-165.2	10.5	0	0	0	111	H498 R499	N495-H498 PolarHBondContact O-N 3.13Å; N495-R499 WeakPolarHBondContact O-CG 3.43Å; N495-R499 PolarHBondContact O-N 3.31Å
496	G	93	Very high	90.8	Very high	0 Å²	0	91.1 Å²	91.1	0%	0	44%	0.443	C	S	.	.	H	α-helix	trans	-60.2	-45.2	171.8	0	0	0	0	0	112.2	A474 S494 H498 R499 W500	A474-G496 WeakPolarHBondContact CB-O 3.35Å; S494-G496 PolarHBondContact O-N 3.2Å; S494-G496 PolarHBondContact OG-N 3.46Å; G496-H498 PolarHBondContact O-N 3.26Å; G496-R499 PolarHBondContact O-N 2.94Å; G496-W500 WeakPolarHBondContact O-CB 3.43Å; G496-W500 PolarHBondContact O-N 3.01Å
497	F	94.1	Very high	90.8	Very high	53 Å²	53	94.2 Å²	94.2	23%	0.232	45%	0.448	C	S	.	.	H	α-helix	trans	-62.2	-43	176.9	178	-96.6	0	0	0	112	M478 I491 T492 S494 R499 W500 K501	M478-F497 HydrophobicContact CG-CB 4.36Å; M478-F497 VanDerWaalsContact SD-CA 3.58Å; M478-F497 HydrophobicContact SD-CB 3.73Å; M478-F497 HydrophobicContact SD-CD2 4.26Å; I491-F497 HydrophobicContact CG2-CD2 4.45Å; I491-F497 WeakPolarHBondContact O-CB 3.48Å; T492-F497 HydrophobicContact CG2-CD1 4.5Å; T492-F497 HydrophobicContact CG2-CE1 4.07Å; T492-F497 HydrophobicContact CG2-CE2 4.43Å; T492-F497 HydrophobicContact CG2-CZ 4.03Å; S494-F497 WeakPolarHBondContact O-CB 3.39Å; S494-F497 PolarHBondContact O-N 3.47Å; F497-R499 PolarHBondContact O-N 3.01Å; F497-W500 PolarHBondContact O-N 3.48Å; F497-K501 WeakPolarHBondContact O-CB 3.21Å; F497-K501 PolarHBondContact O-N 2.93Å
498	H	93.2	Very high	91	Very high	99 Å²	99	89 Å²	89	46%	0.458	42%	0.424	S	S	.	.	H	α-helix	trans	-61	-43.2	176.6	-70.8	-59.4	0	0	0	112.5	T492 S494 N495 G496 K501 E502	T492-H498 PolarHBondContact O-NE2 3.28Å; S494-H498 PolarHBondContact O-CD2 3.31Å; S494-H498 VanDerWaalsContact O-CD2 3.23Å; S494-H498 PolarHBondContact O-N 3.2Å; S494-H498 VanDerWaalsContact O-N 3.13Å; N495-H498 PolarHBondContact O-N 3.13Å; G496-H498 PolarHBondContact O-N 3.26Å; H498-K501 WeakPolarHBondContact O-CB 3.31Å; H498-K501 PolarHBondContact O-N 3.38Å; H498-E502 PolarHBondContact O-N 3.16Å
499	R	91.6	Very high	91.2	Very high	119 Å²	119	84 Å²	84	45%	0.449	39%	0.394	S	S	.	.	H	α-helix	trans	-64.9	-40.9	174.1	-70.5	176.2	-175.6	-176.3	-0.4	112.6	A474 N495 G496 F497 K501 E502	A474-R499 HydrophobicContact CB-CB 4.29Å; N495-R499 WeakPolarHBondContact O-CG 3.43Å; N495-R499 PolarHBondContact O-N 3.31Å; G496-R499 PolarHBondContact O-N 2.94Å; F497-R499 PolarHBondContact O-N 3.01Å; R499-K501 PolarHBondContact O-N 3.15Å; R499-E502 WeakPolarHBondContact O-CB 3.29Å; R499-E502 PolarHBondContact O-N 2.99Å
500	W	92.9	Very high	91.3	Very high	75 Å²	75	85.8 Å²	85.8	28%	0.284	41%	0.406	S	S	.	.	H	α-helix	trans	-60.6	-39.3	176.3	-174.3	94.2	0	0	0	111.1	L471 A474 F475 M478 G496 F497 E502 F503 L504	L471-W500 HydrophobicContact CD2-CG 4.05Å; A474-W500 HydrophobicContact CB-CB 3.91Å; F475-W500 AromaticContact CE2-CD1 3.7Å; F475-W500 AromaticContact CE2-NE1 3.45Å; F475-W500 AromaticContact CZ-CD1 3.9Å; F475-W500 AromaticContact CZ-NE1 3.47Å; M478-W500 HydrophobicContact CE-CB 4.21Å; M478-W500 HydrophobicContact CE-CG 4.36Å; G496-W500 WeakPolarHBondContact O-CB 3.43Å; G496-W500 PolarHBondContact O-N 3.01Å; F497-W500 PolarHBondContact O-N 3.48Å; W500-E502 PolarHBondContact O-N 3.13Å; W500-F503 VanDerWaalsContact O-CB 3.31Å; W500-F503 WeakPolarHBondContact O-CB 3.45Å; W500-F503 PolarHBondContact O-N 2.64Å; W500-F503 VanDerWaalsContact O-N 3.13Å; W500-L504 HydrophobicContact CZ3-CD1 4.04Å; W500-L504 HydrophobicContact CZ3-CG 4.26Å
501	K	92.5	Very high	91.2	Very high	119 Å²	119	86.1 Å²	86.1	52%	0.517	40%	0.404	S	S	.	.	H	α-helix	trans	-63	-25	178.5	-166.3	-177.5	177.7	-176.8	0	113.2	F497 H498 R499 F503 L504	F497-K501 WeakPolarHBondContact O-CB 3.21Å; F497-K501 PolarHBondContact O-N 2.93Å; H498-K501 WeakPolarHBondContact O-CB 3.31Å; H498-K501 PolarHBondContact O-N 3.38Å; R499-K501 PolarHBondContact O-N 3.15Å; K501-F503 PolarHBondContact O-N 3.12Å; K501-L504 HydrophobicContact CG-CD1 4.28Å; K501-L504 WeakPolarHBondContact O-CB 3.45Å; K501-L504 PolarHBondContact O-N 3.18Å; K501-L504 VanDerWaalsContact O-N 3.13Å
502	E	89.4	Confident	91.2	Very high	138 Å²	138	88.3 Å²	88.3	65%	0.645	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.6	175.7	-61.7	-179.3	165.9	0	0	113.4	W467 H498 R499 W500	W467-E502 WeakPolarHBondContact CH2-O 3.47Å; H498-E502 PolarHBondContact O-N 3.16Å; R499-E502 WeakPolarHBondContact O-CB 3.29Å; R499-E502 PolarHBondContact O-N 2.99Å; W500-E502 PolarHBondContact O-N 3.13Å
503	F	86	Confident	91.1	Very high	92 Å²	92	90.5 Å²	90.5	40%	0.404	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-22.6	174.4	-179.2	-107.7	0	0	0	113.5	W467 L471 W500 K501	W467-F503 HydrophobicContact CB-CD2 4.09Å; W467-F503 HydrophobicContact CB-CE2 3.88Å; W467-F503 AromaticContact CD2-CD2 3.49Å; W467-F503 HydrophobicContact CD2-CD2 3.49Å; W467-F503 VanDerWaalsContact CD2-CD2 3.49Å; W467-F503 AromaticContact CD2-CE2 4Å; W467-F503 HydrophobicContact CD2-CE2 4Å; W467-F503 HydrophobicContact CE3-CB 4.13Å; W467-F503 AromaticContact CE3-CD2 3.51Å; W467-F503 HydrophobicContact CE3-CD2 3.51Å; W467-F503 HydrophobicContact CE3-CE2 4.41Å; W467-F503 HydrophobicContact CE3-CG 4.28Å; W467-F503 AromaticContact CG-CD2 3.76Å; W467-F503 HydrophobicContact CG-CD2 3.76Å; W467-F503 AromaticContact CG-CE2 3.76Å; W467-F503 HydrophobicContact CG-CE2 3.76Å; W467-F503 HydrophobicContact CZ3-CB 3.95Å; W467-F503 HydrophobicContact CZ3-CD2 4.05Å; L471-F503 HydrophobicContact CD1-CD1 4.26Å; L471-F503 HydrophobicContact CD1-CD2 4.26Å; L471-F503 HydrophobicContact CD1-CE1 4.34Å; L471-F503 HydrophobicContact CD1-CE2 4.33Å; L471-F503 HydrophobicContact CD1-CG 4.21Å; L471-F503 HydrophobicContact CD1-CZ 4.37Å; L471-F503 HydrophobicContact CD2-CB 3.81Å; L471-F503 HydrophobicContact CD2-CD1 4.29Å; L471-F503 HydrophobicContact CD2-CG 3.97Å; L471-F503 HydrophobicContact CG-CG 4.48Å; W500-F503 VanDerWaalsContact O-CB 3.31Å; W500-F503 WeakPolarHBondContact O-CB 3.45Å; W500-F503 PolarHBondContact O-N 2.64Å; W500-F503 VanDerWaalsContact O-N 3.13Å; K501-F503 PolarHBondContact O-N 3.12Å
504	L	86.3	Confident	91.2	Very high	171 Å²	171	87.2 Å²	87.2	90%	0.895	40%	0.399	S	S	*	.			trans	-77	0	174.8	-63.1	176.4	0	0	0	110.2	W500 K501	W500-L504 HydrophobicContact CZ3-CD1 4.04Å; W500-L504 HydrophobicContact CZ3-CG 4.26Å; K501-L504 HydrophobicContact CG-CD1 4.28Å; K501-L504 WeakPolarHBondContact O-CB 3.45Å; K501-L504 PolarHBondContact O-N 3.18Å; K501-L504 VanDerWaalsContact O-N 3.13Å

Retrieved 504 of 504 residues in 1058.1 ms (Link to these results)

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