A0A096N3W8_PAPAN Loading...

CCA tRNA nucleotidyltransferase 1, mitochondrial

AlphaFold DB , UniProt , Accession A0A096N3W8, Species PAPAN (Papio anubis, Olive baboon), Gene TRNT1, Length 439 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	31.5	Very low	252 Å²	252	185.3 Å²	185.3	100%	1.241	86%	0.856	S	S	*	*				0	119.7	0	-81.6	175.4	-160.1	0	0	107.9
2	L	27.8	Very low	31.4	Very low	165 Å²	165	179.8 Å²	179.8	86%	0.864	85%	0.845	S	S	*	*			trans	-79.6	168.9	-174.4	-85.6	112.1	0	0	0	113.4
3	R	30.4	Very low	31.5	Very low	236 Å²	236	178.6 Å²	178.6	89%	0.891	85%	0.846	S	S	*	*			trans	102.5	129.5	155.7	-58.4	179.5	178.1	-161.1	-1.6	113.6
4	C	29	Very low	31.3	Very low	112 Å²	112	174.1 Å²	174.1	76%	0.757	84%	0.843	S	S	*	*			cis	-140.4	136.1	35.2	-95.9	0	0	0	0	113.9
5	L	29.1	Very low	31.1	Very low	163 Å²	163	170.1 Å²	170.1	85%	0.853	84%	0.838	S	S	*	*			trans	-105.3	138.2	159.9	-84.5	155.7	0	0	0	107.2
6	Y	29.9	Very low	30.9	Very low	221 Å²	221	172.6 Å²	172.6	87%	0.867	84%	0.836	S	S	*	*			trans	-132.4	116.7	158.5	-94.8	-83.3	0	0	0	109.3
7	H	28.6	Very low	30.9	Very low	163 Å²	163	175.8 Å²	175.8	76%	0.755	84%	0.837	S	S	*	*			trans	-100.3	148.5	154.2	-89.4	-51.8	0	0	0	107.2
8	W	30.8	Very low	31.2	Very low	223 Å²	223	174.8 Å²	174.8	85%	0.845	84%	0.837	S	S	*	*				-178.8	138.5	118.5	-99.2	43.3	0	0	0	112.5
9	H	30.1	Very low	31.3	Very low	155 Å²	155	177.8 Å²	177.8	72%	0.718	84%	0.84	S	S	*	*			trans	71.2	111.9	155.7	-68.5	-40.3	0	0	0	125
10	R	29.6	Very low	31.4	Very low	233 Å²	233	177.2 Å²	177.2	88%	0.879	84%	0.841	S	S	*	*			trans	-90.2	162.8	140.5	-100.7	-172	-174.6	-165.8	2.8	108.5
11	P	43	Very low	31.4	Very low	115 Å²	115	173.9 Å²	173.9	75%	0.747	84%	0.835	S	S	*	*				-154.6	177.7	54.7	35.6	-10.3	0	0	0	119.8
12	V	31.3	Very low	31.3	Very low	120 Å²	120	169.7 Å²	169.7	73%	0.727	82%	0.817	S	S	*	*			trans	109.2	99.1	149.7	-164.8	0	0	0	0	118.8
13	L	32.2	Very low	31.7	Very low	164 Å²	164	169.2 Å²	169.2	86%	0.859	82%	0.815	S	S	*	*			trans	39.4	119.2	134.8	-59.5	165.2	0	0	0	121
14	S	28.4	Very low	32	Very low	115 Å²	115	166.1 Å²	166.1	80%	0.804	81%	0.808	S	S	*	*				-167.1	126.3	110.8	72.9	0	0	0	0	113.1
15	C	28.5	Very low	32.4	Very low	114 Å²	114	169 Å²	169	77%	0.77	81%	0.81	S	S	*	*			trans	29.4	129.2	147.6	-95.3	0	0	0	0	123
16	R	28.6	Very low	32.8	Very low	211 Å²	211	169.9 Å²	169.9	80%	0.796	80%	0.803	S	S	*	*				102.5	117.4	124.3	-88.8	-173.3	171.9	-167.3	0.5	119.4
17	W	30.3	Very low	33.3	Very low	226 Å²	226	166.6 Å²	166.6	86%	0.856	80%	0.8	S	S	*	*			trans	108	109.3	143.9	-71.8	32.3	0	0	0	116.9	R19	W17-R19 PolarHBondContact O-N 3.24Å
18	N	35.6	Very low	34.6	Very low	158 Å²	158	168 Å²	168	85%	0.845	80%	0.804	S	S	*	*			trans	-33.4	117.3	168.2	-79.1	-16.3	0	0	0	113.5
19	R	33.6	Very low	36.6	Very low	233 Å²	233	161.6 Å²	161.6	88%	0.879	79%	0.79	S	S	*	*			trans	-121.2	110	142.9	-73.9	-173.4	-175.2	-143.7	0.9	106.7	W17 C21	W17-R19 PolarHBondContact O-N 3.24Å; R19-C21 PolarHBondContact O-N 3.08Å
20	L	33.7	Very low	39	Very low	165 Å²	165	162 Å²	162	86%	0.864	79%	0.794	S	S	*	*			trans	-61.9	89.8	159.2	-95.7	121.7	0	0	0	106.9	L22	L20-L22 VanDerWaalsContact C-N 3.33Å; L20-L22 PolarHBondContact O-N 3.48Å; L20-L22 VanDerWaalsContact O-N 3.08Å
21	C	31.3	Very low	42	Very low	107 Å²	107	156 Å²	156	72%	0.723	77%	0.774	S	S	*	*			trans	-67.2	100.1	159.3	-94.7	0	0	0	0	106.4	R19 L23	R19-C21 PolarHBondContact O-N 3.08Å; C21-L23 PolarHBondContact O-N 3.29Å
22	L	35.7	Very low	44.5	Very low	164 Å²	164	152.6 Å²	152.6	86%	0.859	75%	0.749	S	S	*	*			trans	-55.9	93.8	156.3	-85.3	150.3	0	0	0	107	L20 K24	L20-L22 VanDerWaalsContact C-N 3.33Å; L20-L22 PolarHBondContact O-N 3.48Å; L20-L22 VanDerWaalsContact O-N 3.08Å; L22-K24 PolarHBondContact O-N 3.04Å
23	L	35.4	Very low	47.5	Very low	156 Å²	156	155.7 Å²	155.7	82%	0.817	76%	0.756	S	S	*	*			trans	-58.7	97.2	159.2	-90.7	144.6	0	0	0	105.7	C21 Q25	C21-L23 PolarHBondContact O-N 3.29Å; L23-Q25 PolarHBondContact O-N 3.47Å
24	K	38.2	Very low	50.5	Low	171 Å²	171	149.1 Å²	149.1	74%	0.743	72%	0.724	S	S	*	*			trans	-56.1	97.9	157	-91.7	-176.7	172.7	-179.2	0	105.3	L22 Y26	L22-K24 PolarHBondContact O-N 3.04Å; K24-Y26 VanDerWaalsContact C-N 3.33Å; K24-Y26 WeakPolarHBondContact O-CD2 3.19Å; K24-Y26 PolarHBondContact O-N 3.09Å
25	Q	37	Very low	53.7	Low	171 Å²	171	148.3 Å²	148.3	80%	0.799	72%	0.715	S	S	*	*			trans	-58.7	106.9	160.9	-79.4	176.1	-23.5	0	0	105.3	L23 L27	L23-Q25 PolarHBondContact O-N 3.47Å; Q25-L27 VanDerWaalsContact C-N 3.26Å; Q25-L27 PolarHBondContact O-N 3.26Å
26	Y	37.8	Very low	57	Low	183 Å²	183	145.4 Å²	145.4	72%	0.718	69%	0.691	S	S	*	*			trans	-66.8	96.4	167.5	-74	-91.2	0	0	0	105.8	K24 F28	K24-Y26 VanDerWaalsContact C-N 3.33Å; K24-Y26 WeakPolarHBondContact O-CD2 3.19Å; K24-Y26 PolarHBondContact O-N 3.09Å; Y26-F28 VanDerWaalsContact C-N 3.35Å; Y26-F28 WeakPolarHBondContact O-CD2 3.47Å; Y26-F28 PolarHBondContact O-N 3.42Å
27	L	39.9	Very low	60.3	Low	151 Å²	151	136 Å²	136	79%	0.791	66%	0.655	S	S	*	*			trans	-66.1	101.4	165.5	-71.3	169.6	0	0	0	106.2	Q25 T29	Q25-L27 VanDerWaalsContact C-N 3.26Å; Q25-L27 PolarHBondContact O-N 3.26Å; L27-T29 PolarHBondContact O-N 3.47Å
28	F	55.9	Low	63.4	Low	193 Å²	193	130.9 Å²	130.9	85%	0.846	64%	0.641	S	S	*	*			trans	-74.6	108.2	169.2	-71.9	-85.8	0	0	0	107.4	Y26	Y26-F28 VanDerWaalsContact C-N 3.35Å; Y26-F28 WeakPolarHBondContact O-CD2 3.47Å; Y26-F28 PolarHBondContact O-N 3.42Å
29	T	72.4	Confident	66.2	Low	88 Å²	88	125.6 Å²	125.6	54%	0.54	62%	0.616	S	S	.	*			trans	-90	137.5	170.7	54.5	0	0	0	0	109	L27 K31	L27-T29 PolarHBondContact O-N 3.47Å; T29-K31 PolarHBondContact O-N 3.48Å
30	M	80.4	Confident	69.2	Low	163 Å²	163	115.2 Å²	115.2	80%	0.803	58%	0.578	S	S	*	*			trans	-66.6	134	172.2	-69.2	-141.5	-63.3	0	0	109.2
31	K	93.1	Very high	72.1	Confident	108 Å²	108	109.2 Å²	109.2	47%	0.47	55%	0.545	S	S	.	.	B	Isolated β-bridge	trans	-125.3	138.6	179.1	-69.3	176.5	173.8	-144.2	0	109.3	T29 Q33 D163 G164	T29-K31 PolarHBondContact O-N 3.48Å; K31-Q33 PolarHBondContact O-N 2.91Å; K31-D163 WeakPolarHBondContact CD-O 3.47Å; K31-D163 WeakPolarHBondContact CE-OD2 3.37Å; K31-D163 IonicContact NZ-OD2 3.51Å; K31-D163 PolarHBondContact NZ-OD2 3.31Å; K31-G164 CarbonylContact C-O 3.59Å; K31-G164 VanDerWaalsContact CA-O 3.31Å; K31-G164 WeakPolarHBondContact CA-O 3.42Å
32	L	94.4	Very high	75.2	Confident	43 Å²	43	105.9 Å²	105.9	23%	0.225	52%	0.522	C	S	.	.			trans	-67.9	128	174.2	-175.3	68.1	0	0	0	109.7	F37 L69 L70 L160 G164	L32-F37 HydrophobicContact CD2-CB 4.17Å; L32-F37 HydrophobicContact CD2-CG 4.21Å; L32-L69 HydrophobicContact CD2-CB 3.93Å; L32-L70 HydrophobicContact CD1-CD2 4.42Å; L32-L160 HydrophobicContact CB-CD1 4.24Å; L32-L160 HydrophobicContact CD2-CD2 3.73Å; L32-G164 PolarHBondContact N-O 2.94Å
33	Q	94.9	Very high	78.1	Confident	186 Å²	186	104.5 Å²	104.5	87%	0.869	51%	0.511	S	S	*	.			trans	-138.5	113	171.4	-172.5	177.2	4.5	0	0	108.5	K31	K31-Q33 PolarHBondContact O-N 2.91Å
34	S	95.4	Very high	81	Confident	26 Å²	26	97.1 Å²	97.1	18%	0.182	47%	0.472	C	S	.	.			trans	-152.1	160.3	177.1	89.1	0	0	0	0	111.3	E36 F37 Q38	S34-E36 WeakPolarHBondContact CB-OE2 3.47Å; S34-E36 PolarHBondContact O-N 3.36Å; S34-E36 PolarHBondContact OG-N 3.33Å; S34-E36 PolarHBondContact OG-OE2 3.44Å; S34-F37 PolarHBondContact O-N 3.28Å; S34-F37 PolarHBondContact OG-N 3.36Å; S34-F37 VanDerWaalsContact OG-N 3.17Å; S34-Q38 WeakPolarHBondContact O-CB 3.3Å; S34-Q38 PolarHBondContact O-N 3.37Å
35	P	96.6	Very high	83.8	Confident	97 Å²	97	89.1 Å²	89.1	63%	0.63	44%	0.438	S	S	*	.	H	α-helix	trans	-56.9	-38.1	172.7	-24.2	35	0	0	0	112.8	Q38 S39	P35-Q38 PolarHBondContact O-N 3.05Å; P35-S39 VanDerWaalsContact O-CB 3.3Å; P35-S39 WeakPolarHBondContact O-CB 2.83Å; P35-S39 PolarHBondContact O-N 2.64Å
36	E	96.8	Very high	86.7	Confident	54 Å²	54	85.7 Å²	85.7	25%	0.252	42%	0.42	S	S	.	.	H	α-helix	trans	-64	-46.5	179.8	-58.3	68.6	-139.9	0	0	110.5	S34 S39 L69 K74	S34-E36 WeakPolarHBondContact CB-OE2 3.47Å; S34-E36 PolarHBondContact O-N 3.36Å; S34-E36 PolarHBondContact OG-N 3.33Å; S34-E36 PolarHBondContact OG-OE2 3.44Å; E36-S39 PolarHBondContact O-N 3.25Å; E36-S39 PolarHBondContact O-OG 2.91Å; E36-L69 HydrophobicContact CB-CD2 4.13Å; E36-K74 HydrophobicContact CB-CB 4.34Å
37	F	97.1	Very high	89.5	Confident	12 Å²	12	80 Å²	80	5%	0.053	40%	0.402	C	S	.	.	H	α-helix	trans	-64.9	-45.7	175.8	-177.8	-132.7	0	0	0	111.5	L32 S34 S39 L40 F41 I61 L69 L160	L32-F37 HydrophobicContact CD2-CB 4.17Å; L32-F37 HydrophobicContact CD2-CG 4.21Å; S34-F37 PolarHBondContact O-N 3.28Å; S34-F37 PolarHBondContact OG-N 3.36Å; S34-F37 VanDerWaalsContact OG-N 3.17Å; F37-S39 PolarHBondContact O-N 3.01Å; F37-L40 HydrophobicContact CD2-CD1 4.44Å; F37-L40 WeakPolarHBondContact O-CB 3.35Å; F37-L40 PolarHBondContact O-N 2.82Å; F37-L40 VanDerWaalsContact O-N 3.12Å; F37-F41 HydrophobicContact CD1-CE2 4.19Å; F37-F41 HydrophobicContact CD2-CE2 4.08Å; F37-F41 AromaticContact CE1-CE2 3.91Å; F37-F41 HydrophobicContact CE1-CE2 3.91Å; F37-F41 HydrophobicContact CE1-CZ 4.05Å; F37-F41 AromaticContact CE2-CE2 3.79Å; F37-F41 HydrophobicContact CE2-CE2 3.79Å; F37-F41 AromaticContact CE2-CZ 3.97Å; F37-F41 HydrophobicContact CE2-CZ 3.97Å; F37-F41 HydrophobicContact CG-CE2 4.28Å; F37-F41 AromaticContact CZ-CE2 3.71Å; F37-F41 HydrophobicContact CZ-CE2 3.71Å; F37-F41 AromaticContact CZ-CZ 3.61Å; F37-F41 HydrophobicContact CZ-CZ 3.61Å; F37-F41 WeakPolarHBondContact O-CD2 3.33Å; F37-F41 WeakPolarHBondContact O-CE2 3.41Å; F37-I61 HydrophobicContact CE2-CD1 3.91Å; F37-L69 HydrophobicContact CB-CD2 4.08Å; F37-L69 HydrophobicContact CD2-CD1 3.87Å; F37-L69 HydrophobicContact CD2-CD2 4.49Å; F37-L160 HydrophobicContact CD2-CD2 3.92Å; F37-L160 HydrophobicContact CE2-CD2 3.63Å; F37-L160 HydrophobicContact CE2-CG 4.45Å; F37-L160 HydrophobicContact CZ-CD2 4.1Å
38	Q	95.8	Very high	92.3	Very high	120 Å²	120	72.8 Å²	72.8	56%	0.561	37%	0.365	S	S	*	.	H	α-helix	trans	-61.3	-33.1	178.9	-171	59.7	51.3	0	0	112.3	S34 P35 L40 F41	S34-Q38 WeakPolarHBondContact O-CB 3.3Å; S34-Q38 PolarHBondContact O-N 3.37Å; P35-Q38 PolarHBondContact O-N 3.05Å; Q38-L40 PolarHBondContact O-N 3.4Å; Q38-F41 PolarHBondContact O-N 2.63Å
39	S	95.7	Very high	94.2	Very high	46 Å²	46	64.7 Å²	64.7	32%	0.322	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.6	179.4	81.4	0	0	0	0	114.4	P35 E36 F37 K74	P35-S39 VanDerWaalsContact O-CB 3.3Å; P35-S39 WeakPolarHBondContact O-CB 2.83Å; P35-S39 PolarHBondContact O-N 2.64Å; E36-S39 PolarHBondContact O-N 3.25Å; E36-S39 PolarHBondContact O-OG 2.91Å; F37-S39 PolarHBondContact O-N 3.01Å; S39-K74 VanDerWaalsContact OG-CD 3.29Å; S39-K74 WeakPolarHBondContact OG-CD 3.44Å; S39-K74 VanDerWaalsContact OG-CE 3.29Å; S39-K74 WeakPolarHBondContact OG-CE 3.47Å
40	L	95.5	Very high	95.5	Very high	15 Å²	15	66.3 Å²	66.3	8%	0.079	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-22.1	175.4	-58.9	-174.8	0	0	0	112.7	F37 Q38 T42 L45 I61 L69 K74 P75 V78	F37-L40 HydrophobicContact CD2-CD1 4.44Å; F37-L40 WeakPolarHBondContact O-CB 3.35Å; F37-L40 PolarHBondContact O-N 2.82Å; F37-L40 VanDerWaalsContact O-N 3.12Å; Q38-L40 PolarHBondContact O-N 3.4Å; L40-T42 PolarHBondContact O-N 3.44Å; L40-L45 HydrophobicContact CB-CD2 4.03Å; L40-L45 WeakPolarHBondContact O-CB 3.22Å; L40-L45 WeakPolarHBondContact O-CD2 3.5Å; L40-I61 HydrophobicContact CD1-CD1 4.02Å; L40-L69 HydrophobicContact CD1-CD1 3.92Å; L40-L69 HydrophobicContact CD1-CD2 4.15Å; L40-L69 HydrophobicContact CD1-CG 4.48Å; L40-K74 HydrophobicContact CD2-CG 4.25Å; L40-P75 HydrophobicContact CD1-CG 4.09Å; L40-P75 HydrophobicContact CD2-CG 4.1Å; L40-V78 HydrophobicContact CD1-CG2 4.47Å; L40-V78 HydrophobicContact CD2-CG2 4.21Å
41	F	95.6	Very high	96.3	Very high	39 Å²	39	59.4 Å²	59.4	17%	0.171	30%	0.299	C	S	.	.			trans	-79.5	60.2	-174.3	-67.3	-94.5	0	0	0	112.8	F37 Q38 K46 F162	F37-F41 HydrophobicContact CD1-CE2 4.19Å; F37-F41 HydrophobicContact CD2-CE2 4.08Å; F37-F41 AromaticContact CE1-CE2 3.91Å; F37-F41 HydrophobicContact CE1-CE2 3.91Å; F37-F41 HydrophobicContact CE1-CZ 4.05Å; F37-F41 AromaticContact CE2-CE2 3.79Å; F37-F41 HydrophobicContact CE2-CE2 3.79Å; F37-F41 AromaticContact CE2-CZ 3.97Å; F37-F41 HydrophobicContact CE2-CZ 3.97Å; F37-F41 HydrophobicContact CG-CE2 4.28Å; F37-F41 AromaticContact CZ-CE2 3.71Å; F37-F41 HydrophobicContact CZ-CE2 3.71Å; F37-F41 AromaticContact CZ-CZ 3.61Å; F37-F41 HydrophobicContact CZ-CZ 3.61Å; F37-F41 WeakPolarHBondContact O-CD2 3.33Å; F37-F41 WeakPolarHBondContact O-CE2 3.41Å; Q38-F41 PolarHBondContact O-N 2.63Å; F41-K46 VanDerWaalsContact O-CE 3.22Å; F41-K46 WeakPolarHBondContact O-CE 3.46Å; F41-F162 HydrophobicContact CE1-CB 4.13Å; F41-F162 HydrophobicContact CE1-CD1 4.18Å; F41-F162 HydrophobicContact CZ-CB 4.35Å; F41-F162 HydrophobicContact CZ-CD1 4.36Å; F41-F162 VanDerWaalsContact CZ-O 3.27Å; F41-F162 WeakPolarHBondContact CZ-O 3.2Å
42	T	96.3	Very high	96.5	Very high	38 Å²	38	54.3 Å²	54.3	23%	0.233	28%	0.277	C	S	.	.			trans	-66.8	167.8	170.3	65.3	0	0	0	0	110.6	L40 G44 L45 K46 E118	L40-T42 PolarHBondContact O-N 3.44Å; T42-G44 PolarHBondContact O-N 3.07Å; T42-L45 PolarHBondContact O-N 3.31Å; T42-L45 PolarHBondContact OG1-N 2.95Å; T42-L45 VanDerWaalsContact OG1-N 3.16Å; T42-K46 WeakPolarHBondContact O-CG 3.41Å; T42-K46 PolarHBondContact O-N 3.42Å; T42-E118 WeakPolarHBondContact CB-OE1 3.43Å; T42-E118 WeakPolarHBondContact CB-OE2 3.15Å; T42-E118 WeakPolarHBondContact CG2-OE1 3.28Å; T42-E118 PolarHBondContact OG1-OE2 3.23Å
43	E	96.6	Very high	96.7	Very high	134 Å²	134	57.7 Å²	57.7	63%	0.626	30%	0.299	S	S	*	.	H	α-helix	trans	-61.4	-35.4	173.8	-65.8	-174	175.2	0	0	111.8	N47	E43-N47 WeakPolarHBondContact O-CB 3.26Å; E43-N47 PolarHBondContact O-N 3.21Å; E43-N47 VanDerWaalsContact O-N 3.14Å; E43-N47 PolarHBondContact O-ND2 3.11Å
44	G	96.6	Very high	96.9	Very high	1 Å²	1	56 Å²	56	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-55.1	-55.8	171.2	0	0	0	0	0	112.1	T42 N47 L48 F120	T42-G44 PolarHBondContact O-N 3.07Å; G44-N47 PolarHBondContact O-N 2.94Å; G44-L48 WeakPolarHBondContact O-CB 3.35Å; G44-L48 PolarHBondContact O-N 3.38Å; G44-F120 VanDerWaalsContact C-CZ 3.47Å
45	L	96.6	Very high	97	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.021	30%	0.297	C	S	.	.	H	α-helix	trans	-66.8	-41	-176.9	-174	58.2	0	0	0	112.3	L40 T42 N47 L48 T49 F80 F120 F162	L40-L45 HydrophobicContact CB-CD2 4.03Å; L40-L45 WeakPolarHBondContact O-CB 3.22Å; L40-L45 WeakPolarHBondContact O-CD2 3.5Å; T42-L45 PolarHBondContact O-N 3.31Å; T42-L45 PolarHBondContact OG1-N 2.95Å; T42-L45 VanDerWaalsContact OG1-N 3.16Å; L45-N47 PolarHBondContact O-N 3.38Å; L45-L48 HydrophobicContact CD1-CD2 4.25Å; L45-L48 WeakPolarHBondContact O-CB 3.08Å; L45-L48 PolarHBondContact O-N 3.2Å; L45-T49 HydrophobicContact CD1-CG2 4.23Å; L45-T49 HydrophobicContact CG-CG2 4.38Å; L45-T49 WeakPolarHBondContact O-CG2 3.04Å; L45-T49 PolarHBondContact O-N 3.15Å; L45-T49 PolarHBondContact O-OG1 3.48Å; L45-F80 HydrophobicContact CD1-CE1 3.68Å; L45-F80 HydrophobicContact CD1-CZ 3.61Å; L45-F120 HydrophobicContact CB-CE1 3.96Å; L45-F120 HydrophobicContact CB-CZ 4.33Å; L45-F120 HydrophobicContact CD1-CD1 4.23Å; L45-F120 HydrophobicContact CD1-CE1 3.95Å; L45-F162 HydrophobicContact CD1-CE1 3.84Å; L45-F162 HydrophobicContact CD1-CZ 4.18Å; L45-F162 HydrophobicContact CD2-CD1 4.46Å; L45-F162 HydrophobicContact CD2-CE1 4.02Å; L45-F162 HydrophobicContact CG-CE1 4.19Å
46	K	97.2	Very high	97	Very high	98 Å²	98	60.9 Å²	60.9	43%	0.426	31%	0.305	S	S	.	.	H	α-helix	trans	-57.8	-51.5	177.5	-73.5	172.2	-179.1	168.9	0	111.4	F41 T42 L48 T49 E50	F41-K46 VanDerWaalsContact O-CE 3.22Å; F41-K46 WeakPolarHBondContact O-CE 3.46Å; T42-K46 WeakPolarHBondContact O-CG 3.41Å; T42-K46 PolarHBondContact O-N 3.42Å; K46-L48 VanDerWaalsContact C-N 3.28Å; K46-L48 PolarHBondContact O-N 3.32Å; K46-T49 PolarHBondContact O-N 3.1Å; K46-T49 VanDerWaalsContact O-N 3.14Å; K46-T49 PolarHBondContact O-OG1 3.31Å; K46-E50 WeakPolarHBondContact O-CG 3.42Å; K46-E50 PolarHBondContact O-N 2.92Å
47	N	97.1	Very high	97.1	Very high	63 Å²	63	60.2 Å²	60.2	34%	0.337	30%	0.302	S	S	.	.	H	α-helix	trans	-61.6	-37.1	178	-74.8	-53.9	0	0	0	112.5	E43 G44 L45 L51 L115 H116	E43-N47 WeakPolarHBondContact O-CB 3.26Å; E43-N47 PolarHBondContact O-N 3.21Å; E43-N47 VanDerWaalsContact O-N 3.14Å; E43-N47 PolarHBondContact O-ND2 3.11Å; G44-N47 PolarHBondContact O-N 2.94Å; L45-N47 PolarHBondContact O-N 3.38Å; N47-L51 WeakPolarHBondContact O-CB 3.07Å; N47-L51 PolarHBondContact O-N 3.48Å; N47-L115 HydrophobicContact CB-CD2 4.08Å; N47-H116 PolarHBondContact ND2-CD2 3.37Å; N47-H116 VanDerWaalsContact ND2-CD2 3.32Å; N47-H116 PolarHBondContact ND2-NE2 3.23Å
48	L	97.8	Very high	97.2	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-49.2	174.2	-175.6	68.8	0	0	0	111	G44 L45 K46 E50 L51 F52 L59 F93 L115 F120 I122	G44-L48 WeakPolarHBondContact O-CB 3.35Å; G44-L48 PolarHBondContact O-N 3.38Å; L45-L48 HydrophobicContact CD1-CD2 4.25Å; L45-L48 WeakPolarHBondContact O-CB 3.08Å; L45-L48 PolarHBondContact O-N 3.2Å; K46-L48 VanDerWaalsContact C-N 3.28Å; K46-L48 PolarHBondContact O-N 3.32Å; L48-E50 PolarHBondContact O-N 3.25Å; L48-L51 PolarHBondContact O-N 3.41Å; L48-F52 HydrophobicContact CD1-CD2 4.04Å; L48-F52 HydrophobicContact CD1-CE2 3.66Å; L48-F52 HydrophobicContact CG-CD2 4.28Å; L48-F52 HydrophobicContact CG-CE2 4.24Å; L48-F52 WeakPolarHBondContact O-CD2 3.26Å; L48-F52 PolarHBondContact O-N 3.04Å; L48-F52 VanDerWaalsContact O-N 3.13Å; L48-L59 HydrophobicContact CD2-CD2 4.09Å; L48-L59 HydrophobicContact CG-CD2 4.02Å; L48-F93 HydrophobicContact CD1-CE1 3.91Å; L48-F93 HydrophobicContact CD1-CZ 4.17Å; L48-L115 HydrophobicContact CB-CD2 4.31Å; L48-L115 HydrophobicContact CD1-CD1 4.03Å; L48-F120 HydrophobicContact CD2-CB 3.73Å; L48-F120 HydrophobicContact CD2-CD1 3.72Å; L48-F120 HydrophobicContact CD2-CD2 4.31Å; L48-F120 HydrophobicContact CD2-CE1 4.47Å; L48-F120 HydrophobicContact CD2-CG 3.64Å; L48-I122 HydrophobicContact CD1-CD1 3.84Å; L48-I122 HydrophobicContact CD2-CD1 4.02Å; L48-I122 HydrophobicContact CG-CD1 4.48Å
49	T	97.5	Very high	97.3	Very high	24 Å²	24	59.2 Å²	59.2	15%	0.147	30%	0.298	C	S	.	.	H	α-helix	trans	-63.8	-40.6	-179.9	58.5	0	0	0	0	112.7	L45 K46 L51 F52 V53 L59 F162	L45-T49 HydrophobicContact CD1-CG2 4.23Å; L45-T49 HydrophobicContact CG-CG2 4.38Å; L45-T49 WeakPolarHBondContact O-CG2 3.04Å; L45-T49 PolarHBondContact O-N 3.15Å; L45-T49 PolarHBondContact O-OG1 3.48Å; K46-T49 PolarHBondContact O-N 3.1Å; K46-T49 VanDerWaalsContact O-N 3.14Å; K46-T49 PolarHBondContact O-OG1 3.31Å; T49-L51 VanDerWaalsContact C-N 3.34Å; T49-L51 PolarHBondContact O-N 3.4Å; T49-F52 PolarHBondContact O-N 3.49Å; T49-V53 WeakPolarHBondContact O-CG2 3.48Å; T49-V53 PolarHBondContact O-N 3.25Å; T49-L59 HydrophobicContact CG2-CD2 4.5Å; T49-F162 HydrophobicContact CG2-CB 4.49Å; T49-F162 HydrophobicContact CG2-CD1 3.73Å; T49-F162 HydrophobicContact CG2-CD2 3.49Å; T49-F162 VanDerWaalsContact CG2-CD2 3.49Å; T49-F162 HydrophobicContact CG2-CE1 3.7Å; T49-F162 HydrophobicContact CG2-CE2 3.46Å; T49-F162 VanDerWaalsContact CG2-CE2 3.46Å; T49-F162 HydrophobicContact CG2-CG 3.62Å; T49-F162 HydrophobicContact CG2-CZ 3.55Å
50	E	97.8	Very high	97.4	Very high	122 Å²	122	58.1 Å²	58.1	57%	0.57	29%	0.287	S	S	*	.	H	α-helix	trans	-63.1	-39.8	177.1	-73.4	173.5	-167.6	0	0	111.9	K46 L48 V53 K54	K46-E50 WeakPolarHBondContact O-CG 3.42Å; K46-E50 PolarHBondContact O-N 2.92Å; L48-E50 PolarHBondContact O-N 3.25Å; E50-V53 PolarHBondContact O-N 3.37Å; E50-K54 WeakPolarHBondContact O-CB 3.19Å; E50-K54 PolarHBondContact O-N 3.09Å
51	L	98.1	Very high	97.6	Very high	18 Å²	18	57.4 Å²	57.4	9%	0.094	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-48.8	175.7	179.7	64.5	0	0	0	111.7	N47 L48 T49 V53 K54 E55 M92 F93 A96 I98	N47-L51 WeakPolarHBondContact O-CB 3.07Å; N47-L51 PolarHBondContact O-N 3.48Å; L48-L51 PolarHBondContact O-N 3.41Å; T49-L51 VanDerWaalsContact C-N 3.34Å; T49-L51 PolarHBondContact O-N 3.4Å; L51-V53 VanDerWaalsContact C-N 3.3Å; L51-V53 PolarHBondContact O-N 3.16Å; L51-K54 WeakPolarHBondContact O-CB 3.4Å; L51-K54 PolarHBondContact O-N 3.25Å; L51-K54 VanDerWaalsContact O-N 3.16Å; L51-E55 HydrophobicContact CD1-CG 3.96Å; L51-E55 HydrophobicContact CG-CG 4.45Å; L51-E55 WeakPolarHBondContact O-CG 3.44Å; L51-E55 PolarHBondContact O-N 3.18Å; L51-M92 HydrophobicContact CD1-CG 4.16Å; L51-M92 HydrophobicContact CD2-CG 3.84Å; L51-M92 HydrophobicContact CD2-SD 4.18Å; L51-M92 HydrophobicContact CG-CG 3.94Å; L51-M92 HydrophobicContact CG-SD 3.89Å; L51-F93 HydrophobicContact CD2-CD1 3.89Å; L51-F93 HydrophobicContact CD2-CE1 3.93Å; L51-A96 HydrophobicContact CD1-CB 4.14Å; L51-A96 HydrophobicContact CD2-CB 4.21Å; L51-I98 HydrophobicContact CD2-CD1 3.46Å; L51-I98 VanDerWaalsContact CD2-CD1 3.46Å
52	F	98.4	Very high	97.6	Very high	1 Å²	1	55.6 Å²	55.6	0%	0.004	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-37.3	179.4	-87.6	-102.2	0	0	0	112.2	L48 T49 N56 H57 L59 T82 A84 M89 M92 F93 I122	L48-F52 HydrophobicContact CD1-CD2 4.04Å; L48-F52 HydrophobicContact CD1-CE2 3.66Å; L48-F52 HydrophobicContact CG-CD2 4.28Å; L48-F52 HydrophobicContact CG-CE2 4.24Å; L48-F52 WeakPolarHBondContact O-CD2 3.26Å; L48-F52 PolarHBondContact O-N 3.04Å; L48-F52 VanDerWaalsContact O-N 3.13Å; T49-F52 PolarHBondContact O-N 3.49Å; F52-N56 PolarHBondContact O-N 2.96Å; F52-H57 CarbonylContact C-O 3.41Å; F52-H57 HydrophobicContact CD1-CB 3.84Å; F52-H57 HydrophobicContact CE1-CB 4.45Å; F52-H57 PolarHBondContact O-N 2.97Å; F52-H57 VanDerWaalsContact O-O 3.1Å; F52-L59 HydrophobicContact CB-CB 4.01Å; F52-L59 HydrophobicContact CB-CD2 4.31Å; F52-L59 HydrophobicContact CD1-CB 3.81Å; F52-L59 HydrophobicContact CD1-CD1 4.17Å; F52-L59 HydrophobicContact CD1-CD2 4.39Å; F52-L59 HydrophobicContact CD1-CG 4.34Å; F52-L59 HydrophobicContact CD2-CD2 3.85Å; F52-L59 HydrophobicContact CE1-CB 4.47Å; F52-L59 HydrophobicContact CE1-CD1 4Å; F52-L59 HydrophobicContact CE2-CD1 4.5Å; F52-L59 HydrophobicContact CE2-CD2 4.25Å; F52-L59 HydrophobicContact CG-CB 3.9Å; F52-L59 HydrophobicContact CG-CD1 4.49Å; F52-L59 HydrophobicContact CG-CD2 3.92Å; F52-L59 HydrophobicContact CG-CG 4.33Å; F52-L59 HydrophobicContact CZ-CD1 4.16Å; F52-T82 HydrophobicContact CE1-CG2 4.12Å; F52-T82 VanDerWaalsContact CE1-OG1 3.28Å; F52-T82 WeakPolarHBondContact CE1-OG1 3.29Å; F52-A84 HydrophobicContact CE1-CB 4.24Å; F52-M89 HydrophobicContact CZ-CG 4.29Å; F52-M89 HydrophobicContact CZ-SD 4.24Å; F52-M92 HydrophobicContact CD1-CE 4.3Å; F52-M92 HydrophobicContact CD2-CE 4.47Å; F52-M92 HydrophobicContact CD2-SD 4.41Å; F52-M92 HydrophobicContact CE1-CE 3.82Å; F52-M92 HydrophobicContact CE2-CE 4.03Å; F52-M92 HydrophobicContact CE2-SD 4.43Å; F52-M92 HydrophobicContact CZ-CE 3.69Å; F52-F93 AromaticContact CE2-CE1 3.99Å; F52-F93 HydrophobicContact CE2-CE1 3.99Å; F52-F93 AromaticContact CE2-CZ 3.78Å; F52-F93 HydrophobicContact CE2-CZ 3.78Å; F52-F93 HydrophobicContact CZ-CZ 4.01Å; F52-I122 HydrophobicContact CE2-CD1 4.15Å; F52-I122 HydrophobicContact CZ-CD1 4.15Å; F52-I122 HydrophobicContact CZ-CG2 4.1Å
53	V	97.9	Very high	97.5	Very high	113 Å²	113	53.8 Å²	53.8	69%	0.685	26%	0.264	S	S	*	.	H	α-helix	trans	-63	-46	172.9	170	0	0	0	0	111.2	T49 E50 L51 E55 N56	T49-V53 WeakPolarHBondContact O-CG2 3.48Å; T49-V53 PolarHBondContact O-N 3.25Å; E50-V53 PolarHBondContact O-N 3.37Å; L51-V53 VanDerWaalsContact C-N 3.3Å; L51-V53 PolarHBondContact O-N 3.16Å; V53-E55 VanDerWaalsContact C-N 3.34Å; V53-E55 PolarHBondContact O-N 3.44Å; V53-N56 PolarHBondContact O-N 3.16Å
54	K	97.8	Very high	97.4	Very high	150 Å²	150	48.4 Å²	48.4	65%	0.652	25%	0.245	S	C	*	.	H	α-helix	trans	-61.8	-40.2	179.3	179.4	-172.6	167.8	-164.1	0	112.4	E50 L51 N56	E50-K54 WeakPolarHBondContact O-CB 3.19Å; E50-K54 PolarHBondContact O-N 3.09Å; L51-K54 WeakPolarHBondContact O-CB 3.4Å; L51-K54 PolarHBondContact O-N 3.25Å; L51-K54 VanDerWaalsContact O-N 3.16Å; K54-N56 PolarHBondContact O-N 3.33Å
55	E	97.8	Very high	97.3	Very high	77 Å²	77	48.4 Å²	48.4	36%	0.36	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	11.3	-179.6	-56.9	-60.3	140	0	0	112.8	L51 V53 H57 M92	L51-E55 HydrophobicContact CD1-CG 3.96Å; L51-E55 HydrophobicContact CG-CG 4.45Å; L51-E55 WeakPolarHBondContact O-CG 3.44Å; L51-E55 PolarHBondContact O-N 3.18Å; V53-E55 VanDerWaalsContact C-N 3.34Å; V53-E55 PolarHBondContact O-N 3.44Å; E55-H57 VanDerWaalsContact C-N 3.31Å; E55-H57 PolarHBondContact O-CD2 3.25Å; E55-H57 PolarHBondContact O-N 2.62Å; E55-M92 HydrophobicContact CB-CG 4.49Å; E55-M92 HydrophobicContact CB-SD 3.71Å; E55-M92 HydrophobicContact CG-CG 3.86Å; E55-M92 HydrophobicContact CG-SD 3.63Å
56	N	97.8	Very high	97.4	Very high	149 Å²	149	48.2 Å²	48.2	80%	0.797	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	36.1	175.2	-63.5	106.3	0	0	0	114.8	F52 V53 K54	F52-N56 PolarHBondContact O-N 2.96Å; V53-N56 PolarHBondContact O-N 3.16Å; K54-N56 PolarHBondContact O-N 3.33Å
57	H	98.2	Very high	97.3	Very high	41 Å²	41	44.2 Å²	44.2	19%	0.19	23%	0.226	C	C	.	.			trans	-113.9	135.1	174.5	-67.9	-53.3	0	0	0	111.6	F52 E55 A84	F52-H57 CarbonylContact C-O 3.41Å; F52-H57 HydrophobicContact CD1-CB 3.84Å; F52-H57 HydrophobicContact CE1-CB 4.45Å; F52-H57 PolarHBondContact O-N 2.97Å; F52-H57 VanDerWaalsContact O-O 3.1Å; E55-H57 VanDerWaalsContact C-N 3.31Å; E55-H57 PolarHBondContact O-CD2 3.25Å; E55-H57 PolarHBondContact O-N 2.62Å; H57-A84 HydrophobicContact CB-CB 4Å
58	E	98.4	Very high	97.2	Very high	93 Å²	93	42 Å²	42	44%	0.435	21%	0.214	S	C	.	.			trans	-74.5	136	174.7	-60.8	-170.3	177.9	0	0	110.9	R60 T82 T83 W144	E58-R60 IonicContact OE2-CZ 3.3Å; E58-R60 IonicContact OE2-NE 3.86Å; E58-R60 IonicContact OE2-NH2 2.86Å; E58-R60 PolarHBondContact OE2-NH2 3.14Å; E58-T82 WeakPolarHBondContact O-CA 3.35Å; E58-T82 VanDerWaalsContact O-CB 3.29Å; E58-T82 WeakPolarHBondContact O-CB 3.15Å; E58-T82 PolarHBondContact O-OG1 3.13Å; E58-T83 HydrophobicContact CB-CG2 4.08Å; E58-T83 PolarHBondContact N-OG1 2.86Å; E58-T83 PolarHBondContact O-N 2.89Å; E58-W144 HydrophobicContact CB-CZ2 3.85Å; E58-W144 PolarHBondContact OE2-NE1 3.31Å
59	L	98.6	Very high	97.2	Very high	17 Å²	17	42.1 Å²	42.1	9%	0.089	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	133.4	175.7	-175.6	70.8	0	0	0	108.9	L48 T49 F52 F80 A81 I122 F162	L48-L59 HydrophobicContact CD2-CD2 4.09Å; L48-L59 HydrophobicContact CG-CD2 4.02Å; T49-L59 HydrophobicContact CG2-CD2 4.5Å; F52-L59 HydrophobicContact CB-CB 4.01Å; F52-L59 HydrophobicContact CB-CD2 4.31Å; F52-L59 HydrophobicContact CD1-CB 3.81Å; F52-L59 HydrophobicContact CD1-CD1 4.17Å; F52-L59 HydrophobicContact CD1-CD2 4.39Å; F52-L59 HydrophobicContact CD1-CG 4.34Å; F52-L59 HydrophobicContact CD2-CD2 3.85Å; F52-L59 HydrophobicContact CE1-CB 4.47Å; F52-L59 HydrophobicContact CE1-CD1 4Å; F52-L59 HydrophobicContact CE2-CD1 4.5Å; F52-L59 HydrophobicContact CE2-CD2 4.25Å; F52-L59 HydrophobicContact CG-CB 3.9Å; F52-L59 HydrophobicContact CG-CD1 4.49Å; F52-L59 HydrophobicContact CG-CD2 3.92Å; F52-L59 HydrophobicContact CG-CG 4.33Å; F52-L59 HydrophobicContact CZ-CD1 4.16Å; L59-F80 HydrophobicContact CD1-CB 3.87Å; L59-A81 WeakPolarHBondContact CA-O 3.44Å; L59-I122 HydrophobicContact CD1-CG2 3.78Å; L59-F162 HydrophobicContact CB-CE2 4.04Å; L59-F162 HydrophobicContact CD2-CE2 3.82Å; L59-F162 HydrophobicContact CD2-CZ 3.98Å; L59-F162 HydrophobicContact CG-CE2 3.76Å; L59-F162 HydrophobicContact CG-CZ 4.1Å; L59-F162 VanDerWaalsContact O-CE2 3.29Å; L59-F162 WeakPolarHBondContact O-CE2 3.43Å
60	R	98.6	Very high	97.1	Very high	24 Å²	24	42.9 Å²	42.9	9%	0.091	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	154.5	177.8	-57	-179.7	-166.6	166	3.5	110.7	E58 F80 A81 W144 F159 F167	E58-R60 IonicContact OE2-CZ 3.3Å; E58-R60 IonicContact OE2-NE 3.86Å; E58-R60 IonicContact OE2-NH2 2.86Å; E58-R60 PolarHBondContact OE2-NH2 3.14Å; R60-F80 WeakPolarHBondContact O-CA 3.47Å; R60-A81 PolarHBondContact N-O 3.48Å; R60-A81 PolarHBondContact O-N 2.97Å; R60-W144 HydrophobicContact CB-CH2 3.56Å; R60-W144 HydrophobicContact CB-CZ2 4.45Å; R60-W144 HydrophobicContact CB-CZ3 3.75Å; R60-W144 VanDerWaalsContact CD-CH2 3.45Å; R60-W144 HydrophobicContact CG-CH2 3.39Å; R60-W144 HydrophobicContact CG-CZ2 3.79Å; R60-W144 HydrophobicContact CG-CZ3 3.88Å; R60-W144 VanDerWaalsContact NH1-CD2 3.25Å; R60-W144 VanDerWaalsContact NH1-CG 3.3Å; R60-F159 HydrophobicContact CB-CB 4.15Å; R60-F167 VanDerWaalsContact NH1-CD1 3.28Å; R60-F167 VanDerWaalsContact NH1-CG 3.34Å
61	I	98.3	Very high	96.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	140.3	166.3	-58.9	170.8	0	0	0	107.7	F37 L40 A65 V66 L69 V78 F80 F159 L160 F162	F37-I61 HydrophobicContact CE2-CD1 3.91Å; L40-I61 HydrophobicContact CD1-CD1 4.02Å; I61-A65 HydrophobicContact CG2-CB 3.67Å; I61-V66 HydrophobicContact CB-CG2 4.35Å; I61-V66 HydrophobicContact CG2-CG2 3.87Å; I61-V66 WeakPolarHBondContact O-CG2 3.46Å; I61-L69 HydrophobicContact CD1-CD1 4.29Å; I61-V78 HydrophobicContact CG1-CG1 4.26Å; I61-V78 HydrophobicContact CG2-CG1 3.84Å; I61-F80 HydrophobicContact CG1-CD1 4.21Å; I61-F80 HydrophobicContact CG1-CE1 3.85Å; I61-F159 CarbonylContact O-C 3.58Å; I61-F159 VanDerWaalsContact O-CA 3.23Å; I61-F159 WeakPolarHBondContact O-CA 3.48Å; I61-L160 HydrophobicContact CB-CB 4.26Å; I61-L160 HydrophobicContact CD1-CD2 4.49Å; I61-L160 PolarHBondContact N-O 2.72Å; I61-L160 PolarHBondContact O-N 3.17Å; I61-F162 HydrophobicContact CD1-CE1 4.23Å; I61-F162 HydrophobicContact CG1-CE1 3.92Å; I61-F162 HydrophobicContact CG1-CZ 4.33Å
62	A	97.1	Very high	96.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	151.6	-174.3	0	0	0	0	0	113.6	G64 D79 A81 F159	A62-G64 PolarHBondContact O-N 3.36Å; A62-D79 PolarHBondContact N-O 3.22Å; A62-A81 HydrophobicContact CB-CB 3.8Å; A62-F159 HydrophobicContact CB-CD1 3.66Å; A62-F159 HydrophobicContact CB-CE1 3.85Å
63	G	93.9	Very high	96.4	Very high	1 Å²	1	44 Å²	44	1%	0.01	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	-122.1	162	0	0	0	0	0	115.3	A65 V66 R67 N156 M158	G63-A65 VanDerWaalsContact C-N 3.25Å; G63-A65 PolarHBondContact O-N 3.3Å; G63-V66 WeakPolarHBondContact O-CB 3.14Å; G63-V66 PolarHBondContact O-N 3.08Å; G63-V66 VanDerWaalsContact O-N 3.08Å; G63-R67 PolarHBondContact O-N 3.48Å; G63-N156 VanDerWaalsContact CA-O 3.26Å; G63-N156 WeakPolarHBondContact CA-O 3.49Å; G63-M158 PolarHBondContact N-O 2.92Å
64	G	93.3	Very high	96.3	Very high	21 Å²	21	44 Å²	44	22%	0.216	23%	0.23	C	C	.	.	H	α-helix	trans	-63.3	-30.1	-168.2	0	0	0	0	0	114.4	A62 R67 D68	A62-G64 PolarHBondContact O-N 3.36Å; G64-R67 VanDerWaalsContact CA-NH1 3.3Å; G64-R67 PolarHBondContact O-N 3.26Å; G64-R67 PolarHBondContact O-NH2 3.2Å; G64-D68 PolarHBondContact O-N 2.89Å; G64-D68 VanDerWaalsContact O-N 3.08Å
65	A	95.8	Very high	96.1	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-67.8	-37.8	175.8	0	0	0	0	0	112.1	I61 G63 D68 L69 P75 V78	I61-A65 HydrophobicContact CG2-CB 3.67Å; G63-A65 VanDerWaalsContact C-N 3.25Å; G63-A65 PolarHBondContact O-N 3.3Å; A65-D68 PolarHBondContact O-N 3.04Å; A65-L69 WeakPolarHBondContact O-CG 3.23Å; A65-L69 PolarHBondContact O-N 3.48Å; A65-P75 HydrophobicContact CB-CB 3.82Å; A65-P75 HydrophobicContact CB-CG 4.04Å; A65-V78 HydrophobicContact CB-CB 4.47Å; A65-V78 HydrophobicContact CB-CG1 4.05Å
66	V	97.4	Very high	95.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.8	-45.6	175.6	-176.5	0	0	0	0	110.4	I61 G63 D68 L69 L70 M158 L160 L166	I61-V66 HydrophobicContact CB-CG2 4.35Å; I61-V66 HydrophobicContact CG2-CG2 3.87Å; I61-V66 WeakPolarHBondContact O-CG2 3.46Å; G63-V66 WeakPolarHBondContact O-CB 3.14Å; G63-V66 PolarHBondContact O-N 3.08Å; G63-V66 VanDerWaalsContact O-N 3.08Å; V66-D68 VanDerWaalsContact C-N 3.34Å; V66-D68 PolarHBondContact O-N 3.3Å; V66-L69 PolarHBondContact O-N 2.83Å; V66-L70 HydrophobicContact CG1-CD1 3.96Å; V66-L70 HydrophobicContact CG1-CG 4.38Å; V66-L70 WeakPolarHBondContact O-CB 3.17Å; V66-L70 VanDerWaalsContact O-CG 3.31Å; V66-L70 WeakPolarHBondContact O-CG 3.34Å; V66-L70 PolarHBondContact O-N 3.44Å; V66-M158 HydrophobicContact CG1-CB 3.9Å; V66-L160 HydrophobicContact CG1-CB 4.18Å; V66-L160 HydrophobicContact CG2-CB 3.9Å; V66-L166 HydrophobicContact CG1-CD1 3.69Å
67	R	96.5	Very high	94.9	Very high	14 Å²	14	41.7 Å²	41.7	5%	0.053	22%	0.222	C	C	.	.	H	α-helix	trans	-58.4	-43.5	175.9	-173.2	-160.4	62.8	-105.6	-12.3	112.6	G63 G64 N71 I155 N156 L176	G63-R67 PolarHBondContact O-N 3.48Å; G64-R67 VanDerWaalsContact CA-NH1 3.3Å; G64-R67 PolarHBondContact O-N 3.26Å; G64-R67 PolarHBondContact O-NH2 3.2Å; R67-N71 PolarHBondContact O-N 3.35Å; R67-N71 VanDerWaalsContact O-N 3.15Å; R67-N71 PolarHBondContact O-ND2 2.99Å; R67-I155 WeakPolarHBondContact CB-O 3.21Å; R67-I155 HydrophobicContact CG-CB 4.39Å; R67-N156 PolarHBondContact NH1-OD1 3.44Å; R67-L176 HydrophobicContact CG-CD1 3.81Å; R67-L176 HydrophobicContact CG-CD2 4.1Å
68	D	95.4	Very high	94.6	Very high	17 Å²	17	41 Å²	41	9%	0.091	22%	0.221	C	C	.	.	H	α-helix	trans	-67.4	-43.4	-180	-73.4	-18.8	0	0	0	110.9	G64 A65 V66 L70 N71 G72 V73 P75 R207	G64-D68 PolarHBondContact O-N 2.89Å; G64-D68 VanDerWaalsContact O-N 3.08Å; A65-D68 PolarHBondContact O-N 3.04Å; V66-D68 VanDerWaalsContact C-N 3.34Å; V66-D68 PolarHBondContact O-N 3.3Å; D68-L70 PolarHBondContact O-N 3.03Å; D68-N71 CarbonylContact O-C 3.56Å; D68-N71 WeakPolarHBondContact O-CA 3.4Å; D68-N71 PolarHBondContact O-N 3Å; D68-N71 VanDerWaalsContact O-N 3.08Å; D68-G72 PolarHBondContact O-N 3.36Å; D68-V73 CarbonylContact C-O 3.56Å; D68-V73 HydrophobicContact CB-CB 4.39Å; D68-V73 PolarHBondContact O-N 3.2Å; D68-V73 VanDerWaalsContact O-O 3.08Å; D68-P75 HydrophobicContact CB-CB 4.33Å; D68-R207 VanDerWaalsContact CG-NH2 3.33Å; D68-R207 IonicContact OD1-CZ 2.77Å; D68-R207 IonicContact OD1-NE 3.31Å; D68-R207 IonicContact OD1-NH2 2.8Å; D68-R207 PolarHBondContact OD1-NH2 3.32Å; D68-R207 IonicContact OD2-NH2 2.84Å; D68-R207 PolarHBondContact OD2-NH2 3.16Å
69	L	96.8	Very high	94.4	Very high	2 Å²	2	40 Å²	40	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-43.7	174.9	-74.1	173.5	0	0	0	112.7	L32 E36 F37 L40 I61 A65 V66 N71 G72 V73 P75 L160	L32-L69 HydrophobicContact CD2-CB 3.93Å; E36-L69 HydrophobicContact CB-CD2 4.13Å; F37-L69 HydrophobicContact CB-CD2 4.08Å; F37-L69 HydrophobicContact CD2-CD1 3.87Å; F37-L69 HydrophobicContact CD2-CD2 4.49Å; L40-L69 HydrophobicContact CD1-CD1 3.92Å; L40-L69 HydrophobicContact CD1-CD2 4.15Å; L40-L69 HydrophobicContact CD1-CG 4.48Å; I61-L69 HydrophobicContact CD1-CD1 4.29Å; A65-L69 WeakPolarHBondContact O-CG 3.23Å; A65-L69 PolarHBondContact O-N 3.48Å; V66-L69 PolarHBondContact O-N 2.83Å; L69-N71 PolarHBondContact O-N 2.88Å; L69-G72 PolarHBondContact O-N 3.12Å; L69-V73 PolarHBondContact N-O 3.27Å; L69-P75 HydrophobicContact CD2-CG 4.4Å; L69-P75 HydrophobicContact CG-CG 4.24Å; L69-L160 HydrophobicContact CD1-CD2 3.7Å
70	L	95.7	Very high	94.4	Very high	40 Å²	40	39.5 Å²	39.5	21%	0.209	22%	0.215	C	C	.	.	H	α-helix	trans	-66.7	-22.1	176.6	-69.2	172.8	0	0	0	113	L32 V66 D68 G72 M158 L166 Y173 L176	L32-L70 HydrophobicContact CD1-CD2 4.42Å; V66-L70 HydrophobicContact CG1-CD1 3.96Å; V66-L70 HydrophobicContact CG1-CG 4.38Å; V66-L70 WeakPolarHBondContact O-CB 3.17Å; V66-L70 VanDerWaalsContact O-CG 3.31Å; V66-L70 WeakPolarHBondContact O-CG 3.34Å; V66-L70 PolarHBondContact O-N 3.44Å; D68-L70 PolarHBondContact O-N 3.03Å; L70-G72 VanDerWaalsContact C-N 3.33Å; L70-M158 HydrophobicContact CD1-CE 3.67Å; L70-M158 HydrophobicContact CD1-SD 3.78Å; L70-L166 HydrophobicContact CD1-CD1 4.11Å; L70-L166 HydrophobicContact CD1-CD2 4.29Å; L70-Y173 HydrophobicContact CD1-CD2 4.19Å; L70-Y173 HydrophobicContact CD2-CD2 4.13Å; L70-Y173 HydrophobicContact CD2-CE2 4.18Å; L70-L176 HydrophobicContact CB-CD2 3.53Å; L70-L176 HydrophobicContact CD1-CD2 4.02Å; L70-L176 HydrophobicContact CG-CD2 4.45Å
71	N	92.9	Very high	94.4	Very high	55 Å²	55	38.4 Å²	38.4	29%	0.294	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	5.6	171	-83.7	-42.5	0	0	0	113.4	R67 D68 L69 V73	R67-N71 PolarHBondContact O-N 3.35Å; R67-N71 VanDerWaalsContact O-N 3.15Å; R67-N71 PolarHBondContact O-ND2 2.99Å; D68-N71 CarbonylContact O-C 3.56Å; D68-N71 WeakPolarHBondContact O-CA 3.4Å; D68-N71 PolarHBondContact O-N 3Å; D68-N71 VanDerWaalsContact O-N 3.08Å; L69-N71 PolarHBondContact O-N 2.88Å; N71-V73 VanDerWaalsContact C-N 3.35Å
72	G	93.6	Very high	94.4	Very high	43 Å²	43	38.4 Å²	38.4	44%	0.443	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	29.1	-178.6	0	0	0	0	0	113.6	D68 L69 L70	D68-G72 PolarHBondContact O-N 3.36Å; L69-G72 PolarHBondContact O-N 3.12Å; L70-G72 VanDerWaalsContact C-N 3.33Å
73	V	93.5	Very high	94.4	Very high	66 Å²	66	39.4 Å²	39.4	40%	0.4	22%	0.218	S	C	.	.			trans	-118.2	133.1	177.9	-179.7	0	0	0	0	109.6	D68 L69 N71 P75	D68-V73 CarbonylContact C-O 3.56Å; D68-V73 HydrophobicContact CB-CB 4.39Å; D68-V73 PolarHBondContact O-N 3.2Å; D68-V73 VanDerWaalsContact O-O 3.08Å; L69-V73 PolarHBondContact N-O 3.27Å; N71-V73 VanDerWaalsContact C-N 3.35Å; V73-P75 WeakPolarHBondContact O-CD 3.38Å
74	K	94.1	Very high	94.6	Very high	113 Å²	113	39.4 Å²	39.4	49%	0.491	22%	0.217	S	C	.	.			trans	-67.2	121.9	171.6	-173.5	-175.6	-178.2	172.7	0	109.7	E36 S39 L40	E36-K74 HydrophobicContact CB-CB 4.34Å; S39-K74 VanDerWaalsContact OG-CD 3.29Å; S39-K74 WeakPolarHBondContact OG-CD 3.44Å; S39-K74 VanDerWaalsContact OG-CE 3.29Å; S39-K74 WeakPolarHBondContact OG-CE 3.47Å; L40-K74 HydrophobicContact CD2-CG 4.25Å
75	P	93.5	Very high	94.8	Very high	6 Å²	6	40.6 Å²	40.6	4%	0.039	22%	0.221	C	C	.	.			trans	-66.5	142.2	174.5	27.9	-34.5	0	0	0	110.9	L40 A65 D68 L69 V73 V78	L40-P75 HydrophobicContact CD1-CG 4.09Å; L40-P75 HydrophobicContact CD2-CG 4.1Å; A65-P75 HydrophobicContact CB-CB 3.82Å; A65-P75 HydrophobicContact CB-CG 4.04Å; D68-P75 HydrophobicContact CB-CB 4.33Å; L69-P75 HydrophobicContact CD2-CG 4.4Å; L69-P75 HydrophobicContact CG-CG 4.24Å; V73-P75 WeakPolarHBondContact O-CD 3.38Å; P75-V78 HydrophobicContact CB-CG2 4.16Å; P75-V78 HydrophobicContact CG-CG2 3.78Å
76	Q	84.8	Confident	94.7	Very high	186 Å²	186	40.8 Å²	40.8	87%	0.869	22%	0.222	S	C	*	.	S	Bend	trans	-82.7	-47.1	175.7	-67.4	-175.5	4.4	0	0	111.2
77	D	86.3	Confident	94.6	Very high	135 Å²	135	44.6 Å²	44.6	72%	0.722	25%	0.245	S	C	*	.	S	Bend	trans	-109.9	125.3	174.8	-57.6	-49.7	0	0	0	108.3
78	V	92.8	Very high	94.6	Very high	28 Å²	28	47.4 Å²	47.4	17%	0.17	26%	0.259	C	S	.	.			trans	-110.4	109.9	-179.9	-172.2	0	0	0	0	109.1	L40 I61 A65 P75 F80	L40-V78 HydrophobicContact CD1-CG2 4.47Å; L40-V78 HydrophobicContact CD2-CG2 4.21Å; I61-V78 HydrophobicContact CG1-CG1 4.26Å; I61-V78 HydrophobicContact CG2-CG1 3.84Å; A65-V78 HydrophobicContact CB-CB 4.47Å; A65-V78 HydrophobicContact CB-CG1 4.05Å; P75-V78 HydrophobicContact CB-CG2 4.16Å; P75-V78 HydrophobicContact CG-CG2 3.78Å; V78-F80 HydrophobicContact CB-CE2 3.99Å; V78-F80 HydrophobicContact CB-CZ 3.97Å; V78-F80 HydrophobicContact CG1-CD1 4.44Å; V78-F80 HydrophobicContact CG1-CD2 4.48Å; V78-F80 HydrophobicContact CG1-CE1 3.78Å; V78-F80 HydrophobicContact CG1-CE2 3.79Å; V78-F80 HydrophobicContact CG1-CZ 3.41Å; V78-F80 VanDerWaalsContact CG1-CZ 3.41Å; V78-F80 WeakPolarHBondContact O-CD2 3.26Å; V78-F80 WeakPolarHBondContact O-CE2 3.39Å
79	D	93.9	Very high	94.7	Very high	70 Å²	70	46.6 Å²	46.6	37%	0.374	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	131.3	172.2	-62	-30.1	0	0	0	109.5	A62	A62-D79 PolarHBondContact N-O 3.22Å
80	F	97.8	Very high	94.6	Very high	7 Å²	7	48.4 Å²	48.4	3%	0.031	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	144.1	172.9	-58.7	-83.5	0	0	0	110.8	L45 L59 R60 I61 V78 F120 E121 I122 T123 F162	L45-F80 HydrophobicContact CD1-CE1 3.68Å; L45-F80 HydrophobicContact CD1-CZ 3.61Å; L59-F80 HydrophobicContact CD1-CB 3.87Å; R60-F80 WeakPolarHBondContact O-CA 3.47Å; I61-F80 HydrophobicContact CG1-CD1 4.21Å; I61-F80 HydrophobicContact CG1-CE1 3.85Å; V78-F80 HydrophobicContact CB-CE2 3.99Å; V78-F80 HydrophobicContact CB-CZ 3.97Å; V78-F80 HydrophobicContact CG1-CD1 4.44Å; V78-F80 HydrophobicContact CG1-CD2 4.48Å; V78-F80 HydrophobicContact CG1-CE1 3.78Å; V78-F80 HydrophobicContact CG1-CE2 3.79Å; V78-F80 HydrophobicContact CG1-CZ 3.41Å; V78-F80 VanDerWaalsContact CG1-CZ 3.41Å; V78-F80 WeakPolarHBondContact O-CD2 3.26Å; V78-F80 WeakPolarHBondContact O-CE2 3.39Å; F80-F120 HydrophobicContact CD2-CB 4.38Å; F80-F120 HydrophobicContact CD2-CD1 4.46Å; F80-F120 HydrophobicContact CE2-CB 4.29Å; F80-F120 AromaticContact CE2-CD1 3.63Å; F80-F120 HydrophobicContact CE2-CD1 3.63Å; F80-F120 HydrophobicContact CE2-CG 4.46Å; F80-F120 HydrophobicContact CZ-CD1 4.01Å; F80-E121 PolarHBondContact N-O 3.43Å; F80-I122 HydrophobicContact CB-CB 4.4Å; F80-I122 HydrophobicContact CB-CG1 4.04Å; F80-I122 HydrophobicContact CB-CG2 4.32Å; F80-I122 HydrophobicContact CD2-CG1 4.42Å; F80-T123 PolarHBondContact O-N 3.06Å; F80-F162 HydrophobicContact CD1-CE1 4.41Å; F80-F162 AromaticContact CD1-CZ 3.83Å; F80-F162 HydrophobicContact CD1-CZ 3.83Å; F80-F162 AromaticContact CE1-CE1 3.87Å; F80-F162 HydrophobicContact CE1-CE1 3.87Å; F80-F162 AromaticContact CE1-CZ 3.72Å; F80-F162 HydrophobicContact CE1-CZ 3.72Å
81	A	98.3	Very high	94.6	Very high	2 Å²	2	51.8 Å²	51.8	2%	0.017	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	144.8	173.4	0	0	0	0	0	110.4	L59 R60 A62 T123 L125 W144 F159	L59-A81 WeakPolarHBondContact CA-O 3.44Å; R60-A81 PolarHBondContact N-O 3.48Å; R60-A81 PolarHBondContact O-N 2.97Å; A62-A81 HydrophobicContact CB-CB 3.8Å; A81-T123 VanDerWaalsContact CA-O 3.28Å; A81-T123 WeakPolarHBondContact CA-O 3.37Å; A81-L125 HydrophobicContact CB-CD2 3.87Å; A81-W144 HydrophobicContact CB-CH2 4.22Å; A81-W144 HydrophobicContact CB-CZ3 3.78Å; A81-W144 WeakPolarHBondContact O-CH2 3.32Å; A81-F159 HydrophobicContact CB-CD1 4.16Å; A81-F159 HydrophobicContact CB-CE1 3.89Å
82	T	98.6	Very high	94.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	153.7	-177.6	-174.7	0	0	0	0	113.6	F52 E58 A84 M89 I122 T123 T124 L125	F52-T82 HydrophobicContact CE1-CG2 4.12Å; F52-T82 VanDerWaalsContact CE1-OG1 3.28Å; F52-T82 WeakPolarHBondContact CE1-OG1 3.29Å; E58-T82 WeakPolarHBondContact O-CA 3.35Å; E58-T82 VanDerWaalsContact O-CB 3.29Å; E58-T82 WeakPolarHBondContact O-CB 3.15Å; E58-T82 PolarHBondContact O-OG1 3.13Å; T82-A84 VanDerWaalsContact C-N 3.29Å; T82-A84 HydrophobicContact CG2-CB 4.01Å; T82-A84 WeakPolarHBondContact CG2-O 3.1Å; T82-A84 PolarHBondContact OG1-N 3.02Å; T82-A84 VanDerWaalsContact OG1-N 3.11Å; T82-M89 HydrophobicContact CG2-CE 4.15Å; T82-M89 HydrophobicContact CG2-SD 3.7Å; T82-I122 HydrophobicContact CG2-CG2 3.57Å; T82-T123 PolarHBondContact N-O 3.29Å; T82-T124 WeakPolarHBondContact O-CA 3.07Å; T82-L125 WeakPolarHBondContact O-CG 3.26Å; T82-L125 PolarHBondContact O-N 3.19Å
83	T	98.4	Very high	95	Very high	21 Å²	21	47.7 Å²	47.7	13%	0.129	25%	0.245	C	C	.	.	S	Bend	trans	-76.1	-15.2	169.2	49.7	0	0	0	0	113.1	E58 L125 T142 W144	E58-T83 HydrophobicContact CB-CG2 4.08Å; E58-T83 PolarHBondContact N-OG1 2.86Å; E58-T83 PolarHBondContact O-N 2.89Å; T83-L125 HydrophobicContact CG2-CD1 3.95Å; T83-T142 HydrophobicContact CG2-CG2 4.22Å; T83-W144 HydrophobicContact CG2-CZ2 4.33Å
84	A	97.9	Very high	95.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.254	C	S	.	.	S	Bend	trans	-69.5	132.3	175.5	0	0	0	0	0	111.3	F52 H57 T82 Q88 M89 M92 T124	F52-A84 HydrophobicContact CE1-CB 4.24Å; H57-A84 HydrophobicContact CB-CB 4Å; T82-A84 VanDerWaalsContact C-N 3.29Å; T82-A84 HydrophobicContact CG2-CB 4.01Å; T82-A84 WeakPolarHBondContact CG2-O 3.1Å; T82-A84 PolarHBondContact OG1-N 3.02Å; T82-A84 VanDerWaalsContact OG1-N 3.11Å; A84-Q88 HydrophobicContact CB-CB 4.44Å; A84-M89 HydrophobicContact CB-CG 3.73Å; A84-M92 HydrophobicContact CB-CE 4.48Å; A84-T124 WeakPolarHBondContact O-CB 3.22Å; A84-T124 VanDerWaalsContact O-CG2 3.25Å; A84-T124 WeakPolarHBondContact O-CG2 3.46Å; A84-T124 PolarHBondContact O-OG1 3.37Å
85	T	96.3	Very high	95.2	Very high	46 Å²	46	50.3 Å²	50.3	28%	0.282	27%	0.266	S	S	.	.			trans	-69.4	161.3	172	62.7	0	0	0	0	111.5	T87 Q88 M89	T85-T87 PolarHBondContact O-N 3.16Å; T85-Q88 PolarHBondContact O-N 2.99Å; T85-Q88 VanDerWaalsContact O-N 3.16Å; T85-Q88 WeakPolarHBondContact OG1-CG 3.26Å; T85-Q88 PolarHBondContact OG1-N 3.4Å; T85-Q88 PolarHBondContact OG1-OE1 3.38Å; T85-M89 PolarHBondContact O-N 2.77Å
86	P	94.9	Very high	95.3	Very high	5 Å²	5	52.4 Å²	52.4	3%	0.032	29%	0.285	C	S	.	.	H	α-helix	trans	-58.2	-35.7	177.3	-26.1	37	0	0	0	113.1	K90 E106 I111 T124 F140	P86-K90 VanDerWaalsContact O-CG 3.3Å; P86-K90 WeakPolarHBondContact O-CG 3.5Å; P86-K90 PolarHBondContact O-N 3.21Å; P86-E106 HydrophobicContact CB-CG 4.23Å; P86-I111 HydrophobicContact CB-CD1 4.37Å; P86-I111 HydrophobicContact CB-CG1 4.24Å; P86-T124 VanDerWaalsContact CD-OG1 3.27Å; P86-T124 WeakPolarHBondContact CD-OG1 3.5Å; P86-F140 HydrophobicContact CG-CE1 4.32Å; P86-F140 HydrophobicContact CG-CE2 3.91Å; P86-F140 HydrophobicContact CG-CZ 3.66Å
87	T	94.2	Very high	95.9	Very high	81 Å²	81	47 Å²	47	50%	0.497	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-49.6	175.5	-53.3	0	0	0	0	111.4	T85 M89 K90 E91	T85-T87 PolarHBondContact O-N 3.16Å; T87-M89 PolarHBondContact O-N 2.82Å; T87-K90 WeakPolarHBondContact O-CB 3.27Å; T87-K90 PolarHBondContact O-N 3.24Å; T87-E91 WeakPolarHBondContact O-CG 3.36Å; T87-E91 PolarHBondContact O-N 3.49Å
88	Q	96.9	Very high	96.3	Very high	73 Å²	73	42 Å²	42	34%	0.341	25%	0.252	S	S	.	.	H	α-helix	trans	-60.8	-43.6	177	-73.5	165.2	-46.2	0	0	111.8	A84 T85 K90 E91 M92	A84-Q88 HydrophobicContact CB-CB 4.44Å; T85-Q88 PolarHBondContact O-N 2.99Å; T85-Q88 VanDerWaalsContact O-N 3.16Å; T85-Q88 WeakPolarHBondContact OG1-CG 3.26Å; T85-Q88 PolarHBondContact OG1-N 3.4Å; T85-Q88 PolarHBondContact OG1-OE1 3.38Å; Q88-K90 VanDerWaalsContact C-N 3.32Å; Q88-K90 PolarHBondContact O-N 2.85Å; Q88-E91 PolarHBondContact O-N 2.84Å; Q88-M92 WeakPolarHBondContact O-CB 3.37Å; Q88-M92 PolarHBondContact O-N 3.01Å
89	M	96.8	Very high	96.4	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59	-43.1	175.7	-75	-166.5	-76.2	0	0	112.1	F52 T82 A84 T85 T87 M92 F93 I111 I122 T124	F52-M89 HydrophobicContact CZ-CG 4.29Å; F52-M89 HydrophobicContact CZ-SD 4.24Å; T82-M89 HydrophobicContact CG2-CE 4.15Å; T82-M89 HydrophobicContact CG2-SD 3.7Å; A84-M89 HydrophobicContact CB-CG 3.73Å; T85-M89 PolarHBondContact O-N 2.77Å; T87-M89 PolarHBondContact O-N 2.82Å; M89-M92 HydrophobicContact CB-CE 4.39Å; M89-M92 HydrophobicContact CG-CE 4.05Å; M89-M92 PolarHBondContact O-N 3.49Å; M89-F93 HydrophobicContact CB-CD2 4.26Å; M89-F93 HydrophobicContact CB-CE2 3.91Å; M89-F93 HydrophobicContact CG-CE2 4.43Å; M89-F93 WeakPolarHBondContact O-CB 3.42Å; M89-F93 WeakPolarHBondContact O-CD2 3.27Å; M89-F93 VanDerWaalsContact O-CG 3.23Å; M89-F93 WeakPolarHBondContact O-CG 3.41Å; M89-F93 PolarHBondContact O-N 2.63Å; M89-I111 HydrophobicContact CB-CG1 4.28Å; M89-I111 HydrophobicContact CE-CB 4.07Å; M89-I111 HydrophobicContact CE-CG1 3.8Å; M89-I111 HydrophobicContact SD-CB 4.31Å; M89-I122 HydrophobicContact SD-CB 4.01Å; M89-I122 HydrophobicContact SD-CG2 3.53Å; M89-I122 VanDerWaalsContact SD-CG2 3.53Å; M89-T124 WeakPolarHBondContact CE-OG1 3.46Å
90	K	94.8	Very high	96.4	Very high	39 Å²	39	47.7 Å²	47.7	17%	0.17	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-48.7	177.2	-77.3	172.9	166.7	-167.3	0	112.4	P86 T87 Q88 M92 F93 Q94 M100 E106 I111	P86-K90 VanDerWaalsContact O-CG 3.3Å; P86-K90 WeakPolarHBondContact O-CG 3.5Å; P86-K90 PolarHBondContact O-N 3.21Å; T87-K90 WeakPolarHBondContact O-CB 3.27Å; T87-K90 PolarHBondContact O-N 3.24Å; Q88-K90 VanDerWaalsContact C-N 3.32Å; Q88-K90 PolarHBondContact O-N 2.85Å; K90-M92 VanDerWaalsContact C-N 3.33Å; K90-F93 PolarHBondContact O-N 3.09Å; K90-Q94 VanDerWaalsContact O-CB 3.27Å; K90-Q94 WeakPolarHBondContact O-CB 3.42Å; K90-Q94 WeakPolarHBondContact O-CG 3.48Å; K90-Q94 PolarHBondContact O-N 3.46Å; K90-M100 HydrophobicContact CB-CE 4.2Å; K90-M100 HydrophobicContact CB-SD 4.21Å; K90-M100 HydrophobicContact CG-CE 4.04Å; K90-M100 HydrophobicContact CG-SD 3.74Å; K90-E106 VanDerWaalsContact CE-CD 3.43Å; K90-E106 VanDerWaalsContact CE-OE1 3.3Å; K90-E106 WeakPolarHBondContact CE-OE1 3.34Å; K90-E106 WeakPolarHBondContact CE-OE2 3.36Å; K90-E106 IonicContact NZ-OE1 3.11Å; K90-E106 PolarHBondContact NZ-OE1 3.08Å; K90-E106 IonicContact NZ-OE2 3.34Å; K90-E106 PolarHBondContact NZ-OE2 3.12Å; K90-I111 HydrophobicContact CD-CD1 4.47Å; K90-I111 HydrophobicContact CG-CD1 4.08Å
91	E	96.1	Very high	95.9	Very high	112 Å²	112	48.8 Å²	48.8	52%	0.523	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-44.3	179.4	-71	171.9	178.8	0	0	111	T87 Q88 Q94 S95	T87-E91 WeakPolarHBondContact O-CG 3.36Å; T87-E91 PolarHBondContact O-N 3.49Å; Q88-E91 PolarHBondContact O-N 2.84Å; E91-Q94 PolarHBondContact O-N 3.03Å; E91-S95 VanDerWaalsContact O-CB 3.24Å; E91-S95 WeakPolarHBondContact O-CB 3.37Å; E91-S95 PolarHBondContact O-N 3.21Å; E91-S95 PolarHBondContact O-OG 3.36Å
92	M	97.3	Very high	94.5	Very high	11 Å²	11	54.6 Å²	54.6	5%	0.054	30%	0.304	C	S	.	.	H	α-helix	trans	-58.4	-52.1	174.7	166	170.8	45.3	0	0	111.7	L51 F52 E55 A84 Q88 M89 K90 S95 A96	L51-M92 HydrophobicContact CD1-CG 4.16Å; L51-M92 HydrophobicContact CD2-CG 3.84Å; L51-M92 HydrophobicContact CD2-SD 4.18Å; L51-M92 HydrophobicContact CG-CG 3.94Å; L51-M92 HydrophobicContact CG-SD 3.89Å; F52-M92 HydrophobicContact CD1-CE 4.3Å; F52-M92 HydrophobicContact CD2-CE 4.47Å; F52-M92 HydrophobicContact CD2-SD 4.41Å; F52-M92 HydrophobicContact CE1-CE 3.82Å; F52-M92 HydrophobicContact CE2-CE 4.03Å; F52-M92 HydrophobicContact CE2-SD 4.43Å; F52-M92 HydrophobicContact CZ-CE 3.69Å; E55-M92 HydrophobicContact CB-CG 4.49Å; E55-M92 HydrophobicContact CB-SD 3.71Å; E55-M92 HydrophobicContact CG-CG 3.86Å; E55-M92 HydrophobicContact CG-SD 3.63Å; A84-M92 HydrophobicContact CB-CE 4.48Å; Q88-M92 WeakPolarHBondContact O-CB 3.37Å; Q88-M92 PolarHBondContact O-N 3.01Å; M89-M92 HydrophobicContact CB-CE 4.39Å; M89-M92 HydrophobicContact CG-CE 4.05Å; M89-M92 PolarHBondContact O-N 3.49Å; K90-M92 VanDerWaalsContact C-N 3.33Å; M92-S95 PolarHBondContact O-N 3.28Å; M92-A96 VanDerWaalsContact O-CB 3.31Å; M92-A96 WeakPolarHBondContact O-CB 3.43Å; M92-A96 PolarHBondContact O-N 3.43Å
93	F	96.9	Very high	92.8	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-67.3	-39.7	-179.3	-66	-43.3	0	0	0	112.5	L48 L51 F52 M89 K90 A96 G97 I98 M100 I111 A113 I122	L48-F93 HydrophobicContact CD1-CE1 3.91Å; L48-F93 HydrophobicContact CD1-CZ 4.17Å; L51-F93 HydrophobicContact CD2-CD1 3.89Å; L51-F93 HydrophobicContact CD2-CE1 3.93Å; F52-F93 AromaticContact CE2-CE1 3.99Å; F52-F93 HydrophobicContact CE2-CE1 3.99Å; F52-F93 AromaticContact CE2-CZ 3.78Å; F52-F93 HydrophobicContact CE2-CZ 3.78Å; F52-F93 HydrophobicContact CZ-CZ 4.01Å; M89-F93 HydrophobicContact CB-CD2 4.26Å; M89-F93 HydrophobicContact CB-CE2 3.91Å; M89-F93 HydrophobicContact CG-CE2 4.43Å; M89-F93 WeakPolarHBondContact O-CB 3.42Å; M89-F93 WeakPolarHBondContact O-CD2 3.27Å; M89-F93 VanDerWaalsContact O-CG 3.23Å; M89-F93 WeakPolarHBondContact O-CG 3.41Å; M89-F93 PolarHBondContact O-N 2.63Å; K90-F93 PolarHBondContact O-N 3.09Å; F93-A96 CarbonylContact O-C 3.55Å; F93-A96 PolarHBondContact O-N 2.97Å; F93-G97 PolarHBondContact O-N 3.46Å; F93-G97 VanDerWaalsContact O-N 3.1Å; F93-I98 HydrophobicContact CB-CB 4.13Å; F93-I98 HydrophobicContact CB-CG2 4.36Å; F93-I98 HydrophobicContact CD1-CB 4.15Å; F93-I98 HydrophobicContact CD1-CD1 4.04Å; F93-I98 HydrophobicContact CD1-CG2 3.97Å; F93-I98 HydrophobicContact CG-CG2 4.33Å; F93-I98 PolarHBondContact O-N 3.43Å; F93-M100 HydrophobicContact CB-CE 4.49Å; F93-M100 HydrophobicContact CB-CG 3.99Å; F93-M100 HydrophobicContact CB-SD 4.04Å; F93-M100 HydrophobicContact CD2-CG 3.89Å; F93-M100 HydrophobicContact CD2-SD 3.84Å; F93-M100 HydrophobicContact CG-CG 4.28Å; F93-M100 HydrophobicContact CG-SD 4.43Å; F93-I111 HydrophobicContact CD2-CG2 3.98Å; F93-I111 HydrophobicContact CE2-CG2 3.81Å; F93-A113 HydrophobicContact CD1-CB 4.31Å; F93-A113 HydrophobicContact CD2-CB 4.24Å; F93-A113 HydrophobicContact CE1-CB 3.95Å; F93-A113 HydrophobicContact CE2-CB 3.88Å; F93-A113 HydrophobicContact CG-CB 4.47Å; F93-A113 HydrophobicContact CZ-CB 3.74Å; F93-I122 HydrophobicContact CE2-CD1 4.26Å; F93-I122 HydrophobicContact CZ-CD1 3.65Å
94	Q	95.9	Very high	91.2	Very high	126 Å²	126	67.8 Å²	67.8	59%	0.589	36%	0.364	S	S	*	.	H	α-helix	trans	-62.8	-45.4	175.8	-73.9	170	5.5	0	0	111.5	K90 E91 A96 G97 M100	K90-Q94 VanDerWaalsContact O-CB 3.27Å; K90-Q94 WeakPolarHBondContact O-CB 3.42Å; K90-Q94 WeakPolarHBondContact O-CG 3.48Å; K90-Q94 PolarHBondContact O-N 3.46Å; E91-Q94 PolarHBondContact O-N 3.03Å; Q94-A96 VanDerWaalsContact C-N 3.27Å; Q94-A96 PolarHBondContact O-N 3.44Å; Q94-G97 PolarHBondContact O-N 3.01Å; Q94-G97 VanDerWaalsContact O-N 3.07Å; Q94-M100 HydrophobicContact CG-CE 3.79Å
95	S	96.4	Very high	89.8	Confident	108 Å²	108	69 Å²	69	76%	0.755	38%	0.376	S	S	*	.	H	α-helix	trans	-65	-32.9	178.5	-58.3	0	0	0	0	112.2	E91 M92 G97	E91-S95 VanDerWaalsContact O-CB 3.24Å; E91-S95 WeakPolarHBondContact O-CB 3.37Å; E91-S95 PolarHBondContact O-N 3.21Å; E91-S95 PolarHBondContact O-OG 3.36Å; M92-S95 PolarHBondContact O-N 3.28Å; S95-G97 VanDerWaalsContact C-N 3.3Å
96	A	96.1	Very high	88.8	Confident	51 Å²	51	69.7 Å²	69.7	42%	0.421	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-1.7	175	0	0	0	0	0	114	L51 M92 F93 Q94 I98	L51-A96 HydrophobicContact CD1-CB 4.14Å; L51-A96 HydrophobicContact CD2-CB 4.21Å; M92-A96 VanDerWaalsContact O-CB 3.31Å; M92-A96 WeakPolarHBondContact O-CB 3.43Å; M92-A96 PolarHBondContact O-N 3.43Å; F93-A96 CarbonylContact O-C 3.55Å; F93-A96 PolarHBondContact O-N 2.97Å; Q94-A96 VanDerWaalsContact C-N 3.27Å; Q94-A96 PolarHBondContact O-N 3.44Å; A96-I98 HydrophobicContact CB-CD1 3.76Å; A96-I98 HydrophobicContact CB-CG1 4.05Å; A96-I98 PolarHBondContact O-N 3.35Å
97	G	96.3	Very high	87.9	Confident	71 Å²	71	78 Å²	78	73%	0.732	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	20.9	-176.2	0	0	0	0	0	114.1	F93 Q94 S95	F93-G97 PolarHBondContact O-N 3.46Å; F93-G97 VanDerWaalsContact O-N 3.1Å; Q94-G97 PolarHBondContact O-N 3.01Å; Q94-G97 VanDerWaalsContact O-N 3.07Å; S95-G97 VanDerWaalsContact C-N 3.3Å
98	I	96.3	Very high	87	Confident	32 Å²	32	78.1 Å²	78.1	16%	0.164	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-86.9	130	-179.2	-68	165.5	0	0	0	109.7	L51 F93 A96 A113 L115	L51-I98 HydrophobicContact CD2-CD1 3.46Å; L51-I98 VanDerWaalsContact CD2-CD1 3.46Å; F93-I98 HydrophobicContact CB-CB 4.13Å; F93-I98 HydrophobicContact CB-CG2 4.36Å; F93-I98 HydrophobicContact CD1-CB 4.15Å; F93-I98 HydrophobicContact CD1-CD1 4.04Å; F93-I98 HydrophobicContact CD1-CG2 3.97Å; F93-I98 HydrophobicContact CG-CG2 4.33Å; F93-I98 PolarHBondContact O-N 3.43Å; A96-I98 HydrophobicContact CB-CD1 3.76Å; A96-I98 HydrophobicContact CB-CG1 4.05Å; A96-I98 PolarHBondContact O-N 3.35Å; I98-A113 HydrophobicContact CG2-CB 4.15Å; I98-L115 HydrophobicContact CD1-CD2 3.83Å; I98-L115 HydrophobicContact CD1-CG 4.25Å; I98-L115 HydrophobicContact CG1-CD2 4.4Å; I98-L115 HydrophobicContact CG1-CG 4.39Å; I98-L115 HydrophobicContact CG2-CD1 3.85Å; I98-L115 HydrophobicContact CG2-CG 3.96Å
99	R	94.7	Very high	86.6	Confident	174 Å²	174	74.7 Å²	74.7	66%	0.657	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	131.5	178.3	-177.1	177.9	178.8	180	1.5	110.4	R114	R99-R114 PolarHBondContact O-N 3.49Å
100	M	94	Very high	86.4	Confident	42 Å²	42	75.5 Å²	75.5	21%	0.207	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	148.1	168	-64.8	175.4	-75.1	0	0	111.1	K90 F93 Q94 I111 T112	K90-M100 HydrophobicContact CB-CE 4.2Å; K90-M100 HydrophobicContact CB-SD 4.21Å; K90-M100 HydrophobicContact CG-CE 4.04Å; K90-M100 HydrophobicContact CG-SD 3.74Å; F93-M100 HydrophobicContact CB-CE 4.49Å; F93-M100 HydrophobicContact CB-CG 3.99Å; F93-M100 HydrophobicContact CB-SD 4.04Å; F93-M100 HydrophobicContact CD2-CG 3.89Å; F93-M100 HydrophobicContact CD2-SD 3.84Å; F93-M100 HydrophobicContact CG-CG 4.28Å; F93-M100 HydrophobicContact CG-SD 4.43Å; Q94-M100 HydrophobicContact CG-CE 3.79Å; M100-I111 HydrophobicContact CG-CG2 4.09Å; M100-I111 HydrophobicContact SD-CG2 3.83Å; M100-T112 CarbonylContact C-O 3.57Å; M100-T112 VanDerWaalsContact CA-O 3.3Å; M100-T112 WeakPolarHBondContact CA-O 3.47Å
101	I	86.2	Confident	86.4	Confident	30 Å²	30	73.8 Å²	73.8	15%	0.154	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	134.9	179.3	-61.1	179.2	0	0	0	108.5	T112 R114 N119	I101-T112 HydrophobicContact CB-CG2 4.29Å; I101-T112 PolarHBondContact N-O 2.88Å; I101-T112 WeakPolarHBondContact O-CB 3.3Å; I101-R114 HydrophobicContact CD1-CB 3.85Å; I101-R114 HydrophobicContact CD1-CG 4.25Å; I101-R114 HydrophobicContact CG1-CB 4.24Å; I101-N119 WeakPolarHBondContact CD1-OD1 3.42Å
102	N	68.5	Low	86.4	Confident	125 Å²	125	69.6 Å²	69.6	67%	0.668	37%	0.37	S	S	*	.			trans	58.5	93.8	169.3	-63.7	-16.1	0	0	0	116.7	K104	N102-K104 PolarHBondContact O-N 3.41Å
103	N	62.9	Low	86.3	Confident	104 Å²	104	69 Å²	69	56%	0.556	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	5.1	174.3	-61.1	1.6	0	0	0	114.6
104	K	66.3	Low	86.2	Confident	194 Å²	194	73.9 Å²	73.9	84%	0.843	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-28.4	-177.4	-71.3	-173	179.4	-179.8	0	112.9	N102 E106	N102-K104 PolarHBondContact O-N 3.41Å; K104-E106 VanDerWaalsContact C-N 3.32Å
105	G	68.5	Low	86.1	Confident	25 Å²	25	68.5 Å²	68.5	26%	0.258	36%	0.361	S	S	.	.	S	Bend	trans	-78.7	-12.1	179.4	0	0	0	0	0	114.6	K107 H108 G109 T110	G105-K107 VanDerWaalsContact C-N 3.28Å; G105-K107 PolarHBondContact O-N 3.46Å; G105-H108 PolarHBondContact O-N 3.11Å; G105-G109 PolarHBondContact O-N 2.96Å; G105-T110 CarbonylContact C-O 3.51Å; G105-T110 VanDerWaalsContact C-O 3.26Å; G105-T110 PolarHBondContact O-N 3.39Å; G105-T110 VanDerWaalsContact O-N 3.16Å
106	E	75	Confident	86	Confident	60 Å²	60	68.1 Å²	68.1	28%	0.28	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-59.9	-36.9	-173.6	-179.2	-178.5	-177.2	0	0	113.1	P86 K90 K104 H108 G109 T110 I111	P86-E106 HydrophobicContact CB-CG 4.23Å; K90-E106 VanDerWaalsContact CE-CD 3.43Å; K90-E106 VanDerWaalsContact CE-OE1 3.3Å; K90-E106 WeakPolarHBondContact CE-OE1 3.34Å; K90-E106 WeakPolarHBondContact CE-OE2 3.36Å; K90-E106 IonicContact NZ-OE1 3.11Å; K90-E106 PolarHBondContact NZ-OE1 3.08Å; K90-E106 IonicContact NZ-OE2 3.34Å; K90-E106 PolarHBondContact NZ-OE2 3.12Å; K104-E106 VanDerWaalsContact C-N 3.32Å; E106-H108 PolarHBondContact O-N 3.4Å; E106-G109 PolarHBondContact O-N 3.21Å; E106-T110 WeakPolarHBondContact CA-O 3.22Å; E106-T110 PolarHBondContact N-O 3.35Å; E106-I111 HydrophobicContact CB-CD1 4.46Å; E106-I111 HydrophobicContact CG-CD1 4.43Å
107	K	75	Confident	85.7	Confident	181 Å²	181	73.7 Å²	73.7	79%	0.787	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-58.7	-20.5	176.8	-68.3	-172.7	176.6	-173.1	0	113.2	G105	G105-K107 VanDerWaalsContact C-N 3.28Å; G105-K107 PolarHBondContact O-N 3.46Å
108	H	76.9	Confident	85.6	Confident	83 Å²	83	73.8 Å²	73.8	38%	0.384	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-109.2	10.7	178.7	-56.1	-60.2	0	0	0	112.6	G105 E106 R126	G105-H108 PolarHBondContact O-N 3.11Å; E106-H108 PolarHBondContact O-N 3.4Å; H108-R126 PolarHBondContact O-NH1 3.47Å
109	G	87.9	Confident	85.5	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	9.6	177.3	0	0	0	0	0	115.3	G105 E106 T123 T124	G105-G109 PolarHBondContact O-N 2.96Å; E106-G109 PolarHBondContact O-N 3.21Å; G109-T123 WeakPolarHBondContact O-CA 3.39Å; G109-T124 PolarHBondContact O-N 2.6Å
110	T	92.6	Very high	85.5	Confident	17 Å²	17	69 Å²	69	10%	0.104	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	130	-173.1	-55.4	0	0	0	0	111.9	G105 E106 E121 I122 T123	G105-T110 CarbonylContact C-O 3.51Å; G105-T110 VanDerWaalsContact C-O 3.26Å; G105-T110 PolarHBondContact O-N 3.39Å; G105-T110 VanDerWaalsContact O-N 3.16Å; E106-T110 WeakPolarHBondContact CA-O 3.22Å; E106-T110 PolarHBondContact N-O 3.35Å; T110-E121 HydrophobicContact CG2-CG 3.3Å; T110-I122 WeakPolarHBondContact CA-O 3.46Å; T110-T123 PolarHBondContact OG1-OG1 2.9Å
111	I	94.8	Very high	85.6	Confident	4 Å²	4	71.3 Å²	71.3	2%	0.021	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.9	171.5	-62.2	-64.5	0	0	0	108.5	P86 M89 K90 F93 M100 E106 I122	P86-I111 HydrophobicContact CB-CD1 4.37Å; P86-I111 HydrophobicContact CB-CG1 4.24Å; M89-I111 HydrophobicContact CB-CG1 4.28Å; M89-I111 HydrophobicContact CE-CB 4.07Å; M89-I111 HydrophobicContact CE-CG1 3.8Å; M89-I111 HydrophobicContact SD-CB 4.31Å; K90-I111 HydrophobicContact CD-CD1 4.47Å; K90-I111 HydrophobicContact CG-CD1 4.08Å; F93-I111 HydrophobicContact CD2-CG2 3.98Å; F93-I111 HydrophobicContact CE2-CG2 3.81Å; M100-I111 HydrophobicContact CG-CG2 4.09Å; M100-I111 HydrophobicContact SD-CG2 3.83Å; E106-I111 HydrophobicContact CB-CD1 4.46Å; E106-I111 HydrophobicContact CG-CD1 4.43Å; I111-I122 PolarHBondContact N-O 2.71Å; I111-I122 PolarHBondContact O-N 2.98Å
112	T	95.1	Very high	86.1	Confident	23 Å²	23	69.9 Å²	69.9	14%	0.141	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	116.8	172.2	-48.6	0	0	0	0	109.8	M100 I101 N119 F120	M100-T112 CarbonylContact C-O 3.57Å; M100-T112 VanDerWaalsContact CA-O 3.3Å; M100-T112 WeakPolarHBondContact CA-O 3.47Å; I101-T112 HydrophobicContact CB-CG2 4.29Å; I101-T112 PolarHBondContact N-O 2.88Å; I101-T112 WeakPolarHBondContact O-CB 3.3Å; T112-N119 HydrophobicContact CG2-CB 3.99Å; T112-F120 CarbonylContact C-O 3.58Å; T112-F120 VanDerWaalsContact CA-O 3.25Å; T112-F120 WeakPolarHBondContact CA-O 3.47Å
113	A	95.2	Very high	87.4	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	146.9	174.2	0	0	0	0	0	110.7	F93 I98 L115 N119 F120 I122	F93-A113 HydrophobicContact CD1-CB 4.31Å; F93-A113 HydrophobicContact CD2-CB 4.24Å; F93-A113 HydrophobicContact CE1-CB 3.95Å; F93-A113 HydrophobicContact CE2-CB 3.88Å; F93-A113 HydrophobicContact CG-CB 4.47Å; F93-A113 HydrophobicContact CZ-CB 3.74Å; I98-A113 HydrophobicContact CG2-CB 4.15Å; A113-L115 HydrophobicContact CB-CD1 3.75Å; A113-N119 CarbonylContact O-C 3.53Å; A113-N119 WeakPolarHBondContact O-CA 3.47Å; A113-F120 PolarHBondContact N-O 3.26Å; A113-F120 PolarHBondContact O-N 3.38Å; A113-I122 HydrophobicContact CB-CD1 4.36Å
114	R	95.3	Very high	89	Confident	102 Å²	102	59.9 Å²	59.9	39%	0.385	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	115.7	172.8	-167.1	-177	-166.3	138.3	-2.5	110.8	R99 I101 E117 E118 N119	R99-R114 PolarHBondContact O-N 3.49Å; I101-R114 HydrophobicContact CD1-CB 3.85Å; I101-R114 HydrophobicContact CD1-CG 4.25Å; I101-R114 HydrophobicContact CG1-CB 4.24Å; R114-E117 PolarHBondContact NE-O 3.08Å; R114-E117 PolarHBondContact NH2-O 3.22Å; R114-E117 VanDerWaalsContact NH2-O 3.09Å; R114-E118 CarbonylContact C-O 3.57Å; R114-E118 VanDerWaalsContact CA-O 3.24Å; R114-E118 WeakPolarHBondContact CA-O 3.4Å; R114-E118 WeakPolarHBondContact CG-O 3.46Å; R114-N119 WeakPolarHBondContact CG-OD1 3.15Å
115	L	94.5	Very high	90.5	Very high	13 Å²	13	50.7 Å²	50.7	7%	0.068	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	134	176.2	-62	86.8	0	0	0	108.3	N47 L48 I98 A113 E117 E118 F120	N47-L115 HydrophobicContact CB-CD2 4.08Å; L48-L115 HydrophobicContact CB-CD2 4.31Å; L48-L115 HydrophobicContact CD1-CD1 4.03Å; I98-L115 HydrophobicContact CD1-CD2 3.83Å; I98-L115 HydrophobicContact CD1-CG 4.25Å; I98-L115 HydrophobicContact CG1-CD2 4.4Å; I98-L115 HydrophobicContact CG1-CG 4.39Å; I98-L115 HydrophobicContact CG2-CD1 3.85Å; I98-L115 HydrophobicContact CG2-CG 3.96Å; A113-L115 HydrophobicContact CB-CD1 3.75Å; L115-E117 VanDerWaalsContact C-N 3.29Å; L115-E117 PolarHBondContact O-N 3.33Å; L115-E118 PolarHBondContact N-O 3.1Å; L115-E118 PolarHBondContact O-N 3.43Å; L115-F120 HydrophobicContact CB-CD2 4.49Å; L115-F120 HydrophobicContact CB-CE2 4.04Å; L115-F120 HydrophobicContact CD1-CD2 3.82Å; L115-F120 HydrophobicContact CD1-CE2 4.21Å
116	H	92.9	Very high	91.7	Very high	100 Å²	100	51.7 Å²	51.7	46%	0.463	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	48.7	176.5	-65.8	-71.7	0	0	0	113.7	N47 E118	N47-H116 PolarHBondContact ND2-CD2 3.37Å; N47-H116 VanDerWaalsContact ND2-CD2 3.32Å; N47-H116 PolarHBondContact ND2-NE2 3.23Å; H116-E118 PolarHBondContact O-N 3.12Å
117	E	90.8	Very high	92.5	Very high	167 Å²	167	51 Å²	51	78%	0.78	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.4	-3.5	-178.9	-54.3	-175.5	170.6	0	0	116.2	R114 L115	R114-E117 PolarHBondContact NE-O 3.08Å; R114-E117 PolarHBondContact NH2-O 3.22Å; R114-E117 VanDerWaalsContact NH2-O 3.09Å; L115-E117 VanDerWaalsContact C-N 3.29Å; L115-E117 PolarHBondContact O-N 3.33Å
118	E	93.5	Very high	93	Very high	74 Å²	74	44.4 Å²	44.4	35%	0.346	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	146.9	179	-66.9	175.7	-177.8	0	0	111.8	T42 R114 L115 H116 F120	T42-E118 WeakPolarHBondContact CB-OE1 3.43Å; T42-E118 WeakPolarHBondContact CB-OE2 3.15Å; T42-E118 WeakPolarHBondContact CG2-OE1 3.28Å; T42-E118 PolarHBondContact OG1-OE2 3.23Å; R114-E118 CarbonylContact C-O 3.57Å; R114-E118 VanDerWaalsContact CA-O 3.24Å; R114-E118 WeakPolarHBondContact CA-O 3.4Å; R114-E118 WeakPolarHBondContact CG-O 3.46Å; L115-E118 PolarHBondContact N-O 3.1Å; L115-E118 PolarHBondContact O-N 3.43Å; H116-E118 PolarHBondContact O-N 3.12Å; E118-F120 HydrophobicContact CB-CE2 3.73Å; E118-F120 HydrophobicContact CB-CZ 3.78Å; E118-F120 WeakPolarHBondContact OE2-CZ 3.43Å
119	N	94.3	Very high	93.1	Very high	92 Å²	92	44.2 Å²	44.2	49%	0.492	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.3	177.6	-59.5	-28.9	0	0	0	109.8	I101 T112 A113 R114	I101-N119 WeakPolarHBondContact CD1-OD1 3.42Å; T112-N119 HydrophobicContact CG2-CB 3.99Å; A113-N119 CarbonylContact O-C 3.53Å; A113-N119 WeakPolarHBondContact O-CA 3.47Å; R114-N119 WeakPolarHBondContact CG-OD1 3.15Å
120	F	95.3	Very high	92.4	Very high	12 Å²	12	49 Å²	49	5%	0.053	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	114.4	179.9	-59.6	-86.8	0	0	0	109.4	G44 L45 L48 F80 T112 A113 L115 E118 I122	G44-F120 VanDerWaalsContact C-CZ 3.47Å; L45-F120 HydrophobicContact CB-CE1 3.96Å; L45-F120 HydrophobicContact CB-CZ 4.33Å; L45-F120 HydrophobicContact CD1-CD1 4.23Å; L45-F120 HydrophobicContact CD1-CE1 3.95Å; L48-F120 HydrophobicContact CD2-CB 3.73Å; L48-F120 HydrophobicContact CD2-CD1 3.72Å; L48-F120 HydrophobicContact CD2-CD2 4.31Å; L48-F120 HydrophobicContact CD2-CE1 4.47Å; L48-F120 HydrophobicContact CD2-CG 3.64Å; F80-F120 HydrophobicContact CD2-CB 4.38Å; F80-F120 HydrophobicContact CD2-CD1 4.46Å; F80-F120 HydrophobicContact CE2-CB 4.29Å; F80-F120 AromaticContact CE2-CD1 3.63Å; F80-F120 HydrophobicContact CE2-CD1 3.63Å; F80-F120 HydrophobicContact CE2-CG 4.46Å; F80-F120 HydrophobicContact CZ-CD1 4.01Å; T112-F120 CarbonylContact C-O 3.58Å; T112-F120 VanDerWaalsContact CA-O 3.25Å; T112-F120 WeakPolarHBondContact CA-O 3.47Å; A113-F120 PolarHBondContact N-O 3.26Å; A113-F120 PolarHBondContact O-N 3.38Å; L115-F120 HydrophobicContact CB-CD2 4.49Å; L115-F120 HydrophobicContact CB-CE2 4.04Å; L115-F120 HydrophobicContact CD1-CD2 3.82Å; L115-F120 HydrophobicContact CD1-CE2 4.21Å; E118-F120 HydrophobicContact CB-CE2 3.73Å; E118-F120 HydrophobicContact CB-CZ 3.78Å; E118-F120 WeakPolarHBondContact OE2-CZ 3.43Å; F120-I122 HydrophobicContact CB-CD1 4.27Å; F120-I122 HydrophobicContact CB-CG1 4.31Å
121	E	95.2	Very high	91.5	Very high	91 Å²	91	50.1 Å²	50.1	43%	0.425	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	112.8	176.1	-170.2	169.8	143.5	0	0	110	F80 T110	F80-E121 PolarHBondContact N-O 3.43Å; T110-E121 HydrophobicContact CG2-CG 3.3Å
122	I	96.8	Very high	90.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	121.9	-171.5	-52.6	156.4	0	0	0	108.4	L48 F52 L59 F80 T82 M89 F93 T110 I111 A113 F120	L48-I122 HydrophobicContact CD1-CD1 3.84Å; L48-I122 HydrophobicContact CD2-CD1 4.02Å; L48-I122 HydrophobicContact CG-CD1 4.48Å; F52-I122 HydrophobicContact CE2-CD1 4.15Å; F52-I122 HydrophobicContact CZ-CD1 4.15Å; F52-I122 HydrophobicContact CZ-CG2 4.1Å; L59-I122 HydrophobicContact CD1-CG2 3.78Å; F80-I122 HydrophobicContact CB-CB 4.4Å; F80-I122 HydrophobicContact CB-CG1 4.04Å; F80-I122 HydrophobicContact CB-CG2 4.32Å; F80-I122 HydrophobicContact CD2-CG1 4.42Å; T82-I122 HydrophobicContact CG2-CG2 3.57Å; M89-I122 HydrophobicContact SD-CB 4.01Å; M89-I122 HydrophobicContact SD-CG2 3.53Å; M89-I122 VanDerWaalsContact SD-CG2 3.53Å; F93-I122 HydrophobicContact CE2-CD1 4.26Å; F93-I122 HydrophobicContact CZ-CD1 3.65Å; T110-I122 WeakPolarHBondContact CA-O 3.46Å; I111-I122 PolarHBondContact N-O 2.71Å; I111-I122 PolarHBondContact O-N 2.98Å; A113-I122 HydrophobicContact CB-CD1 4.36Å; F120-I122 HydrophobicContact CB-CD1 4.27Å; F120-I122 HydrophobicContact CB-CG1 4.31Å
123	T	96.3	Very high	89	Confident	19 Å²	19	54.3 Å²	54.3	12%	0.117	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	127	-175	-60	0	0	0	0	110.8	F80 A81 T82 G109 T110	F80-T123 PolarHBondContact O-N 3.06Å; A81-T123 VanDerWaalsContact CA-O 3.28Å; A81-T123 WeakPolarHBondContact CA-O 3.37Å; T82-T123 PolarHBondContact N-O 3.29Å; G109-T123 WeakPolarHBondContact O-CA 3.39Å; T110-T123 PolarHBondContact OG1-OG1 2.9Å
124	T	97.2	Very high	87.8	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	136.2	171.3	-53.3	0	0	0	0	110.3	T82 A84 P86 M89 G109 R126 F140	T82-T124 WeakPolarHBondContact O-CA 3.07Å; A84-T124 WeakPolarHBondContact O-CB 3.22Å; A84-T124 VanDerWaalsContact O-CG2 3.25Å; A84-T124 WeakPolarHBondContact O-CG2 3.46Å; A84-T124 PolarHBondContact O-OG1 3.37Å; P86-T124 VanDerWaalsContact CD-OG1 3.27Å; P86-T124 WeakPolarHBondContact CD-OG1 3.5Å; M89-T124 WeakPolarHBondContact CE-OG1 3.46Å; G109-T124 PolarHBondContact O-N 2.6Å; T124-R126 PolarHBondContact O-N 2.77Å; T124-F140 HydrophobicContact CG2-CB 3.89Å; T124-F140 HydrophobicContact CG2-CD1 3.53Å; T124-F140 HydrophobicContact CG2-CE1 4.27Å; T124-F140 HydrophobicContact CG2-CG 3.77Å
125	L	97.5	Very high	86.8	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.312	C	S	.	.			trans	-55.6	138	171.8	-60.1	173.6	0	0	0	110.1	A81 T82 T83 F140 T141 W144 D147 F159	A81-L125 HydrophobicContact CB-CD2 3.87Å; T82-L125 WeakPolarHBondContact O-CG 3.26Å; T82-L125 PolarHBondContact O-N 3.19Å; T83-L125 HydrophobicContact CG2-CD1 3.95Å; L125-F140 WeakPolarHBondContact O-CA 3.27Å; L125-T141 HydrophobicContact CB-CG2 3.94Å; L125-T141 WeakPolarHBondContact CB-O 3.41Å; L125-T141 PolarHBondContact O-N 3.08Å; L125-W144 HydrophobicContact CD1-CD2 3.64Å; L125-W144 HydrophobicContact CD1-CE3 4.01Å; L125-W144 HydrophobicContact CD1-CG 3.94Å; L125-W144 HydrophobicContact CD1-CH2 4.49Å; L125-W144 HydrophobicContact CD1-CZ2 4.18Å; L125-W144 HydrophobicContact CD1-CZ3 4.43Å; L125-W144 HydrophobicContact CD2-CD2 4.11Å; L125-W144 HydrophobicContact CD2-CE3 3.58Å; L125-W144 HydrophobicContact CD2-CH2 4.3Å; L125-W144 HydrophobicContact CD2-CZ3 3.7Å; L125-W144 HydrophobicContact CG-CD2 4.48Å; L125-W144 HydrophobicContact CG-CE3 4.38Å; L125-W144 HydrophobicContact CG-CZ3 4.49Å; L125-D147 WeakPolarHBondContact CA-OD1 3.13Å; L125-D147 HydrophobicContact CB-CB 4.05Å; L125-D147 HydrophobicContact CD2-CB 3.52Å; L125-D147 HydrophobicContact CG-CB 4.31Å; L125-F159 HydrophobicContact CD2-CE1 4.35Å; L125-F159 HydrophobicContact CD2-CZ 4.34Å
126	R	93.9	Very high	85.7	Confident	46 Å²	46	62.8 Å²	62.8	17%	0.174	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	163.8	-175.1	69.4	-171.5	-170.5	-118.2	-5.2	113.1	H108 T124 D128 V138 E139 F140 D147 R150	H108-R126 PolarHBondContact O-NH1 3.47Å; T124-R126 PolarHBondContact O-N 2.77Å; R126-D128 IonicContact NE-OD1 3.54Å; R126-V138 HydrophobicContact CB-CB 4.28Å; R126-V138 HydrophobicContact CG-CB 4.48Å; R126-E139 CarbonylContact C-O 3.13Å; R126-E139 WeakPolarHBondContact CA-O 3.12Å; R126-F140 HydrophobicContact CB-CD1 4.12Å; R126-D147 PolarHBondContact N-OD1 3.4Å; R126-R150 VanDerWaalsContact CG-NE 3.28Å; R126-R150 WeakPolarHBondContact O-CD 3.09Å; R126-R150 PolarHBondContact O-NE 3.48Å; R126-R150 VanDerWaalsContact O-NE 3.1Å
127	I	90.9	Very high	85.3	Confident	46 Å²	46	64.7 Å²	64.7	24%	0.236	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.2	171.6	-55.9	166.6	0	0	0	106.4	V138 E139 T141 K146	I127-V138 WeakPolarHBondContact O-CA 3.47Å; I127-E139 PolarHBondContact N-O 3.48Å; I127-E139 PolarHBondContact O-N 2.73Å; I127-T141 HydrophobicContact CD1-CG2 4.39Å; I127-T141 HydrophobicContact CG1-CG2 4.07Å; I127-K146 HydrophobicContact CD1-CB 4.21Å; I127-K146 HydrophobicContact CD1-CD 3.57Å; I127-K146 HydrophobicContact CD1-CG 4.5Å; I127-K146 HydrophobicContact CG1-CB 4.02Å; I127-K146 HydrophobicContact CG1-CD 4.3Å
128	D	85.6	Confident	85.1	Confident	42 Å²	42	58.1 Å²	58.1	23%	0.225	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	114.4	175.6	-60.4	-34.6	0	0	0	108.1	R126 A136 V138	R126-D128 IonicContact NE-OD1 3.54Å; D128-A136 HydrophobicContact CB-CB 4.37Å; D128-V138 WeakPolarHBondContact OD1-CG1 3.35Å
129	V	79.1	Confident	85	Confident	79 Å²	79	60.3 Å²	60.3	48%	0.479	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-40.2	-176.4	179	0	0	0	0	111.1	E137 E139	V129-E137 PolarHBondContact N-O 2.95Å; V129-E139 HydrophobicContact CG2-CB 4.06Å
130	T	74.7	Confident	85	Confident	100 Å²	100	59.5 Å²	59.5	61%	0.613	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.3	131.1	171.5	-61.3	0	0	0	0	107.1	A136 E137	T130-A136 VanDerWaalsContact O-CA 3.26Å; T130-A136 WeakPolarHBondContact O-CA 3.22Å; T130-E137 PolarHBondContact O-N 3.33Å; T130-E137 VanDerWaalsContact O-N 3.07Å
131	T	73.1	Confident	85.1	Confident	41 Å²	41	60 Å²	60	25%	0.252	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	141.1	-178.8	-167.4	0	0	0	0	112	G133 H135 E193	T131-G133 PolarHBondContact OG1-N 2.84Å; T131-H135 WeakPolarHBondContact CA-O 3.35Å; T131-H135 PolarHBondContact OG1-O 3.28Å; T131-E193 HydrophobicContact CG2-CB 4.14Å; T131-E193 HydrophobicContact CG2-CG 4.35Å
132	D	68.8	Low	85.2	Confident	92 Å²	92	60.4 Å²	60.4	49%	0.492	32%	0.316	S	S	.	.			trans	-105.4	13.8	162.7	70.6	5.4	0	0	0	111.5	R134 H135 E193	D132-R134 VanDerWaalsContact C-N 3.29Å; D132-R134 PolarHBondContact O-N 2.98Å; D132-R134 PolarHBondContact OD1-N 3.25Å; D132-H135 PolarHBondContact N-O 3.05Å; D132-H135 PolarHBondContact OD1-N 3.19Å; D132-H135 IonicContact OD1-ND1 3.55Å; D132-H135 IonicContact OD2-ND1 2.84Å; D132-H135 PolarHBondContact OD2-ND1 3.39Å; D132-E193 CarbonylContact C-O 3.26Å
133	G	68.8	Low	85.3	Confident	24 Å²	24	63.3 Å²	63.3	25%	0.247	33%	0.332	C	S	.	.	S	Bend	trans	86.1	-29	-175.5	0	0	0	0	0	115	T131 E193	T131-G133 PolarHBondContact OG1-N 2.84Å; G133-E193 WeakPolarHBondContact CA-O 3.4Å; G133-E193 PolarHBondContact N-O 2.98Å
134	R	70.4	Confident	85.3	Confident	150 Å²	150	63 Å²	63	57%	0.566	33%	0.329	S	S	*	.	S	Bend	trans	-100.8	-41.4	178	-176.8	175.3	-178.8	166.7	2.9	112.1	D132	D132-R134 VanDerWaalsContact C-N 3.29Å; D132-R134 PolarHBondContact O-N 2.98Å; D132-R134 PolarHBondContact OD1-N 3.25Å
135	H	73.9	Confident	85.4	Confident	113 Å²	113	67.6 Å²	67.6	52%	0.523	35%	0.35	S	S	.	.	S	Bend	trans	-113.4	123.3	176.7	-51	100.7	0	0	0	107.2	T131 D132	T131-H135 WeakPolarHBondContact CA-O 3.35Å; T131-H135 PolarHBondContact OG1-O 3.28Å; D132-H135 PolarHBondContact N-O 3.05Å; D132-H135 PolarHBondContact OD1-N 3.19Å; D132-H135 IonicContact OD1-ND1 3.55Å; D132-H135 IonicContact OD2-ND1 2.84Å; D132-H135 PolarHBondContact OD2-ND1 3.39Å
136	A	71.6	Confident	85.3	Confident	29 Å²	29	72.1 Å²	72.1	24%	0.24	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	133	172.1	0	0	0	0	0	108.4	D128 T130 V138	D128-A136 HydrophobicContact CB-CB 4.37Å; T130-A136 VanDerWaalsContact O-CA 3.26Å; T130-A136 WeakPolarHBondContact O-CA 3.22Å; A136-V138 HydrophobicContact CB-CG1 3.77Å
137	E	82.9	Confident	85.4	Confident	140 Å²	140	70 Å²	70	65%	0.654	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.5	156	-174.9	171.4	-176.3	0	0	107.1	V129 T130	V129-E137 PolarHBondContact N-O 2.95Å; T130-E137 PolarHBondContact O-N 3.33Å; T130-E137 VanDerWaalsContact O-N 3.07Å
138	V	87.2	Confident	85.6	Confident	30 Å²	30	67.8 Å²	67.8	18%	0.182	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.9	-170.3	-56.2	0	0	0	0	110.7	R126 I127 D128 A136 F140	R126-V138 HydrophobicContact CB-CB 4.28Å; R126-V138 HydrophobicContact CG-CB 4.48Å; I127-V138 WeakPolarHBondContact O-CA 3.47Å; D128-V138 WeakPolarHBondContact OD1-CG1 3.35Å; A136-V138 HydrophobicContact CB-CG1 3.77Å; V138-F140 HydrophobicContact CG2-CE1 4.21Å; V138-F140 HydrophobicContact CG2-CZ 4.47Å
139	E	91.8	Very high	86.1	Confident	119 Å²	119	71 Å²	71	56%	0.556	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.1	169.9	-173.2	-177.5	166.4	0	0	108.5	R126 I127 V129	R126-E139 CarbonylContact C-O 3.13Å; R126-E139 WeakPolarHBondContact CA-O 3.12Å; I127-E139 PolarHBondContact N-O 3.48Å; I127-E139 PolarHBondContact O-N 2.73Å; V129-E139 HydrophobicContact CG2-CB 4.06Å
140	F	95	Very high	86.7	Confident	76 Å²	76	69.1 Å²	69.1	33%	0.333	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	140.9	176.1	-61.9	-50	0	0	0	110.8	P86 T124 L125 R126 V138	P86-F140 HydrophobicContact CG-CE1 4.32Å; P86-F140 HydrophobicContact CG-CE2 3.91Å; P86-F140 HydrophobicContact CG-CZ 3.66Å; T124-F140 HydrophobicContact CG2-CB 3.89Å; T124-F140 HydrophobicContact CG2-CD1 3.53Å; T124-F140 HydrophobicContact CG2-CE1 4.27Å; T124-F140 HydrophobicContact CG2-CG 3.77Å; L125-F140 WeakPolarHBondContact O-CA 3.27Å; R126-F140 HydrophobicContact CB-CD1 4.12Å; V138-F140 HydrophobicContact CG2-CE1 4.21Å; V138-F140 HydrophobicContact CG2-CZ 4.47Å
141	T	96.3	Very high	87.5	Confident	23 Å²	23	66.2 Å²	66.2	14%	0.141	33%	0.326	C	S	.	.			trans	-133	166.5	-179.9	-168.2	0	0	0	0	110.7	L125 I127 D143 K146	L125-T141 HydrophobicContact CB-CG2 3.94Å; L125-T141 WeakPolarHBondContact CB-O 3.41Å; L125-T141 PolarHBondContact O-N 3.08Å; I127-T141 HydrophobicContact CD1-CG2 4.39Å; I127-T141 HydrophobicContact CG1-CG2 4.07Å; T141-D143 HydrophobicContact CG2-CB 4.47Å; T141-D143 WeakPolarHBondContact OG1-CB 3.33Å; T141-D143 PolarHBondContact OG1-N 3.43Å; T141-D143 VanDerWaalsContact OG1-N 3.16Å; T141-K146 HydrophobicContact CG2-CB 4.47Å
142	T	97.4	Very high	88.5	Confident	99 Å²	99	64.8 Å²	64.8	61%	0.607	32%	0.317	S	S	*	.	S	Bend	trans	-109.5	4.9	166	61.3	0	0	0	0	111.7	T83	T83-T142 HydrophobicContact CG2-CG2 4.22Å
143	D	97.9	Very high	89.9	Confident	60 Å²	60	60.4 Å²	60.4	32%	0.321	29%	0.294	S	S	.	.			trans	-89.4	106.8	179.5	-170.9	-21.8	0	0	0	110.5	T141 Q145 K146 D147	T141-D143 HydrophobicContact CG2-CB 4.47Å; T141-D143 WeakPolarHBondContact OG1-CB 3.33Å; T141-D143 PolarHBondContact OG1-N 3.43Å; T141-D143 VanDerWaalsContact OG1-N 3.16Å; D143-Q145 VanDerWaalsContact C-N 3.29Å; D143-Q145 PolarHBondContact O-N 3.09Å; D143-Q145 WeakPolarHBondContact OD1-CB 3.38Å; D143-Q145 PolarHBondContact OD1-N 3.45Å; D143-K146 HydrophobicContact CB-CB 4.17Å; D143-K146 HydrophobicContact CB-CD 4.04Å; D143-K146 HydrophobicContact CB-CG 4.04Å; D143-K146 PolarHBondContact O-N 2.91Å; D143-K146 PolarHBondContact OD1-N 3.09Å; D143-K146 WeakPolarHBondContact OD2-CE 3.47Å; D143-K146 WeakPolarHBondContact OD2-CG 3.38Å; D143-D147 PolarHBondContact O-N 2.83Å
144	W	97.9	Very high	91.3	Very high	14 Å²	14	59.6 Å²	59.6	5%	0.053	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-33.3	179.4	-68.8	91.6	0	0	0	113.4	E58 R60 A81 T83 L125 K146 D147 A148 F159 Y169	E58-W144 HydrophobicContact CB-CZ2 3.85Å; E58-W144 PolarHBondContact OE2-NE1 3.31Å; R60-W144 HydrophobicContact CB-CH2 3.56Å; R60-W144 HydrophobicContact CB-CZ2 4.45Å; R60-W144 HydrophobicContact CB-CZ3 3.75Å; R60-W144 VanDerWaalsContact CD-CH2 3.45Å; R60-W144 HydrophobicContact CG-CH2 3.39Å; R60-W144 HydrophobicContact CG-CZ2 3.79Å; R60-W144 HydrophobicContact CG-CZ3 3.88Å; R60-W144 VanDerWaalsContact NH1-CD2 3.25Å; R60-W144 VanDerWaalsContact NH1-CG 3.3Å; A81-W144 HydrophobicContact CB-CH2 4.22Å; A81-W144 HydrophobicContact CB-CZ3 3.78Å; A81-W144 WeakPolarHBondContact O-CH2 3.32Å; T83-W144 HydrophobicContact CG2-CZ2 4.33Å; L125-W144 HydrophobicContact CD1-CD2 3.64Å; L125-W144 HydrophobicContact CD1-CE3 4.01Å; L125-W144 HydrophobicContact CD1-CG 3.94Å; L125-W144 HydrophobicContact CD1-CH2 4.49Å; L125-W144 HydrophobicContact CD1-CZ2 4.18Å; L125-W144 HydrophobicContact CD1-CZ3 4.43Å; L125-W144 HydrophobicContact CD2-CD2 4.11Å; L125-W144 HydrophobicContact CD2-CE3 3.58Å; L125-W144 HydrophobicContact CD2-CH2 4.3Å; L125-W144 HydrophobicContact CD2-CZ3 3.7Å; L125-W144 HydrophobicContact CG-CD2 4.48Å; L125-W144 HydrophobicContact CG-CE3 4.38Å; L125-W144 HydrophobicContact CG-CZ3 4.49Å; W144-K146 VanDerWaalsContact C-N 3.34Å; W144-D147 PolarHBondContact O-N 3.19Å; W144-A148 WeakPolarHBondContact O-CB 3.49Å; W144-A148 PolarHBondContact O-N 2.8Å; W144-F159 HydrophobicContact CB-CE2 4.41Å; W144-F159 HydrophobicContact CE3-CB 4.37Å; W144-F159 AromaticContact CE3-CD1 3.73Å; W144-F159 HydrophobicContact CE3-CD1 3.73Å; W144-F159 AromaticContact CE3-CD2 3.75Å; W144-F159 HydrophobicContact CE3-CD2 3.75Å; W144-F159 AromaticContact CE3-CE1 3.82Å; W144-F159 HydrophobicContact CE3-CE1 3.82Å; W144-F159 AromaticContact CE3-CE2 3.81Å; W144-F159 HydrophobicContact CE3-CE2 3.81Å; W144-F159 AromaticContact CE3-CG 3.68Å; W144-F159 HydrophobicContact CE3-CG 3.68Å; W144-F159 AromaticContact CE3-CZ 3.86Å; W144-F159 HydrophobicContact CE3-CZ 3.86Å; W144-F159 HydrophobicContact CZ3-CB 4.34Å; W144-F159 AromaticContact CZ3-CD1 3.56Å; W144-F159 HydrophobicContact CZ3-CD1 3.56Å; W144-F159 HydrophobicContact CZ3-CD2 4.37Å; W144-F159 AromaticContact CZ3-CE1 3.84Å; W144-F159 HydrophobicContact CZ3-CE1 3.84Å; W144-F159 AromaticContact CZ3-CG 3.84Å; W144-F159 HydrophobicContact CZ3-CG 3.84Å; W144-F159 HydrophobicContact CZ3-CZ 4.35Å; W144-F159 WeakPolarHBondContact O-CE2 3.5Å; W144-Y169 HydrophobicContact CB-CE2 3.97Å; W144-Y169 VanDerWaalsContact CB-OH 3.23Å; W144-Y169 WeakPolarHBondContact CB-OH 3.3Å
145	Q	97.8	Very high	92.5	Very high	97 Å²	97	52.5 Å²	52.5	45%	0.453	26%	0.257	S	S	.	.	H	α-helix	trans	-66.7	-40.9	179.6	-176.6	177.3	9.5	0	0	110.2	D143 A148 E149 Y169 F170	D143-Q145 VanDerWaalsContact C-N 3.29Å; D143-Q145 PolarHBondContact O-N 3.09Å; D143-Q145 WeakPolarHBondContact OD1-CB 3.38Å; D143-Q145 PolarHBondContact OD1-N 3.45Å; Q145-A148 WeakPolarHBondContact O-CB 3.42Å; Q145-A148 PolarHBondContact O-N 3.4Å; Q145-E149 PolarHBondContact O-N 3.38Å; Q145-Y169 HydrophobicContact CB-CD1 3.78Å; Q145-Y169 HydrophobicContact CB-CE1 3.97Å; Q145-Y169 HydrophobicContact CB-CG 4.14Å; Q145-Y169 HydrophobicContact CG-CD1 3.87Å; Q145-Y169 HydrophobicContact CG-CG 4.07Å; Q145-F170 HydrophobicContact CG-CZ 4.49Å
146	K	96.1	Very high	93.6	Very high	94 Å²	94	47.4 Å²	47.4	41%	0.409	23%	0.233	S	C	.	.	H	α-helix	trans	-66.1	-37.1	176.9	-67	-173.8	-175.8	-176	0	112.9	I127 T141 D143 W144 A148 E149 R150	I127-K146 HydrophobicContact CD1-CB 4.21Å; I127-K146 HydrophobicContact CD1-CD 3.57Å; I127-K146 HydrophobicContact CD1-CG 4.5Å; I127-K146 HydrophobicContact CG1-CB 4.02Å; I127-K146 HydrophobicContact CG1-CD 4.3Å; T141-K146 HydrophobicContact CG2-CB 4.47Å; D143-K146 HydrophobicContact CB-CB 4.17Å; D143-K146 HydrophobicContact CB-CD 4.04Å; D143-K146 HydrophobicContact CB-CG 4.04Å; D143-K146 PolarHBondContact O-N 2.91Å; D143-K146 PolarHBondContact OD1-N 3.09Å; D143-K146 WeakPolarHBondContact OD2-CE 3.47Å; D143-K146 WeakPolarHBondContact OD2-CG 3.38Å; W144-K146 VanDerWaalsContact C-N 3.34Å; K146-A148 VanDerWaalsContact C-N 3.34Å; K146-E149 PolarHBondContact O-N 2.96Å; K146-R150 PolarHBondContact O-N 3.14Å
147	D	96.3	Very high	94.8	Very high	1 Å²	1	46 Å²	46	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-67.2	-36.8	172.4	-169.1	81.9	0	0	0	112.1	L125 R126 D143 W144 E149 R150 R151 F159	L125-D147 WeakPolarHBondContact CA-OD1 3.13Å; L125-D147 HydrophobicContact CB-CB 4.05Å; L125-D147 HydrophobicContact CD2-CB 3.52Å; L125-D147 HydrophobicContact CG-CB 4.31Å; R126-D147 PolarHBondContact N-OD1 3.4Å; D143-D147 PolarHBondContact O-N 2.83Å; W144-D147 PolarHBondContact O-N 3.19Å; D147-E149 VanDerWaalsContact C-N 3.32Å; D147-R150 WeakPolarHBondContact O-CG 3.41Å; D147-R150 IonicContact OD1-CZ 3.46Å; D147-R150 IonicContact OD1-NE 3.62Å; D147-R150 PolarHBondContact OD1-NE 2.79Å; D147-R150 IonicContact OD1-NH2 3.37Å; D147-R150 PolarHBondContact OD1-NH2 2.92Å; D147-R150 IonicContact OD2-CZ 2.83Å; D147-R150 IonicContact OD2-NH2 3.73Å; D147-R150 PolarHBondContact OD2-NH2 2.84Å; D147-R151 WeakPolarHBondContact O-CG 3.44Å; D147-R151 IonicContact OD2-CZ 2.77Å; D147-R151 IonicContact OD2-NE 3.54Å; D147-R151 PolarHBondContact OD2-NE 3.32Å; D147-R151 IonicContact OD2-NH2 3.03Å; D147-R151 PolarHBondContact OD2-NH2 2.82Å; D147-F159 HydrophobicContact CB-CZ 4.13Å; D147-F159 WeakPolarHBondContact OD2-CZ 3.36Å
148	A	95.7	Very high	95.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.4	-38.6	173.5	0	0	0	0	0	111.8	W144 Q145 K146 R150 R151 S157 F159 Y169 F170	W144-A148 WeakPolarHBondContact O-CB 3.49Å; W144-A148 PolarHBondContact O-N 2.8Å; Q145-A148 WeakPolarHBondContact O-CB 3.42Å; Q145-A148 PolarHBondContact O-N 3.4Å; K146-A148 VanDerWaalsContact C-N 3.34Å; A148-R150 PolarHBondContact O-N 3.48Å; A148-R151 WeakPolarHBondContact O-CB 3.5Å; A148-R151 PolarHBondContact O-N 3.39Å; A148-R151 VanDerWaalsContact O-N 3.11Å; A148-S157 VanDerWaalsContact CB-O 3.26Å; A148-S157 WeakPolarHBondContact CB-O 3.38Å; A148-S157 WeakPolarHBondContact O-CB 3.08Å; A148-F159 HydrophobicContact CB-CE2 3.87Å; A148-F159 HydrophobicContact CB-CZ 4.42Å; A148-Y169 HydrophobicContact CB-CD2 3.71Å; A148-Y169 HydrophobicContact CB-CE2 4.47Å; A148-Y169 HydrophobicContact CB-CG 4.43Å; A148-F170 HydrophobicContact CB-CD2 3.95Å; A148-F170 HydrophobicContact CB-CE2 3.59Å
149	E	95.1	Very high	96.1	Very high	111 Å²	111	37.9 Å²	37.9	52%	0.519	18%	0.182	S	C	.	.	H	α-helix	trans	-62.8	-39.5	-177.8	-165.8	171.6	-163.6	0	0	112.5	Q145 K146 D147 R151 F170 R190	Q145-E149 PolarHBondContact O-N 3.38Å; K146-E149 PolarHBondContact O-N 2.96Å; D147-E149 VanDerWaalsContact C-N 3.32Å; E149-R151 PolarHBondContact O-N 2.98Å; E149-F170 HydrophobicContact CB-CE2 4.12Å; E149-F170 HydrophobicContact CB-CZ 3.71Å; E149-F170 HydrophobicContact CG-CZ 3.96Å; E149-R190 PolarHBondContact O-NH1 3.14Å
150	R	91.1	Very high	96.4	Very high	39 Å²	39	32.2 Å²	32.2	15%	0.147	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-10.1	176.9	66.8	158.3	-173.4	94	3.9	114.2	R126 K146 D147 A148 R190	R126-R150 VanDerWaalsContact CG-NE 3.28Å; R126-R150 WeakPolarHBondContact O-CD 3.09Å; R126-R150 PolarHBondContact O-NE 3.48Å; R126-R150 VanDerWaalsContact O-NE 3.1Å; K146-R150 PolarHBondContact O-N 3.14Å; D147-R150 WeakPolarHBondContact O-CG 3.41Å; D147-R150 IonicContact OD1-CZ 3.46Å; D147-R150 IonicContact OD1-NE 3.62Å; D147-R150 PolarHBondContact OD1-NE 2.79Å; D147-R150 IonicContact OD1-NH2 3.37Å; D147-R150 PolarHBondContact OD1-NH2 2.92Å; D147-R150 IonicContact OD2-CZ 2.83Å; D147-R150 IonicContact OD2-NH2 3.73Å; D147-R150 PolarHBondContact OD2-NH2 2.84Å; A148-R150 PolarHBondContact O-N 3.48Å; R150-R190 PolarHBondContact O-NH2 3.03Å
151	R	92.9	Very high	96.5	Very high	38 Å²	38	29 Å²	29	14%	0.143	14%	0.143	C	C	.	.	S	Bend	trans	-78.8	154.2	178.3	-66.8	168.5	-178.7	-95.7	-4.1	110.4	D147 A148 E149 N156 R190	D147-R151 WeakPolarHBondContact O-CG 3.44Å; D147-R151 IonicContact OD2-CZ 2.77Å; D147-R151 IonicContact OD2-NE 3.54Å; D147-R151 PolarHBondContact OD2-NE 3.32Å; D147-R151 IonicContact OD2-NH2 3.03Å; D147-R151 PolarHBondContact OD2-NH2 2.82Å; A148-R151 WeakPolarHBondContact O-CB 3.5Å; A148-R151 PolarHBondContact O-N 3.39Å; A148-R151 VanDerWaalsContact O-N 3.11Å; E149-R151 PolarHBondContact O-N 2.98Å; R151-N156 WeakPolarHBondContact CD-O 3.47Å; R151-R190 PolarHBondContact O-NH1 3.06Å; R151-R190 PolarHBondContact O-NH2 3.3Å
152	D	94.1	Very high	96.6	Very high	11 Å²	11	29.7 Å²	29.7	6%	0.059	15%	0.145	C	C	.	.	S	Bend	trans	-72.4	-55.1	-168.6	56.7	-13.9	0	0	0	113.2	F183 V184 R197 R200	D152-F183 VanDerWaalsContact O-CA 3.31Å; D152-F183 WeakPolarHBondContact O-CA 3.47Å; D152-F183 WeakPolarHBondContact O-CD1 3.35Å; D152-V184 PolarHBondContact O-N 2.6Å; D152-R197 HydrophobicContact CB-CG 4.08Å; D152-R200 IonicContact OD1-NH2 3.74Å; D152-R200 IonicContact OD2-CZ 2.63Å; D152-R200 IonicContact OD2-NE 3.91Å; D152-R200 PolarHBondContact OD2-NE 2.9Å; D152-R200 IonicContact OD2-NH2 2.68Å; D152-R200 PolarHBondContact OD2-NH2 3.23Å
153	L	97.3	Very high	96.5	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-116.9	146.7	-171.3	-59.5	170.4	0	0	0	111.4	I155 N156 S157 V181 R182 F183 F204	L153-I155 VanDerWaalsContact C-N 3.32Å; L153-I155 HydrophobicContact CB-CG1 4.09Å; L153-I155 PolarHBondContact O-N 2.82Å; L153-N156 HydrophobicContact CB-CB 4.44Å; L153-N156 CarbonylContact O-C 3.47Å; L153-N156 WeakPolarHBondContact O-CA 3.32Å; L153-N156 PolarHBondContact O-N 2.75Å; L153-S157 PolarHBondContact O-N 3.02Å; L153-S157 VanDerWaalsContact O-N 3.08Å; L153-V181 HydrophobicContact CD1-CG1 3.85Å; L153-V181 HydrophobicContact CD2-CG1 3.88Å; L153-V181 HydrophobicContact CG-CG1 4.46Å; L153-R182 CarbonylContact C-O 3Å; L153-R182 WeakPolarHBondContact CA-O 3.36Å; L153-R182 WeakPolarHBondContact CB-O 3.4Å; L153-R182 VanDerWaalsContact CD2-O 3.3Å; L153-R182 WeakPolarHBondContact CD2-O 3.3Å; L153-F183 HydrophobicContact CD2-CD1 3.98Å; L153-F183 HydrophobicContact CD2-CD2 4.39Å; L153-F183 HydrophobicContact CD2-CE1 4.06Å; L153-F183 HydrophobicContact CD2-CE2 4.47Å; L153-F183 HydrophobicContact CD2-CG 4.16Å; L153-F183 HydrophobicContact CD2-CZ 4.31Å; L153-F204 HydrophobicContact CD1-CB 4.01Å; L153-F204 HydrophobicContact CD1-CD2 3.3Å; L153-F204 HydrophobicContact CD1-CE2 3.98Å; L153-F204 HydrophobicContact CD1-CG 3.97Å
154	T	97.9	Very high	96.4	Very high	7 Å²	7	26.1 Å²	26.1	4%	0.043	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-55.3	-46.8	179.7	57.2	0	0	0	0	111.6	N156 S157 F170 G172 D175 R182 V184	T154-N156 PolarHBondContact O-N 3.08Å; T154-S157 PolarHBondContact O-N 2.76Å; T154-S157 PolarHBondContact O-OG 3.03Å; T154-F170 WeakPolarHBondContact CB-O 3.46Å; T154-F170 HydrophobicContact CG2-CB 4.29Å; T154-F170 VanDerWaalsContact CG2-O 3.25Å; T154-F170 WeakPolarHBondContact CG2-O 3.37Å; T154-G172 WeakPolarHBondContact O-CA 3.22Å; T154-D175 WeakPolarHBondContact CB-OD2 3.49Å; T154-D175 PolarHBondContact OG1-OD2 3.43Å; T154-R182 HydrophobicContact CG2-CB 4.21Å; T154-R182 PolarHBondContact N-O 3.16Å; T154-V184 HydrophobicContact CG2-CG2 4.19Å
155	I	97.1	Very high	96.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-61.2	-15.5	176.2	66.9	178.6	0	0	0	114.2	R67 L153 M158 D175 L176 V181 F204 I208	R67-I155 WeakPolarHBondContact CB-O 3.21Å; R67-I155 HydrophobicContact CG-CB 4.39Å; L153-I155 VanDerWaalsContact C-N 3.32Å; L153-I155 HydrophobicContact CB-CG1 4.09Å; L153-I155 PolarHBondContact O-N 2.82Å; I155-M158 VanDerWaalsContact O-CE 3.27Å; I155-M158 WeakPolarHBondContact O-CE 3.24Å; I155-D175 HydrophobicContact CG2-CB 4.12Å; I155-L176 HydrophobicContact CB-CD1 4.45Å; I155-L176 HydrophobicContact CG2-CB 4Å; I155-L176 HydrophobicContact CG2-CD1 4.24Å; I155-V181 HydrophobicContact CD1-CG2 4.45Å; I155-F204 HydrophobicContact CD1-CB 4.21Å; I155-I208 HydrophobicContact CD1-CD1 3.83Å; I155-I208 HydrophobicContact CD1-CG2 4.32Å; I155-I208 HydrophobicContact CG2-CD1 4.33Å
156	N	96.7	Very high	96.4	Very high	6 Å²	6	24.6 Å²	24.6	3%	0.032	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-114.2	6	179.3	-64	-28.9	0	0	0	112.9	G63 R67 R151 L153 T154 F204	G63-N156 VanDerWaalsContact CA-O 3.26Å; G63-N156 WeakPolarHBondContact CA-O 3.49Å; R67-N156 PolarHBondContact NH1-OD1 3.44Å; R151-N156 WeakPolarHBondContact CD-O 3.47Å; L153-N156 HydrophobicContact CB-CB 4.44Å; L153-N156 CarbonylContact O-C 3.47Å; L153-N156 WeakPolarHBondContact O-CA 3.32Å; L153-N156 PolarHBondContact O-N 2.75Å; T154-N156 PolarHBondContact O-N 3.08Å; N156-F204 WeakPolarHBondContact ND2-CE2 3.31Å; N156-F204 WeakPolarHBondContact ND2-CZ 3.32Å
157	S	97.2	Very high	96.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.111	C	C	.	.	S	Bend	trans	-100	0	-179.2	68.2	0	0	0	0	114	A148 L153 T154	A148-S157 VanDerWaalsContact CB-O 3.26Å; A148-S157 WeakPolarHBondContact CB-O 3.38Å; A148-S157 WeakPolarHBondContact O-CB 3.08Å; L153-S157 PolarHBondContact O-N 3.02Å; L153-S157 VanDerWaalsContact O-N 3.08Å; T154-S157 PolarHBondContact O-N 2.76Å; T154-S157 PolarHBondContact O-OG 3.03Å
158	M	98	Very high	96.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.124	C	C	.	.			trans	-82.2	157.5	-179.8	-61.2	175.4	-74.7	0	0	113.3	G63 V66 L70 I155 L166 F167 D168 G172 Y173	G63-M158 PolarHBondContact N-O 2.92Å; V66-M158 HydrophobicContact CG1-CB 3.9Å; L70-M158 HydrophobicContact CD1-CE 3.67Å; L70-M158 HydrophobicContact CD1-SD 3.78Å; I155-M158 VanDerWaalsContact O-CE 3.27Å; I155-M158 WeakPolarHBondContact O-CE 3.24Å; M158-L166 HydrophobicContact CB-CD1 4.13Å; M158-L166 HydrophobicContact SD-CD1 4.15Å; M158-L166 HydrophobicContact SD-CD2 4.28Å; M158-F167 WeakPolarHBondContact CA-O 3.19Å; M158-D168 HydrophobicContact CG-CB 4.03Å; M158-D168 HydrophobicContact SD-CB 4.42Å; M158-G172 VanDerWaalsContact SD-C 3.54Å; M158-Y173 PolarHBondContact SD-N 2.89Å; M158-Y173 VanDerWaalsContact SD-N 3.41Å
159	F	98.4	Very high	96.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	152.6	170	-50	-85.8	0	0	0	111.4	R60 I61 A62 A81 L125 W144 D147 A148 F167 Y169	R60-F159 HydrophobicContact CB-CB 4.15Å; I61-F159 CarbonylContact O-C 3.58Å; I61-F159 VanDerWaalsContact O-CA 3.23Å; I61-F159 WeakPolarHBondContact O-CA 3.48Å; A62-F159 HydrophobicContact CB-CD1 3.66Å; A62-F159 HydrophobicContact CB-CE1 3.85Å; A81-F159 HydrophobicContact CB-CD1 4.16Å; A81-F159 HydrophobicContact CB-CE1 3.89Å; L125-F159 HydrophobicContact CD2-CE1 4.35Å; L125-F159 HydrophobicContact CD2-CZ 4.34Å; W144-F159 HydrophobicContact CB-CE2 4.41Å; W144-F159 HydrophobicContact CE3-CB 4.37Å; W144-F159 AromaticContact CE3-CD1 3.73Å; W144-F159 HydrophobicContact CE3-CD1 3.73Å; W144-F159 AromaticContact CE3-CD2 3.75Å; W144-F159 HydrophobicContact CE3-CD2 3.75Å; W144-F159 AromaticContact CE3-CE1 3.82Å; W144-F159 HydrophobicContact CE3-CE1 3.82Å; W144-F159 AromaticContact CE3-CE2 3.81Å; W144-F159 HydrophobicContact CE3-CE2 3.81Å; W144-F159 AromaticContact CE3-CG 3.68Å; W144-F159 HydrophobicContact CE3-CG 3.68Å; W144-F159 AromaticContact CE3-CZ 3.86Å; W144-F159 HydrophobicContact CE3-CZ 3.86Å; W144-F159 HydrophobicContact CZ3-CB 4.34Å; W144-F159 AromaticContact CZ3-CD1 3.56Å; W144-F159 HydrophobicContact CZ3-CD1 3.56Å; W144-F159 HydrophobicContact CZ3-CD2 4.37Å; W144-F159 AromaticContact CZ3-CE1 3.84Å; W144-F159 HydrophobicContact CZ3-CE1 3.84Å; W144-F159 AromaticContact CZ3-CG 3.84Å; W144-F159 HydrophobicContact CZ3-CG 3.84Å; W144-F159 HydrophobicContact CZ3-CZ 4.35Å; W144-F159 WeakPolarHBondContact O-CE2 3.5Å; D147-F159 HydrophobicContact CB-CZ 4.13Å; D147-F159 WeakPolarHBondContact OD2-CZ 3.36Å; A148-F159 HydrophobicContact CB-CE2 3.87Å; A148-F159 HydrophobicContact CB-CZ 4.42Å; F159-F167 HydrophobicContact CB-CB 4.22Å; F159-F167 PolarHBondContact N-O 3.46Å; F159-F167 PolarHBondContact O-N 2.95Å; F159-Y169 AromaticContact CD2-CE2 3.97Å; F159-Y169 HydrophobicContact CD2-CE2 3.97Å; F159-Y169 HydrophobicContact CE2-CD2 4.47Å; F159-Y169 HydrophobicContact CE2-CE2 4.06Å
160	L	98.4	Very high	96.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	122.3	177.7	-170.3	72.7	0	0	0	110.1	L32 F37 I61 V66 L69 L166	L32-L160 HydrophobicContact CB-CD1 4.24Å; L32-L160 HydrophobicContact CD2-CD2 3.73Å; F37-L160 HydrophobicContact CD2-CD2 3.92Å; F37-L160 HydrophobicContact CE2-CD2 3.63Å; F37-L160 HydrophobicContact CE2-CG 4.45Å; F37-L160 HydrophobicContact CZ-CD2 4.1Å; I61-L160 HydrophobicContact CB-CB 4.26Å; I61-L160 HydrophobicContact CD1-CD2 4.49Å; I61-L160 PolarHBondContact N-O 2.72Å; I61-L160 PolarHBondContact O-N 3.17Å; V66-L160 HydrophobicContact CG1-CB 4.18Å; V66-L160 HydrophobicContact CG2-CB 3.9Å; L69-L160 HydrophobicContact CD1-CD2 3.7Å; L160-L166 HydrophobicContact CD1-CB 4.33Å; L160-L166 HydrophobicContact CD1-CD1 4.27Å
161	G	97.8	Very high	97	Very high	7 Å²	7	29.3 Å²	29.3	7%	0.072	15%	0.145	C	C	.	.			trans	-69.7	152.2	170	0	0	0	0	0	111.3	D163 G164 T165	G161-D163 PolarHBondContact O-N 3.14Å; G161-D163 VanDerWaalsContact O-N 3.14Å; G161-G164 PolarHBondContact O-N 3.35Å; G161-T165 PolarHBondContact N-O 3.19Å
162	F	97.2	Very high	97.2	Very high	39 Å²	39	27.5 Å²	27.5	17%	0.171	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-10.8	178.1	-64.3	-72.3	0	0	0	113.8	F41 L45 T49 L59 I61 F80 G164	F41-F162 HydrophobicContact CE1-CB 4.13Å; F41-F162 HydrophobicContact CE1-CD1 4.18Å; F41-F162 HydrophobicContact CZ-CB 4.35Å; F41-F162 HydrophobicContact CZ-CD1 4.36Å; F41-F162 VanDerWaalsContact CZ-O 3.27Å; F41-F162 WeakPolarHBondContact CZ-O 3.2Å; L45-F162 HydrophobicContact CD1-CE1 3.84Å; L45-F162 HydrophobicContact CD1-CZ 4.18Å; L45-F162 HydrophobicContact CD2-CD1 4.46Å; L45-F162 HydrophobicContact CD2-CE1 4.02Å; L45-F162 HydrophobicContact CG-CE1 4.19Å; T49-F162 HydrophobicContact CG2-CB 4.49Å; T49-F162 HydrophobicContact CG2-CD1 3.73Å; T49-F162 HydrophobicContact CG2-CD2 3.49Å; T49-F162 VanDerWaalsContact CG2-CD2 3.49Å; T49-F162 HydrophobicContact CG2-CE1 3.7Å; T49-F162 HydrophobicContact CG2-CE2 3.46Å; T49-F162 VanDerWaalsContact CG2-CE2 3.46Å; T49-F162 HydrophobicContact CG2-CG 3.62Å; T49-F162 HydrophobicContact CG2-CZ 3.55Å; L59-F162 HydrophobicContact CB-CE2 4.04Å; L59-F162 HydrophobicContact CD2-CE2 3.82Å; L59-F162 HydrophobicContact CD2-CZ 3.98Å; L59-F162 HydrophobicContact CG-CE2 3.76Å; L59-F162 HydrophobicContact CG-CZ 4.1Å; L59-F162 VanDerWaalsContact O-CE2 3.29Å; L59-F162 WeakPolarHBondContact O-CE2 3.43Å; I61-F162 HydrophobicContact CD1-CE1 4.23Å; I61-F162 HydrophobicContact CG1-CE1 3.92Å; I61-F162 HydrophobicContact CG1-CZ 4.33Å; F80-F162 HydrophobicContact CD1-CE1 4.41Å; F80-F162 AromaticContact CD1-CZ 3.83Å; F80-F162 HydrophobicContact CD1-CZ 3.83Å; F80-F162 AromaticContact CE1-CE1 3.87Å; F80-F162 HydrophobicContact CE1-CE1 3.87Å; F80-F162 AromaticContact CE1-CZ 3.72Å; F80-F162 HydrophobicContact CE1-CZ 3.72Å; F162-G164 VanDerWaalsContact C-N 3.29Å
163	D	95.9	Very high	97.4	Very high	82 Å²	82	31 Å²	31	44%	0.439	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	0.7	170.1	74.9	-35.2	0	0	0	113	K31 G161 T165	K31-D163 WeakPolarHBondContact CD-O 3.47Å; K31-D163 WeakPolarHBondContact CE-OD2 3.37Å; K31-D163 IonicContact NZ-OD2 3.51Å; K31-D163 PolarHBondContact NZ-OD2 3.31Å; G161-D163 PolarHBondContact O-N 3.14Å; G161-D163 VanDerWaalsContact O-N 3.14Å; D163-T165 VanDerWaalsContact CG-OG1 3.28Å; D163-T165 VanDerWaalsContact OD1-CB 3.31Å; D163-T165 WeakPolarHBondContact OD1-CB 3.36Å; D163-T165 PolarHBondContact OD1-N 3.1Å; D163-T165 PolarHBondContact OD1-OG1 3.46Å; D163-T165 PolarHBondContact OD2-OG1 3.32Å
164	G	96.4	Very high	97.4	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.01	17%	0.17	C	C	.	.	S	Bend	trans	88.8	2	-177.5	0	0	0	0	0	114.6	K31 L32 G161 F162 L166	K31-G164 CarbonylContact C-O 3.59Å; K31-G164 VanDerWaalsContact CA-O 3.31Å; K31-G164 WeakPolarHBondContact CA-O 3.42Å; L32-G164 PolarHBondContact N-O 2.94Å; G161-G164 PolarHBondContact O-N 3.35Å; F162-G164 VanDerWaalsContact C-N 3.29Å; G164-L166 PolarHBondContact O-N 2.91Å
165	T	97.6	Very high	97.4	Very high	29 Å²	29	35 Å²	35	18%	0.178	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-71.9	124.3	178.5	-61.4	0	0	0	0	110.8	G161 D163 F167	G161-T165 PolarHBondContact N-O 3.19Å; D163-T165 VanDerWaalsContact CG-OG1 3.28Å; D163-T165 VanDerWaalsContact OD1-CB 3.31Å; D163-T165 WeakPolarHBondContact OD1-CB 3.36Å; D163-T165 PolarHBondContact OD1-N 3.1Å; D163-T165 PolarHBondContact OD1-OG1 3.46Å; D163-T165 PolarHBondContact OD2-OG1 3.32Å; T165-F167 HydrophobicContact CG2-CE2 4.02Å; T165-F167 HydrophobicContact CG2-CZ 4.04Å
166	L	97.7	Very high	97.4	Very high	51 Å²	51	35.3 Å²	35.3	27%	0.267	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	131.5	175.6	-175.5	69	0	0	0	110.6	V66 L70 M158 L160 G164 D168 Y173	V66-L166 HydrophobicContact CG1-CD1 3.69Å; L70-L166 HydrophobicContact CD1-CD1 4.11Å; L70-L166 HydrophobicContact CD1-CD2 4.29Å; M158-L166 HydrophobicContact CB-CD1 4.13Å; M158-L166 HydrophobicContact SD-CD1 4.15Å; M158-L166 HydrophobicContact SD-CD2 4.28Å; L160-L166 HydrophobicContact CD1-CB 4.33Å; L160-L166 HydrophobicContact CD1-CD1 4.27Å; G164-L166 PolarHBondContact O-N 2.91Å; L166-D168 HydrophobicContact CD2-CB 4.47Å; L166-D168 HydrophobicContact CG-CB 4.45Å; L166-Y173 HydrophobicContact CD2-CD2 3.94Å; L166-Y173 HydrophobicContact CD2-CG 4.14Å
167	F	97.9	Very high	97.3	Very high	57 Å²	57	41.4 Å²	41.4	25%	0.25	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	107.3	171	-59.6	-94.8	0	0	0	108.3	R60 M158 F159 T165 Y169	R60-F167 VanDerWaalsContact NH1-CD1 3.28Å; R60-F167 VanDerWaalsContact NH1-CG 3.34Å; M158-F167 WeakPolarHBondContact CA-O 3.19Å; F159-F167 HydrophobicContact CB-CB 4.22Å; F159-F167 PolarHBondContact N-O 3.46Å; F159-F167 PolarHBondContact O-N 2.95Å; T165-F167 HydrophobicContact CG2-CE2 4.02Å; T165-F167 HydrophobicContact CG2-CZ 4.04Å; F167-Y169 HydrophobicContact CB-CE2 4.13Å
168	D	97.8	Very high	97.3	Very high	50 Å²	50	45.8 Å²	45.8	27%	0.267	22%	0.221	S	C	.	.			trans	-126.2	120.6	-178.8	-176.5	8.5	0	0	0	109.1	M158 L166 F170 D171 G172 Y173	M158-D168 HydrophobicContact CG-CB 4.03Å; M158-D168 HydrophobicContact SD-CB 4.42Å; L166-D168 HydrophobicContact CD2-CB 4.47Å; L166-D168 HydrophobicContact CG-CB 4.45Å; D168-F170 PolarHBondContact OD1-N 3.4Å; D168-D171 PolarHBondContact OD1-N 2.89Å; D168-G172 VanDerWaalsContact CG-N 3.29Å; D168-G172 PolarHBondContact OD1-N 3.42Å; D168-G172 PolarHBondContact OD2-N 3.35Å; D168-Y173 WeakPolarHBondContact OD2-CB 3.15Å; D168-Y173 PolarHBondContact OD2-N 2.98Å
169	Y	97.3	Very high	97.3	Very high	75 Å²	75	48.5 Å²	48.5	29%	0.294	23%	0.233	S	C	.	.	S	Bend	trans	-108.4	-9.5	-175	-58.6	-79.3	0	0	0	112.7	W144 Q145 A148 F159 F167	W144-Y169 HydrophobicContact CB-CE2 3.97Å; W144-Y169 VanDerWaalsContact CB-OH 3.23Å; W144-Y169 WeakPolarHBondContact CB-OH 3.3Å; Q145-Y169 HydrophobicContact CB-CD1 3.78Å; Q145-Y169 HydrophobicContact CB-CE1 3.97Å; Q145-Y169 HydrophobicContact CB-CG 4.14Å; Q145-Y169 HydrophobicContact CG-CD1 3.87Å; Q145-Y169 HydrophobicContact CG-CG 4.07Å; A148-Y169 HydrophobicContact CB-CD2 3.71Å; A148-Y169 HydrophobicContact CB-CE2 4.47Å; A148-Y169 HydrophobicContact CB-CG 4.43Å; F159-Y169 AromaticContact CD2-CE2 3.97Å; F159-Y169 HydrophobicContact CD2-CE2 3.97Å; F159-Y169 HydrophobicContact CE2-CD2 4.47Å; F159-Y169 HydrophobicContact CE2-CE2 4.06Å; F167-Y169 HydrophobicContact CB-CE2 4.13Å
170	F	96.9	Very high	97.2	Very high	43 Å²	43	51.2 Å²	51.2	19%	0.189	25%	0.245	C	C	.	.	S	Bend	trans	-143	34	-167.6	-60.7	-73.2	0	0	0	112.1	Q145 A148 E149 T154 D168 G172 V184	Q145-F170 HydrophobicContact CG-CZ 4.49Å; A148-F170 HydrophobicContact CB-CD2 3.95Å; A148-F170 HydrophobicContact CB-CE2 3.59Å; E149-F170 HydrophobicContact CB-CE2 4.12Å; E149-F170 HydrophobicContact CB-CZ 3.71Å; E149-F170 HydrophobicContact CG-CZ 3.96Å; T154-F170 WeakPolarHBondContact CB-O 3.46Å; T154-F170 HydrophobicContact CG2-CB 4.29Å; T154-F170 VanDerWaalsContact CG2-O 3.25Å; T154-F170 WeakPolarHBondContact CG2-O 3.37Å; D168-F170 PolarHBondContact OD1-N 3.4Å; F170-G172 PolarHBondContact O-N 2.79Å; F170-G172 VanDerWaalsContact O-N 3.11Å; F170-V184 HydrophobicContact CB-CG1 4.48Å; F170-V184 HydrophobicContact CB-CG2 4.27Å; F170-V184 HydrophobicContact CD1-CG1 3.69Å; F170-V184 HydrophobicContact CD2-CG1 3.83Å; F170-V184 HydrophobicContact CD2-CG2 4.27Å; F170-V184 HydrophobicContact CE1-CG1 3.76Å; F170-V184 HydrophobicContact CE2-CG1 3.91Å; F170-V184 HydrophobicContact CG-CG1 3.73Å; F170-V184 HydrophobicContact CG-CG2 4.25Å; F170-V184 HydrophobicContact CZ-CG1 3.87Å
171	D	97.2	Very high	97.2	Very high	118 Å²	118	51.5 Å²	51.5	63%	0.631	25%	0.247	S	C	*	.	S	Bend	trans	55	29	177.3	-58.2	-46.1	0	0	0	114.7	D168 Y173 E174 D175	D168-D171 PolarHBondContact OD1-N 2.89Å; D171-Y173 VanDerWaalsContact C-N 3.28Å; D171-Y173 PolarHBondContact O-N 2.84Å; D171-E174 PolarHBondContact O-N 3.3Å; D171-D175 WeakPolarHBondContact O-CB 3.33Å; D171-D175 PolarHBondContact O-N 3.4Å
172	G	97.3	Very high	97.1	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.2	-31.7	-179.3	0	0	0	0	0	113.7	T154 M158 D168 F170 L176	T154-G172 WeakPolarHBondContact O-CA 3.22Å; M158-G172 VanDerWaalsContact SD-C 3.54Å; D168-G172 VanDerWaalsContact CG-N 3.29Å; D168-G172 PolarHBondContact OD1-N 3.42Å; D168-G172 PolarHBondContact OD2-N 3.35Å; F170-G172 PolarHBondContact O-N 2.79Å; F170-G172 VanDerWaalsContact O-N 3.11Å; G172-L176 WeakPolarHBondContact O-CB 3.45Å; G172-L176 PolarHBondContact O-N 2.82Å
173	Y	97.2	Very high	97.2	Very high	86 Å²	86	54.8 Å²	54.8	34%	0.337	26%	0.256	S	S	.	.	H	α-helix	trans	-68.7	-46.7	176.6	177.9	-102.4	0	0	0	111.7	L70 M158 L166 D168 D171 L176 K177	L70-Y173 HydrophobicContact CD1-CD2 4.19Å; L70-Y173 HydrophobicContact CD2-CD2 4.13Å; L70-Y173 HydrophobicContact CD2-CE2 4.18Å; M158-Y173 PolarHBondContact SD-N 2.89Å; M158-Y173 VanDerWaalsContact SD-N 3.41Å; L166-Y173 HydrophobicContact CD2-CD2 3.94Å; L166-Y173 HydrophobicContact CD2-CG 4.14Å; D168-Y173 WeakPolarHBondContact OD2-CB 3.15Å; D168-Y173 PolarHBondContact OD2-N 2.98Å; D171-Y173 VanDerWaalsContact C-N 3.28Å; D171-Y173 PolarHBondContact O-N 2.84Å; Y173-L176 PolarHBondContact O-N 2.56Å; Y173-K177 WeakPolarHBondContact O-CB 3.27Å; Y173-K177 PolarHBondContact O-N 3.37Å
174	E	97.3	Very high	97.2	Very high	82 Å²	82	51.1 Å²	51.1	38%	0.383	24%	0.236	S	C	.	.	H	α-helix	trans	-69.7	-40.3	178.8	-73	-59.1	140.6	0	0	111.2	D171 L176 K177 N178	D171-E174 PolarHBondContact O-N 3.3Å; E174-L176 VanDerWaalsContact C-N 3.32Å; E174-L176 PolarHBondContact O-N 3.07Å; E174-K177 PolarHBondContact O-N 2.82Å; E174-N178 VanDerWaalsContact O-CB 3.3Å; E174-N178 WeakPolarHBondContact O-CB 3.18Å; E174-N178 VanDerWaalsContact O-CG 3.29Å; E174-N178 PolarHBondContact O-N 3.27Å; E174-N178 PolarHBondContact O-ND2 3.1Å
175	D	97.5	Very high	97.1	Very high	9 Å²	9	53.9 Å²	53.9	5%	0.048	27%	0.265	C	S	.	.	H	α-helix	trans	-60	-43.5	172.2	-86.8	-15.9	0	0	0	111.3	T154 I155 D171 K177 N178 K179 K180 R182	T154-D175 WeakPolarHBondContact CB-OD2 3.49Å; T154-D175 PolarHBondContact OG1-OD2 3.43Å; I155-D175 HydrophobicContact CG2-CB 4.12Å; D171-D175 WeakPolarHBondContact O-CB 3.33Å; D171-D175 PolarHBondContact O-N 3.4Å; D175-K177 PolarHBondContact O-N 2.78Å; D175-N178 CarbonylContact O-C 3.53Å; D175-N178 PolarHBondContact O-N 2.97Å; D175-K179 PolarHBondContact O-N 2.99Å; D175-K180 HydrophobicContact CB-CB 4.21Å; D175-K180 PolarHBondContact O-N 3.35Å; D175-R182 IonicContact OD1-CZ 3.49Å; D175-R182 IonicContact OD1-NH1 3.1Å; D175-R182 PolarHBondContact OD1-NH1 3.2Å
176	L	96.8	Very high	97	Very high	7 Å²	7	59 Å²	59	4%	0.037	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-43.6	177.8	-174.9	60.4	0	0	0	112	R67 L70 I155 G172 Y173 E174 K179 I208	R67-L176 HydrophobicContact CG-CD1 3.81Å; R67-L176 HydrophobicContact CG-CD2 4.1Å; L70-L176 HydrophobicContact CB-CD2 3.53Å; L70-L176 HydrophobicContact CD1-CD2 4.02Å; L70-L176 HydrophobicContact CG-CD2 4.45Å; I155-L176 HydrophobicContact CB-CD1 4.45Å; I155-L176 HydrophobicContact CG2-CB 4Å; I155-L176 HydrophobicContact CG2-CD1 4.24Å; G172-L176 WeakPolarHBondContact O-CB 3.45Å; G172-L176 PolarHBondContact O-N 2.82Å; Y173-L176 PolarHBondContact O-N 2.56Å; E174-L176 VanDerWaalsContact C-N 3.32Å; E174-L176 PolarHBondContact O-N 3.07Å; L176-K179 WeakPolarHBondContact O-CD 3.4Å; L176-K179 PolarHBondContact O-N 2.9Å; L176-I208 HydrophobicContact CD1-CB 4.37Å; L176-I208 HydrophobicContact CD1-CD1 4.31Å; L176-I208 HydrophobicContact CD1-CG2 3.96Å
177	K	96.4	Very high	96.9	Very high	133 Å²	133	57.1 Å²	57.1	58%	0.578	28%	0.279	S	S	*	.	H	α-helix	trans	-64.8	-39.4	177.6	-177.2	-178.5	171.9	-167.7	0	112.1	Y173 E174 D175 K179	Y173-K177 WeakPolarHBondContact O-CB 3.27Å; Y173-K177 PolarHBondContact O-N 3.37Å; E174-K177 PolarHBondContact O-N 2.82Å; D175-K177 PolarHBondContact O-N 2.78Å; K177-K179 VanDerWaalsContact C-N 3.25Å; K177-K179 PolarHBondContact O-N 3.5Å
178	N	96.8	Very high	96.9	Very high	93 Å²	93	58.9 Å²	58.9	50%	0.497	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	6.8	178.2	-63.6	-48.8	0	0	0	113.3	E174 D175 K180	E174-N178 VanDerWaalsContact O-CB 3.3Å; E174-N178 WeakPolarHBondContact O-CB 3.18Å; E174-N178 VanDerWaalsContact O-CG 3.29Å; E174-N178 PolarHBondContact O-N 3.27Å; E174-N178 PolarHBondContact O-ND2 3.1Å; D175-N178 CarbonylContact O-C 3.53Å; D175-N178 PolarHBondContact O-N 2.97Å; N178-K180 VanDerWaalsContact C-N 3.26Å; N178-K180 HydrophobicContact CB-CG 4.13Å; N178-K180 PolarHBondContact O-N 3.25Å
179	K	96.9	Very high	96.8	Very high	57 Å²	57	61.8 Å²	61.8	25%	0.248	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	37.6	-179.2	-47.9	-48.7	-153.1	152.5	0	113.6	D175 L176 K177 I208 V209 D210	D175-K179 PolarHBondContact O-N 2.99Å; L176-K179 WeakPolarHBondContact O-CD 3.4Å; L176-K179 PolarHBondContact O-N 2.9Å; K177-K179 VanDerWaalsContact C-N 3.25Å; K177-K179 PolarHBondContact O-N 3.5Å; K179-I208 WeakPolarHBondContact CD-O 3.24Å; K179-I208 VanDerWaalsContact CE-O 3.23Å; K179-I208 WeakPolarHBondContact CE-O 3.23Å; K179-I208 PolarHBondContact NZ-O 2.56Å; K179-V209 HydrophobicContact CB-CG2 4.41Å; K179-D210 WeakPolarHBondContact CE-OD2 3.43Å; K179-D210 IonicContact NZ-OD1 3.42Å; K179-D210 IonicContact NZ-OD2 2.7Å
180	K	97.1	Very high	96.6	Very high	56 Å²	56	58.7 Å²	58.7	24%	0.243	29%	0.286	C	S	.	.			trans	-96.8	129.3	178	-62.6	-63.4	176.2	177.2	0	110.3	D175 N178 R182 D214	D175-K180 HydrophobicContact CB-CB 4.21Å; D175-K180 PolarHBondContact O-N 3.35Å; N178-K180 VanDerWaalsContact C-N 3.26Å; N178-K180 HydrophobicContact CB-CG 4.13Å; N178-K180 PolarHBondContact O-N 3.25Å; K180-R182 HydrophobicContact CB-CG 4.46Å; K180-D214 IonicContact NZ-OD1 3.78Å; K180-D214 PolarHBondContact NZ-OD1 2.88Å; K180-D214 IonicContact NZ-OD2 3.27Å; K180-D214 PolarHBondContact NZ-OD2 2.88Å
181	V	97.6	Very high	96.6	Very high	7 Å²	7	56.6 Å²	56.6	4%	0.042	28%	0.277	C	S	.	.			trans	-102.8	102.1	171.4	-177.4	0	0	0	0	107.7	L153 I155 Y201 F204 Y205 I208	L153-V181 HydrophobicContact CD1-CG1 3.85Å; L153-V181 HydrophobicContact CD2-CG1 3.88Å; L153-V181 HydrophobicContact CG-CG1 4.46Å; I155-V181 HydrophobicContact CD1-CG2 4.45Å; V181-Y201 HydrophobicContact CB-CD2 4.21Å; V181-Y201 HydrophobicContact CB-CE2 4.01Å; V181-Y201 HydrophobicContact CG1-CD2 3.58Å; V181-Y201 HydrophobicContact CG1-CE2 3.92Å; V181-Y201 HydrophobicContact CG1-CG 4.49Å; V181-F204 HydrophobicContact CG1-CB 4.38Å; V181-Y205 HydrophobicContact CG2-CD2 4.38Å; V181-I208 HydrophobicContact CG2-CD1 3.61Å; V181-I208 HydrophobicContact CG2-CG1 3.88Å
182	R	97.1	Very high	96.5	Very high	103 Å²	103	55.3 Å²	55.3	39%	0.389	27%	0.267	S	S	.	.			trans	-123.5	148.6	-179.2	-70.7	178.9	172	148.3	-11.4	111.2	L153 T154 D175 K180	L153-R182 CarbonylContact C-O 3Å; L153-R182 WeakPolarHBondContact CA-O 3.36Å; L153-R182 WeakPolarHBondContact CB-O 3.4Å; L153-R182 VanDerWaalsContact CD2-O 3.3Å; L153-R182 WeakPolarHBondContact CD2-O 3.3Å; T154-R182 HydrophobicContact CG2-CB 4.21Å; T154-R182 PolarHBondContact N-O 3.16Å; D175-R182 IonicContact OD1-CZ 3.49Å; D175-R182 IonicContact OD1-NH1 3.1Å; D175-R182 PolarHBondContact OD1-NH1 3.2Å; K180-R182 HydrophobicContact CB-CG 4.46Å
183	F	97.8	Very high	96.2	Very high	12 Å²	12	57.6 Å²	57.6	5%	0.053	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-74.4	149.2	172.3	-75.6	-83.1	0	0	0	110.7	D152 L153 G185 A187 R190 I191 R197 Y201 T219	D152-F183 VanDerWaalsContact O-CA 3.31Å; D152-F183 WeakPolarHBondContact O-CA 3.47Å; D152-F183 WeakPolarHBondContact O-CD1 3.35Å; L153-F183 HydrophobicContact CD2-CD1 3.98Å; L153-F183 HydrophobicContact CD2-CD2 4.39Å; L153-F183 HydrophobicContact CD2-CE1 4.06Å; L153-F183 HydrophobicContact CD2-CE2 4.47Å; L153-F183 HydrophobicContact CD2-CG 4.16Å; L153-F183 HydrophobicContact CD2-CZ 4.31Å; F183-G185 PolarHBondContact O-N 3.41Å; F183-A187 HydrophobicContact CB-CB 4.4Å; F183-A187 HydrophobicContact CD2-CB 3.46Å; F183-A187 VanDerWaalsContact CD2-CB 3.46Å; F183-A187 HydrophobicContact CE2-CB 4.04Å; F183-A187 HydrophobicContact CG-CB 4.13Å; F183-R190 HydrophobicContact CB-CB 4.38Å; F183-R190 HydrophobicContact CB-CG 4.12Å; F183-R190 HydrophobicContact CD1-CB 3.5Å; F183-R190 HydrophobicContact CD1-CG 4.07Å; F183-R190 HydrophobicContact CE1-CB 4.06Å; F183-R190 HydrophobicContact CG-CB 4.15Å; F183-R190 HydrophobicContact CG-CG 4.43Å; F183-I191 HydrophobicContact CE1-CG1 4.28Å; F183-I191 HydrophobicContact CE2-CD1 4.1Å; F183-I191 HydrophobicContact CE2-CG1 4.2Å; F183-I191 HydrophobicContact CZ-CD1 4.09Å; F183-I191 HydrophobicContact CZ-CG1 3.74Å; F183-R197 HydrophobicContact CE1-CB 3.94Å; F183-R197 HydrophobicContact CZ-CB 4.3Å; F183-Y201 HydrophobicContact CE2-CD2 4.48Å; F183-T219 HydrophobicContact CD2-CG2 4.28Å; F183-T219 HydrophobicContact CE2-CG2 3.93Å
184	V	96.3	Very high	96.1	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.024	27%	0.266	C	S	.	.	S	Bend	trans	-72.6	116.1	163.8	176.8	0	0	0	0	107.5	D152 T154 F170 R190	D152-V184 PolarHBondContact O-N 2.6Å; T154-V184 HydrophobicContact CG2-CG2 4.19Å; F170-V184 HydrophobicContact CB-CG1 4.48Å; F170-V184 HydrophobicContact CB-CG2 4.27Å; F170-V184 HydrophobicContact CD1-CG1 3.69Å; F170-V184 HydrophobicContact CD2-CG1 3.83Å; F170-V184 HydrophobicContact CD2-CG2 4.27Å; F170-V184 HydrophobicContact CE1-CG1 3.76Å; F170-V184 HydrophobicContact CE2-CG1 3.91Å; F170-V184 HydrophobicContact CG-CG1 3.73Å; F170-V184 HydrophobicContact CG-CG2 4.25Å; F170-V184 HydrophobicContact CZ-CG1 3.87Å; V184-R190 WeakPolarHBondContact O-CD 3.29Å; V184-R190 VanDerWaalsContact O-CG 3.22Å; V184-R190 WeakPolarHBondContact O-CG 3.29Å; V184-R190 PolarHBondContact O-NH1 3.37Å
185	G	94.4	Very high	96.1	Very high	60 Å²	60	53.7 Å²	53.7	62%	0.619	26%	0.261	S	S	*	.	S	Bend	trans	74.4	-149.9	-170.8	0	0	0	0	0	113	F183	F183-G185 PolarHBondContact O-N 3.41Å
186	H	95.8	Very high	96.1	Very high	135 Å²	135	53.9 Å²	53.9	63%	0.625	26%	0.262	S	S	*	.			trans	-83.3	125.1	-173.4	-64	-67	0	0	0	113.3	K188 Q189 R190	H186-K188 VanDerWaalsContact C-N 3.32Å; H186-K188 PolarHBondContact O-N 3.44Å; H186-Q189 HydrophobicContact CB-CB 4.48Å; H186-Q189 PolarHBondContact O-N 3.01Å; H186-Q189 VanDerWaalsContact O-N 3.16Å; H186-R190 WeakPolarHBondContact O-CG 3.45Å; H186-R190 PolarHBondContact O-N 3.42Å; H186-R190 VanDerWaalsContact O-N 3.09Å
187	A	96.6	Very high	96.1	Very high	13 Å²	13	54.5 Å²	54.5	11%	0.107	26%	0.263	C	S	.	.	H	α-helix	trans	-51.4	-45.8	-177.6	0	0	0	0	0	113.6	F183 Q189 R190 I191 A222	F183-A187 HydrophobicContact CB-CB 4.4Å; F183-A187 HydrophobicContact CD2-CB 3.46Å; F183-A187 VanDerWaalsContact CD2-CB 3.46Å; F183-A187 HydrophobicContact CE2-CB 4.04Å; F183-A187 HydrophobicContact CG-CB 4.13Å; A187-Q189 PolarHBondContact O-N 3.17Å; A187-R190 PolarHBondContact O-N 2.98Å; A187-I191 WeakPolarHBondContact O-CB 3.38Å; A187-I191 VanDerWaalsContact O-CG1 3.29Å; A187-I191 WeakPolarHBondContact O-CG1 3.36Å; A187-I191 PolarHBondContact O-N 2.96Å; A187-A222 HydrophobicContact CB-CB 3.99Å
188	K	97.3	Very high	96.2	Very high	94 Å²	94	48.1 Å²	48.1	41%	0.409	24%	0.236	S	C	.	.	H	α-helix	trans	-57.8	-49.3	179.6	-177.3	167.3	-176.6	154	0	112.7	H186 I191 Q192 A222 E225	H186-K188 VanDerWaalsContact C-N 3.32Å; H186-K188 PolarHBondContact O-N 3.44Å; K188-I191 PolarHBondContact O-N 3.4Å; K188-Q192 VanDerWaalsContact O-CG 3.28Å; K188-Q192 WeakPolarHBondContact O-CG 3.42Å; K188-Q192 PolarHBondContact O-N 2.97Å; K188-A222 HydrophobicContact CB-CB 4.1Å; K188-E225 IonicContact NZ-OE2 2.74Å; K188-E225 PolarHBondContact NZ-OE2 3.33Å
189	Q	94.9	Very high	96.3	Very high	110 Å²	110	43.7 Å²	43.7	51%	0.514	21%	0.212	S	C	.	.	H	α-helix	trans	-62.3	-46.8	178.4	-178.4	-178.5	-3	0	0	110.6	H186 A187 I191 Q192 E193	H186-Q189 HydrophobicContact CB-CB 4.48Å; H186-Q189 PolarHBondContact O-N 3.01Å; H186-Q189 VanDerWaalsContact O-N 3.16Å; A187-Q189 PolarHBondContact O-N 3.17Å; Q189-I191 VanDerWaalsContact C-N 3.31Å; Q189-I191 PolarHBondContact O-N 3.24Å; Q189-Q192 PolarHBondContact O-N 2.93Å; Q189-Q192 VanDerWaalsContact O-N 3.14Å; Q189-E193 WeakPolarHBondContact O-CG 3.44Å; Q189-E193 PolarHBondContact O-N 2.97Å
190	R	94.4	Very high	96.4	Very high	10 Å²	10	43.9 Å²	43.9	4%	0.038	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-36.9	-179.7	-56.5	-40.7	-61.9	-70.7	-2.9	112	E149 R150 R151 F183 V184 H186 A187 E193 R197	E149-R190 PolarHBondContact O-NH1 3.14Å; R150-R190 PolarHBondContact O-NH2 3.03Å; R151-R190 PolarHBondContact O-NH1 3.06Å; R151-R190 PolarHBondContact O-NH2 3.3Å; F183-R190 HydrophobicContact CB-CB 4.38Å; F183-R190 HydrophobicContact CB-CG 4.12Å; F183-R190 HydrophobicContact CD1-CB 3.5Å; F183-R190 HydrophobicContact CD1-CG 4.07Å; F183-R190 HydrophobicContact CE1-CB 4.06Å; F183-R190 HydrophobicContact CG-CB 4.15Å; F183-R190 HydrophobicContact CG-CG 4.43Å; V184-R190 WeakPolarHBondContact O-CD 3.29Å; V184-R190 VanDerWaalsContact O-CG 3.22Å; V184-R190 WeakPolarHBondContact O-CG 3.29Å; V184-R190 PolarHBondContact O-NH1 3.37Å; H186-R190 WeakPolarHBondContact O-CG 3.45Å; H186-R190 PolarHBondContact O-N 3.42Å; H186-R190 VanDerWaalsContact O-N 3.09Å; A187-R190 PolarHBondContact O-N 2.98Å; R190-E193 IonicContact CZ-OE2 3.49Å; R190-E193 IonicContact NE-OE1 3.46Å; R190-E193 PolarHBondContact NE-OE1 3.39Å; R190-E193 IonicContact NE-OE2 2.61Å; R190-E193 PolarHBondContact NE-OE2 2.92Å; R190-E193 IonicContact NH2-OE2 2.68Å; R190-R197 WeakPolarHBondContact O-CD 3.37Å; R190-R197 PolarHBondContact O-NH1 3.12Å
191	I	96.5	Very high	96.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.2	-38.9	175.5	-73.1	166.6	0	0	0	111.1	F183 A187 K188 Q189 E193 D194 Y195 I198 A222 I223 N226	F183-I191 HydrophobicContact CE1-CG1 4.28Å; F183-I191 HydrophobicContact CE2-CD1 4.1Å; F183-I191 HydrophobicContact CE2-CG1 4.2Å; F183-I191 HydrophobicContact CZ-CD1 4.09Å; F183-I191 HydrophobicContact CZ-CG1 3.74Å; A187-I191 WeakPolarHBondContact O-CB 3.38Å; A187-I191 VanDerWaalsContact O-CG1 3.29Å; A187-I191 WeakPolarHBondContact O-CG1 3.36Å; A187-I191 PolarHBondContact O-N 2.96Å; K188-I191 PolarHBondContact O-N 3.4Å; Q189-I191 VanDerWaalsContact C-N 3.31Å; Q189-I191 PolarHBondContact O-N 3.24Å; I191-E193 VanDerWaalsContact C-N 3.34Å; I191-E193 PolarHBondContact O-N 3.22Å; I191-D194 CarbonylContact O-C 3.54Å; I191-D194 PolarHBondContact O-N 3.01Å; I191-Y195 HydrophobicContact CG2-CD1 3.84Å; I191-Y195 HydrophobicContact CG2-CE1 4.35Å; I191-Y195 VanDerWaalsContact O-CA 3.31Å; I191-Y195 WeakPolarHBondContact O-CA 3.47Å; I191-Y195 WeakPolarHBondContact O-CD1 3.49Å; I191-Y195 PolarHBondContact O-N 3.39Å; I191-I198 HydrophobicContact CD1-CG1 4.26Å; I191-I198 HydrophobicContact CG1-CG1 4.21Å; I191-I198 HydrophobicContact CG2-CD1 3.79Å; I191-I198 HydrophobicContact CG2-CG1 3.71Å; I191-A222 HydrophobicContact CD1-CB 3.95Å; I191-I223 HydrophobicContact CD1-CG1 3.83Å; I191-N226 HydrophobicContact CG2-CB 3.57Å
192	Q	95.1	Very high	96.5	Very high	91 Å²	91	41 Å²	41	43%	0.425	20%	0.198	S	C	.	.	H	α-helix	trans	-69.8	-28.9	179.6	-72	173.8	-9.5	0	0	113.4	K188 Q189 D194 Y195 N226	K188-Q192 VanDerWaalsContact O-CG 3.28Å; K188-Q192 WeakPolarHBondContact O-CG 3.42Å; K188-Q192 PolarHBondContact O-N 2.97Å; Q189-Q192 PolarHBondContact O-N 2.93Å; Q189-Q192 VanDerWaalsContact O-N 3.14Å; Q192-D194 VanDerWaalsContact C-N 3.35Å; Q192-Y195 HydrophobicContact CG-CE1 4.27Å; Q192-N226 WeakPolarHBondContact CG-OD1 3.37Å; Q192-N226 PolarHBondContact NE2-OD1 3.26Å
193	E	91.6	Very high	96.6	Very high	47 Å²	47	37.6 Å²	37.6	22%	0.22	19%	0.185	C	C	.	.	H	α-helix	trans	-64.2	-37.4	170.8	-72.5	165.5	-159.7	0	0	112.5	T131 D132 G133 Q189 R190 I191 R197	T131-E193 HydrophobicContact CG2-CB 4.14Å; T131-E193 HydrophobicContact CG2-CG 4.35Å; D132-E193 CarbonylContact C-O 3.26Å; G133-E193 WeakPolarHBondContact CA-O 3.4Å; G133-E193 PolarHBondContact N-O 2.98Å; Q189-E193 WeakPolarHBondContact O-CG 3.44Å; Q189-E193 PolarHBondContact O-N 2.97Å; R190-E193 IonicContact CZ-OE2 3.49Å; R190-E193 IonicContact NE-OE1 3.46Å; R190-E193 PolarHBondContact NE-OE1 3.39Å; R190-E193 IonicContact NE-OE2 2.61Å; R190-E193 PolarHBondContact NE-OE2 2.92Å; R190-E193 IonicContact NH2-OE2 2.68Å; I191-E193 VanDerWaalsContact C-N 3.34Å; I191-E193 PolarHBondContact O-N 3.22Å; E193-R197 IonicContact OE2-CZ 3.78Å; E193-R197 IonicContact OE2-NH1 2.82Å; E193-R197 PolarHBondContact OE2-NH1 3.44Å; E193-R197 IonicContact OE2-NH2 3.7Å; E193-R197 PolarHBondContact OE2-NH2 2.68Å
194	D	94.3	Very high	96.6	Very high	16 Å²	16	37.5 Å²	37.5	9%	0.086	19%	0.185	C	C	.	.			trans	-155.5	102.2	175.4	-175.8	8.5	0	0	0	110.6	I191 Q192 L196 R197 R237	I191-D194 CarbonylContact O-C 3.54Å; I191-D194 PolarHBondContact O-N 3.01Å; Q192-D194 VanDerWaalsContact C-N 3.35Å; D194-L196 PolarHBondContact O-N 3.29Å; D194-L196 VanDerWaalsContact OD1-CB 3.29Å; D194-L196 WeakPolarHBondContact OD1-CB 3.05Å; D194-L196 PolarHBondContact OD1-N 2.88Å; D194-R197 HydrophobicContact CB-CG 4.21Å; D194-R197 WeakPolarHBondContact O-CB 3.33Å; D194-R197 WeakPolarHBondContact O-CG 3.35Å; D194-R197 PolarHBondContact O-N 3.2Å; D194-R237 VanDerWaalsContact CG-NH2 3.28Å; D194-R237 IonicContact OD1-CZ 3.72Å; D194-R237 IonicContact OD1-NH1 3.68Å; D194-R237 IonicContact OD1-NH2 2.73Å; D194-R237 PolarHBondContact OD1-NH2 3.38Å; D194-R237 IonicContact OD2-CZ 2.76Å; D194-R237 IonicContact OD2-NH2 3.79Å; D194-R237 PolarHBondContact OD2-NH2 3.03Å
195	Y	97.3	Very high	96.7	Very high	71 Å²	71	37.6 Å²	37.6	28%	0.278	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-19.5	-177.7	-63.1	-71.9	0	0	0	113.2	I191 Q192 R197 I198 N226 G229 L230	I191-Y195 HydrophobicContact CG2-CD1 3.84Å; I191-Y195 HydrophobicContact CG2-CE1 4.35Å; I191-Y195 VanDerWaalsContact O-CA 3.31Å; I191-Y195 WeakPolarHBondContact O-CA 3.47Å; I191-Y195 WeakPolarHBondContact O-CD1 3.49Å; I191-Y195 PolarHBondContact O-N 3.39Å; Q192-Y195 HydrophobicContact CG-CE1 4.27Å; Y195-R197 PolarHBondContact O-N 3.18Å; Y195-R197 VanDerWaalsContact O-N 3.12Å; Y195-I198 WeakPolarHBondContact O-CB 3.39Å; Y195-I198 WeakPolarHBondContact O-CG1 3.41Å; Y195-I198 PolarHBondContact O-N 3.25Å; Y195-I198 VanDerWaalsContact O-N 3.09Å; Y195-N226 HydrophobicContact CD1-CB 4.16Å; Y195-N226 HydrophobicContact CE1-CB 3.9Å; Y195-G229 WeakPolarHBondContact CD2-O 3.4Å; Y195-L230 VanDerWaalsContact O-CD2 3.26Å; Y195-L230 WeakPolarHBondContact O-CD2 3.36Å
196	L	97.2	Very high	96.8	Very high	12 Å²	12	34.9 Å²	34.9	6%	0.063	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.8	173.1	-169.4	68.6	0	0	0	112.4	D194 I198 L199 R200 I233 R237 I238 E241	D194-L196 PolarHBondContact O-N 3.29Å; D194-L196 VanDerWaalsContact OD1-CB 3.29Å; D194-L196 WeakPolarHBondContact OD1-CB 3.05Å; D194-L196 PolarHBondContact OD1-N 2.88Å; L196-I198 PolarHBondContact O-N 3.37Å; L196-L199 HydrophobicContact CD1-CD1 4.11Å; L196-L199 PolarHBondContact O-N 3.38Å; L196-R200 PolarHBondContact O-N 3.14Å; L196-I233 HydrophobicContact CB-CG2 4.37Å; L196-I233 HydrophobicContact CD1-CG2 4.14Å; L196-R237 HydrophobicContact CD1-CB 4.31Å; L196-R237 HydrophobicContact CD2-CB 4Å; L196-I238 HydrophobicContact CD1-CG1 4.18Å; L196-E241 HydrophobicContact CD1-CB 4.44Å; L196-E241 HydrophobicContact CD1-CG 3.97Å; L196-E241 HydrophobicContact CD2-CG 4.18Å; L196-E241 HydrophobicContact CG-CG 4.08Å
197	R	97.7	Very high	96.8	Very high	20 Å²	20	34.1 Å²	34.1	8%	0.075	15%	0.148	C	C	.	.	H	α-helix	trans	-61	-22.5	175.5	-70.9	168.6	178.2	176.8	3.8	113.4	D152 F183 R190 E193 D194 Y195 R200 Y201	D152-R197 HydrophobicContact CB-CG 4.08Å; F183-R197 HydrophobicContact CE1-CB 3.94Å; F183-R197 HydrophobicContact CZ-CB 4.3Å; R190-R197 WeakPolarHBondContact O-CD 3.37Å; R190-R197 PolarHBondContact O-NH1 3.12Å; E193-R197 IonicContact OE2-CZ 3.78Å; E193-R197 IonicContact OE2-NH1 2.82Å; E193-R197 PolarHBondContact OE2-NH1 3.44Å; E193-R197 IonicContact OE2-NH2 3.7Å; E193-R197 PolarHBondContact OE2-NH2 2.68Å; D194-R197 HydrophobicContact CB-CG 4.21Å; D194-R197 WeakPolarHBondContact O-CB 3.33Å; D194-R197 WeakPolarHBondContact O-CG 3.35Å; D194-R197 PolarHBondContact O-N 3.2Å; Y195-R197 PolarHBondContact O-N 3.18Å; Y195-R197 VanDerWaalsContact O-N 3.12Å; R197-R200 PolarHBondContact O-N 3.34Å; R197-Y201 PolarHBondContact O-N 3.42Å
198	I	98.6	Very high	96.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.2	-49.2	169.5	-65.6	173.8	0	0	0	110.5	I191 Y195 L196 R200 Y201 F202 I223 L230 V263	I191-I198 HydrophobicContact CD1-CG1 4.26Å; I191-I198 HydrophobicContact CG1-CG1 4.21Å; I191-I198 HydrophobicContact CG2-CD1 3.79Å; I191-I198 HydrophobicContact CG2-CG1 3.71Å; Y195-I198 WeakPolarHBondContact O-CB 3.39Å; Y195-I198 WeakPolarHBondContact O-CG1 3.41Å; Y195-I198 PolarHBondContact O-N 3.25Å; Y195-I198 VanDerWaalsContact O-N 3.09Å; L196-I198 PolarHBondContact O-N 3.37Å; I198-R200 VanDerWaalsContact C-N 3.33Å; I198-R200 PolarHBondContact O-N 2.76Å; I198-Y201 WeakPolarHBondContact O-CB 3.49Å; I198-Y201 PolarHBondContact O-N 3.04Å; I198-F202 HydrophobicContact CG2-CD2 4.33Å; I198-F202 HydrophobicContact CG2-CE2 3.63Å; I198-F202 HydrophobicContact CG2-CZ 4.34Å; I198-F202 VanDerWaalsContact O-CD2 3.26Å; I198-F202 WeakPolarHBondContact O-CD2 3.44Å; I198-F202 PolarHBondContact O-N 3.36Å; I198-I223 HydrophobicContact CG1-CG1 4.33Å; I198-I223 HydrophobicContact CG2-CG1 4.37Å; I198-I223 HydrophobicContact CG2-CG2 3.7Å; I198-L230 HydrophobicContact CB-CD1 4.16Å; I198-L230 HydrophobicContact CD1-CD1 4.03Å; I198-L230 HydrophobicContact CD1-CG 4.2Å; I198-L230 HydrophobicContact CG2-CD1 4Å; I198-V263 HydrophobicContact CG2-CG1 4.42Å; I198-V263 HydrophobicContact CG2-CG2 4.15Å
199	L	98.7	Very high	96.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-70.1	-33.5	178.9	-59.9	-175.4	0	0	0	112	L196 Y201 F202 R203 L230 I238 E241 I245 V263 I267	L196-L199 HydrophobicContact CD1-CD1 4.11Å; L196-L199 PolarHBondContact O-N 3.38Å; L199-Y201 VanDerWaalsContact C-N 3.33Å; L199-Y201 PolarHBondContact O-N 3.29Å; L199-F202 HydrophobicContact CD2-CD2 4.19Å; L199-F202 PolarHBondContact O-N 2.93Å; L199-R203 PolarHBondContact O-N 3.47Å; L199-L230 HydrophobicContact CD1-CD2 4.47Å; L199-L230 HydrophobicContact CG-CD2 4.27Å; L199-I238 HydrophobicContact CD1-CB 4.19Å; L199-I238 HydrophobicContact CD1-CG1 4.08Å; L199-I238 HydrophobicContact CD1-CG2 3.81Å; L199-E241 HydrophobicContact CB-CB 3.85Å; L199-E241 HydrophobicContact CB-CG 4.47Å; L199-E241 HydrophobicContact CD1-CB 4.23Å; L199-I245 HydrophobicContact CB-CD1 4.38Å; L199-V263 HydrophobicContact CD2-CG1 4.25Å; L199-I267 HydrophobicContact CD1-CG2 4.19Å; L199-I267 HydrophobicContact CD2-CD1 4.29Å; L199-I267 HydrophobicContact CD2-CG2 4.32Å
200	R	98.3	Very high	96.7	Very high	60 Å²	60	30.1 Å²	30.1	23%	0.226	13%	0.134	C	C	.	.	H	α-helix	trans	-65.4	-37.7	175.6	-65.1	173.5	55.7	91.7	-3.5	111.6	D152 L196 R197 I198 R203 F204 E241	D152-R200 IonicContact OD1-NH2 3.74Å; D152-R200 IonicContact OD2-CZ 2.63Å; D152-R200 IonicContact OD2-NE 3.91Å; D152-R200 PolarHBondContact OD2-NE 2.9Å; D152-R200 IonicContact OD2-NH2 2.68Å; D152-R200 PolarHBondContact OD2-NH2 3.23Å; L196-R200 PolarHBondContact O-N 3.14Å; R197-R200 PolarHBondContact O-N 3.34Å; I198-R200 VanDerWaalsContact C-N 3.33Å; I198-R200 PolarHBondContact O-N 2.76Å; R200-R203 VanDerWaalsContact NH1-NH2 3.15Å; R200-R203 PolarHBondContact O-N 3.33Å; R200-F204 HydrophobicContact CB-CD2 4.27Å; R200-F204 HydrophobicContact CB-CE2 4.32Å; R200-F204 WeakPolarHBondContact O-CB 3.23Å; R200-F204 WeakPolarHBondContact O-CD2 3.41Å; R200-F204 PolarHBondContact O-N 3.33Å; R200-E241 HydrophobicContact CG-CG 4.2Å; R200-E241 IonicContact NH1-OE1 2.6Å
201	Y	98.7	Very high	96.8	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-54.7	-54.7	171.4	171.1	-94.6	0	0	0	110.9	V181 F183 R197 I198 L199 R203 F204 Y205 H215 T219 L220 I223	V181-Y201 HydrophobicContact CB-CD2 4.21Å; V181-Y201 HydrophobicContact CB-CE2 4.01Å; V181-Y201 HydrophobicContact CG1-CD2 3.58Å; V181-Y201 HydrophobicContact CG1-CE2 3.92Å; V181-Y201 HydrophobicContact CG1-CG 4.49Å; F183-Y201 HydrophobicContact CE2-CD2 4.48Å; R197-Y201 PolarHBondContact O-N 3.42Å; I198-Y201 WeakPolarHBondContact O-CB 3.49Å; I198-Y201 PolarHBondContact O-N 3.04Å; L199-Y201 VanDerWaalsContact C-N 3.33Å; L199-Y201 PolarHBondContact O-N 3.29Å; Y201-R203 PolarHBondContact O-N 3.4Å; Y201-F204 PolarHBondContact O-N 2.92Å; Y201-Y205 WeakPolarHBondContact O-CB 3.25Å; Y201-Y205 PolarHBondContact O-N 3.31Å; Y201-H215 AromaticContact CE1-ND1 3.97Å; Y201-H215 AromaticContact CZ-ND1 3.77Å; Y201-H215 PolarHBondContact OH-ND1 3.06Å; Y201-T219 HydrophobicContact CD2-CG2 3.76Å; Y201-T219 HydrophobicContact CE1-CG2 4.49Å; Y201-T219 HydrophobicContact CE2-CG2 3.47Å; Y201-T219 VanDerWaalsContact CE2-CG2 3.47Å; Y201-T219 HydrophobicContact CG-CG2 4.39Å; Y201-L220 HydrophobicContact CE1-CD2 4.31Å; Y201-I223 HydrophobicContact CD1-CD1 3.42Å; Y201-I223 VanDerWaalsContact CD1-CD1 3.42Å; Y201-I223 HydrophobicContact CE1-CD1 3.75Å; Y201-I223 HydrophobicContact CG-CD1 3.89Å
202	F	98.7	Very high	96.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.4	-46.7	178.5	-62.8	-52.9	0	0	0	112.2	I198 L199 F204 Y205 G206 I223 I245 L254 L257 I258 L261 V263	I198-F202 HydrophobicContact CG2-CD2 4.33Å; I198-F202 HydrophobicContact CG2-CE2 3.63Å; I198-F202 HydrophobicContact CG2-CZ 4.34Å; I198-F202 VanDerWaalsContact O-CD2 3.26Å; I198-F202 WeakPolarHBondContact O-CD2 3.44Å; I198-F202 PolarHBondContact O-N 3.36Å; L199-F202 HydrophobicContact CD2-CD2 4.19Å; L199-F202 PolarHBondContact O-N 2.93Å; F202-F204 VanDerWaalsContact C-N 3.34Å; F202-F204 PolarHBondContact O-N 3.43Å; F202-Y205 PolarHBondContact O-N 3.03Å; F202-G206 PolarHBondContact O-N 2.86Å; F202-I223 HydrophobicContact CZ-CG2 4.08Å; F202-I245 HydrophobicContact CB-CD1 3.92Å; F202-I245 HydrophobicContact CB-CG1 4.47Å; F202-L254 HydrophobicContact CB-CD2 4.12Å; F202-L254 HydrophobicContact CD1-CD2 4.22Å; F202-L254 WeakPolarHBondContact O-CD1 3.3Å; F202-L257 HydrophobicContact CD1-CD2 4.14Å; F202-L257 HydrophobicContact CE1-CB 4.45Å; F202-L257 HydrophobicContact CE1-CD2 3.68Å; F202-L257 HydrophobicContact CE1-CG 3.88Å; F202-I258 HydrophobicContact CD2-CD1 4.01Å; F202-I258 HydrophobicContact CD2-CG1 3.7Å; F202-I258 HydrophobicContact CE1-CG1 4.46Å; F202-I258 HydrophobicContact CE2-CD1 4.36Å; F202-I258 HydrophobicContact CE2-CG1 3.57Å; F202-I258 HydrophobicContact CG-CD1 4.42Å; F202-I258 HydrophobicContact CG-CG1 4.23Å; F202-I258 HydrophobicContact CZ-CG1 3.98Å; F202-L261 HydrophobicContact CE1-CD1 4.17Å; F202-L261 HydrophobicContact CZ-CD1 4Å; F202-V263 HydrophobicContact CE2-CG1 4.41Å; F202-V263 HydrophobicContact CE2-CG2 4.27Å; F202-V263 HydrophobicContact CZ-CG2 4.38Å
203	R	98.2	Very high	96.8	Very high	33 Å²	33	38.7 Å²	38.7	13%	0.125	19%	0.189	C	C	.	.	H	α-helix	trans	-55.9	-49.5	178.1	-178	-172.5	69.7	-166.4	-1.5	111.5	L199 R200 Y201 G206 R207 E241 K244 I245	L199-R203 PolarHBondContact O-N 3.47Å; R200-R203 VanDerWaalsContact NH1-NH2 3.15Å; R200-R203 PolarHBondContact O-N 3.33Å; Y201-R203 PolarHBondContact O-N 3.4Å; R203-G206 PolarHBondContact O-N 3.28Å; R203-R207 WeakPolarHBondContact O-CB 3.22Å; R203-R207 PolarHBondContact O-N 2.96Å; R203-E241 VanDerWaalsContact CD-OE2 3.23Å; R203-E241 WeakPolarHBondContact CD-OE2 3.32Å; R203-E241 IonicContact CZ-OE1 3.4Å; R203-E241 IonicContact CZ-OE2 3.73Å; R203-E241 IonicContact NE-OE2 3.16Å; R203-E241 PolarHBondContact NE-OE2 2.81Å; R203-E241 IonicContact NH1-OE1 2.72Å; R203-E241 PolarHBondContact NH1-OE1 2.99Å; R203-E241 IonicContact NH1-OE2 2.86Å; R203-E241 PolarHBondContact NH1-OE2 3.08Å; R203-E241 IonicContact NH2-OE1 2.76Å; R203-E241 IonicContact NH2-OE2 3.98Å; R203-K244 HydrophobicContact CG-CB 4.07Å; R203-I245 HydrophobicContact CB-CG1 3.86Å
204	F	97.4	Very high	97	Very high	10 Å²	10	41.3 Å²	41.3	4%	0.044	21%	0.205	C	C	.	.	H	α-helix	trans	-75.2	-30.1	-175.7	-72.6	-57.3	0	0	0	112.8	L153 I155 N156 V181 R200 Y201 F202 R207 I208	L153-F204 HydrophobicContact CD1-CB 4.01Å; L153-F204 HydrophobicContact CD1-CD2 3.3Å; L153-F204 HydrophobicContact CD1-CE2 3.98Å; L153-F204 HydrophobicContact CD1-CG 3.97Å; I155-F204 HydrophobicContact CD1-CB 4.21Å; N156-F204 WeakPolarHBondContact ND2-CE2 3.31Å; N156-F204 WeakPolarHBondContact ND2-CZ 3.32Å; V181-F204 HydrophobicContact CG1-CB 4.38Å; R200-F204 HydrophobicContact CB-CD2 4.27Å; R200-F204 HydrophobicContact CB-CE2 4.32Å; R200-F204 WeakPolarHBondContact O-CB 3.23Å; R200-F204 WeakPolarHBondContact O-CD2 3.41Å; R200-F204 PolarHBondContact O-N 3.33Å; Y201-F204 PolarHBondContact O-N 2.92Å; F202-F204 VanDerWaalsContact C-N 3.34Å; F202-F204 PolarHBondContact O-N 3.43Å; F204-R207 PolarHBondContact O-N 3.06Å; F204-R207 VanDerWaalsContact O-N 3.15Å; F204-I208 WeakPolarHBondContact O-CG1 3.4Å; F204-I208 PolarHBondContact O-N 2.92Å
205	Y	98.5	Very high	97.1	Very high	6 Å²	6	42 Å²	42	2%	0.024	21%	0.207	C	C	.	.	H	α-helix	trans	-57.8	-52.8	169.1	-169.6	-81.5	0	0	0	110.2	V181 Y201 F202 R207 I208 V209 P212 G213 D214 H215 H253 L254	V181-Y205 HydrophobicContact CG2-CD2 4.38Å; Y201-Y205 WeakPolarHBondContact O-CB 3.25Å; Y201-Y205 PolarHBondContact O-N 3.31Å; F202-Y205 PolarHBondContact O-N 3.03Å; Y205-R207 PolarHBondContact O-N 3.44Å; Y205-I208 PolarHBondContact O-N 2.92Å; Y205-V209 HydrophobicContact CD1-CB 4.23Å; Y205-V209 HydrophobicContact CD1-CG2 3.98Å; Y205-V209 HydrophobicContact CD2-CG2 3.85Å; Y205-V209 HydrophobicContact CE1-CB 4.03Å; Y205-V209 HydrophobicContact CE1-CG1 3.95Å; Y205-V209 HydrophobicContact CE1-CG2 3.92Å; Y205-V209 HydrophobicContact CE2-CG2 3.79Å; Y205-V209 HydrophobicContact CG-CG2 3.94Å; Y205-V209 VanDerWaalsContact O-CB 3.26Å; Y205-V209 WeakPolarHBondContact O-CB 2.97Å; Y205-V209 VanDerWaalsContact O-CG2 3.31Å; Y205-V209 WeakPolarHBondContact O-CG2 3.38Å; Y205-V209 PolarHBondContact O-N 2.73Å; Y205-P212 HydrophobicContact CE1-CB 4.02Å; Y205-G213 PolarHBondContact OH-N 3.47Å; Y205-G213 VanDerWaalsContact OH-N 3.09Å; Y205-D214 VanDerWaalsContact CE2-O 3.28Å; Y205-D214 WeakPolarHBondContact CE2-O 3.3Å; Y205-D214 PolarHBondContact OH-N 3.13Å; Y205-D214 PolarHBondContact OH-O 3.5Å; Y205-H215 AromaticContact CD1-CE1 3.96Å; Y205-H215 AromaticContact CD2-CE1 3.62Å; Y205-H215 AromaticContact CD2-ND1 3.76Å; Y205-H215 AromaticContact CE1-CE1 3.61Å; Y205-H215 AromaticContact CE1-NE2 3.81Å; Y205-H215 AromaticContact CE2-CE1 3.23Å; Y205-H215 WeakPolarHBondContact CE2-CE1 3.38Å; Y205-H215 AromaticContact CE2-ND1 3.37Å; Y205-H215 WeakPolarHBondContact CE2-ND1 3.3Å; Y205-H215 AromaticContact CE2-NE2 3.82Å; Y205-H215 AromaticContact CG-CE1 3.97Å; Y205-H215 AromaticContact CZ-CE1 3.23Å; Y205-H215 AromaticContact CZ-ND1 3.8Å; Y205-H215 AromaticContact CZ-NE2 3.39Å; Y205-H215 PolarHBondContact OH-NE2 2.99Å; Y205-H253 AromaticContact CE1-NE2 4Å; Y205-L254 HydrophobicContact CD1-CD2 3.98Å; Y205-L254 HydrophobicContact CG-CD2 4.5Å
206	G	97.4	Very high	96.9	Very high	2 Å²	2	41.4 Å²	41.4	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-58	-33	174.6	0	0	0	0	0	113.3	F202 R203 N249	F202-G206 PolarHBondContact O-N 2.86Å; R203-G206 PolarHBondContact O-N 3.28Å; G206-N249 WeakPolarHBondContact O-CB 3.25Å
207	R	95.4	Very high	96.9	Very high	119 Å²	119	44.3 Å²	44.3	45%	0.449	24%	0.235	S	C	.	.	H	α-helix	trans	-73.2	-38	-177.7	-178.2	58.4	172.1	-118.3	-11.2	114.1	D68 R203 F204 Y205	D68-R207 VanDerWaalsContact CG-NH2 3.33Å; D68-R207 IonicContact OD1-CZ 2.77Å; D68-R207 IonicContact OD1-NE 3.31Å; D68-R207 IonicContact OD1-NH2 2.8Å; D68-R207 PolarHBondContact OD1-NH2 3.32Å; D68-R207 IonicContact OD2-NH2 2.84Å; D68-R207 PolarHBondContact OD2-NH2 3.16Å; R203-R207 WeakPolarHBondContact O-CB 3.22Å; R203-R207 PolarHBondContact O-N 2.96Å; F204-R207 PolarHBondContact O-N 3.06Å; F204-R207 VanDerWaalsContact O-N 3.15Å; Y205-R207 PolarHBondContact O-N 3.44Å
208	I	95.4	Very high	96.8	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-109.2	-26.1	-169.7	74.4	170	0	0	0	114.3	I155 L176 K179 V181 F204 Y205	I155-I208 HydrophobicContact CD1-CD1 3.83Å; I155-I208 HydrophobicContact CD1-CG2 4.32Å; I155-I208 HydrophobicContact CG2-CD1 4.33Å; L176-I208 HydrophobicContact CD1-CB 4.37Å; L176-I208 HydrophobicContact CD1-CD1 4.31Å; L176-I208 HydrophobicContact CD1-CG2 3.96Å; K179-I208 WeakPolarHBondContact CD-O 3.24Å; K179-I208 VanDerWaalsContact CE-O 3.23Å; K179-I208 WeakPolarHBondContact CE-O 3.23Å; K179-I208 PolarHBondContact NZ-O 2.56Å; V181-I208 HydrophobicContact CG2-CD1 3.61Å; V181-I208 HydrophobicContact CG2-CG1 3.88Å; F204-I208 WeakPolarHBondContact O-CG1 3.4Å; F204-I208 PolarHBondContact O-N 2.92Å; Y205-I208 PolarHBondContact O-N 2.92Å
209	V	97.1	Very high	96.7	Very high	11 Å²	11	50.1 Å²	50.1	7%	0.067	26%	0.263	C	S	.	.			trans	-77.3	135.6	-174.5	175.4	0	0	0	0	109.8	K179 Y205 K211 H250	K179-V209 HydrophobicContact CB-CG2 4.41Å; Y205-V209 HydrophobicContact CD1-CB 4.23Å; Y205-V209 HydrophobicContact CD1-CG2 3.98Å; Y205-V209 HydrophobicContact CD2-CG2 3.85Å; Y205-V209 HydrophobicContact CE1-CB 4.03Å; Y205-V209 HydrophobicContact CE1-CG1 3.95Å; Y205-V209 HydrophobicContact CE1-CG2 3.92Å; Y205-V209 HydrophobicContact CE2-CG2 3.79Å; Y205-V209 HydrophobicContact CG-CG2 3.94Å; Y205-V209 VanDerWaalsContact O-CB 3.26Å; Y205-V209 WeakPolarHBondContact O-CB 2.97Å; Y205-V209 VanDerWaalsContact O-CG2 3.31Å; Y205-V209 WeakPolarHBondContact O-CG2 3.38Å; Y205-V209 PolarHBondContact O-N 2.73Å; V209-K211 VanDerWaalsContact CG1-O 3.27Å; V209-K211 WeakPolarHBondContact CG1-O 3.32Å; V209-H250 PolarHBondContact O-CD2 3.49Å; V209-H250 VanDerWaalsContact O-CD2 3.26Å; V209-H250 PolarHBondContact O-NE2 2.86Å
210	D	94.4	Very high	96.7	Very high	120 Å²	120	51.9 Å²	51.9	64%	0.642	27%	0.273	S	S	*	.	S	Bend	trans	-86.9	-44.3	177.7	-60.7	-40.4	0	0	0	111.4	K179 H250	K179-D210 WeakPolarHBondContact CE-OD2 3.43Å; K179-D210 IonicContact NZ-OD1 3.42Å; K179-D210 IonicContact NZ-OD2 2.7Å; D210-H250 PolarHBondContact O-CE1 2.87Å; D210-H250 VanDerWaalsContact O-CE1 3.24Å; D210-H250 PolarHBondContact O-NE2 3.4Å
211	K	97	Very high	96.7	Very high	182 Å²	182	54.5 Å²	54.5	79%	0.791	29%	0.287	S	S	*	.	S	Bend	trans	-123.3	111.8	177.1	-176.4	177.9	176.2	-179.2	0	110.4	V209	V209-K211 VanDerWaalsContact CG1-O 3.27Å; V209-K211 WeakPolarHBondContact CG1-O 3.32Å
212	P	96.8	Very high	96.7	Very high	44 Å²	44	54.6 Å²	54.6	29%	0.286	29%	0.288	S	S	.	.			trans	-68.5	156.2	-179.6	22.4	-27.7	0	0	0	112.9	Y205 H250 H253	Y205-P212 HydrophobicContact CE1-CB 4.02Å; P212-H250 HydrophobicContact CG-CB 4.48Å; P212-H253 HydrophobicContact CB-CB 4Å; P212-H253 VanDerWaalsContact CB-CG 3.5Å; P212-H253 HydrophobicContact CG-CB 4.12Å
213	G	93.7	Very high	96.7	Very high	54 Å²	54	54.6 Å²	54.6	56%	0.557	29%	0.288	S	S	*	.			trans	133.1	-27.2	171.3	0	0	0	0	0	114.4	Y205	Y205-G213 PolarHBondContact OH-N 3.47Å; Y205-G213 VanDerWaalsContact OH-N 3.09Å
214	D	95.6	Very high	96.7	Very high	103 Å²	103	55.2 Å²	55.2	55%	0.551	30%	0.301	S	S	*	.			trans	-90.5	115	175.2	-177.9	-2.6	0	0	0	109.5	K180 Y205	K180-D214 IonicContact NZ-OD1 3.78Å; K180-D214 PolarHBondContact NZ-OD1 2.88Å; K180-D214 IonicContact NZ-OD2 3.27Å; K180-D214 PolarHBondContact NZ-OD2 2.88Å; Y205-D214 VanDerWaalsContact CE2-O 3.28Å; Y205-D214 WeakPolarHBondContact CE2-O 3.3Å; Y205-D214 PolarHBondContact OH-N 3.13Å; Y205-D214 PolarHBondContact OH-O 3.5Å
215	H	97.1	Very high	96.8	Very high	29 Å²	29	59.7 Å²	59.7	13%	0.134	32%	0.322	C	S	.	.			trans	-129.8	147.3	177.3	-67.1	-92.7	0	0	0	109.4	Y201 Y205 A217 L220 H253 L257	Y201-H215 AromaticContact CE1-ND1 3.97Å; Y201-H215 AromaticContact CZ-ND1 3.77Å; Y201-H215 PolarHBondContact OH-ND1 3.06Å; Y205-H215 AromaticContact CD1-CE1 3.96Å; Y205-H215 AromaticContact CD2-CE1 3.62Å; Y205-H215 AromaticContact CD2-ND1 3.76Å; Y205-H215 AromaticContact CE1-CE1 3.61Å; Y205-H215 AromaticContact CE1-NE2 3.81Å; Y205-H215 AromaticContact CE2-CE1 3.23Å; Y205-H215 WeakPolarHBondContact CE2-CE1 3.38Å; Y205-H215 AromaticContact CE2-ND1 3.37Å; Y205-H215 WeakPolarHBondContact CE2-ND1 3.3Å; Y205-H215 AromaticContact CE2-NE2 3.82Å; Y205-H215 AromaticContact CG-CE1 3.97Å; Y205-H215 AromaticContact CZ-CE1 3.23Å; Y205-H215 AromaticContact CZ-ND1 3.8Å; Y205-H215 AromaticContact CZ-NE2 3.39Å; Y205-H215 PolarHBondContact OH-NE2 2.99Å; H215-A217 PolarHBondContact O-N 2.86Å; H215-L220 HydrophobicContact CB-CD1 3.62Å; H215-L220 HydrophobicContact CB-CD2 3.88Å; H215-L220 HydrophobicContact CB-CG 3.75Å; H215-H253 AromaticContact CE1-NE2 3.61Å; H215-H253 AromaticContact NE2-CE1 3.57Å; H215-H253 AromaticContact NE2-NE2 2.87Å; H215-H253 PolarHBondContact NE2-NE2 2.85Å; H215-L257 WeakPolarHBondContact CE1-CD2 3.34Å
216	D	94.1	Very high	96.8	Very high	60 Å²	60	60 Å²	60	32%	0.321	32%	0.324	S	S	.	.			trans	-70.2	121.7	170.5	-165.7	-17.7	0	0	0	110.1	E218 T219 L220	D216-E218 VanDerWaalsContact C-N 3.3Å; D216-E218 PolarHBondContact O-N 2.88Å; D216-E218 PolarHBondContact OD1-N 3.28Å; D216-T219 WeakPolarHBondContact O-CB 3.47Å; D216-T219 PolarHBondContact O-N 3.05Å; D216-T219 VanDerWaalsContact O-N 3.09Å; D216-L220 PolarHBondContact O-N 3.09Å
217	A	95.8	Very high	96.8	Very high	73 Å²	73	60 Å²	60	60%	0.603	32%	0.324	S	S	*	.	H	α-helix	trans	-59.7	-40.9	-175.9	0	0	0	0	0	111.9	H215 T219 L220 E221	H215-A217 PolarHBondContact O-N 2.86Å; A217-T219 VanDerWaalsContact C-N 3.25Å; A217-T219 PolarHBondContact O-N 3.07Å; A217-L220 PolarHBondContact O-N 2.63Å; A217-E221 WeakPolarHBondContact O-CB 3.3Å; A217-E221 PolarHBondContact O-N 2.76Å
218	E	95.8	Very high	97	Very high	137 Å²	137	61.5 Å²	61.5	64%	0.64	33%	0.334	S	S	*	.	H	α-helix	trans	-64	-34	178.4	-65.5	-173.8	-179.2	0	0	111.6	D216 A222	D216-E218 VanDerWaalsContact C-N 3.3Å; D216-E218 PolarHBondContact O-N 2.88Å; D216-E218 PolarHBondContact OD1-N 3.28Å; E218-A222 VanDerWaalsContact O-CB 3.27Å; E218-A222 WeakPolarHBondContact O-CB 3.35Å; E218-A222 PolarHBondContact O-N 3.01Å
219	T	97.6	Very high	97.1	Very high	4 Å²	4	62.2 Å²	62.2	3%	0.025	34%	0.341	C	S	.	.	H	α-helix	trans	-71.8	-41.8	177.1	-63.8	0	0	0	0	111.2	F183 Y201 D216 A217 A222 I223	F183-T219 HydrophobicContact CD2-CG2 4.28Å; F183-T219 HydrophobicContact CE2-CG2 3.93Å; Y201-T219 HydrophobicContact CD2-CG2 3.76Å; Y201-T219 HydrophobicContact CE1-CG2 4.49Å; Y201-T219 HydrophobicContact CE2-CG2 3.47Å; Y201-T219 VanDerWaalsContact CE2-CG2 3.47Å; Y201-T219 HydrophobicContact CG-CG2 4.39Å; D216-T219 WeakPolarHBondContact O-CB 3.47Å; D216-T219 PolarHBondContact O-N 3.05Å; D216-T219 VanDerWaalsContact O-N 3.09Å; A217-T219 VanDerWaalsContact C-N 3.25Å; A217-T219 PolarHBondContact O-N 3.07Å; T219-A222 PolarHBondContact O-N 2.87Å; T219-I223 HydrophobicContact CG2-CD1 3.93Å; T219-I223 VanDerWaalsContact O-CG1 3.26Å; T219-I223 WeakPolarHBondContact O-CG1 3.31Å; T219-I223 PolarHBondContact O-N 2.85Å
220	L	98.1	Very high	97.1	Very high	38 Å²	38	61.7 Å²	61.7	20%	0.199	34%	0.338	C	S	.	.	H	α-helix	trans	-65.1	-42.1	176.9	-64.2	-167.2	0	0	0	111.9	Y201 H215 D216 A217 I223 A224 L257 L261	Y201-L220 HydrophobicContact CE1-CD2 4.31Å; H215-L220 HydrophobicContact CB-CD1 3.62Å; H215-L220 HydrophobicContact CB-CD2 3.88Å; H215-L220 HydrophobicContact CB-CG 3.75Å; D216-L220 PolarHBondContact O-N 3.09Å; A217-L220 PolarHBondContact O-N 2.63Å; L220-I223 PolarHBondContact O-N 2.6Å; L220-A224 PolarHBondContact O-N 3.44Å; L220-L257 HydrophobicContact CD2-CD2 4.35Å; L220-L261 HydrophobicContact CB-CD2 4.48Å; L220-L261 HydrophobicContact CD2-CD1 4.06Å
221	E	98.4	Very high	97.3	Very high	114 Å²	114	58.8 Å²	58.8	53%	0.533	33%	0.331	S	S	.	.	H	α-helix	trans	-59	-50	173.8	-178.1	178.2	-165.2	0	0	110.8	A217 I223 A224 E225	A217-E221 WeakPolarHBondContact O-CB 3.3Å; A217-E221 PolarHBondContact O-N 2.76Å; E221-I223 VanDerWaalsContact C-N 3.27Å; E221-I223 PolarHBondContact O-N 3.33Å; E221-A224 PolarHBondContact O-N 3.29Å; E221-E225 HydrophobicContact CG-CG 4.39Å; E221-E225 WeakPolarHBondContact O-CB 3.3Å; E221-E225 WeakPolarHBondContact O-CG 3.41Å; E221-E225 PolarHBondContact O-N 3.17Å
222	A	98.4	Very high	97.2	Very high	4 Å²	4	53.6 Å²	53.6	3%	0.033	33%	0.329	C	S	.	.	H	α-helix	trans	-59.2	-37.6	177.2	0	0	0	0	0	112.5	A187 K188 I191 E218 T219 N226	A187-A222 HydrophobicContact CB-CB 3.99Å; K188-A222 HydrophobicContact CB-CB 4.1Å; I191-A222 HydrophobicContact CD1-CB 3.95Å; E218-A222 VanDerWaalsContact O-CB 3.27Å; E218-A222 WeakPolarHBondContact O-CB 3.35Å; E218-A222 PolarHBondContact O-N 3.01Å; T219-A222 PolarHBondContact O-N 2.87Å; A222-N226 VanDerWaalsContact O-CB 3.3Å; A222-N226 WeakPolarHBondContact O-CB 3.37Å; A222-N226 PolarHBondContact O-N 3.49Å; A222-N226 PolarHBondContact O-ND2 3.19Å
223	I	98.8	Very high	97.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.9	-51.7	174.8	-72.4	165.3	0	0	0	110.7	I191 I198 Y201 F202 T219 L220 E221 E225 N226 A227 L261 V263	I191-I223 HydrophobicContact CD1-CG1 3.83Å; I198-I223 HydrophobicContact CG1-CG1 4.33Å; I198-I223 HydrophobicContact CG2-CG1 4.37Å; I198-I223 HydrophobicContact CG2-CG2 3.7Å; Y201-I223 HydrophobicContact CD1-CD1 3.42Å; Y201-I223 VanDerWaalsContact CD1-CD1 3.42Å; Y201-I223 HydrophobicContact CE1-CD1 3.75Å; Y201-I223 HydrophobicContact CG-CD1 3.89Å; F202-I223 HydrophobicContact CZ-CG2 4.08Å; T219-I223 HydrophobicContact CG2-CD1 3.93Å; T219-I223 VanDerWaalsContact O-CG1 3.26Å; T219-I223 WeakPolarHBondContact O-CG1 3.31Å; T219-I223 PolarHBondContact O-N 2.85Å; L220-I223 PolarHBondContact O-N 2.6Å; E221-I223 VanDerWaalsContact C-N 3.27Å; E221-I223 PolarHBondContact O-N 3.33Å; I223-E225 PolarHBondContact O-N 2.7Å; I223-N226 CarbonylContact O-C 3.35Å; I223-N226 PolarHBondContact O-N 3.42Å; I223-A227 PolarHBondContact O-N 2.96Å; I223-L261 HydrophobicContact CB-CD1 4.42Å; I223-L261 HydrophobicContact CG2-CB 4.38Å; I223-L261 HydrophobicContact CG2-CD1 3.82Å; I223-V263 HydrophobicContact CG2-CG2 3.96Å
224	A	98.5	Very high	97.4	Very high	46 Å²	46	50.8 Å²	50.8	38%	0.38	30%	0.301	S	S	.	.	H	α-helix	trans	-60.7	-46.5	-177.4	0	0	0	0	0	111.8	L220 E221 N226 A227 L261	L220-A224 PolarHBondContact O-N 3.44Å; E221-A224 PolarHBondContact O-N 3.29Å; A224-N226 PolarHBondContact O-N 2.93Å; A224-A227 PolarHBondContact O-N 3.08Å; A224-L261 HydrophobicContact CB-CD2 4.23Å
225	E	98.6	Very high	97.5	Very high	105 Å²	105	46.1 Å²	46.1	49%	0.491	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-28.6	179.2	-71.2	-170	155	0	0	113.3	K188 E221 I223	K188-E225 IonicContact NZ-OE2 2.74Å; K188-E225 PolarHBondContact NZ-OE2 3.33Å; E221-E225 HydrophobicContact CG-CG 4.39Å; E221-E225 WeakPolarHBondContact O-CB 3.3Å; E221-E225 WeakPolarHBondContact O-CG 3.41Å; E221-E225 PolarHBondContact O-N 3.17Å; I223-E225 PolarHBondContact O-N 2.7Å
226	N	98.5	Very high	97.5	Very high	13 Å²	13	49.7 Å²	49.7	7%	0.07	29%	0.294	C	S	.	.	H	α-helix	trans	-110.6	3	-172.9	-66.3	-84.7	0	0	0	113.6	I191 Q192 Y195 A222 I223 A224 K228 G229	I191-N226 HydrophobicContact CG2-CB 3.57Å; Q192-N226 WeakPolarHBondContact CG-OD1 3.37Å; Q192-N226 PolarHBondContact NE2-OD1 3.26Å; Y195-N226 HydrophobicContact CD1-CB 4.16Å; Y195-N226 HydrophobicContact CE1-CB 3.9Å; A222-N226 VanDerWaalsContact O-CB 3.3Å; A222-N226 WeakPolarHBondContact O-CB 3.37Å; A222-N226 PolarHBondContact O-N 3.49Å; A222-N226 PolarHBondContact O-ND2 3.19Å; I223-N226 CarbonylContact O-C 3.35Å; I223-N226 PolarHBondContact O-N 3.42Å; A224-N226 PolarHBondContact O-N 2.93Å; N226-K228 PolarHBondContact O-N 2.9Å; N226-G229 PolarHBondContact O-N 3.42Å
227	A	98.6	Very high	97.6	Very high	2 Å²	2	49.4 Å²	49.4	2%	0.017	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-53.2	-40.2	-178.4	0	0	0	0	0	112.5	I223 A224 G229 L230 V263 Y266	I223-A227 PolarHBondContact O-N 2.96Å; A224-A227 PolarHBondContact O-N 3.08Å; A227-G229 PolarHBondContact O-N 3.45Å; A227-G229 VanDerWaalsContact O-N 3.13Å; A227-L230 VanDerWaalsContact O-CB 3.32Å; A227-L230 WeakPolarHBondContact O-CB 3.43Å; A227-L230 PolarHBondContact O-N 3.33Å; A227-V263 HydrophobicContact CB-CG2 3.91Å; A227-Y266 HydrophobicContact CB-CD2 4.03Å; A227-Y266 HydrophobicContact CB-CE2 4.03Å; A227-Y266 WeakPolarHBondContact O-CD2 3.41Å
228	K	98.4	Very high	97.8	Very high	150 Å²	150	46 Å²	46	65%	0.652	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-57.1	-28.8	177.4	-175.9	175.2	178.7	-178.9	0	113.6	N226 L230 A231 Y266	N226-K228 PolarHBondContact O-N 2.9Å; K228-L230 PolarHBondContact O-N 3Å; K228-A231 WeakPolarHBondContact O-CB 3.18Å; K228-A231 PolarHBondContact O-N 3.3Å; K228-Y266 HydrophobicContact CB-CD1 4.49Å; K228-Y266 HydrophobicContact CB-CE1 3.91Å; K228-Y266 HydrophobicContact CB-CE2 4.29Å; K228-Y266 HydrophobicContact CG-CD1 4.45Å; K228-Y266 HydrophobicContact CG-CE1 3.81Å
229	G	97.8	Very high	97.9	Very high	17 Å²	17	39.9 Å²	39.9	18%	0.175	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-60.6	-25.7	177.2	0	0	0	0	0	113.5	Y195 N226 A227 A231 G232	Y195-G229 WeakPolarHBondContact CD2-O 3.4Å; N226-G229 PolarHBondContact O-N 3.42Å; A227-G229 PolarHBondContact O-N 3.45Å; A227-G229 VanDerWaalsContact O-N 3.13Å; G229-A231 PolarHBondContact O-N 2.86Å; G229-A231 VanDerWaalsContact O-N 3.14Å; G229-G232 PolarHBondContact O-N 3.32Å
230	L	98.3	Very high	97.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-60.9	-22.5	173.8	-74.8	162.9	0	0	0	113	Y195 I198 L199 A227 K228 G232 I233 V263 I267 R312	Y195-L230 VanDerWaalsContact O-CD2 3.26Å; Y195-L230 WeakPolarHBondContact O-CD2 3.36Å; I198-L230 HydrophobicContact CB-CD1 4.16Å; I198-L230 HydrophobicContact CD1-CD1 4.03Å; I198-L230 HydrophobicContact CD1-CG 4.2Å; I198-L230 HydrophobicContact CG2-CD1 4Å; L199-L230 HydrophobicContact CD1-CD2 4.47Å; L199-L230 HydrophobicContact CG-CD2 4.27Å; A227-L230 VanDerWaalsContact O-CB 3.32Å; A227-L230 WeakPolarHBondContact O-CB 3.43Å; A227-L230 PolarHBondContact O-N 3.33Å; K228-L230 PolarHBondContact O-N 3Å; L230-G232 PolarHBondContact O-N 3.46Å; L230-I233 HydrophobicContact CD2-CG1 4.35Å; L230-I233 PolarHBondContact O-N 3.36Å; L230-V263 HydrophobicContact CD1-CG1 3.61Å; L230-I267 HydrophobicContact CB-CG2 4.23Å; L230-I267 HydrophobicContact CD1-CG2 3.91Å; L230-I267 HydrophobicContact CD2-CG2 4.47Å; L230-I267 HydrophobicContact CG-CG2 4.45Å; L230-R312 PolarHBondContact O-NH2 3.11Å
231	A	97.3	Very high	97.9	Very high	60 Å²	60	41.8 Å²	41.8	50%	0.496	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-60.5	-27.4	173.3	0	0	0	0	0	112.7	K228 G229 Y266	K228-A231 WeakPolarHBondContact O-CB 3.18Å; K228-A231 PolarHBondContact O-N 3.3Å; G229-A231 PolarHBondContact O-N 2.86Å; G229-A231 VanDerWaalsContact O-N 3.14Å; A231-Y266 HydrophobicContact CB-CD1 4.17Å
232	G	95.9	Very high	97.9	Very high	72 Å²	72	36.4 Å²	36.4	74%	0.742	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-81.4	-11.6	175.5	0	0	0	0	0	114.3	G229 L230	G229-G232 PolarHBondContact O-N 3.32Å; L230-G232 PolarHBondContact O-N 3.46Å
233	I	96.9	Very high	97.9	Very high	13 Å²	13	39.2 Å²	39.2	7%	0.067	23%	0.229	C	C	.	.	S	Bend	trans	-86.9	134.1	-178.1	-54.6	-62.1	0	0	0	110.6	L196 L230 R237 I238 R312	L196-I233 HydrophobicContact CB-CG2 4.37Å; L196-I233 HydrophobicContact CD1-CG2 4.14Å; L230-I233 HydrophobicContact CD2-CG1 4.35Å; L230-I233 PolarHBondContact O-N 3.36Å; I233-R237 HydrophobicContact CG2-CB 4.07Å; I233-I238 HydrophobicContact CB-CD1 4.04Å; I233-I238 HydrophobicContact CB-CG1 4.26Å; I233-I238 HydrophobicContact CG2-CD1 4.22Å; I233-I238 HydrophobicContact CG2-CG1 3.95Å; I233-R312 PolarHBondContact O-NH1 3.3Å; I233-R312 PolarHBondContact O-NH2 3.25Å
234	S	97	Very high	97.9	Very high	27 Å²	27	44 Å²	44	19%	0.189	25%	0.25	C	C	.	.			trans	-54.3	138	177.4	58.6	0	0	0	0	111.9	E236 R237 I238	S234-E236 VanDerWaalsContact C-N 3.26Å; S234-E236 PolarHBondContact O-N 2.93Å; S234-R237 PolarHBondContact O-N 3.16Å; S234-R237 WeakPolarHBondContact OG-CB 3.27Å; S234-R237 VanDerWaalsContact OG-CD 3.29Å; S234-R237 WeakPolarHBondContact OG-CD 3.48Å; S234-R237 VanDerWaalsContact OG-CG 3.24Å; S234-R237 WeakPolarHBondContact OG-CG 3.38Å; S234-I238 PolarHBondContact O-N 2.94Å
235	G	97.9	Very high	97.9	Very high	5 Å²	5	41.9 Å²	41.9	5%	0.052	23%	0.232	C	C	.	.	H	α-helix	trans	-56.1	-37.9	-177.9	0	0	0	0	0	114	R237 I238 W239 R312 L313	G235-R237 PolarHBondContact O-N 3.21Å; G235-I238 PolarHBondContact O-N 3.46Å; G235-W239 WeakPolarHBondContact O-CB 3.32Å; G235-W239 PolarHBondContact O-N 3.18Å; G235-R312 VanDerWaalsContact CA-O 3.28Å; G235-R312 WeakPolarHBondContact CA-O 3.22Å; G235-L313 CarbonylContact C-O 3.16Å
236	E	96.8	Very high	97.9	Very high	104 Å²	104	37 Å²	37	49%	0.486	21%	0.209	S	C	.	.	H	α-helix	trans	-63.1	-43.1	-179.3	-60.1	84.5	168.6	0	0	111.6	S234 W239 V240 K314	S234-E236 VanDerWaalsContact C-N 3.26Å; S234-E236 PolarHBondContact O-N 2.93Å; E236-W239 PolarHBondContact O-N 3.45Å; E236-V240 WeakPolarHBondContact O-CG2 3.29Å; E236-V240 PolarHBondContact O-N 2.89Å; E236-K314 HydrophobicContact CG-CB 4.37Å
237	R	97	Very high	97.8	Very high	54 Å²	54	40.3 Å²	40.3	20%	0.204	23%	0.23	C	C	.	.	H	α-helix	trans	-64.7	-43.4	177.2	-73.5	178.2	73	-149.4	-2.9	111.3	D194 L196 I233 S234 G235 W239 V240 E241	D194-R237 VanDerWaalsContact CG-NH2 3.28Å; D194-R237 IonicContact OD1-CZ 3.72Å; D194-R237 IonicContact OD1-NH1 3.68Å; D194-R237 IonicContact OD1-NH2 2.73Å; D194-R237 PolarHBondContact OD1-NH2 3.38Å; D194-R237 IonicContact OD2-CZ 2.76Å; D194-R237 IonicContact OD2-NH2 3.79Å; D194-R237 PolarHBondContact OD2-NH2 3.03Å; L196-R237 HydrophobicContact CD1-CB 4.31Å; L196-R237 HydrophobicContact CD2-CB 4Å; I233-R237 HydrophobicContact CG2-CB 4.07Å; S234-R237 PolarHBondContact O-N 3.16Å; S234-R237 WeakPolarHBondContact OG-CB 3.27Å; S234-R237 VanDerWaalsContact OG-CD 3.29Å; S234-R237 WeakPolarHBondContact OG-CD 3.48Å; S234-R237 VanDerWaalsContact OG-CG 3.24Å; S234-R237 WeakPolarHBondContact OG-CG 3.38Å; G235-R237 PolarHBondContact O-N 3.21Å; R237-W239 VanDerWaalsContact C-N 3.35Å; R237-V240 PolarHBondContact O-N 3.11Å; R237-E241 PolarHBondContact O-N 3.29Å
238	I	98.6	Very high	97.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.8	-46	175.4	-73.8	164	0	0	0	110.3	L196 L199 I233 S234 G235 V240 E241 L242 I267 L313	L196-I238 HydrophobicContact CD1-CG1 4.18Å; L199-I238 HydrophobicContact CD1-CB 4.19Å; L199-I238 HydrophobicContact CD1-CG1 4.08Å; L199-I238 HydrophobicContact CD1-CG2 3.81Å; I233-I238 HydrophobicContact CB-CD1 4.04Å; I233-I238 HydrophobicContact CB-CG1 4.26Å; I233-I238 HydrophobicContact CG2-CD1 4.22Å; I233-I238 HydrophobicContact CG2-CG1 3.95Å; S234-I238 PolarHBondContact O-N 2.94Å; G235-I238 PolarHBondContact O-N 3.46Å; I238-V240 VanDerWaalsContact C-N 3.32Å; I238-V240 PolarHBondContact O-N 3.17Å; I238-E241 PolarHBondContact O-N 3.02Å; I238-E241 VanDerWaalsContact O-N 3.16Å; I238-L242 WeakPolarHBondContact O-CB 3.35Å; I238-L242 PolarHBondContact O-N 3.4Å; I238-I267 HydrophobicContact CD1-CG2 4.23Å; I238-I267 HydrophobicContact CG1-CG2 4.49Å; I238-I267 HydrophobicContact CG2-CB 3.79Å; I238-I267 HydrophobicContact CG2-CG2 3.93Å; I238-L313 HydrophobicContact CB-CD2 3.92Å; I238-L313 HydrophobicContact CG2-CD2 3.48Å; I238-L313 VanDerWaalsContact CG2-CD2 3.48Å
239	W	98.6	Very high	97.6	Very high	10 Å²	10	39.6 Å²	39.6	4%	0.038	24%	0.241	C	C	.	.	H	α-helix	trans	-63.1	-37.9	-177.1	-174.9	-136.6	0	0	0	112.6	G235 E236 R237 E241 L242 K243 L246 P292 M293 L296 L313 I315 E319	G235-W239 WeakPolarHBondContact O-CB 3.32Å; G235-W239 PolarHBondContact O-N 3.18Å; E236-W239 PolarHBondContact O-N 3.45Å; R237-W239 VanDerWaalsContact C-N 3.35Å; W239-E241 VanDerWaalsContact C-N 3.35Å; W239-E241 PolarHBondContact O-N 3.07Å; W239-L242 HydrophobicContact CE3-CB 4.23Å; W239-L242 HydrophobicContact CE3-CD2 4.08Å; W239-L242 HydrophobicContact CE3-CG 4.35Å; W239-L242 HydrophobicContact CZ3-CD2 4.04Å; W239-L242 HydrophobicContact CZ3-CG 4.26Å; W239-L242 PolarHBondContact O-N 3.37Å; W239-K243 HydrophobicContact CD2-CD 4.16Å; W239-K243 HydrophobicContact CD2-CG 3.77Å; W239-K243 HydrophobicContact CE3-CG 3.99Å; W239-K243 HydrophobicContact CG-CG 4.46Å; W239-K243 HydrophobicContact CH2-CD 4.34Å; W239-K243 HydrophobicContact CH2-CG 3.77Å; W239-K243 HydrophobicContact CZ2-CD 3.63Å; W239-K243 HydrophobicContact CZ2-CG 3.54Å; W239-K243 HydrophobicContact CZ3-CG 3.98Å; W239-K243 WeakPolarHBondContact O-CB 3.22Å; W239-K243 VanDerWaalsContact O-CG 3.32Å; W239-K243 WeakPolarHBondContact O-CG 3.39Å; W239-K243 PolarHBondContact O-N 2.87Å; W239-L246 HydrophobicContact CH2-CD1 4.38Å; W239-L246 HydrophobicContact CZ3-CD1 4.1Å; W239-P292 HydrophobicContact CH2-CB 4.16Å; W239-M293 HydrophobicContact CH2-CE 4.2Å; W239-M293 HydrophobicContact CZ2-CE 4.37Å; W239-L296 HydrophobicContact CH2-CD2 4.24Å; W239-L296 HydrophobicContact CZ3-CD2 3.98Å; W239-L313 HydrophobicContact CB-CB 4.31Å; W239-L313 HydrophobicContact CD2-CD1 4.44Å; W239-L313 HydrophobicContact CE3-CD1 3.79Å; W239-L313 HydrophobicContact CZ3-CD1 4.46Å; W239-I315 HydrophobicContact CD2-CG2 4Å; W239-I315 HydrophobicContact CG-CG2 4.17Å; W239-I315 HydrophobicContact CZ2-CG2 4.26Å; W239-E319 HydrophobicContact CZ2-CG 4.45Å; W239-E319 PolarHBondContact NE1-OE1 3.24Å; W239-E319 PolarHBondContact NE1-OE2 3.47Å
240	V	97.9	Very high	97.6	Very high	72 Å²	72	41.3 Å²	41.3	44%	0.436	24%	0.244	S	C	.	.	H	α-helix	trans	-59.1	-45	174.2	168.9	0	0	0	0	111.7	E236 R237 I238 K244	E236-V240 WeakPolarHBondContact O-CG2 3.29Å; E236-V240 PolarHBondContact O-N 2.89Å; R237-V240 PolarHBondContact O-N 3.11Å; I238-V240 VanDerWaalsContact C-N 3.32Å; I238-V240 PolarHBondContact O-N 3.17Å; V240-K244 WeakPolarHBondContact O-CG 3.42Å
241	E	98.4	Very high	97.6	Very high	10 Å²	10	42.3 Å²	42.3	5%	0.047	25%	0.25	C	C	.	.	H	α-helix	trans	-72.9	-43.7	179	-69.3	-61.2	162.2	0	0	112.1	L196 L199 R200 R203 R237 I238 W239 K243 K244 I245	L196-E241 HydrophobicContact CD1-CB 4.44Å; L196-E241 HydrophobicContact CD1-CG 3.97Å; L196-E241 HydrophobicContact CD2-CG 4.18Å; L196-E241 HydrophobicContact CG-CG 4.08Å; L199-E241 HydrophobicContact CB-CB 3.85Å; L199-E241 HydrophobicContact CB-CG 4.47Å; L199-E241 HydrophobicContact CD1-CB 4.23Å; R200-E241 HydrophobicContact CG-CG 4.2Å; R200-E241 IonicContact NH1-OE1 2.6Å; R203-E241 VanDerWaalsContact CD-OE2 3.23Å; R203-E241 WeakPolarHBondContact CD-OE2 3.32Å; R203-E241 IonicContact CZ-OE1 3.4Å; R203-E241 IonicContact CZ-OE2 3.73Å; R203-E241 IonicContact NE-OE2 3.16Å; R203-E241 PolarHBondContact NE-OE2 2.81Å; R203-E241 IonicContact NH1-OE1 2.72Å; R203-E241 PolarHBondContact NH1-OE1 2.99Å; R203-E241 IonicContact NH1-OE2 2.86Å; R203-E241 PolarHBondContact NH1-OE2 3.08Å; R203-E241 IonicContact NH2-OE1 2.76Å; R203-E241 IonicContact NH2-OE2 3.98Å; R237-E241 PolarHBondContact O-N 3.29Å; I238-E241 PolarHBondContact O-N 3.02Å; I238-E241 VanDerWaalsContact O-N 3.16Å; W239-E241 VanDerWaalsContact C-N 3.35Å; W239-E241 PolarHBondContact O-N 3.07Å; E241-K243 VanDerWaalsContact C-N 3.32Å; E241-K243 PolarHBondContact O-N 2.76Å; E241-K244 WeakPolarHBondContact O-CB 3.28Å; E241-K244 PolarHBondContact O-N 3.46Å; E241-K244 VanDerWaalsContact O-N 3.08Å; E241-I245 WeakPolarHBondContact O-CG1 3.47Å; E241-I245 PolarHBondContact O-N 3.08Å
242	L	98.8	Very high	97.7	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-40	179	-176.5	58.5	0	0	0	111.8	I238 W239 K244 I245 L246 I267 L269 L313	I238-L242 WeakPolarHBondContact O-CB 3.35Å; I238-L242 PolarHBondContact O-N 3.4Å; W239-L242 HydrophobicContact CE3-CB 4.23Å; W239-L242 HydrophobicContact CE3-CD2 4.08Å; W239-L242 HydrophobicContact CE3-CG 4.35Å; W239-L242 HydrophobicContact CZ3-CD2 4.04Å; W239-L242 HydrophobicContact CZ3-CG 4.26Å; W239-L242 PolarHBondContact O-N 3.37Å; L242-K244 VanDerWaalsContact C-N 3.3Å; L242-K244 PolarHBondContact O-N 3.36Å; L242-I245 WeakPolarHBondContact O-CB 3.39Å; L242-I245 PolarHBondContact O-N 2.89Å; L242-L246 HydrophobicContact CD1-CD1 4.35Å; L242-L246 HydrophobicContact CD1-CG 4.28Å; L242-L246 HydrophobicContact CG-CD1 3.92Å; L242-L246 HydrophobicContact CG-CG 4.34Å; L242-L246 WeakPolarHBondContact O-CB 3.45Å; L242-L246 VanDerWaalsContact O-CG 3.25Å; L242-L246 WeakPolarHBondContact O-CG 3.48Å; L242-L246 PolarHBondContact O-N 3.19Å; L242-I267 HydrophobicContact CD1-CD1 4.46Å; L242-L269 HydrophobicContact CD2-CD2 4.34Å; L242-L313 HydrophobicContact CD2-CD1 4.15Å
243	K	98.4	Very high	97.8	Very high	63 Å²	63	40.8 Å²	40.8	27%	0.274	22%	0.215	S	C	.	.	H	α-helix	trans	-58.5	-42.2	173.6	-79.1	-164.4	-79.4	-165.7	0	112.7	W239 E241 I245 L246 V247 P292 E319	W239-K243 HydrophobicContact CD2-CD 4.16Å; W239-K243 HydrophobicContact CD2-CG 3.77Å; W239-K243 HydrophobicContact CE3-CG 3.99Å; W239-K243 HydrophobicContact CG-CG 4.46Å; W239-K243 HydrophobicContact CH2-CD 4.34Å; W239-K243 HydrophobicContact CH2-CG 3.77Å; W239-K243 HydrophobicContact CZ2-CD 3.63Å; W239-K243 HydrophobicContact CZ2-CG 3.54Å; W239-K243 HydrophobicContact CZ3-CG 3.98Å; W239-K243 WeakPolarHBondContact O-CB 3.22Å; W239-K243 VanDerWaalsContact O-CG 3.32Å; W239-K243 WeakPolarHBondContact O-CG 3.39Å; W239-K243 PolarHBondContact O-N 2.87Å; E241-K243 VanDerWaalsContact C-N 3.32Å; E241-K243 PolarHBondContact O-N 2.76Å; K243-I245 VanDerWaalsContact C-N 3.32Å; K243-L246 PolarHBondContact O-N 3.3Å; K243-V247 WeakPolarHBondContact O-CG2 3.49Å; K243-V247 PolarHBondContact O-N 2.9Å; K243-P292 HydrophobicContact CB-CB 4.27Å; K243-P292 HydrophobicContact CB-CG 3.99Å; K243-P292 HydrophobicContact CD-CB 4.31Å; K243-P292 HydrophobicContact CD-CG 3.87Å; K243-P292 HydrophobicContact CG-CB 3.78Å; K243-P292 HydrophobicContact CG-CG 3.72Å; K243-E319 WeakPolarHBondContact CD-OE1 3.33Å; K243-E319 IonicContact NZ-OE1 3.87Å; K243-E319 PolarHBondContact NZ-OE1 2.66Å
244	K	98	Very high	97.9	Very high	100 Å²	100	40.2 Å²	40.2	44%	0.435	21%	0.212	S	C	.	.	H	α-helix	trans	-67.6	-33.5	178.9	-68.5	174.8	-179.7	-176.4	0	112	R203 V240 E241 L242 G248	R203-K244 HydrophobicContact CG-CB 4.07Å; V240-K244 WeakPolarHBondContact O-CG 3.42Å; E241-K244 WeakPolarHBondContact O-CB 3.28Å; E241-K244 PolarHBondContact O-N 3.46Å; E241-K244 VanDerWaalsContact O-N 3.08Å; L242-K244 VanDerWaalsContact C-N 3.3Å; L242-K244 PolarHBondContact O-N 3.36Å; K244-G248 PolarHBondContact O-N 3.21Å
245	I	98.6	Very high	98	Very high	2 Å²	2	39 Å²	39	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-66.4	-47.8	171.6	-65.4	165.9	0	0	0	110.1	L199 F202 R203 E241 L242 K243 V247 G248 L254	L199-I245 HydrophobicContact CB-CD1 4.38Å; F202-I245 HydrophobicContact CB-CD1 3.92Å; F202-I245 HydrophobicContact CB-CG1 4.47Å; R203-I245 HydrophobicContact CB-CG1 3.86Å; E241-I245 WeakPolarHBondContact O-CG1 3.47Å; E241-I245 PolarHBondContact O-N 3.08Å; L242-I245 WeakPolarHBondContact O-CB 3.39Å; L242-I245 PolarHBondContact O-N 2.89Å; K243-I245 VanDerWaalsContact C-N 3.32Å; I245-V247 VanDerWaalsContact C-N 3.29Å; I245-V247 PolarHBondContact O-N 2.97Å; I245-G248 PolarHBondContact O-N 3.04Å; I245-G248 VanDerWaalsContact O-N 3.11Å; I245-L254 HydrophobicContact CG2-CB 4.14Å; I245-L254 HydrophobicContact CG2-CD1 3.96Å
246	L	98.4	Very high	98	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-29.9	-174.2	-73.4	165.9	0	0	0	114.4	W239 L242 K243 V251 I255 P292 L295 L296	W239-L246 HydrophobicContact CH2-CD1 4.38Å; W239-L246 HydrophobicContact CZ3-CD1 4.1Å; L242-L246 HydrophobicContact CD1-CD1 4.35Å; L242-L246 HydrophobicContact CD1-CG 4.28Å; L242-L246 HydrophobicContact CG-CD1 3.92Å; L242-L246 HydrophobicContact CG-CG 4.34Å; L242-L246 WeakPolarHBondContact O-CB 3.45Å; L242-L246 VanDerWaalsContact O-CG 3.25Å; L242-L246 WeakPolarHBondContact O-CG 3.48Å; L242-L246 PolarHBondContact O-N 3.19Å; K243-L246 PolarHBondContact O-N 3.3Å; L246-V251 HydrophobicContact CD2-CG2 4.31Å; L246-I255 HydrophobicContact CD2-CD1 4.25Å; L246-P292 HydrophobicContact CB-CB 4.05Å; L246-P292 HydrophobicContact CD1-CB 3.85Å; L246-L295 HydrophobicContact CD2-CD2 4.26Å; L246-L295 HydrophobicContact CD2-CG 4.44Å; L246-L296 HydrophobicContact CD1-CB 4.18Å; L246-L296 HydrophobicContact CD1-CD1 4.06Å; L246-L296 HydrophobicContact CD1-CD2 4.45Å; L246-L296 HydrophobicContact CD1-CG 4.48Å; L246-L296 HydrophobicContact CD2-CB 4.48Å; L246-L296 HydrophobicContact CD2-CD1 4.02Å
247	V	96.8	Very high	98.1	Very high	84 Å²	84	36.7 Å²	36.7	51%	0.509	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	1.7	177.2	-53.8	0	0	0	0	112.8	K243 I245 P292	K243-V247 WeakPolarHBondContact O-CG2 3.49Å; K243-V247 PolarHBondContact O-N 2.9Å; I245-V247 VanDerWaalsContact C-N 3.29Å; I245-V247 PolarHBondContact O-N 2.97Å; V247-P292 HydrophobicContact CG1-CB 4.4Å; V247-P292 HydrophobicContact CG1-CG 3.74Å
248	G	96.1	Very high	98.2	Very high	31 Å²	31	34.1 Å²	34.1	32%	0.32	18%	0.182	S	C	.	.	S	Bend	trans	-85.8	174.5	177.8	0	0	0	0	0	112.4	K244 I245	K244-G248 PolarHBondContact O-N 3.21Å; I245-G248 PolarHBondContact O-N 3.04Å; I245-G248 VanDerWaalsContact O-N 3.11Å
249	N	96.3	Very high	98.2	Very high	105 Å²	105	35.7 Å²	35.7	56%	0.561	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	159	174	-53.5	-24.7	0	0	0	110.6	G206 V251	G206-N249 WeakPolarHBondContact O-CB 3.25Å; N249-V251 PolarHBondContact O-N 3.38Å; N249-V251 VanDerWaalsContact O-N 3.12Å
250	H	97.9	Very high	98.2	Very high	53 Å²	53	41 Å²	41	25%	0.245	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	23.2	175.5	-50.3	-52.9	0	0	0	114.8	V209 D210 P212 N252 H253 L254	V209-H250 PolarHBondContact O-CD2 3.49Å; V209-H250 VanDerWaalsContact O-CD2 3.26Å; V209-H250 PolarHBondContact O-NE2 2.86Å; D210-H250 PolarHBondContact O-CE1 2.87Å; D210-H250 VanDerWaalsContact O-CE1 3.24Å; D210-H250 PolarHBondContact O-NE2 3.4Å; P212-H250 HydrophobicContact CG-CB 4.48Å; H250-N252 PolarHBondContact O-N 2.85Å; H250-N252 VanDerWaalsContact O-N 3.11Å; H250-H253 PolarHBondContact O-N 3.08Å; H250-H253 VanDerWaalsContact O-N 3.15Å; H250-L254 WeakPolarHBondContact O-CG 3.48Å; H250-L254 PolarHBondContact O-N 3.35Å
251	V	98.4	Very high	98.2	Very high	21 Å²	21	38.8 Å²	38.8	13%	0.127	20%	0.203	C	C	.	.	H	α-helix	trans	-54	-34.5	-179.4	65.3	0	0	0	0	112.8	L246 N249 L254 I255 F278 L295	L246-V251 HydrophobicContact CD2-CG2 4.31Å; N249-V251 PolarHBondContact O-N 3.38Å; N249-V251 VanDerWaalsContact O-N 3.12Å; V251-L254 PolarHBondContact O-N 3.25Å; V251-I255 HydrophobicContact CG2-CG1 4.11Å; V251-I255 WeakPolarHBondContact O-CB 3.5Å; V251-I255 WeakPolarHBondContact O-CG1 3.26Å; V251-I255 PolarHBondContact O-N 3.19Å; V251-F278 HydrophobicContact CG2-CZ 4.38Å; V251-L295 HydrophobicContact CB-CD2 4.27Å; V251-L295 HydrophobicContact CG1-CD2 3.71Å; V251-L295 HydrophobicContact CG2-CD2 3.56Å
252	N	98.5	Very high	98.2	Very high	55 Å²	55	42.5 Å²	42.5	29%	0.294	22%	0.223	S	C	.	.	H	α-helix	trans	-59.6	-56.6	177.7	-176.5	-88.7	0	0	0	111.2	H250 L254 I255 H256 F278 D279 S282	H250-N252 PolarHBondContact O-N 2.85Å; H250-N252 VanDerWaalsContact O-N 3.11Å; N252-L254 VanDerWaalsContact C-N 3.33Å; N252-L254 PolarHBondContact O-N 3.19Å; N252-I255 PolarHBondContact O-N 3.16Å; N252-H256 PolarHBondContact O-CD2 3.19Å; N252-H256 VanDerWaalsContact O-CD2 3.23Å; N252-H256 PolarHBondContact O-N 3.4Å; N252-F278 HydrophobicContact CB-CE1 4.46Å; N252-D279 PolarHBondContact ND2-OD1 3Å; N252-S282 PolarHBondContact ND2-OG 3.39Å
253	H	98.7	Very high	98.2	Very high	46 Å²	46	42.5 Å²	42.5	21%	0.213	22%	0.223	C	C	.	.	H	α-helix	trans	-55.6	-45.6	175.9	176	77.3	0	0	0	112.4	Y205 P212 H215 H250 I255 H256 L257	Y205-H253 AromaticContact CE1-NE2 4Å; P212-H253 HydrophobicContact CB-CB 4Å; P212-H253 VanDerWaalsContact CB-CG 3.5Å; P212-H253 HydrophobicContact CG-CB 4.12Å; H215-H253 AromaticContact CE1-NE2 3.61Å; H215-H253 AromaticContact NE2-CE1 3.57Å; H215-H253 AromaticContact NE2-NE2 2.87Å; H215-H253 PolarHBondContact NE2-NE2 2.85Å; H250-H253 PolarHBondContact O-N 3.08Å; H250-H253 VanDerWaalsContact O-N 3.15Å; H253-I255 PolarHBondContact O-N 2.92Å; H253-H256 PolarHBondContact O-N 3.44Å; H253-L257 WeakPolarHBondContact O-CB 3.36Å; H253-L257 PolarHBondContact O-N 3.35Å
254	L	98.8	Very high	98.2	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-67.5	-38	-175.9	-65.7	177.6	0	0	0	113.1	F202 Y205 I245 H250 V251 N252 L257 I258	F202-L254 HydrophobicContact CB-CD2 4.12Å; F202-L254 HydrophobicContact CD1-CD2 4.22Å; F202-L254 WeakPolarHBondContact O-CD1 3.3Å; Y205-L254 HydrophobicContact CD1-CD2 3.98Å; Y205-L254 HydrophobicContact CG-CD2 4.5Å; I245-L254 HydrophobicContact CG2-CB 4.14Å; I245-L254 HydrophobicContact CG2-CD1 3.96Å; H250-L254 WeakPolarHBondContact O-CG 3.48Å; H250-L254 PolarHBondContact O-N 3.35Å; V251-L254 PolarHBondContact O-N 3.25Å; N252-L254 VanDerWaalsContact C-N 3.33Å; N252-L254 PolarHBondContact O-N 3.19Å; L254-L257 PolarHBondContact O-N 2.83Å; L254-I258 WeakPolarHBondContact O-CB 3.36Å; L254-I258 VanDerWaalsContact O-CG1 3.26Å; L254-I258 WeakPolarHBondContact O-CG1 3.42Å; L254-I258 PolarHBondContact O-N 3.49Å
255	I	98.8	Very high	98.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-69.1	-42.4	176.9	-70.1	-68.4	0	0	0	110.5	L246 V251 N252 H253 L257 I258 Y259 F278 L299	L246-I255 HydrophobicContact CD2-CD1 4.25Å; V251-I255 HydrophobicContact CG2-CG1 4.11Å; V251-I255 WeakPolarHBondContact O-CB 3.5Å; V251-I255 WeakPolarHBondContact O-CG1 3.26Å; V251-I255 PolarHBondContact O-N 3.19Å; N252-I255 PolarHBondContact O-N 3.16Å; H253-I255 PolarHBondContact O-N 2.92Å; I255-L257 VanDerWaalsContact C-N 3.34Å; I255-L257 PolarHBondContact O-N 3.49Å; I255-I258 HydrophobicContact CD1-CD1 4.26Å; I255-I258 WeakPolarHBondContact O-CB 3.39Å; I255-I258 PolarHBondContact O-N 3.07Å; I255-Y259 HydrophobicContact CG2-CD2 4.09Å; I255-Y259 HydrophobicContact CG2-CE2 4.12Å; I255-Y259 WeakPolarHBondContact O-CD2 3.42Å; I255-Y259 PolarHBondContact O-N 3.39Å; I255-Y259 VanDerWaalsContact O-N 3.11Å; I255-F278 HydrophobicContact CB-CD1 4.44Å; I255-F278 HydrophobicContact CB-CE1 3.57Å; I255-F278 HydrophobicContact CB-CE2 4.06Å; I255-F278 HydrophobicContact CB-CZ 3.37Å; I255-F278 HydrophobicContact CG1-CE1 4.17Å; I255-F278 HydrophobicContact CG1-CE2 3.83Å; I255-F278 HydrophobicContact CG1-CZ 3.42Å; I255-F278 VanDerWaalsContact CG1-CZ 3.42Å; I255-F278 HydrophobicContact CG2-CD1 4.03Å; I255-F278 HydrophobicContact CG2-CD2 4.3Å; I255-F278 HydrophobicContact CG2-CE1 3.63Å; I255-F278 HydrophobicContact CG2-CE2 3.95Å; I255-F278 HydrophobicContact CG2-CG 4.36Å; I255-F278 HydrophobicContact CG2-CZ 3.63Å; I255-L299 HydrophobicContact CG2-CD1 4.24Å; I255-L299 HydrophobicContact CG2-CD2 4.26Å
256	H	98.8	Very high	98.2	Very high	45 Å²	45	40 Å²	40	21%	0.208	22%	0.216	C	C	.	.	H	α-helix	trans	-56.3	-49	172.1	-81	-74.5	0	0	0	111.4	N252 H253 I258 Y259 D260 D279	N252-H256 PolarHBondContact O-CD2 3.19Å; N252-H256 VanDerWaalsContact O-CD2 3.23Å; N252-H256 PolarHBondContact O-N 3.4Å; H253-H256 PolarHBondContact O-N 3.44Å; H256-I258 VanDerWaalsContact C-N 3.29Å; H256-I258 PolarHBondContact O-N 3.15Å; H256-Y259 CarbonylContact O-C 3.48Å; H256-Y259 WeakPolarHBondContact O-CA 3.18Å; H256-Y259 WeakPolarHBondContact O-CB 3.39Å; H256-Y259 PolarHBondContact O-N 3.16Å; H256-D260 VanDerWaalsContact O-CG 3.29Å; H256-D260 PolarHBondContact O-N 3.46Å; H256-D279 IonicContact CD2-OD1 2.66Å; H256-D279 IonicContact CE1-OD1 2.73Å; H256-D279 IonicContact CE1-OD2 3.06Å; H256-D279 IonicContact NE2-OD1 3.51Å; H256-D279 PolarHBondContact NE2-OD1 3.24Å; H256-D279 IonicContact NE2-OD2 2.86Å
257	L	98.7	Very high	98.2	Very high	16 Å²	16	39.9 Å²	39.9	8%	0.084	22%	0.216	C	C	.	.	H	α-helix	trans	-62.5	-34.3	178.7	-170.2	62.4	0	0	0	113.1	F202 H215 L220 H253 L254 I255 Y259 D260 L261	F202-L257 HydrophobicContact CD1-CD2 4.14Å; F202-L257 HydrophobicContact CE1-CB 4.45Å; F202-L257 HydrophobicContact CE1-CD2 3.68Å; F202-L257 HydrophobicContact CE1-CG 3.88Å; H215-L257 WeakPolarHBondContact CE1-CD2 3.34Å; L220-L257 HydrophobicContact CD2-CD2 4.35Å; H253-L257 WeakPolarHBondContact O-CB 3.36Å; H253-L257 PolarHBondContact O-N 3.35Å; L254-L257 PolarHBondContact O-N 2.83Å; I255-L257 VanDerWaalsContact C-N 3.34Å; I255-L257 PolarHBondContact O-N 3.49Å; L257-Y259 VanDerWaalsContact C-N 3.3Å; L257-Y259 PolarHBondContact O-N 3.06Å; L257-D260 PolarHBondContact O-N 3.37Å; L257-L261 HydrophobicContact CD1-CD1 3.8Å; L257-L261 HydrophobicContact CD1-CG 3.98Å; L257-L261 HydrophobicContact CD2-CD1 4.45Å; L257-L261 HydrophobicContact CG-CD1 3.77Å; L257-L261 HydrophobicContact CG-CG 4.29Å; L257-L261 WeakPolarHBondContact O-CB 3.4Å; L257-L261 VanDerWaalsContact O-CG 3.3Å; L257-L261 WeakPolarHBondContact O-CG 3.43Å; L257-L261 PolarHBondContact O-N 2.93Å
258	I	98.8	Very high	98.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.9	-36	172.9	-80.3	165.9	0	0	0	111.6	F202 L254 I255 H256 V263 A264 I267 L269	F202-I258 HydrophobicContact CD2-CD1 4.01Å; F202-I258 HydrophobicContact CD2-CG1 3.7Å; F202-I258 HydrophobicContact CE1-CG1 4.46Å; F202-I258 HydrophobicContact CE2-CD1 4.36Å; F202-I258 HydrophobicContact CE2-CG1 3.57Å; F202-I258 HydrophobicContact CG-CD1 4.42Å; F202-I258 HydrophobicContact CG-CG1 4.23Å; F202-I258 HydrophobicContact CZ-CG1 3.98Å; L254-I258 WeakPolarHBondContact O-CB 3.36Å; L254-I258 VanDerWaalsContact O-CG1 3.26Å; L254-I258 WeakPolarHBondContact O-CG1 3.42Å; L254-I258 PolarHBondContact O-N 3.49Å; I255-I258 HydrophobicContact CD1-CD1 4.26Å; I255-I258 WeakPolarHBondContact O-CB 3.39Å; I255-I258 PolarHBondContact O-N 3.07Å; H256-I258 VanDerWaalsContact C-N 3.29Å; H256-I258 PolarHBondContact O-N 3.15Å; I258-V263 HydrophobicContact CG2-CB 4.11Å; I258-V263 HydrophobicContact CG2-CG1 4.24Å; I258-V263 WeakPolarHBondContact O-CB 3.39Å; I258-V263 PolarHBondContact O-N 2.74Å; I258-A264 HydrophobicContact CG2-CB 3.97Å; I258-A264 PolarHBondContact O-N 3.33Å; I258-I267 HydrophobicContact CG2-CD1 4.08Å; I258-L269 HydrophobicContact CG2-CD1 4.34Å
259	Y	98.7	Very high	98.4	Very high	33 Å²	33	35.4 Å²	35.4	13%	0.129	19%	0.185	C	C	.	.	H	α-helix	trans	-76	-43.4	174.4	-86.1	-88.9	0	0	0	111.8	I255 H256 L257 L261 D262 A264 L269 P270 A273 L275 L299	I255-Y259 HydrophobicContact CG2-CD2 4.09Å; I255-Y259 HydrophobicContact CG2-CE2 4.12Å; I255-Y259 WeakPolarHBondContact O-CD2 3.42Å; I255-Y259 PolarHBondContact O-N 3.39Å; I255-Y259 VanDerWaalsContact O-N 3.11Å; H256-Y259 CarbonylContact O-C 3.48Å; H256-Y259 WeakPolarHBondContact O-CA 3.18Å; H256-Y259 WeakPolarHBondContact O-CB 3.39Å; H256-Y259 PolarHBondContact O-N 3.16Å; L257-Y259 VanDerWaalsContact C-N 3.3Å; L257-Y259 PolarHBondContact O-N 3.06Å; Y259-L261 VanDerWaalsContact C-N 3.27Å; Y259-L261 PolarHBondContact O-N 3.21Å; Y259-D262 PolarHBondContact O-N 3.41Å; Y259-A264 HydrophobicContact CD1-CB 3.82Å; Y259-A264 HydrophobicContact CD2-CB 4.11Å; Y259-A264 HydrophobicContact CE1-CB 3.68Å; Y259-A264 HydrophobicContact CE2-CB 3.99Å; Y259-A264 HydrophobicContact CG-CB 4.02Å; Y259-L269 HydrophobicContact CE2-CD1 4.23Å; Y259-P270 VanDerWaalsContact CE1-O 3.27Å; Y259-P270 WeakPolarHBondContact CE1-O 3.45Å; Y259-P270 PolarHBondContact OH-O 3.45Å; Y259-A273 HydrophobicContact CE1-CB 3.96Å; Y259-A273 HydrophobicContact CE2-CB 4.47Å; Y259-A273 WeakPolarHBondContact OH-CB 3.48Å; Y259-L275 HydrophobicContact CD2-CD2 3.8Å; Y259-L275 HydrophobicContact CE2-CD2 3.97Å; Y259-L275 HydrophobicContact CG-CD1 4.48Å; Y259-L275 HydrophobicContact CG-CD2 4.15Å; Y259-L299 HydrophobicContact CE2-CD1 4.21Å; Y259-L299 HydrophobicContact CE2-CD2 4.16Å
260	D	98.4	Very high	98.5	Very high	122 Å²	122	31.6 Å²	31.6	65%	0.652	17%	0.166	S	C	*	.	H	α-helix	trans	-61.7	-34.5	-179.3	-67.6	-21.6	0	0	0	112.6	H256 L257 D262	H256-D260 VanDerWaalsContact O-CG 3.29Å; H256-D260 PolarHBondContact O-N 3.46Å; L257-D260 PolarHBondContact O-N 3.37Å; D260-D262 VanDerWaalsContact C-N 3.33Å
261	L	98.4	Very high	98.3	Very high	25 Å²	25	32.9 Å²	32.9	13%	0.131	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	12	178.2	-58.9	173.9	0	0	0	113.5	F202 L220 I223 A224 L257 Y259 V263	F202-L261 HydrophobicContact CE1-CD1 4.17Å; F202-L261 HydrophobicContact CZ-CD1 4Å; L220-L261 HydrophobicContact CB-CD2 4.48Å; L220-L261 HydrophobicContact CD2-CD1 4.06Å; I223-L261 HydrophobicContact CB-CD1 4.42Å; I223-L261 HydrophobicContact CG2-CB 4.38Å; I223-L261 HydrophobicContact CG2-CD1 3.82Å; A224-L261 HydrophobicContact CB-CD2 4.23Å; L257-L261 HydrophobicContact CD1-CD1 3.8Å; L257-L261 HydrophobicContact CD1-CG 3.98Å; L257-L261 HydrophobicContact CD2-CD1 4.45Å; L257-L261 HydrophobicContact CG-CD1 3.77Å; L257-L261 HydrophobicContact CG-CG 4.29Å; L257-L261 WeakPolarHBondContact O-CB 3.4Å; L257-L261 VanDerWaalsContact O-CG 3.3Å; L257-L261 WeakPolarHBondContact O-CG 3.43Å; L257-L261 PolarHBondContact O-N 2.93Å; Y259-L261 VanDerWaalsContact C-N 3.27Å; Y259-L261 PolarHBondContact O-N 3.21Å; L261-V263 HydrophobicContact CB-CG2 4.18Å; L261-V263 PolarHBondContact O-N 3.43Å; L261-V263 VanDerWaalsContact O-N 3.13Å
262	D	98.4	Very high	98.1	Very high	88 Å²	88	37.7 Å²	37.7	47%	0.471	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	31.4	-179.3	-162	41.4	0	0	0	114	Y259 D260 P265 Y266	Y259-D262 PolarHBondContact O-N 3.41Å; D260-D262 VanDerWaalsContact C-N 3.33Å; D262-P265 WeakPolarHBondContact O-CD 3.46Å; D262-P265 WeakPolarHBondContact OD1-CG 3.36Å; D262-Y266 VanDerWaalsContact O-CD2 3.25Å; D262-Y266 WeakPolarHBondContact O-CD2 3.45Å; D262-Y266 WeakPolarHBondContact O-CE2 3.35Å
263	V	98.8	Very high	98	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.202	C	C	.	.			trans	-78.4	-34.2	176.6	172.2	0	0	0	0	110.9	I198 L199 F202 I223 A227 L230 I258 L261 P265 Y266 I267	I198-V263 HydrophobicContact CG2-CG1 4.42Å; I198-V263 HydrophobicContact CG2-CG2 4.15Å; L199-V263 HydrophobicContact CD2-CG1 4.25Å; F202-V263 HydrophobicContact CE2-CG1 4.41Å; F202-V263 HydrophobicContact CE2-CG2 4.27Å; F202-V263 HydrophobicContact CZ-CG2 4.38Å; I223-V263 HydrophobicContact CG2-CG2 3.96Å; A227-V263 HydrophobicContact CB-CG2 3.91Å; L230-V263 HydrophobicContact CD1-CG1 3.61Å; I258-V263 HydrophobicContact CG2-CB 4.11Å; I258-V263 HydrophobicContact CG2-CG1 4.24Å; I258-V263 WeakPolarHBondContact O-CB 3.39Å; I258-V263 PolarHBondContact O-N 2.74Å; L261-V263 HydrophobicContact CB-CG2 4.18Å; L261-V263 PolarHBondContact O-N 3.43Å; L261-V263 VanDerWaalsContact O-N 3.13Å; V263-P265 VanDerWaalsContact C-CD 3.44Å; V263-Y266 PolarHBondContact O-N 3.29Å; V263-Y266 VanDerWaalsContact O-N 3.13Å; V263-I267 HydrophobicContact CG1-CD1 4.28Å; V263-I267 HydrophobicContact CG1-CG2 4.3Å
264	A	98.6	Very high	97.8	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.008	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-48.1	-47.3	-173.3	0	0	0	0	0	114.8	I258 Y259 Y266 I267 L269	I258-A264 HydrophobicContact CG2-CB 3.97Å; I258-A264 PolarHBondContact O-N 3.33Å; Y259-A264 HydrophobicContact CD1-CB 3.82Å; Y259-A264 HydrophobicContact CD2-CB 4.11Å; Y259-A264 HydrophobicContact CE1-CB 3.68Å; Y259-A264 HydrophobicContact CE2-CB 3.99Å; Y259-A264 HydrophobicContact CG-CB 4.02Å; A264-Y266 VanDerWaalsContact C-N 3.29Å; A264-Y266 PolarHBondContact O-N 3.16Å; A264-I267 VanDerWaalsContact O-CG1 3.32Å; A264-I267 WeakPolarHBondContact O-CG1 3.37Å; A264-I267 PolarHBondContact O-N 3.44Å; A264-L269 HydrophobicContact CB-CB 4Å; A264-L269 HydrophobicContact CB-CD1 4.28Å; A264-L269 WeakPolarHBondContact O-CB 3.34Å; A264-L269 PolarHBondContact O-N 3.23Å; A264-L269 VanDerWaalsContact O-N 3.12Å
265	P	98.1	Very high	97.7	Very high	52 Å²	52	37.5 Å²	37.5	34%	0.338	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-63.6	-32.2	-176.7	-22.3	35.3	0	0	0	113.7	D262 V263 I267 A271	D262-P265 WeakPolarHBondContact O-CD 3.46Å; D262-P265 WeakPolarHBondContact OD1-CG 3.36Å; V263-P265 VanDerWaalsContact C-CD 3.44Å; P265-I267 VanDerWaalsContact C-N 3.33Å; P265-I267 PolarHBondContact O-N 2.94Å; P265-A271 HydrophobicContact CG-CB 4.47Å
266	Y	98.6	Very high	97.7	Very high	59 Å²	59	45.3 Å²	45.3	23%	0.231	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-79.7	-17.8	-174.8	-54.7	-65.2	0	0	0	113.4	A227 K228 A231 D262 V263 A264 R312	A227-Y266 HydrophobicContact CB-CD2 4.03Å; A227-Y266 HydrophobicContact CB-CE2 4.03Å; A227-Y266 WeakPolarHBondContact O-CD2 3.41Å; K228-Y266 HydrophobicContact CB-CD1 4.49Å; K228-Y266 HydrophobicContact CB-CE1 3.91Å; K228-Y266 HydrophobicContact CB-CE2 4.29Å; K228-Y266 HydrophobicContact CG-CD1 4.45Å; K228-Y266 HydrophobicContact CG-CE1 3.81Å; A231-Y266 HydrophobicContact CB-CD1 4.17Å; D262-Y266 VanDerWaalsContact O-CD2 3.25Å; D262-Y266 WeakPolarHBondContact O-CD2 3.45Å; D262-Y266 WeakPolarHBondContact O-CE2 3.35Å; V263-Y266 PolarHBondContact O-N 3.29Å; V263-Y266 VanDerWaalsContact O-N 3.13Å; A264-Y266 VanDerWaalsContact C-N 3.29Å; A264-Y266 PolarHBondContact O-N 3.16Å; Y266-R312 PolarHBondContact O-NE 3.38Å; Y266-R312 VanDerWaalsContact O-NE 3.1Å; Y266-R312 PolarHBondContact O-NH2 2.66Å
267	I	98.4	Very high	97.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-106.4	13.1	179.8	62.9	165.2	0	0	0	113	L199 L230 I238 L242 I258 V263 A264 P265 L269 L313	L199-I267 HydrophobicContact CD1-CG2 4.19Å; L199-I267 HydrophobicContact CD2-CD1 4.29Å; L199-I267 HydrophobicContact CD2-CG2 4.32Å; L230-I267 HydrophobicContact CB-CG2 4.23Å; L230-I267 HydrophobicContact CD1-CG2 3.91Å; L230-I267 HydrophobicContact CD2-CG2 4.47Å; L230-I267 HydrophobicContact CG-CG2 4.45Å; I238-I267 HydrophobicContact CD1-CG2 4.23Å; I238-I267 HydrophobicContact CG1-CG2 4.49Å; I238-I267 HydrophobicContact CG2-CB 3.79Å; I238-I267 HydrophobicContact CG2-CG2 3.93Å; L242-I267 HydrophobicContact CD1-CD1 4.46Å; I258-I267 HydrophobicContact CG2-CD1 4.08Å; V263-I267 HydrophobicContact CG1-CD1 4.28Å; V263-I267 HydrophobicContact CG1-CG2 4.3Å; A264-I267 VanDerWaalsContact O-CG1 3.32Å; A264-I267 WeakPolarHBondContact O-CG1 3.37Å; A264-I267 PolarHBondContact O-N 3.44Å; P265-I267 VanDerWaalsContact C-N 3.33Å; P265-I267 PolarHBondContact O-N 2.94Å; I267-L269 HydrophobicContact CD1-CD1 3.95Å; I267-L269 HydrophobicContact CD1-CG 4.17Å; I267-L269 HydrophobicContact CG1-CD1 4.33Å; I267-L269 HydrophobicContact CG1-CG 4.07Å; I267-L313 WeakPolarHBondContact O-CD2 3.24Å
268	G	97.8	Very high	97.7	Very high	14 Å²	14	44.7 Å²	44.7	14%	0.144	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.3	10.9	172.2	0	0	0	0	0	115.4	L309	G268-L309 WeakPolarHBondContact O-CD1 3.46Å
269	L	98.5	Very high	97.6	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.042	26%	0.261	C	S	.	.			trans	-84.1	147.2	173.2	-56.6	-173.8	0	0	0	110.4	L242 I258 Y259 A264 I267 A271 L296 L299 L309	L242-L269 HydrophobicContact CD2-CD2 4.34Å; I258-L269 HydrophobicContact CG2-CD1 4.34Å; Y259-L269 HydrophobicContact CE2-CD1 4.23Å; A264-L269 HydrophobicContact CB-CB 4Å; A264-L269 HydrophobicContact CB-CD1 4.28Å; A264-L269 WeakPolarHBondContact O-CB 3.34Å; A264-L269 PolarHBondContact O-N 3.23Å; A264-L269 VanDerWaalsContact O-N 3.12Å; I267-L269 HydrophobicContact CD1-CD1 3.95Å; I267-L269 HydrophobicContact CD1-CG 4.17Å; I267-L269 HydrophobicContact CG1-CD1 4.33Å; I267-L269 HydrophobicContact CG1-CG 4.07Å; L269-A271 PolarHBondContact O-N 3.18Å; L269-L296 HydrophobicContact CD2-CD1 3.64Å; L269-L296 HydrophobicContact CD2-CD2 4.39Å; L269-L296 HydrophobicContact CD2-CG 4.36Å; L269-L299 HydrophobicContact CD1-CD1 4.26Å; L269-L309 HydrophobicContact CD2-CD1 3.95Å
270	P	97.4	Very high	97.6	Very high	25 Å²	25	51.1 Å²	51.1	16%	0.162	28%	0.28	C	S	.	.			trans	-68.1	131.6	177.1	27.5	-33.2	0	0	0	110.2	Y259 N272 A273 L299 F300	Y259-P270 VanDerWaalsContact CE1-O 3.27Å; Y259-P270 WeakPolarHBondContact CE1-O 3.45Å; Y259-P270 PolarHBondContact OH-O 3.45Å; P270-N272 PolarHBondContact O-N 3.45Å; P270-A273 HydrophobicContact CG-CB 4.2Å; P270-A273 PolarHBondContact O-N 3.34Å; P270-L299 WeakPolarHBondContact CG-O 3.46Å; P270-F300 HydrophobicContact CG-CD1 4.05Å; P270-F300 HydrophobicContact CG-CE1 4.39Å
271	A	94.4	Very high	97.6	Very high	79 Å²	79	45.3 Å²	45.3	65%	0.653	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-32.5	178.1	0	0	0	0	0	112.8	P265 L269	P265-A271 HydrophobicContact CG-CB 4.47Å; L269-A271 PolarHBondContact O-N 3.18Å
272	N	94.3	Very high	97.6	Very high	123 Å²	123	44.7 Å²	44.7	66%	0.658	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.9	61.9	178	-169.7	-8.3	0	0	0	111	P270 K301	P270-N272 PolarHBondContact O-N 3.45Å; N272-K301 VanDerWaalsContact CG-NZ 3.32Å; N272-K301 WeakPolarHBondContact O-CE 3.25Å; N272-K301 PolarHBondContact O-NZ 3.21Å; N272-K301 PolarHBondContact OD1-NZ 3.06Å
273	A	96.5	Very high	97.6	Very high	13 Å²	13	47.3 Å²	47.3	11%	0.107	25%	0.254	C	S	.	.			trans	-71	164.1	172.4	0	0	0	0	0	112.4	Y259 P270 L299	Y259-A273 HydrophobicContact CE1-CB 3.96Å; Y259-A273 HydrophobicContact CE2-CB 4.47Å; Y259-A273 WeakPolarHBondContact OH-CB 3.48Å; P270-A273 HydrophobicContact CG-CB 4.2Å; P270-A273 PolarHBondContact O-N 3.34Å; A273-L299 WeakPolarHBondContact CA-O 3.36Å; A273-L299 HydrophobicContact CB-CB 3.97Å; A273-L299 HydrophobicContact CB-CD2 3.83Å; A273-L299 HydrophobicContact CB-CG 4.49Å; A273-L299 WeakPolarHBondContact CB-O 3.27Å
274	S	94.1	Very high	97.6	Very high	38 Å²	38	48.8 Å²	48.8	27%	0.266	26%	0.261	S	S	.	.			trans	-93	94.3	166.1	-177.1	0	0	0	0	109.2	E276 E277 F278	S274-E276 VanDerWaalsContact C-N 3.28Å; S274-E276 PolarHBondContact O-N 2.83Å; S274-E277 PolarHBondContact O-N 3.29Å; S274-E277 WeakPolarHBondContact OG-CB 3.31Å; S274-E277 PolarHBondContact OG-N 3.13Å; S274-F278 PolarHBondContact O-N 2.89Å; S274-F278 VanDerWaalsContact O-N 3.16Å
275	L	97.5	Very high	97.6	Very high	47 Å²	47	49 Å²	49	25%	0.246	26%	0.263	C	S	.	.	H	α-helix	trans	-68.1	-29.9	177.4	-63	-179.8	0	0	0	112	Y259 F278 D279 L299	Y259-L275 HydrophobicContact CD2-CD2 3.8Å; Y259-L275 HydrophobicContact CE2-CD2 3.97Å; Y259-L275 HydrophobicContact CG-CD1 4.48Å; Y259-L275 HydrophobicContact CG-CD2 4.15Å; L275-F278 CarbonylContact O-C 3.47Å; L275-F278 WeakPolarHBondContact O-CB 3.31Å; L275-F278 PolarHBondContact O-N 3.18Å; L275-D279 VanDerWaalsContact O-CG 3.31Å; L275-D279 PolarHBondContact O-N 3.14Å; L275-L299 HydrophobicContact CD2-CD2 3.9Å
276	E	98.1	Very high	97.4	Very high	164 Å²	164	53.5 Å²	53.5	77%	0.766	28%	0.279	S	S	*	.	H	α-helix	trans	-60	-46.6	172.3	-176.2	-173.3	174.2	0	0	112.3	S274 F278 D279 K280	S274-E276 VanDerWaalsContact C-N 3.28Å; S274-E276 PolarHBondContact O-N 2.83Å; E276-F278 VanDerWaalsContact C-N 3.29Å; E276-F278 PolarHBondContact O-N 3.46Å; E276-D279 PolarHBondContact O-N 3.22Å; E276-K280 PolarHBondContact O-N 2.86Å; E276-K280 VanDerWaalsContact O-N 3.08Å
277	E	98.2	Very high	97.2	Very high	48 Å²	48	54.3 Å²	54.3	22%	0.224	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-37	175.7	-179.1	72.2	169.2	0	0	110.7	S274 K280 V281 Y368	S274-E277 PolarHBondContact O-N 3.29Å; S274-E277 WeakPolarHBondContact OG-CB 3.31Å; S274-E277 PolarHBondContact OG-N 3.13Å; E277-K280 PolarHBondContact O-N 3.49Å; E277-V281 HydrophobicContact CG-CG2 4.25Å; E277-V281 WeakPolarHBondContact O-CB 3.31Å; E277-V281 WeakPolarHBondContact O-CG2 3.49Å; E277-V281 PolarHBondContact O-N 3.26Å; E277-Y368 WeakPolarHBondContact CG-OH 3.33Å; E277-Y368 WeakPolarHBondContact OE1-CE1 3.4Å; E277-Y368 PolarHBondContact OE1-OH 2.99Å
278	F	98.6	Very high	97.1	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64.6	-38.9	174	174.7	-93.2	0	0	0	113	V251 N252 I255 S274 L275 E276 K280 V281 S282 L295 S298 L299	V251-F278 HydrophobicContact CG2-CZ 4.38Å; N252-F278 HydrophobicContact CB-CE1 4.46Å; I255-F278 HydrophobicContact CB-CD1 4.44Å; I255-F278 HydrophobicContact CB-CE1 3.57Å; I255-F278 HydrophobicContact CB-CE2 4.06Å; I255-F278 HydrophobicContact CB-CZ 3.37Å; I255-F278 HydrophobicContact CG1-CE1 4.17Å; I255-F278 HydrophobicContact CG1-CE2 3.83Å; I255-F278 HydrophobicContact CG1-CZ 3.42Å; I255-F278 VanDerWaalsContact CG1-CZ 3.42Å; I255-F278 HydrophobicContact CG2-CD1 4.03Å; I255-F278 HydrophobicContact CG2-CD2 4.3Å; I255-F278 HydrophobicContact CG2-CE1 3.63Å; I255-F278 HydrophobicContact CG2-CE2 3.95Å; I255-F278 HydrophobicContact CG2-CG 4.36Å; I255-F278 HydrophobicContact CG2-CZ 3.63Å; S274-F278 PolarHBondContact O-N 2.89Å; S274-F278 VanDerWaalsContact O-N 3.16Å; L275-F278 CarbonylContact O-C 3.47Å; L275-F278 WeakPolarHBondContact O-CB 3.31Å; L275-F278 PolarHBondContact O-N 3.18Å; E276-F278 VanDerWaalsContact C-N 3.29Å; E276-F278 PolarHBondContact O-N 3.46Å; F278-K280 VanDerWaalsContact C-N 3.33Å; F278-K280 PolarHBondContact O-N 2.82Å; F278-V281 PolarHBondContact O-N 3.08Å; F278-S282 WeakPolarHBondContact O-CB 3.48Å; F278-S282 PolarHBondContact O-N 3.15Å; F278-S282 PolarHBondContact O-OG 3.32Å; F278-L295 HydrophobicContact CD2-CD1 4.03Å; F278-L295 HydrophobicContact CD2-CG 4.33Å; F278-L295 HydrophobicContact CE2-CD1 3.75Å; F278-L295 HydrophobicContact CE2-CD2 4.06Å; F278-L295 HydrophobicContact CE2-CG 3.73Å; F278-S298 VanDerWaalsContact CA-OG 3.26Å; F278-S298 WeakPolarHBondContact CA-OG 3.28Å; F278-S298 WeakPolarHBondContact CB-OG 3.23Å; F278-S298 VanDerWaalsContact CD2-OG 3.3Å; F278-S298 WeakPolarHBondContact CD2-OG 3.49Å; F278-L299 HydrophobicContact CB-CD2 3.7Å; F278-L299 HydrophobicContact CB-CG 4.48Å; F278-L299 HydrophobicContact CD2-CD2 3.93Å; F278-L299 HydrophobicContact CD2-CG 4.07Å; F278-L299 HydrophobicContact CG-CD2 3.87Å
279	D	98.6	Very high	97	Very high	46 Å²	46	62 Å²	62	25%	0.246	35%	0.348	C	S	.	.	H	α-helix	trans	-62.7	-40.4	174.2	-70.8	-28.5	0	0	0	112.2	N252 H256 L275 E276 S282 K283	N252-D279 PolarHBondContact ND2-OD1 3Å; H256-D279 IonicContact CD2-OD1 2.66Å; H256-D279 IonicContact CE1-OD1 2.73Å; H256-D279 IonicContact CE1-OD2 3.06Å; H256-D279 IonicContact NE2-OD1 3.51Å; H256-D279 PolarHBondContact NE2-OD1 3.24Å; H256-D279 IonicContact NE2-OD2 2.86Å; L275-D279 VanDerWaalsContact O-CG 3.31Å; L275-D279 PolarHBondContact O-N 3.14Å; E276-D279 PolarHBondContact O-N 3.22Å; D279-S282 WeakPolarHBondContact CA-OG 3.45Å; D279-S282 PolarHBondContact O-OG 3Å; D279-S282 VanDerWaalsContact O-OG 3.07Å; D279-K283 WeakPolarHBondContact O-CG 3.42Å; D279-K283 PolarHBondContact O-N 3.48Å
280	K	98.6	Very high	97	Very high	121 Å²	121	62.8 Å²	62.8	53%	0.526	35%	0.354	S	S	.	.	H	α-helix	trans	-65.7	-51.2	174.8	-178	-176.9	175.2	-172.9	0	111.3	E276 E277 F278 K283 N284	E276-K280 PolarHBondContact O-N 2.86Å; E276-K280 VanDerWaalsContact O-N 3.08Å; E277-K280 PolarHBondContact O-N 3.49Å; F278-K280 VanDerWaalsContact C-N 3.33Å; F278-K280 PolarHBondContact O-N 2.82Å; K280-K283 PolarHBondContact O-N 2.93Å; K280-N284 VanDerWaalsContact O-CG 3.24Å; K280-N284 PolarHBondContact O-N 2.79Å; K280-N284 PolarHBondContact O-OD1 2.85Å
281	V	98.6	Very high	97	Very high	1 Å²	1	65 Å²	65	1%	0.006	36%	0.361	C	S	.	.	H	α-helix	trans	-69.1	-38.1	-174.7	174	0	0	0	0	111.5	E277 F278 K283 N284 V285 L295 Y368	E277-V281 HydrophobicContact CG-CG2 4.25Å; E277-V281 WeakPolarHBondContact O-CB 3.31Å; E277-V281 WeakPolarHBondContact O-CG2 3.49Å; E277-V281 PolarHBondContact O-N 3.26Å; F278-V281 PolarHBondContact O-N 3.08Å; V281-K283 VanDerWaalsContact C-N 3.28Å; V281-K283 PolarHBondContact O-N 3.35Å; V281-N284 WeakPolarHBondContact O-CB 3.4Å; V281-N284 PolarHBondContact O-N 2.68Å; V281-N284 VanDerWaalsContact O-N 3.08Å; V281-V285 HydrophobicContact CG1-CG1 4.19Å; V281-V285 WeakPolarHBondContact O-CG1 3.48Å; V281-V285 WeakPolarHBondContact O-CG2 3.23Å; V281-V285 PolarHBondContact O-N 3.43Å; V281-L295 HydrophobicContact CG1-CD1 4Å; V281-Y368 HydrophobicContact CB-CE2 4.39Å; V281-Y368 HydrophobicContact CG1-CD2 3.65Å; V281-Y368 HydrophobicContact CG1-CE2 3.91Å; V281-Y368 HydrophobicContact CG1-CG 4.14Å; V281-Y368 HydrophobicContact CG2-CD1 4.09Å; V281-Y368 HydrophobicContact CG2-CD2 4Å; V281-Y368 HydrophobicContact CG2-CE1 3.69Å; V281-Y368 HydrophobicContact CG2-CE2 3.65Å; V281-Y368 HydrophobicContact CG2-CG 4.21Å; V281-Y368 VanDerWaalsContact CG2-CZ 3.45Å
282	S	98.1	Very high	97.2	Very high	12 Å²	12	62.5 Å²	62.5	8%	0.084	34%	0.338	C	S	.	.	H	α-helix	trans	-59	-39.1	175.6	54.6	0	0	0	0	112.2	N252 F278 D279 E286	N252-S282 PolarHBondContact ND2-OG 3.39Å; F278-S282 WeakPolarHBondContact O-CB 3.48Å; F278-S282 PolarHBondContact O-N 3.15Å; F278-S282 PolarHBondContact O-OG 3.32Å; D279-S282 WeakPolarHBondContact CA-OG 3.45Å; D279-S282 PolarHBondContact O-OG 3Å; D279-S282 VanDerWaalsContact O-OG 3.07Å; S282-E286 PolarHBondContact O-N 2.75Å
283	K	98.3	Very high	97.4	Very high	143 Å²	143	56.7 Å²	56.7	62%	0.622	31%	0.307	S	S	*	.	H	α-helix	trans	-68.2	-42	171.2	-67.3	171.3	-173	173.3	0	112.2	D279 K280 V281 V285 E286	D279-K283 WeakPolarHBondContact O-CG 3.42Å; D279-K283 PolarHBondContact O-N 3.48Å; K280-K283 PolarHBondContact O-N 2.93Å; V281-K283 VanDerWaalsContact C-N 3.28Å; V281-K283 PolarHBondContact O-N 3.35Å; K283-V285 VanDerWaalsContact C-N 3.28Å; K283-V285 PolarHBondContact O-N 2.89Å; K283-E286 PolarHBondContact O-N 3.16Å
284	N	98.3	Very high	97.5	Very high	30 Å²	30	56.1 Å²	56.1	16%	0.16	30%	0.302	C	S	.	.	H	α-helix	trans	-60.1	-36.8	179.7	-72.1	-6.5	0	0	0	112.8	K280 V281 Y368 Q369 H372	K280-N284 VanDerWaalsContact O-CG 3.24Å; K280-N284 PolarHBondContact O-N 2.79Å; K280-N284 PolarHBondContact O-OD1 2.85Å; V281-N284 WeakPolarHBondContact O-CB 3.4Å; V281-N284 PolarHBondContact O-N 2.68Å; V281-N284 VanDerWaalsContact O-N 3.08Å; N284-Y368 PolarHBondContact ND2-O 3.25Å; N284-Q369 PolarHBondContact ND2-O 3.03Å; N284-H372 PolarHBondContact O-NE2 3.33Å
285	V	97.8	Very high	97.7	Very high	5 Å²	5	54.3 Å²	54.3	3%	0.03	29%	0.289	C	S	.	.	H	α-helix	trans	-91.7	-6.6	-175.8	-57.4	0	0	0	0	114.1	V281 K283 G287 F288 P290 L295 K367	V281-V285 HydrophobicContact CG1-CG1 4.19Å; V281-V285 WeakPolarHBondContact O-CG1 3.48Å; V281-V285 WeakPolarHBondContact O-CG2 3.23Å; V281-V285 PolarHBondContact O-N 3.43Å; K283-V285 VanDerWaalsContact C-N 3.28Å; K283-V285 PolarHBondContact O-N 2.89Å; V285-G287 PolarHBondContact O-N 3.07Å; V285-F288 PolarHBondContact O-N 3.14Å; V285-P290 HydrophobicContact CB-CB 3.86Å; V285-P290 HydrophobicContact CB-CG 3.84Å; V285-P290 HydrophobicContact CG1-CB 4.13Å; V285-P290 HydrophobicContact CG2-CB 4.14Å; V285-P290 HydrophobicContact CG2-CG 3.72Å; V285-L295 HydrophobicContact CG2-CD1 4.19Å; V285-K367 HydrophobicContact CG1-CB 4.15Å
286	E	95.2	Very high	97.7	Very high	148 Å²	148	52.1 Å²	52.1	69%	0.692	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	124.3	-175.9	-171.1	172.3	-163.5	0	0	111.2	S282 K283 F288	S282-E286 PolarHBondContact O-N 2.75Å; K283-E286 PolarHBondContact O-N 3.16Å; E286-F288 VanDerWaalsContact C-N 3.31Å; E286-F288 WeakPolarHBondContact O-CD2 3.12Å; E286-F288 PolarHBondContact O-N 3.42Å
287	G	94.6	Very high	97.8	Very high	76 Å²	76	44.3 Å²	44.3	78%	0.784	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.4	-2.1	-177.7	0	0	0	0	0	116	V285	V285-G287 PolarHBondContact O-N 3.07Å
288	F	96.1	Very high	97.8	Very high	73 Å²	73	42 Å²	42	32%	0.32	23%	0.231	S	C	.	.	S	Bend	trans	-110.2	16.7	-177.3	-65.7	-84.9	0	0	0	114.5	V285 E286 K367 H372 L375	V285-F288 PolarHBondContact O-N 3.14Å; E286-F288 VanDerWaalsContact C-N 3.31Å; E286-F288 WeakPolarHBondContact O-CD2 3.12Å; E286-F288 PolarHBondContact O-N 3.42Å; F288-K367 HydrophobicContact CB-CG 4.3Å; F288-K367 WeakPolarHBondContact O-CD 3.39Å; F288-K367 WeakPolarHBondContact O-CE 3.26Å; F288-K367 PolarHBondContact O-NZ 2.75Å; F288-H372 AromaticContact CD2-CD2 3.75Å; F288-H372 AromaticContact CD2-NE2 3.63Å; F288-H372 HydrophobicContact CE1-CB 4Å; F288-H372 HydrophobicContact CE2-CB 4.31Å; F288-H372 AromaticContact CE2-CD2 3.41Å; F288-H372 VanDerWaalsContact CE2-CD2 3.41Å; F288-H372 WeakPolarHBondContact CE2-CD2 3.47Å; F288-H372 AromaticContact CE2-CE1 3.38Å; F288-H372 WeakPolarHBondContact CE2-CE1 3.22Å; F288-H372 AromaticContact CE2-CG 3.51Å; F288-H372 AromaticContact CE2-ND1 3.51Å; F288-H372 AromaticContact CE2-NE2 3.32Å; F288-H372 VanDerWaalsContact CE2-NE2 3.32Å; F288-H372 WeakPolarHBondContact CE2-NE2 3.36Å; F288-H372 HydrophobicContact CZ-CB 3.64Å; F288-H372 AromaticContact CZ-CD2 3.63Å; F288-H372 AromaticContact CZ-CE1 3.97Å; F288-H372 AromaticContact CZ-CG 3.35Å; F288-H372 AromaticContact CZ-ND1 3.59Å; F288-H372 AromaticContact CZ-NE2 3.99Å; F288-L375 HydrophobicContact CB-CD2 4.27Å; F288-L375 HydrophobicContact CD1-CD2 3.7Å; F288-L375 HydrophobicContact CE1-CD2 4.46Å; F288-L375 HydrophobicContact CG-CD2 4.26Å
289	S	95.6	Very high	97.8	Very high	103 Å²	103	42 Å²	42	72%	0.72	23%	0.231	S	C	*	.			trans	46.5	65.8	176.4	-55.7	0	0	0	0	112.9	K367	S289-K367 PolarHBondContact O-NZ 2.91Å
290	P	97.4	Very high	97.8	Very high	24 Å²	24	39.9 Å²	39.9	16%	0.156	22%	0.219	C	C	.	.			trans	-63.6	146.8	177.5	28.8	-36.4	0	0	0	111.3	V285	V285-P290 HydrophobicContact CB-CB 3.86Å; V285-P290 HydrophobicContact CB-CG 3.84Å; V285-P290 HydrophobicContact CG1-CB 4.13Å; V285-P290 HydrophobicContact CG2-CB 4.14Å; V285-P290 HydrophobicContact CG2-CG 3.72Å
291	K	98.3	Very high	97.7	Very high	70 Å²	70	38.8 Å²	38.8	30%	0.304	21%	0.214	S	C	.	.			trans	-64.2	146.7	160.2	-71.4	-176.6	-178.7	-117	0	108.6	M293 T294 E318 L322 E364	K291-M293 VanDerWaalsContact C-N 3.26Å; K291-M293 PolarHBondContact O-N 2.9Å; K291-M293 VanDerWaalsContact O-N 3.16Å; K291-T294 VanDerWaalsContact O-CB 3.23Å; K291-T294 WeakPolarHBondContact O-CB 3.49Å; K291-T294 PolarHBondContact O-N 2.98Å; K291-T294 PolarHBondContact O-OG1 2.88Å; K291-E318 IonicContact NZ-OE1 2.63Å; K291-E318 PolarHBondContact NZ-OE1 3.31Å; K291-L322 HydrophobicContact CB-CD2 3.96Å; K291-L322 HydrophobicContact CD-CD2 3.71Å; K291-L322 HydrophobicContact CG-CD2 4.46Å; K291-E364 HydrophobicContact CB-CG 4.43Å; K291-E364 WeakPolarHBondContact CB-OE2 3.32Å; K291-E364 HydrophobicContact CD-CG 4.03Å; K291-E364 HydrophobicContact CG-CG 4.23Å; K291-E364 PolarHBondContact N-OE2 3.49Å
292	P	98.4	Very high	97.7	Very high	27 Å²	27	42.3 Å²	42.3	18%	0.175	24%	0.236	C	C	.	.	H	α-helix	trans	-52.8	-42.3	-177.9	-24.5	28.4	0	0	0	113.7	W239 K243 L246 V247 T294 L295 L296	W239-P292 HydrophobicContact CH2-CB 4.16Å; K243-P292 HydrophobicContact CB-CB 4.27Å; K243-P292 HydrophobicContact CB-CG 3.99Å; K243-P292 HydrophobicContact CD-CB 4.31Å; K243-P292 HydrophobicContact CD-CG 3.87Å; K243-P292 HydrophobicContact CG-CB 3.78Å; K243-P292 HydrophobicContact CG-CG 3.72Å; L246-P292 HydrophobicContact CB-CB 4.05Å; L246-P292 HydrophobicContact CD1-CB 3.85Å; V247-P292 HydrophobicContact CG1-CB 4.4Å; V247-P292 HydrophobicContact CG1-CG 3.74Å; P292-T294 PolarHBondContact O-N 3.15Å; P292-L295 PolarHBondContact O-N 2.95Å; P292-L296 WeakPolarHBondContact O-CB 3.41Å; P292-L296 PolarHBondContact O-N 2.93Å
293	M	98.6	Very high	97.7	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-28.6	179.4	-174.9	60.8	63.3	0	0	113.2	W239 K291 L296 A297 F300 L309 I315 E319 L322	W239-M293 HydrophobicContact CH2-CE 4.2Å; W239-M293 HydrophobicContact CZ2-CE 4.37Å; K291-M293 VanDerWaalsContact C-N 3.26Å; K291-M293 PolarHBondContact O-N 2.9Å; K291-M293 VanDerWaalsContact O-N 3.16Å; M293-L296 PolarHBondContact O-N 3.28Å; M293-L296 HydrophobicContact SD-CB 4.5Å; M293-L296 HydrophobicContact SD-CD2 4.4Å; M293-A297 VanDerWaalsContact O-CB 3.3Å; M293-A297 WeakPolarHBondContact O-CB 3.2Å; M293-A297 PolarHBondContact O-N 3.08Å; M293-F300 HydrophobicContact SD-CE2 4.02Å; M293-L309 HydrophobicContact CE-CD2 3.72Å; M293-L309 HydrophobicContact SD-CD2 4.38Å; M293-I315 HydrophobicContact CE-CD1 3.59Å; M293-E319 HydrophobicContact CE-CB 4.21Å; M293-E319 WeakPolarHBondContact CG-O 3.49Å; M293-L322 HydrophobicContact CB-CD2 4.05Å; M293-L322 HydrophobicContact CB-CG 4.36Å; M293-L322 HydrophobicContact CG-CB 4.39Å; M293-L322 HydrophobicContact CG-CG 4.28Å
294	T	98.6	Very high	97.7	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-48.6	-179.9	-54.8	0	0	0	0	110.9	K291 P292 I326 E364 Y368	K291-T294 VanDerWaalsContact O-CB 3.23Å; K291-T294 WeakPolarHBondContact O-CB 3.49Å; K291-T294 PolarHBondContact O-N 2.98Å; K291-T294 PolarHBondContact O-OG1 2.88Å; P292-T294 PolarHBondContact O-N 3.15Å; T294-I326 HydrophobicContact CG2-CD1 3.95Å; T294-E364 WeakPolarHBondContact CB-OE2 3.45Å; T294-E364 HydrophobicContact CG2-CB 4.14Å; T294-E364 WeakPolarHBondContact CG2-O 3.32Å; T294-E364 WeakPolarHBondContact OG1-CB 3.26Å; T294-E364 PolarHBondContact OG1-OE2 3.28Å; T294-Y368 WeakPolarHBondContact O-CD2 3.44Å
295	L	98.3	Very high	97.7	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-69.7	-41.8	175.2	-177.7	58.6	0	0	0	111.1	L246 V251 F278 V281 V285 P292 A297 S298	L246-L295 HydrophobicContact CD2-CD2 4.26Å; L246-L295 HydrophobicContact CD2-CG 4.44Å; V251-L295 HydrophobicContact CB-CD2 4.27Å; V251-L295 HydrophobicContact CG1-CD2 3.71Å; V251-L295 HydrophobicContact CG2-CD2 3.56Å; F278-L295 HydrophobicContact CD2-CD1 4.03Å; F278-L295 HydrophobicContact CD2-CG 4.33Å; F278-L295 HydrophobicContact CE2-CD1 3.75Å; F278-L295 HydrophobicContact CE2-CD2 4.06Å; F278-L295 HydrophobicContact CE2-CG 3.73Å; V281-L295 HydrophobicContact CG1-CD1 4Å; V285-L295 HydrophobicContact CG2-CD1 4.19Å; P292-L295 PolarHBondContact O-N 2.95Å; L295-A297 PolarHBondContact O-N 3.42Å; L295-S298 WeakPolarHBondContact O-CB 3.36Å; L295-S298 PolarHBondContact O-N 3.37Å; L295-S298 PolarHBondContact O-OG 3.08Å
296	L	98.3	Very high	97.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-31.1	-178.7	-162.7	70.9	0	0	0	113.3	W239 L246 L269 P292 M293 S298 L299 F300 L309	W239-L296 HydrophobicContact CH2-CD2 4.24Å; W239-L296 HydrophobicContact CZ3-CD2 3.98Å; L246-L296 HydrophobicContact CD1-CB 4.18Å; L246-L296 HydrophobicContact CD1-CD1 4.06Å; L246-L296 HydrophobicContact CD1-CD2 4.45Å; L246-L296 HydrophobicContact CD1-CG 4.48Å; L246-L296 HydrophobicContact CD2-CB 4.48Å; L246-L296 HydrophobicContact CD2-CD1 4.02Å; L269-L296 HydrophobicContact CD2-CD1 3.64Å; L269-L296 HydrophobicContact CD2-CD2 4.39Å; L269-L296 HydrophobicContact CD2-CG 4.36Å; P292-L296 WeakPolarHBondContact O-CB 3.41Å; P292-L296 PolarHBondContact O-N 2.93Å; M293-L296 PolarHBondContact O-N 3.28Å; M293-L296 HydrophobicContact SD-CB 4.5Å; M293-L296 HydrophobicContact SD-CD2 4.4Å; L296-S298 PolarHBondContact O-N 3.46Å; L296-S298 VanDerWaalsContact O-N 3.15Å; L296-L299 HydrophobicContact CD1-CD1 3.84Å; L296-L299 WeakPolarHBondContact O-CB 3.29Å; L296-L299 PolarHBondContact O-N 3.25Å; L296-F300 HydrophobicContact CD2-CE2 4.46Å; L296-F300 HydrophobicContact CD2-CZ 3.84Å; L296-F300 HydrophobicContact CG-CE1 4.49Å; L296-F300 HydrophobicContact CG-CE2 4.31Å; L296-F300 HydrophobicContact CG-CZ 3.76Å; L296-L309 HydrophobicContact CD2-CD1 4.01Å; L296-L309 HydrophobicContact CD2-CD2 3.61Å; L296-L309 HydrophobicContact CD2-CG 4.46Å
297	A	98.6	Very high	97.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-61.7	-20.1	178.7	0	0	0	0	0	114.1	M293 L295 L299 F300 I326 V327 R330 Y368	M293-A297 VanDerWaalsContact O-CB 3.3Å; M293-A297 WeakPolarHBondContact O-CB 3.2Å; M293-A297 PolarHBondContact O-N 3.08Å; L295-A297 PolarHBondContact O-N 3.42Å; A297-L299 PolarHBondContact O-N 3.06Å; A297-F300 HydrophobicContact CB-CD2 4.34Å; A297-F300 PolarHBondContact O-N 3.37Å; A297-I326 HydrophobicContact CB-CB 4.04Å; A297-I326 HydrophobicContact CB-CD1 4.34Å; A297-I326 HydrophobicContact CB-CG2 3.72Å; A297-V327 HydrophobicContact CB-CG2 4.34Å; A297-R330 PolarHBondContact O-NH1 3Å; A297-Y368 HydrophobicContact CB-CE2 4.42Å
298	S	98.6	Very high	98	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-68.4	-26.2	175.7	72	0	0	0	0	112.4	F278 L295 L296 F300	F278-S298 VanDerWaalsContact CA-OG 3.26Å; F278-S298 WeakPolarHBondContact CA-OG 3.28Å; F278-S298 WeakPolarHBondContact CB-OG 3.23Å; F278-S298 VanDerWaalsContact CD2-OG 3.3Å; F278-S298 WeakPolarHBondContact CD2-OG 3.49Å; L295-S298 WeakPolarHBondContact O-CB 3.36Å; L295-S298 PolarHBondContact O-N 3.37Å; L295-S298 PolarHBondContact O-OG 3.08Å; L296-S298 PolarHBondContact O-N 3.46Å; L296-S298 VanDerWaalsContact O-N 3.15Å; S298-F300 VanDerWaalsContact C-N 3.26Å; S298-F300 PolarHBondContact O-N 3.15Å
299	L	98.5	Very high	98.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-75.3	-16.3	176.1	-60.9	174.3	0	0	0	112.5	I255 Y259 L269 P270 A273 L275 F278 L296 A297	I255-L299 HydrophobicContact CG2-CD1 4.24Å; I255-L299 HydrophobicContact CG2-CD2 4.26Å; Y259-L299 HydrophobicContact CE2-CD1 4.21Å; Y259-L299 HydrophobicContact CE2-CD2 4.16Å; L269-L299 HydrophobicContact CD1-CD1 4.26Å; P270-L299 WeakPolarHBondContact CG-O 3.46Å; A273-L299 WeakPolarHBondContact CA-O 3.36Å; A273-L299 HydrophobicContact CB-CB 3.97Å; A273-L299 HydrophobicContact CB-CD2 3.83Å; A273-L299 HydrophobicContact CB-CG 4.49Å; A273-L299 WeakPolarHBondContact CB-O 3.27Å; L275-L299 HydrophobicContact CD2-CD2 3.9Å; F278-L299 HydrophobicContact CB-CD2 3.7Å; F278-L299 HydrophobicContact CB-CG 4.48Å; F278-L299 HydrophobicContact CD2-CD2 3.93Å; F278-L299 HydrophobicContact CD2-CG 4.07Å; F278-L299 HydrophobicContact CG-CD2 3.87Å; L296-L299 HydrophobicContact CD1-CD1 3.84Å; L296-L299 WeakPolarHBondContact O-CB 3.29Å; L296-L299 PolarHBondContact O-N 3.25Å; A297-L299 PolarHBondContact O-N 3.06Å
300	F	98.4	Very high	98.3	Very high	1 Å²	1	35 Å²	35	0%	0.004	18%	0.178	C	C	.	.			trans	-89.5	133.8	-177.3	-56.2	-29.2	0	0	0	111.3	P270 M293 L296 A297 S298 D305 V306 L309 V327 R330	P270-F300 HydrophobicContact CG-CD1 4.05Å; P270-F300 HydrophobicContact CG-CE1 4.39Å; M293-F300 HydrophobicContact SD-CE2 4.02Å; L296-F300 HydrophobicContact CD2-CE2 4.46Å; L296-F300 HydrophobicContact CD2-CZ 3.84Å; L296-F300 HydrophobicContact CG-CE1 4.49Å; L296-F300 HydrophobicContact CG-CE2 4.31Å; L296-F300 HydrophobicContact CG-CZ 3.76Å; A297-F300 HydrophobicContact CB-CD2 4.34Å; A297-F300 PolarHBondContact O-N 3.37Å; S298-F300 VanDerWaalsContact C-N 3.26Å; S298-F300 PolarHBondContact O-N 3.15Å; F300-D305 HydrophobicContact CB-CB 3.85Å; F300-D305 HydrophobicContact CD1-CB 3.57Å; F300-D305 HydrophobicContact CE1-CB 4.4Å; F300-D305 HydrophobicContact CG-CB 3.81Å; F300-V306 HydrophobicContact CD2-CG2 3.56Å; F300-V306 HydrophobicContact CE2-CG2 3.99Å; F300-V306 HydrophobicContact CG-CG2 4.34Å; F300-L309 HydrophobicContact CE2-CD2 4.4Å; F300-L309 HydrophobicContact CZ-CB 4.32Å; F300-L309 HydrophobicContact CZ-CD1 4.33Å; F300-L309 HydrophobicContact CZ-CD2 3.88Å; F300-L309 HydrophobicContact CZ-CG 4.39Å; F300-V327 HydrophobicContact CB-CG2 3.81Å; F300-V327 HydrophobicContact CD2-CG2 4.19Å; F300-R330 PolarHBondContact O-NH1 3.48Å; F300-R330 VanDerWaalsContact O-NH1 3.09Å; F300-R330 PolarHBondContact O-NH2 3.03Å
301	K	97.6	Very high	98.3	Very high	98 Å²	98	39.8 Å²	39.8	43%	0.426	20%	0.201	S	C	.	.	S	Bend	trans	-90.2	-38.3	175.4	-73.7	175.8	175.4	164.4	0	110.6	N272 D305 R330	N272-K301 VanDerWaalsContact CG-NZ 3.32Å; N272-K301 WeakPolarHBondContact O-CE 3.25Å; N272-K301 PolarHBondContact O-NZ 3.21Å; N272-K301 PolarHBondContact OD1-NZ 3.06Å; K301-D305 PolarHBondContact N-OD2 3.33Å; K301-R330 PolarHBondContact O-NH2 3.24Å
302	V	97.9	Very high	98.3	Very high	76 Å²	76	39.2 Å²	39.2	46%	0.461	20%	0.197	S	C	.	.	S	Bend	trans	-137.3	163.8	-175.3	-64.6	0	0	0	0	111.6	D304 D305	V302-D304 HydrophobicContact CG2-CB 4.11Å; V302-D304 PolarHBondContact O-N 2.96Å; V302-D305 PolarHBondContact N-OD2 3.23Å; V302-D305 WeakPolarHBondContact O-CB 3.4Å; V302-D305 PolarHBondContact O-N 2.89Å; V302-D305 VanDerWaalsContact O-N 3.14Å
303	Q	98.1	Very high	98.3	Very high	85 Å²	85	38 Å²	38	40%	0.397	19%	0.189	S	C	.	.	H	α-helix	trans	-61.7	-26.9	-178.9	-72.4	178.9	53	0	0	113.1	D305 V306 T307 L324 V327	Q303-D305 PolarHBondContact O-N 3.05Å; Q303-V306 WeakPolarHBondContact O-CB 3.37Å; Q303-V306 PolarHBondContact O-N 3.3Å; Q303-V306 VanDerWaalsContact O-N 3.13Å; Q303-T307 PolarHBondContact O-N 3.11Å; Q303-L324 HydrophobicContact CB-CD2 3.75Å; Q303-L324 HydrophobicContact CG-CD2 4.04Å; Q303-V327 HydrophobicContact CG-CB 4.41Å; Q303-V327 HydrophobicContact CG-CG1 4.07Å
304	D	98.3	Very high	98.3	Very high	104 Å²	104	43.4 Å²	43.4	56%	0.556	21%	0.213	S	C	*	.	H	α-helix	trans	-62.7	-28.1	176.8	-71.2	-6.5	0	0	0	112.9	V302 V306 T307 K308	V302-D304 HydrophobicContact CG2-CB 4.11Å; V302-D304 PolarHBondContact O-N 2.96Å; D304-V306 VanDerWaalsContact C-N 3.3Å; D304-V306 PolarHBondContact O-N 2.7Å; D304-T307 PolarHBondContact O-N 3.42Å; D304-K308 WeakPolarHBondContact O-CG 3.37Å; D304-K308 PolarHBondContact O-N 3.04Å
305	D	98.4	Very high	98.2	Very high	20 Å²	20	44 Å²	44	11%	0.107	22%	0.216	C	C	.	.	H	α-helix	trans	-65.1	-37.1	176.4	-60.8	-36.2	0	0	0	110.9	F300 K301 V302 Q303 T307 K308 L309	F300-D305 HydrophobicContact CB-CB 3.85Å; F300-D305 HydrophobicContact CD1-CB 3.57Å; F300-D305 HydrophobicContact CE1-CB 4.4Å; F300-D305 HydrophobicContact CG-CB 3.81Å; K301-D305 PolarHBondContact N-OD2 3.33Å; V302-D305 PolarHBondContact N-OD2 3.23Å; V302-D305 WeakPolarHBondContact O-CB 3.4Å; V302-D305 PolarHBondContact O-N 2.89Å; V302-D305 VanDerWaalsContact O-N 3.14Å; Q303-D305 PolarHBondContact O-N 3.05Å; D305-T307 VanDerWaalsContact C-N 3.33Å; D305-T307 PolarHBondContact O-N 2.97Å; D305-K308 PolarHBondContact O-N 3.15Å; D305-L309 WeakPolarHBondContact O-CB 3.19Å; D305-L309 PolarHBondContact O-N 2.75Å
306	V	98.5	Very high	98.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-41.5	173.7	-174	0	0	0	0	110.6	F300 Q303 D304 L309 D310 K320 L324 V327	F300-V306 HydrophobicContact CD2-CG2 3.56Å; F300-V306 HydrophobicContact CE2-CG2 3.99Å; F300-V306 HydrophobicContact CG-CG2 4.34Å; Q303-V306 WeakPolarHBondContact O-CB 3.37Å; Q303-V306 PolarHBondContact O-N 3.3Å; Q303-V306 VanDerWaalsContact O-N 3.13Å; D304-V306 VanDerWaalsContact C-N 3.3Å; D304-V306 PolarHBondContact O-N 2.7Å; V306-L309 PolarHBondContact O-N 3.44Å; V306-D310 WeakPolarHBondContact O-CB 3.5Å; V306-D310 PolarHBondContact O-N 3.12Å; V306-K320 HydrophobicContact CG1-CG 4.27Å; V306-L324 HydrophobicContact CB-CD2 3.96Å; V306-L324 HydrophobicContact CB-CG 4.38Å; V306-L324 HydrophobicContact CG1-CD2 4.2Å; V306-L324 HydrophobicContact CG1-CG 4.08Å; V306-L324 HydrophobicContact CG2-CD2 4.31Å; V306-V327 HydrophobicContact CG2-CG2 4.08Å
307	T	98.3	Very high	98.1	Very high	63 Å²	63	54.3 Å²	54.3	39%	0.387	27%	0.27	S	S	.	.	H	α-helix	trans	-67	-38.3	178.4	-58.4	0	0	0	0	111.8	Q303 D304 D305 D310 L311	Q303-T307 PolarHBondContact O-N 3.11Å; D304-T307 PolarHBondContact O-N 3.42Å; D305-T307 VanDerWaalsContact C-N 3.33Å; D305-T307 PolarHBondContact O-N 2.97Å; T307-D310 PolarHBondContact O-N 3.23Å; T307-L311 PolarHBondContact O-N 3.37Å
308	K	98.3	Very high	98	Very high	131 Å²	131	59.4 Å²	59.4	57%	0.57	29%	0.294	S	S	*	.	H	α-helix	trans	-66.3	-42.7	174.4	-71.3	170.1	-172.5	168.2	0	111.9	D304 D305 L311 R312	D304-K308 WeakPolarHBondContact O-CG 3.37Å; D304-K308 PolarHBondContact O-N 3.04Å; D305-K308 PolarHBondContact O-N 3.15Å; K308-L311 PolarHBondContact O-N 3.37Å; K308-R312 PolarHBondContact O-N 2.83Å; K308-R312 VanDerWaalsContact O-N 3.15Å
309	L	98.5	Very high	98	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.1	-49.8	174.1	-176.4	88.5	0	0	0	110.7	G268 L269 M293 L296 F300 D305 V306 L311 R312 L313 I315	G268-L309 WeakPolarHBondContact O-CD1 3.46Å; L269-L309 HydrophobicContact CD2-CD1 3.95Å; M293-L309 HydrophobicContact CE-CD2 3.72Å; M293-L309 HydrophobicContact SD-CD2 4.38Å; L296-L309 HydrophobicContact CD2-CD1 4.01Å; L296-L309 HydrophobicContact CD2-CD2 3.61Å; L296-L309 HydrophobicContact CD2-CG 4.46Å; F300-L309 HydrophobicContact CE2-CD2 4.4Å; F300-L309 HydrophobicContact CZ-CB 4.32Å; F300-L309 HydrophobicContact CZ-CD1 4.33Å; F300-L309 HydrophobicContact CZ-CD2 3.88Å; F300-L309 HydrophobicContact CZ-CG 4.39Å; D305-L309 WeakPolarHBondContact O-CB 3.19Å; D305-L309 PolarHBondContact O-N 2.75Å; V306-L309 PolarHBondContact O-N 3.44Å; L309-L311 VanDerWaalsContact C-N 3.31Å; L309-L311 PolarHBondContact O-N 2.73Å; L309-R312 PolarHBondContact O-N 3.26Å; L309-R312 VanDerWaalsContact O-N 3.08Å; L309-L313 HydrophobicContact CD1-CD1 3.54Å; L309-L313 HydrophobicContact CD1-CG 4.23Å; L309-L313 HydrophobicContact CG-CD1 3.96Å; L309-L313 HydrophobicContact CG-CG 4.41Å; L309-L313 WeakPolarHBondContact O-CB 3.29Å; L309-L313 PolarHBondContact O-N 2.93Å; L309-I315 HydrophobicContact CD2-CD1 4.28Å
310	D	98.5	Very high	98	Very high	33 Å²	33	63.7 Å²	63.7	18%	0.176	31%	0.313	C	S	.	.	H	α-helix	trans	-57.8	-43.7	178.1	177.1	37	0	0	0	111.8	V306 T307 R312 L313 K314 I315 K320	V306-D310 WeakPolarHBondContact O-CB 3.5Å; V306-D310 PolarHBondContact O-N 3.12Å; T307-D310 PolarHBondContact O-N 3.23Å; D310-R312 PolarHBondContact O-N 3.45Å; D310-L313 PolarHBondContact O-N 3.04Å; D310-K314 WeakPolarHBondContact O-CA 3.47Å; D310-K314 PolarHBondContact O-N 2.85Å; D310-I315 HydrophobicContact CB-CD1 4.08Å; D310-I315 HydrophobicContact CB-CG1 3.92Å; D310-I315 WeakPolarHBondContact OD1-CG1 3.45Å; D310-I315 PolarHBondContact OD1-N 2.63Å; D310-K320 HydrophobicContact CB-CD 4.42Å; D310-K320 WeakPolarHBondContact OD2-CD 3.18Å; D310-K320 WeakPolarHBondContact OD2-CE 3.46Å; D310-K320 IonicContact OD2-NZ 3.98Å; D310-K320 PolarHBondContact OD2-NZ 3.19Å
311	L	98.2	Very high	98	Very high	124 Å²	124	66.2 Å²	66.2	65%	0.649	33%	0.327	S	S	*	.	H	α-helix	trans	-59	-37.2	176.8	-172.9	64.6	0	0	0	112.3	T307 K308 L309 K314	T307-L311 PolarHBondContact O-N 3.37Å; K308-L311 PolarHBondContact O-N 3.37Å; L309-L311 VanDerWaalsContact C-N 3.31Å; L309-L311 PolarHBondContact O-N 2.73Å; L311-K314 WeakPolarHBondContact O-CE 3.44Å; L311-K314 PolarHBondContact O-NZ 2.72Å
312	R	98.3	Very high	98	Very high	59 Å²	59	61.8 Å²	61.8	22%	0.223	31%	0.308	C	S	.	.	H	α-helix	trans	-82.9	-39.4	-178.5	175.4	57.6	-174.1	105.4	-12	113.9	L230 I233 G235 Y266 K308 L309 D310	L230-R312 PolarHBondContact O-NH2 3.11Å; I233-R312 PolarHBondContact O-NH1 3.3Å; I233-R312 PolarHBondContact O-NH2 3.25Å; G235-R312 VanDerWaalsContact CA-O 3.28Å; G235-R312 WeakPolarHBondContact CA-O 3.22Å; Y266-R312 PolarHBondContact O-NE 3.38Å; Y266-R312 VanDerWaalsContact O-NE 3.1Å; Y266-R312 PolarHBondContact O-NH2 2.66Å; K308-R312 PolarHBondContact O-N 2.83Å; K308-R312 VanDerWaalsContact O-N 3.15Å; L309-R312 PolarHBondContact O-N 3.26Å; L309-R312 VanDerWaalsContact O-N 3.08Å; D310-R312 PolarHBondContact O-N 3.45Å
313	L	98.2	Very high	98	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-106.3	-12.4	-168.6	-64.4	-169.1	0	0	0	114.5	G235 I238 W239 L242 I267 L309 D310 I315	G235-L313 CarbonylContact C-O 3.16Å; I238-L313 HydrophobicContact CB-CD2 3.92Å; I238-L313 HydrophobicContact CG2-CD2 3.48Å; I238-L313 VanDerWaalsContact CG2-CD2 3.48Å; W239-L313 HydrophobicContact CB-CB 4.31Å; W239-L313 HydrophobicContact CD2-CD1 4.44Å; W239-L313 HydrophobicContact CE3-CD1 3.79Å; W239-L313 HydrophobicContact CZ3-CD1 4.46Å; L242-L313 HydrophobicContact CD2-CD1 4.15Å; I267-L313 WeakPolarHBondContact O-CD2 3.24Å; L309-L313 HydrophobicContact CD1-CD1 3.54Å; L309-L313 HydrophobicContact CD1-CG 4.23Å; L309-L313 HydrophobicContact CG-CD1 3.96Å; L309-L313 HydrophobicContact CG-CG 4.41Å; L309-L313 WeakPolarHBondContact O-CB 3.29Å; L309-L313 PolarHBondContact O-N 2.93Å; D310-L313 PolarHBondContact O-N 3.04Å; L313-I315 HydrophobicContact CB-CG2 3.87Å
314	K	97.4	Very high	98.1	Very high	116 Å²	116	56 Å²	56	50%	0.504	28%	0.277	S	S	.	.			trans	54.7	55.9	179.9	-50.1	-51.9	-172	-166	0	111.6	E236 D310 L311	E236-K314 HydrophobicContact CG-CB 4.37Å; D310-K314 WeakPolarHBondContact O-CA 3.47Å; D310-K314 PolarHBondContact O-N 2.85Å; L311-K314 WeakPolarHBondContact O-CE 3.44Å; L311-K314 PolarHBondContact O-NZ 2.72Å
315	I	98.1	Very high	98.1	Very high	14 Å²	14	51.5 Å²	51.5	7%	0.072	25%	0.252	C	S	.	.			trans	-75.3	161.7	-174.7	65.7	177.6	0	0	0	111.4	W239 M293 L309 D310 L313 E319 K320	W239-I315 HydrophobicContact CD2-CG2 4Å; W239-I315 HydrophobicContact CG-CG2 4.17Å; W239-I315 HydrophobicContact CZ2-CG2 4.26Å; M293-I315 HydrophobicContact CE-CD1 3.59Å; L309-I315 HydrophobicContact CD2-CD1 4.28Å; D310-I315 HydrophobicContact CB-CD1 4.08Å; D310-I315 HydrophobicContact CB-CG1 3.92Å; D310-I315 WeakPolarHBondContact OD1-CG1 3.45Å; D310-I315 PolarHBondContact OD1-N 2.63Å; L313-I315 HydrophobicContact CB-CG2 3.87Å; I315-E319 HydrophobicContact CB-CB 4.23Å; I315-E319 HydrophobicContact CD1-CB 4.25Å; I315-E319 HydrophobicContact CG1-CB 4.47Å; I315-K320 HydrophobicContact CD1-CB 3.85Å; I315-K320 HydrophobicContact CG1-CB 4.16Å
316	A	97.5	Very high	98.1	Very high	52 Å²	52	50.5 Å²	50.5	43%	0.43	25%	0.247	S	C	.	.			trans	-67.4	152.9	175.7	0	0	0	0	0	111.3	E318 E319 K320	A316-E318 VanDerWaalsContact C-N 3.26Å; A316-E318 PolarHBondContact O-N 3.37Å; A316-E319 HydrophobicContact CB-CG 4.18Å; A316-E319 WeakPolarHBondContact CB-OE2 3.28Å; A316-E319 PolarHBondContact N-OE2 2.91Å; A316-E319 WeakPolarHBondContact O-CB 3.39Å; A316-E319 PolarHBondContact O-N 3.38Å; A316-K320 PolarHBondContact O-N 2.86Å
317	K	96.6	Very high	98.1	Very high	164 Å²	164	51.3 Å²	51.3	71%	0.713	25%	0.252	S	S	*	.	H	α-helix	trans	-55.3	-40.4	177.5	-175.4	-179.4	177.1	-176.3	0	112.5	K320 N321	K317-K320 PolarHBondContact O-N 2.83Å; K317-N321 WeakPolarHBondContact O-CB 3.23Å; K317-N321 VanDerWaalsContact O-CG 3.23Å; K317-N321 PolarHBondContact O-N 3.35Å
318	E	96.6	Very high	98.1	Very high	107 Å²	107	54.4 Å²	54.4	50%	0.5	26%	0.26	S	S	.	.	H	α-helix	trans	-61.2	-44.6	176.3	-171.5	-170.1	153.4	0	0	111.3	K291 A316 N321 L322	K291-E318 IonicContact NZ-OE1 2.63Å; K291-E318 PolarHBondContact NZ-OE1 3.31Å; A316-E318 VanDerWaalsContact C-N 3.26Å; A316-E318 PolarHBondContact O-N 3.37Å; E318-N321 PolarHBondContact O-N 3.39Å; E318-L322 WeakPolarHBondContact O-CB 3.14Å; E318-L322 PolarHBondContact O-N 3.49Å
319	E	98	Very high	98.1	Very high	35 Å²	35	49.2 Å²	49.2	16%	0.164	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-45.6	178.5	-64.6	170	144.7	0	0	110.5	W239 K243 M293 I315 A316 L322 G323	W239-E319 HydrophobicContact CZ2-CG 4.45Å; W239-E319 PolarHBondContact NE1-OE1 3.24Å; W239-E319 PolarHBondContact NE1-OE2 3.47Å; K243-E319 WeakPolarHBondContact CD-OE1 3.33Å; K243-E319 IonicContact NZ-OE1 3.87Å; K243-E319 PolarHBondContact NZ-OE1 2.66Å; M293-E319 HydrophobicContact CE-CB 4.21Å; M293-E319 WeakPolarHBondContact CG-O 3.49Å; I315-E319 HydrophobicContact CB-CB 4.23Å; I315-E319 HydrophobicContact CD1-CB 4.25Å; I315-E319 HydrophobicContact CG1-CB 4.47Å; A316-E319 HydrophobicContact CB-CG 4.18Å; A316-E319 WeakPolarHBondContact CB-OE2 3.28Å; A316-E319 PolarHBondContact N-OE2 2.91Å; A316-E319 WeakPolarHBondContact O-CB 3.39Å; A316-E319 PolarHBondContact O-N 3.38Å; E319-L322 PolarHBondContact O-N 2.87Å; E319-G323 PolarHBondContact O-N 3.16Å
320	K	98.3	Very high	98	Very high	55 Å²	55	50.6 Å²	50.6	24%	0.239	24%	0.244	C	C	.	.	H	α-helix	trans	-59.7	-49.2	175.8	-177.1	-178.2	-172.5	158.1	0	112.3	V306 D310 I315 A316 K317 L322 G323 L324	V306-K320 HydrophobicContact CG1-CG 4.27Å; D310-K320 HydrophobicContact CB-CD 4.42Å; D310-K320 WeakPolarHBondContact OD2-CD 3.18Å; D310-K320 WeakPolarHBondContact OD2-CE 3.46Å; D310-K320 IonicContact OD2-NZ 3.98Å; D310-K320 PolarHBondContact OD2-NZ 3.19Å; I315-K320 HydrophobicContact CD1-CB 3.85Å; I315-K320 HydrophobicContact CG1-CB 4.16Å; A316-K320 PolarHBondContact O-N 2.86Å; K317-K320 PolarHBondContact O-N 2.83Å; K320-L322 VanDerWaalsContact C-N 3.28Å; K320-L322 PolarHBondContact O-N 3.47Å; K320-G323 PolarHBondContact O-N 3.04Å; K320-L324 HydrophobicContact CG-CD1 4.13Å; K320-L324 WeakPolarHBondContact O-CG 3.16Å; K320-L324 PolarHBondContact O-N 3.27Å
321	N	97.8	Very high	97.9	Very high	54 Å²	54	56.8 Å²	56.8	29%	0.289	27%	0.269	S	S	.	.	H	α-helix	trans	-62.5	-37.3	-178.8	-75.9	-3.5	0	0	0	111.8	K317 E318 F325	K317-N321 WeakPolarHBondContact O-CB 3.23Å; K317-N321 VanDerWaalsContact O-CG 3.23Å; K317-N321 PolarHBondContact O-N 3.35Å; E318-N321 PolarHBondContact O-N 3.39Å; N321-F325 WeakPolarHBondContact O-CB 3.5Å; N321-F325 PolarHBondContact O-N 2.81Å
322	L	98.5	Very high	97.8	Very high	6 Å²	6	57.3 Å²	57.3	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-63.7	-46.5	174.2	177	59.3	0	0	0	111.7	K291 M293 E318 E319 K320 L324 F325 I326 R361 E364	K291-L322 HydrophobicContact CB-CD2 3.96Å; K291-L322 HydrophobicContact CD-CD2 3.71Å; K291-L322 HydrophobicContact CG-CD2 4.46Å; M293-L322 HydrophobicContact CB-CD2 4.05Å; M293-L322 HydrophobicContact CB-CG 4.36Å; M293-L322 HydrophobicContact CG-CB 4.39Å; M293-L322 HydrophobicContact CG-CG 4.28Å; E318-L322 WeakPolarHBondContact O-CB 3.14Å; E318-L322 PolarHBondContact O-N 3.49Å; E319-L322 PolarHBondContact O-N 2.87Å; K320-L322 VanDerWaalsContact C-N 3.28Å; K320-L322 PolarHBondContact O-N 3.47Å; L322-L324 PolarHBondContact O-N 2.8Å; L322-F325 PolarHBondContact O-N 2.81Å; L322-I326 HydrophobicContact CD1-CD1 3.81Å; L322-I326 HydrophobicContact CD1-CG1 4.15Å; L322-I326 HydrophobicContact CG-CD1 4.11Å; L322-I326 WeakPolarHBondContact O-CG1 3.44Å; L322-I326 PolarHBondContact O-N 2.92Å; L322-R361 HydrophobicContact CD1-CB 4.44Å; L322-R361 HydrophobicContact CD1-CG 3.98Å; L322-E364 HydrophobicContact CD1-CB 3.76Å; L322-E364 HydrophobicContact CD1-CG 4.09Å; L322-E364 HydrophobicContact CD2-CG 4.19Å
323	G	98.4	Very high	97.8	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.9	-47.3	176.9	0	0	0	0	0	112.3	E319 K320 F325 I326 V327	E319-G323 PolarHBondContact O-N 3.16Å; K320-G323 PolarHBondContact O-N 3.04Å; G323-F325 VanDerWaalsContact C-N 3.33Å; G323-F325 PolarHBondContact O-N 3.12Å; G323-I326 PolarHBondContact O-N 2.85Å; G323-V327 VanDerWaalsContact O-CG2 3.31Å; G323-V327 WeakPolarHBondContact O-CG2 3.26Å; G323-V327 PolarHBondContact O-N 3.47Å
324	L	98.5	Very high	97.7	Very high	38 Å²	38	59.6 Å²	59.6	20%	0.199	29%	0.288	C	S	.	.	H	α-helix	trans	-60.5	-42.8	176.1	-69.2	174.2	0	0	0	111.9	Q303 V306 K320 L322 K328	Q303-L324 HydrophobicContact CB-CD2 3.75Å; Q303-L324 HydrophobicContact CG-CD2 4.04Å; V306-L324 HydrophobicContact CB-CD2 3.96Å; V306-L324 HydrophobicContact CB-CG 4.38Å; V306-L324 HydrophobicContact CG1-CD2 4.2Å; V306-L324 HydrophobicContact CG1-CG 4.08Å; V306-L324 HydrophobicContact CG2-CD2 4.31Å; K320-L324 HydrophobicContact CG-CD1 4.13Å; K320-L324 WeakPolarHBondContact O-CG 3.16Å; K320-L324 PolarHBondContact O-N 3.27Å; L322-L324 PolarHBondContact O-N 2.8Å; L324-K328 WeakPolarHBondContact O-CB 3.27Å; L324-K328 PolarHBondContact O-N 3.44Å
325	F	98.4	Very high	97.6	Very high	10 Å²	10	57.8 Å²	57.8	4%	0.044	28%	0.28	C	S	.	.	H	α-helix	trans	-61.2	-49	178.5	173	-98	0	0	0	112	N321 L322 G323 K328 N329 L333 F349 R361 V362 L365	N321-F325 WeakPolarHBondContact O-CB 3.5Å; N321-F325 PolarHBondContact O-N 2.81Å; L322-F325 PolarHBondContact O-N 2.81Å; G323-F325 VanDerWaalsContact C-N 3.33Å; G323-F325 PolarHBondContact O-N 3.12Å; F325-K328 PolarHBondContact O-N 3.29Å; F325-N329 WeakPolarHBondContact CD2-ND2 3.38Å; F325-N329 HydrophobicContact CE2-CB 4.32Å; F325-N329 VanDerWaalsContact CE2-ND2 3.27Å; F325-N329 WeakPolarHBondContact CE2-ND2 3.44Å; F325-N329 HydrophobicContact CZ-CB 4.46Å; F325-N329 WeakPolarHBondContact O-CB 3.38Å; F325-N329 PolarHBondContact O-N 3.02Å; F325-N329 PolarHBondContact O-ND2 3.25Å; F325-L333 HydrophobicContact CZ-CD2 4.07Å; F325-F349 HydrophobicContact CD2-CE1 4.3Å; F325-F349 AromaticContact CD2-CZ 3.95Å; F325-F349 HydrophobicContact CD2-CZ 3.95Å; F325-F349 HydrophobicContact CE2-CD1 4.18Å; F325-F349 AromaticContact CE2-CE1 3.45Å; F325-F349 HydrophobicContact CE2-CE1 3.45Å; F325-F349 VanDerWaalsContact CE2-CE1 3.45Å; F325-F349 AromaticContact CE2-CE2 3.89Å; F325-F349 HydrophobicContact CE2-CE2 3.89Å; F325-F349 AromaticContact CE2-CZ 3.31Å; F325-F349 HydrophobicContact CE2-CZ 3.31Å; F325-F349 HydrophobicContact CZ-CD1 4.44Å; F325-F349 HydrophobicContact CZ-CE1 4.05Å; F325-F349 HydrophobicContact CZ-CZ 4.3Å; F325-R361 HydrophobicContact CB-CG 4.47Å; F325-R361 HydrophobicContact CD1-CB 3.61Å; F325-R361 HydrophobicContact CD1-CG 4.23Å; F325-R361 HydrophobicContact CD2-CB 4.45Å; F325-R361 VanDerWaalsContact CE1-C 3.46Å; F325-R361 HydrophobicContact CE1-CB 3.75Å; F325-R361 VanDerWaalsContact CE1-O 3.22Å; F325-R361 WeakPolarHBondContact CE1-O 3.27Å; F325-R361 HydrophobicContact CG-CB 3.98Å; F325-R361 HydrophobicContact CG-CG 4.3Å; F325-R361 HydrophobicContact CZ-CB 4.27Å; F325-V362 HydrophobicContact CZ-CG2 4.03Å; F325-L365 HydrophobicContact CE1-CB 3.76Å; F325-L365 HydrophobicContact CE1-CD2 3.95Å; F325-L365 HydrophobicContact CE1-CG 4.44Å; F325-L365 HydrophobicContact CZ-CD2 4.03Å
326	I	98.6	Very high	97.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.2	-50.4	-179.1	-68.5	170.7	0	0	0	110.3	T294 A297 L322 G323 K328 N329 R330 Y368	T294-I326 HydrophobicContact CG2-CD1 3.95Å; A297-I326 HydrophobicContact CB-CB 4.04Å; A297-I326 HydrophobicContact CB-CD1 4.34Å; A297-I326 HydrophobicContact CB-CG2 3.72Å; L322-I326 HydrophobicContact CD1-CD1 3.81Å; L322-I326 HydrophobicContact CD1-CG1 4.15Å; L322-I326 HydrophobicContact CG-CD1 4.11Å; L322-I326 WeakPolarHBondContact O-CG1 3.44Å; L322-I326 PolarHBondContact O-N 2.92Å; G323-I326 PolarHBondContact O-N 2.85Å; I326-K328 PolarHBondContact O-N 3.01Å; I326-N329 PolarHBondContact O-N 3.06Å; I326-R330 HydrophobicContact CG2-CB 4.43Å; I326-R330 WeakPolarHBondContact O-CB 3.26Å; I326-R330 WeakPolarHBondContact O-CG 3.31Å; I326-R330 PolarHBondContact O-N 3.1Å; I326-Y368 HydrophobicContact CG2-CD1 4.47Å; I326-Y368 HydrophobicContact CG2-CD2 3.56Å; I326-Y368 HydrophobicContact CG2-CE2 3.72Å; I326-Y368 HydrophobicContact CG2-CG 3.97Å
327	V	98.4	Very high	96.6	Very high	17 Å²	17	61.3 Å²	61.3	10%	0.103	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-37.4	-177.9	175.1	0	0	0	0	111.5	A297 F300 Q303 V306 G323	A297-V327 HydrophobicContact CB-CG2 4.34Å; F300-V327 HydrophobicContact CB-CG2 3.81Å; F300-V327 HydrophobicContact CD2-CG2 4.19Å; Q303-V327 HydrophobicContact CG-CB 4.41Å; Q303-V327 HydrophobicContact CG-CG1 4.07Å; V306-V327 HydrophobicContact CG2-CG2 4.08Å; G323-V327 VanDerWaalsContact O-CG2 3.31Å; G323-V327 WeakPolarHBondContact O-CG2 3.26Å; G323-V327 PolarHBondContact O-N 3.47Å
328	K	98.2	Very high	95.8	Very high	128 Å²	128	61.1 Å²	61.1	56%	0.557	31%	0.307	S	S	*	.	H	α-helix	trans	-68.8	-45.2	176.7	-179.2	179.7	175.2	-178.1	0	112.8	L324 F325 I326	L324-K328 WeakPolarHBondContact O-CB 3.27Å; L324-K328 PolarHBondContact O-N 3.44Å; F325-K328 PolarHBondContact O-N 3.29Å; I326-K328 PolarHBondContact O-N 3.01Å
329	N	98.1	Very high	95	Very high	21 Å²	21	58.3 Å²	58.3	11%	0.112	30%	0.299	C	S	.	.	H	α-helix	trans	-104.7	-10.2	-164.2	-61	-75.1	0	0	0	114.3	F325 I326 K331 D332 L333 L365	F325-N329 WeakPolarHBondContact CD2-ND2 3.38Å; F325-N329 HydrophobicContact CE2-CB 4.32Å; F325-N329 VanDerWaalsContact CE2-ND2 3.27Å; F325-N329 WeakPolarHBondContact CE2-ND2 3.44Å; F325-N329 HydrophobicContact CZ-CB 4.46Å; F325-N329 WeakPolarHBondContact O-CB 3.38Å; F325-N329 PolarHBondContact O-N 3.02Å; F325-N329 PolarHBondContact O-ND2 3.25Å; I326-N329 PolarHBondContact O-N 3.06Å; N329-K331 PolarHBondContact O-N 2.7Å; N329-D332 PolarHBondContact O-N 2.86Å; N329-L333 HydrophobicContact CB-CB 3.91Å; N329-L333 HydrophobicContact CB-CD2 4.39Å; N329-L333 PolarHBondContact O-N 3.26Å; N329-L365 HydrophobicContact CB-CD2 4.17Å
330	R	97.7	Very high	94.2	Very high	29 Å²	29	63 Å²	63	11%	0.109	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.7	-173.1	63	179.4	175	-174.3	-2.9	116.2	A297 F300 K301 I326 L365 Y368 Q369	A297-R330 PolarHBondContact O-NH1 3Å; F300-R330 PolarHBondContact O-NH1 3.48Å; F300-R330 VanDerWaalsContact O-NH1 3.09Å; F300-R330 PolarHBondContact O-NH2 3.03Å; K301-R330 PolarHBondContact O-NH2 3.24Å; I326-R330 HydrophobicContact CG2-CB 4.43Å; I326-R330 WeakPolarHBondContact O-CB 3.26Å; I326-R330 WeakPolarHBondContact O-CG 3.31Å; I326-R330 PolarHBondContact O-N 3.1Å; R330-L365 HydrophobicContact CB-CD1 4.05Å; R330-Y368 HydrophobicContact CB-CD1 4.2Å; R330-Y368 HydrophobicContact CB-CE1 3.87Å; R330-Y368 VanDerWaalsContact CD-OH 3.3Å; R330-Y368 WeakPolarHBondContact CD-OH 3.39Å; R330-Y368 HydrophobicContact CG-CE1 4.43Å; R330-Y368 PolarHBondContact NH1-OH 3.04Å; R330-Q369 PolarHBondContact O-NE2 3.27Å
331	K	96.5	Very high	93.6	Very high	163 Å²	163	62.2 Å²	62.2	71%	0.709	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-32	179.7	-59.1	-172.6	179.8	-178.9	0	113.5	N329	N329-K331 PolarHBondContact O-N 2.7Å
332	D	96.4	Very high	93.3	Very high	135 Å²	135	62 Å²	62	72%	0.722	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-34.9	-167.8	-56.6	-30.5	0	0	0	112.3	N329 I334	N329-D332 PolarHBondContact O-N 2.86Å; D332-I334 PolarHBondContact O-N 2.97Å
333	L	96.6	Very high	93	Very high	18 Å²	18	61.9 Å²	61.9	9%	0.094	34%	0.335	C	S	.	.	S	Bend	trans	-89.5	80.8	176.5	-174.8	58.7	0	0	0	109.3	F325 N329 P345 Y346 F349 L365 Q369	F325-L333 HydrophobicContact CZ-CD2 4.07Å; N329-L333 HydrophobicContact CB-CB 3.91Å; N329-L333 HydrophobicContact CB-CD2 4.39Å; N329-L333 PolarHBondContact O-N 3.26Å; L333-P345 HydrophobicContact CD1-CB 4.09Å; L333-P345 WeakPolarHBondContact CD1-O 3.08Å; L333-Y346 HydrophobicContact CD1-CD1 4.23Å; L333-Y346 HydrophobicContact CD2-CD1 4.22Å; L333-Y346 HydrophobicContact CG-CD1 3.84Å; L333-Y346 HydrophobicContact CG-CE1 4.03Å; L333-Y346 WeakPolarHBondContact O-CE1 3.26Å; L333-F349 HydrophobicContact CD1-CB 4.23Å; L333-F349 HydrophobicContact CD2-CB 4.03Å; L333-F349 HydrophobicContact CD2-CD1 4.44Å; L333-F349 HydrophobicContact CD2-CD2 4.06Å; L333-F349 HydrophobicContact CD2-CG 3.89Å; L333-L365 HydrophobicContact CB-CD2 4.04Å; L333-L365 HydrophobicContact CD2-CD2 3.75Å; L333-L365 HydrophobicContact CG-CD2 4.02Å; L333-Q369 PolarHBondContact O-NE2 2.83Å
334	I	96.9	Very high	92.7	Very high	89 Å²	89	63.8 Å²	63.8	46%	0.456	34%	0.343	S	S	.	.			trans	-118	162.8	-179.6	60.4	173	0	0	0	110.8	D332 P345 Y346	D332-I334 PolarHBondContact O-N 2.97Å; I334-P345 WeakPolarHBondContact O-CB 3.37Å; I334-P345 WeakPolarHBondContact O-CG 3.26Å; I334-Y346 WeakPolarHBondContact CA-OH 3.43Å
335	K	94.6	Very high	92.5	Very high	79 Å²	79	63.6 Å²	63.6	34%	0.343	35%	0.345	S	S	.	.			trans	-57.4	146.8	174.6	67.7	-177.8	171.2	-153.2	0	111.9	T337 P342 Y346 E371 L374	K335-T337 PolarHBondContact O-N 3.41Å; K335-P342 WeakPolarHBondContact CA-O 3.33Å; K335-P342 HydrophobicContact CB-CB 4.31Å; K335-Y346 HydrophobicContact CB-CE2 4.08Å; K335-Y346 PolarHBondContact N-OH 2.96Å; K335-Y346 VanDerWaalsContact N-OH 3.08Å; K335-E371 WeakPolarHBondContact CD-OE1 3.4Å; K335-E371 WeakPolarHBondContact CE-OE1 3.42Å; K335-E371 IonicContact NZ-OE1 2.76Å; K335-E371 PolarHBondContact NZ-OE1 2.88Å; K335-E371 IonicContact NZ-OE2 3.98Å; K335-E371 PolarHBondContact NZ-OE2 3.45Å; K335-L374 HydrophobicContact CB-CD1 3.76Å; K335-L374 HydrophobicContact CD-CD1 4.22Å
336	A	91.8	Very high	92.3	Very high	28 Å²	28	63.2 Å²	63.2	23%	0.231	34%	0.343	C	S	.	.			trans	-74	122.7	171.7	0	0	0	0	0	109.8	P342 P345	A336-P342 PolarHBondContact N-O 3.01Å; A336-P345 HydrophobicContact CB-CG 4Å
337	T	83.6	Confident	92	Very high	112 Å²	112	63.9 Å²	63.9	69%	0.687	35%	0.346	S	S	*	.	S	Bend	trans	-82.3	-17.9	-173.3	47.4	0	0	0	0	114.5	K335	K335-T337 PolarHBondContact O-N 3.41Å
338	D	79.3	Confident	91.6	Very high	159 Å²	159	64.4 Å²	64.4	85%	0.85	35%	0.348	S	S	*	.	S	Bend	trans	-134	28.9	-173.9	-56.3	-72.2	0	0	0	112.4
339	S	79.9	Confident	91.4	Very high	48 Å²	48	60.7 Å²	60.7	34%	0.336	33%	0.332	S	S	.	.	S	Bend	trans	-112.4	148.8	-177.9	177.5	0	0	0	0	110.9	D341	S339-D341 PolarHBondContact O-N 2.7Å; S339-D341 PolarHBondContact OG-N 2.76Å; S339-D341 PolarHBondContact OG-O 3.06Å
340	S	80.8	Confident	91	Very high	135 Å²	135	60 Å²	60	94%	0.944	33%	0.329	S	S	*	.	S	Bend	trans	-62.6	-18.1	167.6	55.7	0	0	0	0	112.9
341	D	85.9	Confident	90.6	Very high	38 Å²	38	60 Å²	60	20%	0.203	33%	0.33	C	S	.	.			trans	-128.6	97.3	175.4	-178.6	-0.8	0	0	0	110	S339 L343 K344 Q347	S339-D341 PolarHBondContact O-N 2.7Å; S339-D341 PolarHBondContact OG-N 2.76Å; S339-D341 PolarHBondContact OG-O 3.06Å; D341-L343 PolarHBondContact O-N 2.9Å; D341-L343 WeakPolarHBondContact OD1-CA 2.99Å; D341-L343 VanDerWaalsContact OD1-CB 3.26Å; D341-L343 WeakPolarHBondContact OD1-CB 3.46Å; D341-L343 PolarHBondContact OD1-N 3.05Å; D341-K344 HydrophobicContact CB-CB 4.14Å; D341-K344 WeakPolarHBondContact O-CB 3.44Å; D341-K344 PolarHBondContact O-N 3.26Å; D341-K344 PolarHBondContact OD1-N 3.08Å; D341-K344 VanDerWaalsContact OD1-N 3.13Å; D341-Q347 PolarHBondContact OD2-OE1 2.73Å
342	P	92.3	Very high	90.1	Very high	48 Å²	48	56.8 Å²	56.8	31%	0.312	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-22.4	174.6	-22.6	34.6	0	0	0	113.7	K335 A336 K344 P345 L374	K335-P342 WeakPolarHBondContact CA-O 3.33Å; K335-P342 HydrophobicContact CB-CB 4.31Å; A336-P342 PolarHBondContact N-O 3.01Å; P342-K344 VanDerWaalsContact C-N 3.34Å; P342-P345 WeakPolarHBondContact O-CD 3.46Å; P342-L374 HydrophobicContact CB-CD1 4.47Å; P342-L374 HydrophobicContact CB-CD2 4.22Å
343	L	93	Very high	89.4	Confident	4 Å²	4	52 Å²	52	2%	0.021	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-17.6	-176.9	-161.4	65.8	0	0	0	112.3	D341 P345 Y346 Q347 L374 E377 M378	D341-L343 PolarHBondContact O-N 2.9Å; D341-L343 WeakPolarHBondContact OD1-CA 2.99Å; D341-L343 VanDerWaalsContact OD1-CB 3.26Å; D341-L343 WeakPolarHBondContact OD1-CB 3.46Å; D341-L343 PolarHBondContact OD1-N 3.05Å; L343-P345 VanDerWaalsContact C-CD 3.47Å; L343-Y346 HydrophobicContact CD1-CD2 4.09Å; L343-Y346 WeakPolarHBondContact O-CB 3.34Å; L343-Y346 PolarHBondContact O-N 2.85Å; L343-Q347 HydrophobicContact CD2-CG 4.36Å; L343-Q347 HydrophobicContact CG-CG 4.16Å; L343-Q347 PolarHBondContact O-N 3.33Å; L343-Q347 VanDerWaalsContact O-N 3.11Å; L343-L374 HydrophobicContact CD1-CB 3.85Å; L343-L374 HydrophobicContact CD1-CD2 4.21Å; L343-L374 HydrophobicContact CD1-CG 4.42Å; L343-E377 HydrophobicContact CD2-CB 4.01Å; L343-M378 HydrophobicContact CD1-CB 4.27Å; L343-M378 HydrophobicContact CD1-CE 3.72Å; L343-M378 HydrophobicContact CD2-CB 4.49Å; L343-M378 HydrophobicContact CD2-CE 3.96Å; L343-M378 HydrophobicContact CG-CE 3.68Å
344	K	90.7	Very high	88.3	Confident	40 Å²	40	59.9 Å²	59.9	17%	0.174	33%	0.326	C	S	.	.	H	α-helix	trans	-47	-46.5	-175.8	-166.1	-174.6	-172.9	-46	0	115	D341 P342 Y346 Q347 D348 K416	D341-K344 HydrophobicContact CB-CB 4.14Å; D341-K344 WeakPolarHBondContact O-CB 3.44Å; D341-K344 PolarHBondContact O-N 3.26Å; D341-K344 PolarHBondContact OD1-N 3.08Å; D341-K344 VanDerWaalsContact OD1-N 3.13Å; P342-K344 VanDerWaalsContact C-N 3.34Å; K344-Y346 PolarHBondContact O-N 2.92Å; K344-Q347 PolarHBondContact O-N 3.39Å; K344-D348 IonicContact NZ-OD1 3.93Å; K344-D348 PolarHBondContact NZ-OD1 3.5Å; K344-D348 IonicContact NZ-OD2 2.72Å; K344-D348 PolarHBondContact NZ-OD2 2.88Å; K344-D348 VanDerWaalsContact O-CB 3.26Å; K344-D348 WeakPolarHBondContact O-CB 3.44Å; K344-D348 PolarHBondContact O-N 2.66Å; K344-K416 VanDerWaalsContact CE-O 3.23Å; K344-K416 WeakPolarHBondContact CE-O 3.38Å; K344-K416 PolarHBondContact NZ-O 2.82Å; K344-K416 VanDerWaalsContact NZ-O 3.12Å
345	P	94.2	Very high	87.5	Confident	35 Å²	35	60.2 Å²	60.2	23%	0.227	33%	0.326	C	S	.	.	H	α-helix	trans	-59.1	-36.1	179.4	-25.6	37.2	0	0	0	113.1	L333 I334 A336 P342 L343 F349	L333-P345 HydrophobicContact CD1-CB 4.09Å; L333-P345 WeakPolarHBondContact CD1-O 3.08Å; I334-P345 WeakPolarHBondContact O-CB 3.37Å; I334-P345 WeakPolarHBondContact O-CG 3.26Å; A336-P345 HydrophobicContact CB-CG 4Å; P342-P345 WeakPolarHBondContact O-CD 3.46Å; L343-P345 VanDerWaalsContact C-CD 3.47Å; P345-F349 PolarHBondContact O-N 3.39Å; P345-F349 VanDerWaalsContact O-N 3.08Å
346	Y	94.7	Very high	86.7	Confident	1 Å²	1	63 Å²	63	0%	0.004	35%	0.352	C	S	.	.	H	α-helix	trans	-73.8	-40.6	178.5	-55.1	-81	0	0	0	112	L333 I334 K335 L343 K344 F349 I350 V362 L365 L366 Q369 L374	L333-Y346 HydrophobicContact CD1-CD1 4.23Å; L333-Y346 HydrophobicContact CD2-CD1 4.22Å; L333-Y346 HydrophobicContact CG-CD1 3.84Å; L333-Y346 HydrophobicContact CG-CE1 4.03Å; L333-Y346 WeakPolarHBondContact O-CE1 3.26Å; I334-Y346 WeakPolarHBondContact CA-OH 3.43Å; K335-Y346 HydrophobicContact CB-CE2 4.08Å; K335-Y346 PolarHBondContact N-OH 2.96Å; K335-Y346 VanDerWaalsContact N-OH 3.08Å; L343-Y346 HydrophobicContact CD1-CD2 4.09Å; L343-Y346 WeakPolarHBondContact O-CB 3.34Å; L343-Y346 PolarHBondContact O-N 2.85Å; K344-Y346 PolarHBondContact O-N 2.92Å; Y346-F349 WeakPolarHBondContact O-CB 3.39Å; Y346-F349 PolarHBondContact O-N 3Å; Y346-I350 WeakPolarHBondContact O-CG1 3.39Å; Y346-I350 PolarHBondContact O-N 3.5Å; Y346-I350 VanDerWaalsContact O-N 3.1Å; Y346-V362 HydrophobicContact CD1-CG1 3.98Å; Y346-V362 HydrophobicContact CG-CG1 4.25Å; Y346-L365 HydrophobicContact CE1-CD2 4.43Å; Y346-L366 HydrophobicContact CD1-CD2 4.05Å; Y346-L366 HydrophobicContact CD1-CG 4.41Å; Y346-L366 HydrophobicContact CD2-CD2 4.19Å; Y346-L366 HydrophobicContact CE1-CD2 3.61Å; Y346-L366 HydrophobicContact CE1-CG 4.26Å; Y346-L366 HydrophobicContact CE2-CD2 3.76Å; Y346-L366 HydrophobicContact CG-CD2 4.31Å; Y346-L366 VanDerWaalsContact CZ-CD2 3.44Å; Y346-Q369 PolarHBondContact OH-OE1 3.4Å; Y346-L374 HydrophobicContact CE2-CD1 4.22Å
347	Q	91.9	Very high	86.6	Confident	14 Å²	14	63.7 Å²	63.7	7%	0.065	35%	0.352	C	S	.	.	H	α-helix	trans	-63.7	-43.4	174	-63.4	169.7	-9.4	0	0	111.4	D341 L343 K344 F349 I350 I351 M378 W381 Y420	D341-Q347 PolarHBondContact OD2-OE1 2.73Å; L343-Q347 HydrophobicContact CD2-CG 4.36Å; L343-Q347 HydrophobicContact CG-CG 4.16Å; L343-Q347 PolarHBondContact O-N 3.33Å; L343-Q347 VanDerWaalsContact O-N 3.11Å; K344-Q347 PolarHBondContact O-N 3.39Å; Q347-F349 VanDerWaalsContact C-N 3.3Å; Q347-F349 PolarHBondContact O-N 3.31Å; Q347-I350 PolarHBondContact O-N 2.86Å; Q347-I350 VanDerWaalsContact O-N 3.16Å; Q347-I351 PolarHBondContact O-N 3.06Å; Q347-M378 HydrophobicContact CG-CE 4.23Å; Q347-W381 HydrophobicContact CB-CH2 3.73Å; Q347-W381 HydrophobicContact CB-CZ2 3.92Å; Q347-W381 HydrophobicContact CB-CZ3 4.26Å; Q347-W381 HydrophobicContact CG-CD2 4.25Å; Q347-W381 HydrophobicContact CG-CE3 4.36Å; Q347-W381 HydrophobicContact CG-CH2 3.94Å; Q347-W381 HydrophobicContact CG-CZ2 3.84Å; Q347-W381 HydrophobicContact CG-CZ3 4.21Å; Q347-Y420 HydrophobicContact CB-CD2 4.31Å; Q347-Y420 HydrophobicContact CB-CE2 3.64Å
348	D	90.6	Very high	87	Confident	29 Å²	29	58.3 Å²	58.3	16%	0.155	32%	0.319	C	S	.	.	H	α-helix	trans	-53.1	-47.9	173.2	-73.8	-5.4	0	0	0	110.6	K344 D352 K416 Y420	K344-D348 IonicContact NZ-OD1 3.93Å; K344-D348 PolarHBondContact NZ-OD1 3.5Å; K344-D348 IonicContact NZ-OD2 2.72Å; K344-D348 PolarHBondContact NZ-OD2 2.88Å; K344-D348 VanDerWaalsContact O-CB 3.26Å; K344-D348 WeakPolarHBondContact O-CB 3.44Å; K344-D348 PolarHBondContact O-N 2.66Å; D348-D352 VanDerWaalsContact O-CB 3.27Å; D348-D352 WeakPolarHBondContact O-CB 3.43Å; D348-D352 PolarHBondContact O-N 3.17Å; D348-K416 VanDerWaalsContact CB-CE 3.41Å; D348-K416 WeakPolarHBondContact OD1-CE 3.46Å; D348-K416 WeakPolarHBondContact OD1-CG 3.4Å; D348-K416 WeakPolarHBondContact OD2-CE 3.46Å; D348-K416 IonicContact OD2-NZ 2.63Å; D348-Y420 WeakPolarHBondContact CA-OH 3.36Å; D348-Y420 PolarHBondContact N-OH 2.93Å; D348-Y420 PolarHBondContact OD1-OH 2.92Å
349	F	93.1	Very high	87.8	Confident	50 Å²	50	52.6 Å²	52.6	22%	0.219	29%	0.29	C	S	.	.	H	α-helix	trans	-60.1	-47	176.2	-177.9	-87	0	0	0	112.9	F325 L333 P345 Y346 Q347 D352 S353 A358 V362	F325-F349 HydrophobicContact CD2-CE1 4.3Å; F325-F349 AromaticContact CD2-CZ 3.95Å; F325-F349 HydrophobicContact CD2-CZ 3.95Å; F325-F349 HydrophobicContact CE2-CD1 4.18Å; F325-F349 AromaticContact CE2-CE1 3.45Å; F325-F349 HydrophobicContact CE2-CE1 3.45Å; F325-F349 VanDerWaalsContact CE2-CE1 3.45Å; F325-F349 AromaticContact CE2-CE2 3.89Å; F325-F349 HydrophobicContact CE2-CE2 3.89Å; F325-F349 AromaticContact CE2-CZ 3.31Å; F325-F349 HydrophobicContact CE2-CZ 3.31Å; F325-F349 HydrophobicContact CZ-CD1 4.44Å; F325-F349 HydrophobicContact CZ-CE1 4.05Å; F325-F349 HydrophobicContact CZ-CZ 4.3Å; L333-F349 HydrophobicContact CD1-CB 4.23Å; L333-F349 HydrophobicContact CD2-CB 4.03Å; L333-F349 HydrophobicContact CD2-CD1 4.44Å; L333-F349 HydrophobicContact CD2-CD2 4.06Å; L333-F349 HydrophobicContact CD2-CG 3.89Å; P345-F349 PolarHBondContact O-N 3.39Å; P345-F349 VanDerWaalsContact O-N 3.08Å; Y346-F349 WeakPolarHBondContact O-CB 3.39Å; Y346-F349 PolarHBondContact O-N 3Å; Q347-F349 VanDerWaalsContact C-N 3.3Å; Q347-F349 PolarHBondContact O-N 3.31Å; F349-D352 PolarHBondContact O-N 3.48Å; F349-S353 VanDerWaalsContact O-CB 3.3Å; F349-S353 WeakPolarHBondContact O-CB 3.34Å; F349-S353 PolarHBondContact O-N 3.34Å; F349-S353 PolarHBondContact O-OG 3.32Å; F349-A358 HydrophobicContact CE1-CB 4.47Å; F349-V362 HydrophobicContact CD1-CG2 3.7Å; F349-V362 HydrophobicContact CE1-CG2 4.31Å
350	I	91.6	Very high	88.5	Confident	7 Å²	7	53.1 Å²	53.1	4%	0.036	29%	0.291	C	S	.	.	H	α-helix	trans	-62.2	-48.3	-177.5	-69.2	167.3	0	0	0	110.6	Y346 Q347 S353 R354 A358 T359 V362 M378 W381 I383	Y346-I350 WeakPolarHBondContact O-CG1 3.39Å; Y346-I350 PolarHBondContact O-N 3.5Å; Y346-I350 VanDerWaalsContact O-N 3.1Å; Q347-I350 PolarHBondContact O-N 2.86Å; Q347-I350 VanDerWaalsContact O-N 3.16Å; I350-S353 PolarHBondContact O-OG 3.38Å; I350-R354 PolarHBondContact O-N 3.31Å; I350-A358 HydrophobicContact CG1-CB 4.28Å; I350-A358 HydrophobicContact CG2-CB 4.39Å; I350-T359 HydrophobicContact CD1-CG2 4.38Å; I350-V362 HydrophobicContact CD1-CB 4.12Å; I350-V362 HydrophobicContact CD1-CG1 4.14Å; I350-V362 HydrophobicContact CD1-CG2 4.18Å; I350-V362 HydrophobicContact CG1-CB 4.32Å; I350-V362 HydrophobicContact CG1-CG2 3.85Å; I350-M378 HydrophobicContact CD1-CE 3.91Å; I350-M378 HydrophobicContact CD1-SD 3.36Å; I350-M378 WeakPolarHBondContact CD1-SD 3.37Å; I350-W381 HydrophobicContact CB-CZ3 4.1Å; I350-W381 HydrophobicContact CD1-CE3 4.33Å; I350-W381 HydrophobicContact CD1-CZ3 3.88Å; I350-W381 HydrophobicContact CG2-CZ3 3.97Å; I350-I383 HydrophobicContact CG2-CD1 3.59Å; I350-I383 HydrophobicContact CG2-CG1 4.04Å
351	I	87.5	Confident	89.3	Confident	28 Å²	28	47.8 Å²	47.8	14%	0.144	25%	0.25	C	S	.	.	H	α-helix	trans	-68.4	-37.2	-176.9	-76.6	169.9	0	0	0	111.9	Q347 W381 I383 W415 Y420	Q347-I351 PolarHBondContact O-N 3.06Å; I351-W381 HydrophobicContact CD1-CH2 3.59Å; I351-W381 HydrophobicContact CD1-CZ2 3.85Å; I351-W381 HydrophobicContact CG1-CH2 3.93Å; I351-I383 HydrophobicContact CD1-CG2 4.42Å; I351-I383 HydrophobicContact CG1-CG2 3.99Å; I351-W415 HydrophobicContact CD1-CH2 4.14Å; I351-W415 HydrophobicContact CD1-CZ3 4.23Å; I351-W415 HydrophobicContact CG2-CZ3 4.16Å; I351-Y420 HydrophobicContact CB-CE1 4.3Å; I351-Y420 HydrophobicContact CD1-CD1 3.44Å; I351-Y420 VanDerWaalsContact CD1-CD1 3.44Å; I351-Y420 HydrophobicContact CD1-CD2 3.93Å; I351-Y420 HydrophobicContact CD1-CE1 3.19Å; I351-Y420 HydrophobicContact CD1-CE2 3.72Å; I351-Y420 HydrophobicContact CD1-CG 3.76Å; I351-Y420 HydrophobicContact CG1-CE1 4.29Å; I351-Y420 HydrophobicContact CG2-CE1 4.06Å
352	D	85.8	Confident	89.9	Confident	95 Å²	95	46 Å²	46	51%	0.508	24%	0.241	S	C	.	.	H	α-helix	trans	-75.1	-36.8	-179.3	-69.4	-15.1	0	0	0	112.4	D348 F349 R354 K416	D348-D352 VanDerWaalsContact O-CB 3.27Å; D348-D352 WeakPolarHBondContact O-CB 3.43Å; D348-D352 PolarHBondContact O-N 3.17Å; F349-D352 PolarHBondContact O-N 3.48Å; D352-R354 PolarHBondContact O-N 2.94Å; D352-K416 IonicContact OD1-NZ 3.67Å; D352-K416 IonicContact OD2-NZ 3.12Å; D352-K416 PolarHBondContact OD2-NZ 2.94Å
353	S	83.3	Confident	90.1	Very high	35 Å²	35	44.2 Å²	44.2	25%	0.245	23%	0.229	C	C	.	.	H	α-helix	trans	-65.8	-36.3	-178	70.3	0	0	0	0	113	F349 I350 E355 A358	F349-S353 VanDerWaalsContact O-CB 3.3Å; F349-S353 WeakPolarHBondContact O-CB 3.34Å; F349-S353 PolarHBondContact O-N 3.34Å; F349-S353 PolarHBondContact O-OG 3.32Å; I350-S353 PolarHBondContact O-OG 3.38Å; S353-E355 PolarHBondContact O-N 3.29Å; S353-E355 VanDerWaalsContact O-N 3.09Å; S353-E355 PolarHBondContact OG-N 3.35Å; S353-A358 WeakPolarHBondContact OG-CB 3.35Å
354	R	73.4	Confident	90.4	Very high	184 Å²	184	44.4 Å²	44.4	69%	0.694	23%	0.23	S	C	*	.			trans	54.4	19.2	-172.1	-52.7	-179.2	-176.5	177.5	3.8	114	I350 D352	I350-R354 PolarHBondContact O-N 3.31Å; D352-R354 PolarHBondContact O-N 2.94Å
355	E	80.7	Confident	90.8	Very high	95 Å²	95	42.5 Å²	42.5	44%	0.444	22%	0.222	S	C	.	.			trans	-88.4	131.7	178	-66.6	-176.4	150.8	0	0	109.1	S353 D357 A358 R361	S353-E355 PolarHBondContact O-N 3.29Å; S353-E355 VanDerWaalsContact O-N 3.09Å; S353-E355 PolarHBondContact OG-N 3.35Å; E355-D357 WeakPolarHBondContact CB-OD1 3.08Å; E355-D357 PolarHBondContact O-N 3.21Å; E355-D357 VanDerWaalsContact O-N 3.12Å; E355-A358 HydrophobicContact CB-CB 4.43Å; E355-A358 VanDerWaalsContact O-CB 3.26Å; E355-A358 WeakPolarHBondContact O-CB 3.2Å; E355-A358 PolarHBondContact O-N 3.47Å; E355-A358 VanDerWaalsContact O-N 3.08Å; E355-R361 VanDerWaalsContact CB-NH2 3.33Å; E355-R361 IonicContact OE2-CZ 3.98Å; E355-R361 IonicContact OE2-NH1 3.73Å; E355-R361 PolarHBondContact OE2-NH1 3.45Å; E355-R361 IonicContact OE2-NH2 2.85Å; E355-R361 PolarHBondContact OE2-NH2 2.9Å
356	P	77.4	Confident	91	Very high	137 Å²	137	40.8 Å²	40.8	89%	0.89	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.9	-174.7	24.4	-33.5	0	0	0	113.6
357	D	89.1	Confident	91.2	Very high	43 Å²	43	41.5 Å²	41.5	23%	0.23	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	7.2	179.4	68	-21.3	0	0	0	113.4	E355 T360 R361	E355-D357 WeakPolarHBondContact CB-OD1 3.08Å; E355-D357 PolarHBondContact O-N 3.21Å; E355-D357 VanDerWaalsContact O-N 3.12Å; D357-T360 PolarHBondContact O-N 2.83Å; D357-R361 PolarHBondContact O-N 2.84Å; D357-R361 VanDerWaalsContact O-N 3.12Å; D357-R361 PolarHBondContact O-NE 2.97Å; D357-R361 IonicContact OD1-CZ 3.35Å; D357-R361 IonicContact OD1-NE 3.7Å; D357-R361 IonicContact OD1-NH2 2.77Å; D357-R361 PolarHBondContact OD1-NH2 3.2Å; D357-R361 IonicContact OD2-CZ 3.59Å; D357-R361 IonicContact OD2-NE 2.71Å; D357-R361 PolarHBondContact OD2-NE 3.12Å; D357-R361 IonicContact OD2-NH2 3.83Å
358	A	92.9	Very high	91.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.7	-45.3	-177.4	0	0	0	0	0	112.3	F349 I350 S353 E355 T360 R361 V362	F349-A358 HydrophobicContact CE1-CB 4.47Å; I350-A358 HydrophobicContact CG1-CB 4.28Å; I350-A358 HydrophobicContact CG2-CB 4.39Å; S353-A358 WeakPolarHBondContact OG-CB 3.35Å; E355-A358 HydrophobicContact CB-CB 4.43Å; E355-A358 VanDerWaalsContact O-CB 3.26Å; E355-A358 WeakPolarHBondContact O-CB 3.2Å; E355-A358 PolarHBondContact O-N 3.47Å; E355-A358 VanDerWaalsContact O-N 3.08Å; A358-T360 VanDerWaalsContact C-N 3.32Å; A358-T360 PolarHBondContact O-N 3.1Å; A358-R361 PolarHBondContact O-N 3.11Å; A358-V362 WeakPolarHBondContact O-CG2 3.42Å; A358-V362 PolarHBondContact O-N 3.22Å
359	T	94.3	Very high	91.9	Very high	38 Å²	38	41.3 Å²	41.3	23%	0.233	21%	0.212	C	C	.	.	H	α-helix	trans	-59.2	-43.2	177.9	-52.6	0	0	0	0	111.6	I350 R361 V362 C363	I350-T359 HydrophobicContact CD1-CG2 4.38Å; T359-R361 PolarHBondContact O-N 2.93Å; T359-V362 PolarHBondContact O-N 2.97Å; T359-C363 WeakPolarHBondContact O-CB 3.29Å; T359-C363 PolarHBondContact O-N 2.7Å; T359-C363 PolarHBondContact O-SG 3.03Å
360	T	95.8	Very high	92.1	Very high	60 Å²	60	39.9 Å²	39.9	37%	0.368	21%	0.212	S	C	.	.	H	α-helix	trans	-60.4	-47.4	177.2	-58.4	0	0	0	0	111.2	D357 A358 C363 E364	D357-T360 PolarHBondContact O-N 2.83Å; A358-T360 VanDerWaalsContact C-N 3.32Å; A358-T360 PolarHBondContact O-N 3.1Å; T360-C363 PolarHBondContact O-N 2.98Å; T360-E364 WeakPolarHBondContact O-CG 3.43Å; T360-E364 PolarHBondContact O-N 3.19Å; T360-E364 VanDerWaalsContact O-N 3.09Å
361	R	97.3	Very high	92.4	Very high	22 Å²	22	41.5 Å²	41.5	8%	0.083	22%	0.219	C	C	.	.	H	α-helix	trans	-63.2	-42.9	178.5	-80	-179.7	-68.3	161.3	4.3	112.3	L322 F325 E355 D357 A358 T359 E364 L365	L322-R361 HydrophobicContact CD1-CB 4.44Å; L322-R361 HydrophobicContact CD1-CG 3.98Å; F325-R361 HydrophobicContact CB-CG 4.47Å; F325-R361 HydrophobicContact CD1-CB 3.61Å; F325-R361 HydrophobicContact CD1-CG 4.23Å; F325-R361 HydrophobicContact CD2-CB 4.45Å; F325-R361 VanDerWaalsContact CE1-C 3.46Å; F325-R361 HydrophobicContact CE1-CB 3.75Å; F325-R361 VanDerWaalsContact CE1-O 3.22Å; F325-R361 WeakPolarHBondContact CE1-O 3.27Å; F325-R361 HydrophobicContact CG-CB 3.98Å; F325-R361 HydrophobicContact CG-CG 4.3Å; F325-R361 HydrophobicContact CZ-CB 4.27Å; E355-R361 VanDerWaalsContact CB-NH2 3.33Å; E355-R361 IonicContact OE2-CZ 3.98Å; E355-R361 IonicContact OE2-NH1 3.73Å; E355-R361 PolarHBondContact OE2-NH1 3.45Å; E355-R361 IonicContact OE2-NH2 2.85Å; E355-R361 PolarHBondContact OE2-NH2 2.9Å; D357-R361 PolarHBondContact O-N 2.84Å; D357-R361 VanDerWaalsContact O-N 3.12Å; D357-R361 PolarHBondContact O-NE 2.97Å; D357-R361 IonicContact OD1-CZ 3.35Å; D357-R361 IonicContact OD1-NE 3.7Å; D357-R361 IonicContact OD1-NH2 2.77Å; D357-R361 PolarHBondContact OD1-NH2 3.2Å; D357-R361 IonicContact OD2-CZ 3.59Å; D357-R361 IonicContact OD2-NE 2.71Å; D357-R361 PolarHBondContact OD2-NE 3.12Å; D357-R361 IonicContact OD2-NH2 3.83Å; A358-R361 PolarHBondContact O-N 3.11Å; T359-R361 PolarHBondContact O-N 2.93Å; R361-E364 PolarHBondContact O-N 3Å; R361-L365 PolarHBondContact O-N 3.02Å
362	V	97.7	Very high	92.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.6	-43	176.2	166.7	0	0	0	0	111.7	F325 Y346 F349 I350 A358 T359 E364 L365 L366 M378	F325-V362 HydrophobicContact CZ-CG2 4.03Å; Y346-V362 HydrophobicContact CD1-CG1 3.98Å; Y346-V362 HydrophobicContact CG-CG1 4.25Å; F349-V362 HydrophobicContact CD1-CG2 3.7Å; F349-V362 HydrophobicContact CE1-CG2 4.31Å; I350-V362 HydrophobicContact CD1-CB 4.12Å; I350-V362 HydrophobicContact CD1-CG1 4.14Å; I350-V362 HydrophobicContact CD1-CG2 4.18Å; I350-V362 HydrophobicContact CG1-CB 4.32Å; I350-V362 HydrophobicContact CG1-CG2 3.85Å; A358-V362 WeakPolarHBondContact O-CG2 3.42Å; A358-V362 PolarHBondContact O-N 3.22Å; T359-V362 PolarHBondContact O-N 2.97Å; V362-E364 VanDerWaalsContact C-N 3.31Å; V362-E364 PolarHBondContact O-N 3.32Å; V362-L365 WeakPolarHBondContact O-CB 3.36Å; V362-L365 PolarHBondContact O-N 2.9Å; V362-L365 VanDerWaalsContact O-N 3.14Å; V362-L366 HydrophobicContact CG1-CD1 4.21Å; V362-L366 WeakPolarHBondContact O-CG 3.26Å; V362-L366 PolarHBondContact O-N 3.13Å; V362-M378 HydrophobicContact CG1-CE 3.93Å; V362-M378 HydrophobicContact CG1-CG 4.11Å; V362-M378 HydrophobicContact CG1-SD 4.27Å
363	C	98	Very high	93.2	Very high	11 Å²	11	43.7 Å²	43.7	7%	0.074	24%	0.235	C	C	.	.	H	α-helix	trans	-59.5	-42.5	175.1	-70.3	0	0	0	0	111.8	T359 T360 L365 L366 K367 L375	T359-C363 WeakPolarHBondContact O-CB 3.29Å; T359-C363 PolarHBondContact O-N 2.7Å; T359-C363 PolarHBondContact O-SG 3.03Å; T360-C363 PolarHBondContact O-N 2.98Å; C363-L365 VanDerWaalsContact C-N 3.33Å; C363-L366 PolarHBondContact O-N 3Å; C363-K367 WeakPolarHBondContact O-CG 3.46Å; C363-K367 PolarHBondContact O-N 2.77Å; C363-L375 HydrophobicContact CB-CD1 3.92Å; C363-L375 WeakPolarHBondContact O-CD1 3.28Å
364	E	98.6	Very high	93.8	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.037	23%	0.227	C	C	.	.	H	α-helix	trans	-66.5	-34.8	175.7	-69.4	-54.2	124.1	0	0	112.6	K291 T294 L322 T360 R361 V362 K367 Y368	K291-E364 HydrophobicContact CB-CG 4.43Å; K291-E364 WeakPolarHBondContact CB-OE2 3.32Å; K291-E364 HydrophobicContact CD-CG 4.03Å; K291-E364 HydrophobicContact CG-CG 4.23Å; K291-E364 PolarHBondContact N-OE2 3.49Å; T294-E364 WeakPolarHBondContact CB-OE2 3.45Å; T294-E364 HydrophobicContact CG2-CB 4.14Å; T294-E364 WeakPolarHBondContact CG2-O 3.32Å; T294-E364 WeakPolarHBondContact OG1-CB 3.26Å; T294-E364 PolarHBondContact OG1-OE2 3.28Å; L322-E364 HydrophobicContact CD1-CB 3.76Å; L322-E364 HydrophobicContact CD1-CG 4.09Å; L322-E364 HydrophobicContact CD2-CG 4.19Å; T360-E364 WeakPolarHBondContact O-CG 3.43Å; T360-E364 PolarHBondContact O-N 3.19Å; T360-E364 VanDerWaalsContact O-N 3.09Å; R361-E364 PolarHBondContact O-N 3Å; V362-E364 VanDerWaalsContact C-N 3.31Å; V362-E364 PolarHBondContact O-N 3.32Å; E364-K367 WeakPolarHBondContact O-CB 3.37Å; E364-K367 PolarHBondContact O-N 3.07Å; E364-K367 WeakPolarHBondContact OE1-CE 3.22Å; E364-K367 IonicContact OE1-NZ 3.86Å; E364-K367 PolarHBondContact OE1-NZ 3.31Å; E364-K367 IonicContact OE2-NZ 2.6Å; E364-Y368 PolarHBondContact O-N 3.46Å
365	L	98.6	Very high	94.9	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.6	-40	172.9	174.7	64.5	0	0	0	112.4	F325 N329 R330 L333 Y346 R361 V362 C363 K367 Y368 Q369	F325-L365 HydrophobicContact CE1-CB 3.76Å; F325-L365 HydrophobicContact CE1-CD2 3.95Å; F325-L365 HydrophobicContact CE1-CG 4.44Å; F325-L365 HydrophobicContact CZ-CD2 4.03Å; N329-L365 HydrophobicContact CB-CD2 4.17Å; R330-L365 HydrophobicContact CB-CD1 4.05Å; L333-L365 HydrophobicContact CB-CD2 4.04Å; L333-L365 HydrophobicContact CD2-CD2 3.75Å; L333-L365 HydrophobicContact CG-CD2 4.02Å; Y346-L365 HydrophobicContact CE1-CD2 4.43Å; R361-L365 PolarHBondContact O-N 3.02Å; V362-L365 WeakPolarHBondContact O-CB 3.36Å; V362-L365 PolarHBondContact O-N 2.9Å; V362-L365 VanDerWaalsContact O-N 3.14Å; C363-L365 VanDerWaalsContact C-N 3.33Å; L365-K367 VanDerWaalsContact C-N 3.32Å; L365-K367 PolarHBondContact O-N 3.2Å; L365-Y368 WeakPolarHBondContact O-CB 3.42Å; L365-Y368 PolarHBondContact O-N 3.04Å; L365-Q369 HydrophobicContact CD1-CG 4.07Å; L365-Q369 HydrophobicContact CG-CG 4.43Å; L365-Q369 WeakPolarHBondContact O-CB 3.48Å; L365-Q369 WeakPolarHBondContact O-CG 3.3Å; L365-Q369 PolarHBondContact O-N 3.14Å
366	L	98.6	Very high	95.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-40.8	174.5	-71.3	169	0	0	0	111.4	Y346 V362 C363 Q369 G370 E371 L374 L375 M378	Y346-L366 HydrophobicContact CD1-CD2 4.05Å; Y346-L366 HydrophobicContact CD1-CG 4.41Å; Y346-L366 HydrophobicContact CD2-CD2 4.19Å; Y346-L366 HydrophobicContact CE1-CD2 3.61Å; Y346-L366 HydrophobicContact CE1-CG 4.26Å; Y346-L366 HydrophobicContact CE2-CD2 3.76Å; Y346-L366 HydrophobicContact CG-CD2 4.31Å; Y346-L366 VanDerWaalsContact CZ-CD2 3.44Å; V362-L366 HydrophobicContact CG1-CD1 4.21Å; V362-L366 WeakPolarHBondContact O-CG 3.26Å; V362-L366 PolarHBondContact O-N 3.13Å; C363-L366 PolarHBondContact O-N 3Å; L366-Q369 PolarHBondContact O-N 2.97Å; L366-G370 PolarHBondContact O-N 3.31Å; L366-G370 VanDerWaalsContact O-N 3.1Å; L366-E371 HydrophobicContact CD2-CB 3.86Å; L366-E371 HydrophobicContact CD2-CG 4.44Å; L366-E371 PolarHBondContact O-N 3.33Å; L366-L374 HydrophobicContact CD2-CB 4.05Å; L366-L375 HydrophobicContact CB-CB 4.33Å; L366-L375 HydrophobicContact CB-CD1 4.35Å; L366-M378 HydrophobicContact CD1-CB 3.68Å; L366-M378 HydrophobicContact CD1-CG 3.96Å
367	K	98.6	Very high	96.3	Very high	16 Å²	16	34 Å²	34	7%	0.07	18%	0.181	C	C	.	.	H	α-helix	trans	-59	-49.3	171.1	-68.5	174.6	-172.5	178	0	111.1	V285 F288 S289 C363 E364 L365 Q369 G370 L375	V285-K367 HydrophobicContact CG1-CB 4.15Å; F288-K367 HydrophobicContact CB-CG 4.3Å; F288-K367 WeakPolarHBondContact O-CD 3.39Å; F288-K367 WeakPolarHBondContact O-CE 3.26Å; F288-K367 PolarHBondContact O-NZ 2.75Å; S289-K367 PolarHBondContact O-NZ 2.91Å; C363-K367 WeakPolarHBondContact O-CG 3.46Å; C363-K367 PolarHBondContact O-N 2.77Å; E364-K367 WeakPolarHBondContact O-CB 3.37Å; E364-K367 PolarHBondContact O-N 3.07Å; E364-K367 WeakPolarHBondContact OE1-CE 3.22Å; E364-K367 IonicContact OE1-NZ 3.86Å; E364-K367 PolarHBondContact OE1-NZ 3.31Å; E364-K367 IonicContact OE2-NZ 2.6Å; L365-K367 VanDerWaalsContact C-N 3.32Å; L365-K367 PolarHBondContact O-N 3.2Å; K367-Q369 VanDerWaalsContact C-N 3.27Å; K367-Q369 PolarHBondContact O-N 2.93Å; K367-G370 PolarHBondContact O-N 3.36Å; K367-G370 VanDerWaalsContact O-N 3.14Å; K367-L375 HydrophobicContact CD-CD2 4.48Å; K367-L375 HydrophobicContact CG-CD1 4.08Å; K367-L375 HydrophobicContact CG-CD2 3.61Å; K367-L375 HydrophobicContact CG-CG 4.49Å
368	Y	98.7	Very high	96.6	Very high	5 Å²	5	32 Å²	32	2%	0.02	17%	0.17	C	C	.	.	H	α-helix	trans	-55.3	-43.3	177.8	-178.7	-76.9	0	0	0	112	E277 V281 N284 T294 A297 I326 R330 E364 L365 G370	E277-Y368 WeakPolarHBondContact CG-OH 3.33Å; E277-Y368 WeakPolarHBondContact OE1-CE1 3.4Å; E277-Y368 PolarHBondContact OE1-OH 2.99Å; V281-Y368 HydrophobicContact CB-CE2 4.39Å; V281-Y368 HydrophobicContact CG1-CD2 3.65Å; V281-Y368 HydrophobicContact CG1-CE2 3.91Å; V281-Y368 HydrophobicContact CG1-CG 4.14Å; V281-Y368 HydrophobicContact CG2-CD1 4.09Å; V281-Y368 HydrophobicContact CG2-CD2 4Å; V281-Y368 HydrophobicContact CG2-CE1 3.69Å; V281-Y368 HydrophobicContact CG2-CE2 3.65Å; V281-Y368 HydrophobicContact CG2-CG 4.21Å; V281-Y368 VanDerWaalsContact CG2-CZ 3.45Å; N284-Y368 PolarHBondContact ND2-O 3.25Å; T294-Y368 WeakPolarHBondContact O-CD2 3.44Å; A297-Y368 HydrophobicContact CB-CE2 4.42Å; I326-Y368 HydrophobicContact CG2-CD1 4.47Å; I326-Y368 HydrophobicContact CG2-CD2 3.56Å; I326-Y368 HydrophobicContact CG2-CE2 3.72Å; I326-Y368 HydrophobicContact CG2-CG 3.97Å; R330-Y368 HydrophobicContact CB-CD1 4.2Å; R330-Y368 HydrophobicContact CB-CE1 3.87Å; R330-Y368 VanDerWaalsContact CD-OH 3.3Å; R330-Y368 WeakPolarHBondContact CD-OH 3.39Å; R330-Y368 HydrophobicContact CG-CE1 4.43Å; R330-Y368 PolarHBondContact NH1-OH 3.04Å; E364-Y368 PolarHBondContact O-N 3.46Å; L365-Y368 WeakPolarHBondContact O-CB 3.42Å; L365-Y368 PolarHBondContact O-N 3.04Å; Y368-G370 VanDerWaalsContact C-N 3.31Å; Y368-G370 PolarHBondContact O-N 2.95Å
369	Q	98.4	Very high	96.6	Very high	33 Å²	33	37.3 Å²	37.3	15%	0.154	20%	0.195	C	C	.	.	H	α-helix	trans	-76.3	-14.9	-177.8	-70.4	172	-23.9	0	0	113.7	N284 R330 L333 Y346 L365 L366 K367 E371	N284-Q369 PolarHBondContact ND2-O 3.03Å; R330-Q369 PolarHBondContact O-NE2 3.27Å; L333-Q369 PolarHBondContact O-NE2 2.83Å; Y346-Q369 PolarHBondContact OH-OE1 3.4Å; L365-Q369 HydrophobicContact CD1-CG 4.07Å; L365-Q369 HydrophobicContact CG-CG 4.43Å; L365-Q369 WeakPolarHBondContact O-CB 3.48Å; L365-Q369 WeakPolarHBondContact O-CG 3.3Å; L365-Q369 PolarHBondContact O-N 3.14Å; L366-Q369 PolarHBondContact O-N 2.97Å; K367-Q369 VanDerWaalsContact C-N 3.27Å; K367-Q369 PolarHBondContact O-N 2.93Å; Q369-E371 HydrophobicContact CB-CG 3.94Å
370	G	97.9	Very high	96.5	Very high	21 Å²	21	42 Å²	42	22%	0.216	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	21.2	-175.9	0	0	0	0	0	113.6	L366 K367 Y368 H372	L366-G370 PolarHBondContact O-N 3.31Å; L366-G370 VanDerWaalsContact O-N 3.1Å; K367-G370 PolarHBondContact O-N 3.36Å; K367-G370 VanDerWaalsContact O-N 3.14Å; Y368-G370 VanDerWaalsContact C-N 3.31Å; Y368-G370 PolarHBondContact O-N 2.95Å; G370-H372 VanDerWaalsContact C-N 3.31Å; G370-H372 PolarHBondContact O-N 3.47Å; G370-H372 VanDerWaalsContact O-N 3.08Å
371	E	97.5	Very high	96.3	Very high	40 Å²	40	41.7 Å²	41.7	19%	0.187	21%	0.206	C	C	.	.			trans	-87.5	65.7	-177.4	-64.5	-66.5	174.6	0	0	111	K335 L366 Q369 C373 L374 L375	K335-E371 WeakPolarHBondContact CD-OE1 3.4Å; K335-E371 WeakPolarHBondContact CE-OE1 3.42Å; K335-E371 IonicContact NZ-OE1 2.76Å; K335-E371 PolarHBondContact NZ-OE1 2.88Å; K335-E371 IonicContact NZ-OE2 3.98Å; K335-E371 PolarHBondContact NZ-OE2 3.45Å; L366-E371 HydrophobicContact CD2-CB 3.86Å; L366-E371 HydrophobicContact CD2-CG 4.44Å; L366-E371 PolarHBondContact O-N 3.33Å; Q369-E371 HydrophobicContact CB-CG 3.94Å; E371-C373 PolarHBondContact O-N 2.79Å; E371-L374 HydrophobicContact CB-CB 4.22Å; E371-L374 HydrophobicContact CB-CD1 4.24Å; E371-L374 HydrophobicContact CB-CG 4.49Å; E371-L374 PolarHBondContact O-N 2.94Å; E371-L375 PolarHBondContact O-N 2.85Å
372	H	95.8	Very high	95.8	Very high	70 Å²	70	45.6 Å²	45.6	32%	0.324	24%	0.237	S	C	.	.	H	α-helix	trans	-63.6	-37.6	-169.6	-55.5	155.7	0	0	0	114.4	N284 F288 G370 L375	N284-H372 PolarHBondContact O-NE2 3.33Å; F288-H372 AromaticContact CD2-CD2 3.75Å; F288-H372 AromaticContact CD2-NE2 3.63Å; F288-H372 HydrophobicContact CE1-CB 4Å; F288-H372 HydrophobicContact CE2-CB 4.31Å; F288-H372 AromaticContact CE2-CD2 3.41Å; F288-H372 VanDerWaalsContact CE2-CD2 3.41Å; F288-H372 WeakPolarHBondContact CE2-CD2 3.47Å; F288-H372 AromaticContact CE2-CE1 3.38Å; F288-H372 WeakPolarHBondContact CE2-CE1 3.22Å; F288-H372 AromaticContact CE2-CG 3.51Å; F288-H372 AromaticContact CE2-ND1 3.51Å; F288-H372 AromaticContact CE2-NE2 3.32Å; F288-H372 VanDerWaalsContact CE2-NE2 3.32Å; F288-H372 WeakPolarHBondContact CE2-NE2 3.36Å; F288-H372 HydrophobicContact CZ-CB 3.64Å; F288-H372 AromaticContact CZ-CD2 3.63Å; F288-H372 AromaticContact CZ-CE1 3.97Å; F288-H372 AromaticContact CZ-CG 3.35Å; F288-H372 AromaticContact CZ-ND1 3.59Å; F288-H372 AromaticContact CZ-NE2 3.99Å; G370-H372 VanDerWaalsContact C-N 3.31Å; G370-H372 PolarHBondContact O-N 3.47Å; G370-H372 VanDerWaalsContact O-N 3.08Å; H372-L375 PolarHBondContact O-N 3.46Å
373	C	94.3	Very high	95.2	Very high	100 Å²	100	49.9 Å²	49.9	68%	0.676	26%	0.259	S	S	*	.	H	α-helix	trans	-63.4	-46.7	177.1	-60.7	0	0	0	0	110.8	E371 L375 K376 E377	E371-C373 PolarHBondContact O-N 2.79Å; C373-L375 VanDerWaalsContact C-N 3.35Å; C373-L375 PolarHBondContact O-N 3.29Å; C373-K376 PolarHBondContact O-N 3.18Å; C373-E377 PolarHBondContact O-N 2.96Å
374	L	95.8	Very high	94.6	Very high	11 Å²	11	51 Å²	51	6%	0.058	27%	0.266	C	S	.	.	H	α-helix	trans	-69.4	-31.5	-179.4	-61.3	-175.6	0	0	0	112.6	K335 P342 L343 Y346 L366 E371 K376 E377 M378	K335-L374 HydrophobicContact CB-CD1 3.76Å; K335-L374 HydrophobicContact CD-CD1 4.22Å; P342-L374 HydrophobicContact CB-CD1 4.47Å; P342-L374 HydrophobicContact CB-CD2 4.22Å; L343-L374 HydrophobicContact CD1-CB 3.85Å; L343-L374 HydrophobicContact CD1-CD2 4.21Å; L343-L374 HydrophobicContact CD1-CG 4.42Å; Y346-L374 HydrophobicContact CE2-CD1 4.22Å; L366-L374 HydrophobicContact CD2-CB 4.05Å; E371-L374 HydrophobicContact CB-CB 4.22Å; E371-L374 HydrophobicContact CB-CD1 4.24Å; E371-L374 HydrophobicContact CB-CG 4.49Å; E371-L374 PolarHBondContact O-N 2.94Å; L374-K376 VanDerWaalsContact C-N 3.31Å; L374-K376 PolarHBondContact O-N 2.92Å; L374-E377 PolarHBondContact O-N 3.32Å; L374-M378 WeakPolarHBondContact O-CB 3.27Å; L374-M378 PolarHBondContact O-N 2.78Å
375	L	96.6	Very high	94	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-56.8	-46	175.2	175.1	62.7	0	0	0	111.5	F288 C363 L366 K367 E371 H372 C373 M378 Q379	F288-L375 HydrophobicContact CB-CD2 4.27Å; F288-L375 HydrophobicContact CD1-CD2 3.7Å; F288-L375 HydrophobicContact CE1-CD2 4.46Å; F288-L375 HydrophobicContact CG-CD2 4.26Å; C363-L375 HydrophobicContact CB-CD1 3.92Å; C363-L375 WeakPolarHBondContact O-CD1 3.28Å; L366-L375 HydrophobicContact CB-CB 4.33Å; L366-L375 HydrophobicContact CB-CD1 4.35Å; K367-L375 HydrophobicContact CD-CD2 4.48Å; K367-L375 HydrophobicContact CG-CD1 4.08Å; K367-L375 HydrophobicContact CG-CD2 3.61Å; K367-L375 HydrophobicContact CG-CG 4.49Å; E371-L375 PolarHBondContact O-N 2.85Å; H372-L375 PolarHBondContact O-N 3.46Å; C373-L375 VanDerWaalsContact C-N 3.35Å; C373-L375 PolarHBondContact O-N 3.29Å; L375-M378 PolarHBondContact O-N 2.83Å; L375-Q379 HydrophobicContact CD1-CG 4.23Å; L375-Q379 WeakPolarHBondContact O-CB 3.43Å; L375-Q379 VanDerWaalsContact O-CG 3.27Å; L375-Q379 WeakPolarHBondContact O-CG 3.45Å; L375-Q379 PolarHBondContact O-N 2.9Å
376	K	94.4	Very high	93.5	Very high	133 Å²	133	57.6 Å²	57.6	58%	0.578	31%	0.306	S	S	*	.	H	α-helix	trans	-66.8	-42.1	-178.9	-171.9	175.2	179.8	-178.7	0	111.6	C373 L374 Q379 Q380	C373-K376 PolarHBondContact O-N 3.18Å; L374-K376 VanDerWaalsContact C-N 3.31Å; L374-K376 PolarHBondContact O-N 2.92Å; K376-Q379 PolarHBondContact O-N 3.23Å; K376-Q380 WeakPolarHBondContact O-CG 3.23Å; K376-Q380 PolarHBondContact O-N 3.37Å
377	E	94.4	Very high	93	Very high	99 Å²	99	59.3 Å²	59.3	46%	0.463	32%	0.317	S	S	.	.	H	α-helix	trans	-61.6	-46.5	175.6	-68.3	174.1	-158	0	0	111.3	L343 C373 L374 Q379 Q380 W381	L343-E377 HydrophobicContact CD2-CB 4.01Å; C373-E377 PolarHBondContact O-N 2.96Å; L374-E377 PolarHBondContact O-N 3.32Å; E377-Q379 PolarHBondContact O-N 2.93Å; E377-Q380 PolarHBondContact O-N 3.43Å; E377-W381 WeakPolarHBondContact O-CB 3.23Å; E377-W381 PolarHBondContact O-N 3.11Å
378	M	94.5	Very high	92.6	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-40.1	178.7	-176.9	55.4	68.5	0	0	112.9	L343 Q347 I350 V362 L366 L374 L375 Q380 W381	L343-M378 HydrophobicContact CD1-CB 4.27Å; L343-M378 HydrophobicContact CD1-CE 3.72Å; L343-M378 HydrophobicContact CD2-CB 4.49Å; L343-M378 HydrophobicContact CD2-CE 3.96Å; L343-M378 HydrophobicContact CG-CE 3.68Å; Q347-M378 HydrophobicContact CG-CE 4.23Å; I350-M378 HydrophobicContact CD1-CE 3.91Å; I350-M378 HydrophobicContact CD1-SD 3.36Å; I350-M378 WeakPolarHBondContact CD1-SD 3.37Å; V362-M378 HydrophobicContact CG1-CE 3.93Å; V362-M378 HydrophobicContact CG1-CG 4.11Å; V362-M378 HydrophobicContact CG1-SD 4.27Å; L366-M378 HydrophobicContact CD1-CB 3.68Å; L366-M378 HydrophobicContact CD1-CG 3.96Å; L374-M378 WeakPolarHBondContact O-CB 3.27Å; L374-M378 PolarHBondContact O-N 2.78Å; L375-M378 PolarHBondContact O-N 2.83Å; M378-Q380 PolarHBondContact O-N 3.09Å; M378-W381 PolarHBondContact O-N 3.36Å; M378-W381 HydrophobicContact SD-CE3 3.88Å; M378-W381 HydrophobicContact SD-CZ3 4.47Å
379	Q	93.2	Very high	92.3	Very high	113 Å²	113	61 Å²	61	53%	0.528	33%	0.331	S	S	.	.	H	α-helix	trans	-65.6	-28.6	178.2	-75.9	174.7	-23.8	0	0	113.1	L375 K376 E377	L375-Q379 HydrophobicContact CD1-CG 4.23Å; L375-Q379 WeakPolarHBondContact O-CB 3.43Å; L375-Q379 VanDerWaalsContact O-CG 3.27Å; L375-Q379 WeakPolarHBondContact O-CG 3.45Å; L375-Q379 PolarHBondContact O-N 2.9Å; K376-Q379 PolarHBondContact O-N 3.23Å; E377-Q379 PolarHBondContact O-N 2.93Å
380	Q	92.4	Very high	91.8	Very high	137 Å²	137	60.6 Å²	60.6	64%	0.64	34%	0.336	S	S	*	.	H	α-helix	trans	-92.2	-13.7	179.1	-66	180	-12.4	0	0	112.6	K376 E377 M378 S382	K376-Q380 WeakPolarHBondContact O-CG 3.23Å; K376-Q380 PolarHBondContact O-N 3.37Å; E377-Q380 PolarHBondContact O-N 3.43Å; M378-Q380 PolarHBondContact O-N 3.09Å; Q380-S382 PolarHBondContact O-N 2.93Å
381	W	90.4	Very high	91.4	Very high	52 Å²	52	65 Å²	65	20%	0.197	35%	0.351	C	S	.	.			trans	-70	118.6	-178	-176.8	64.9	0	0	0	111.2	Q347 I350 I351 E377 M378 I383 Y420	Q347-W381 HydrophobicContact CB-CH2 3.73Å; Q347-W381 HydrophobicContact CB-CZ2 3.92Å; Q347-W381 HydrophobicContact CB-CZ3 4.26Å; Q347-W381 HydrophobicContact CG-CD2 4.25Å; Q347-W381 HydrophobicContact CG-CE3 4.36Å; Q347-W381 HydrophobicContact CG-CH2 3.94Å; Q347-W381 HydrophobicContact CG-CZ2 3.84Å; Q347-W381 HydrophobicContact CG-CZ3 4.21Å; I350-W381 HydrophobicContact CB-CZ3 4.1Å; I350-W381 HydrophobicContact CD1-CE3 4.33Å; I350-W381 HydrophobicContact CD1-CZ3 3.88Å; I350-W381 HydrophobicContact CG2-CZ3 3.97Å; I351-W381 HydrophobicContact CD1-CH2 3.59Å; I351-W381 HydrophobicContact CD1-CZ2 3.85Å; I351-W381 HydrophobicContact CG1-CH2 3.93Å; E377-W381 WeakPolarHBondContact O-CB 3.23Å; E377-W381 PolarHBondContact O-N 3.11Å; M378-W381 PolarHBondContact O-N 3.36Å; M378-W381 HydrophobicContact SD-CE3 3.88Å; M378-W381 HydrophobicContact SD-CZ3 4.47Å; W381-I383 HydrophobicContact CE3-CG1 4.16Å; W381-I383 HydrophobicContact CH2-CG1 4.26Å; W381-I383 HydrophobicContact CZ3-CG1 3.8Å; W381-Y420 HydrophobicContact CZ2-CD2 4.24Å
382	S	86.9	Confident	91.1	Very high	104 Å²	104	63.9 Å²	63.9	73%	0.727	35%	0.346	S	S	*	.			trans	-89.1	121.9	171.4	-65.3	0	0	0	0	108.8	Q380 P384	Q380-S382 PolarHBondContact O-N 2.93Å; S382-P384 WeakPolarHBondContact O-CD 3.45Å
383	I	86.3	Confident	90.7	Very high	90 Å²	90	60.5 Å²	60.5	46%	0.462	33%	0.331	S	S	.	.			trans	-60.7	111.9	179.1	-56.5	168.1	0	0	0	108.1	I350 I351 W381	I350-I383 HydrophobicContact CG2-CD1 3.59Å; I350-I383 HydrophobicContact CG2-CG1 4.04Å; I351-I383 HydrophobicContact CD1-CG2 4.42Å; I351-I383 HydrophobicContact CG1-CG2 3.99Å; W381-I383 HydrophobicContact CE3-CG1 4.16Å; W381-I383 HydrophobicContact CH2-CG1 4.26Å; W381-I383 HydrophobicContact CZ3-CG1 3.8Å
384	P	85.3	Confident	90.5	Very high	34 Å²	34	62.8 Å²	62.8	22%	0.221	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-69.1	136.3	-178.5	27.1	-31.4	0	0	0	109.3	S382 F386 W415 Y420	S382-P384 WeakPolarHBondContact O-CD 3.45Å; P384-F386 PolarHBondContact O-N 2.99Å; P384-W415 HydrophobicContact CB-CH2 4.45Å; P384-W415 HydrophobicContact CB-CZ2 3.86Å; P384-W415 HydrophobicContact CG-CH2 3.95Å; P384-W415 HydrophobicContact CG-CZ2 3.6Å; P384-W415 WeakPolarHBondContact O-CH2 3.25Å; P384-Y420 HydrophobicContact CG-CG 4.37Å
385	P	84.9	Confident	90.1	Very high	116 Å²	116	69.7 Å²	69.7	75%	0.753	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-67.7	136	174.7	27.9	-32.6	0	0	0	109.1	P387	P385-P387 WeakPolarHBondContact O-CD 3.5Å; P385-P387 VanDerWaalsContact O-N 3.11Å
386	F	88.1	Confident	89.4	Confident	31 Å²	31	72 Å²	72	14%	0.136	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-59.6	119.2	172.8	178.3	-114.9	0	0	0	109.2	P384 V388 L408 L411 R412 W415 L427	P384-F386 PolarHBondContact O-N 2.99Å; F386-V388 VanDerWaalsContact C-N 3.27Å; F386-V388 HydrophobicContact CD1-CB 4.47Å; F386-V388 WeakPolarHBondContact CD1-O 3.47Å; F386-V388 HydrophobicContact CE1-CB 3.73Å; F386-V388 WeakPolarHBondContact CE1-O 3.49Å; F386-V388 HydrophobicContact CZ-CB 3.83Å; F386-V388 HydrophobicContact CZ-CG2 4.34Å; F386-V388 PolarHBondContact O-N 2.81Å; F386-L408 HydrophobicContact CE1-CD2 3.88Å; F386-L411 HydrophobicContact CE2-CB 4.37Å; F386-L411 HydrophobicContact CZ-CB 3.8Å; F386-R412 HydrophobicContact CD1-CG 4.09Å; F386-R412 HydrophobicContact CD2-CG 3.79Å; F386-R412 HydrophobicContact CE1-CG 3.87Å; F386-R412 HydrophobicContact CE2-CB 4.31Å; F386-R412 HydrophobicContact CE2-CG 3.59Å; F386-R412 HydrophobicContact CG-CG 4.04Å; F386-R412 HydrophobicContact CZ-CG 3.63Å; F386-W415 HydrophobicContact CB-CE3 4.45Å; F386-W415 HydrophobicContact CB-CH2 4.38Å; F386-W415 HydrophobicContact CB-CZ3 4.16Å; F386-W415 HydrophobicContact CD2-CB 4.31Å; F386-W415 AromaticContact CD2-CD2 3.77Å; F386-W415 HydrophobicContact CD2-CD2 3.77Å; F386-W415 AromaticContact CD2-CE3 3.58Å; F386-W415 HydrophobicContact CD2-CE3 3.58Å; F386-W415 HydrophobicContact CD2-CG 4.12Å; F386-W415 HydrophobicContact CD2-CZ3 4.14Å; F386-W415 HydrophobicContact CE2-CB 4.05Å; F386-W415 HydrophobicContact CE2-CD2 4.39Å; F386-W415 HydrophobicContact CE2-CE3 4.36Å; F386-W415 HydrophobicContact CE2-CG 4.29Å; F386-W415 HydrophobicContact CG-CE3 4.46Å; F386-L427 HydrophobicContact CE2-CD1 4.11Å
387	P	89.1	Confident	88.9	Confident	36 Å²	36	68.8 Å²	68.8	23%	0.234	37%	0.373	C	S	.	.	S	Bend	trans	-80.9	-5.6	-161.3	32.8	-39.2	0	0	0	113.5	P385 K424 L427	P385-P387 WeakPolarHBondContact O-CD 3.5Å; P385-P387 VanDerWaalsContact O-N 3.11Å; P387-K424 HydrophobicContact CB-CB 4.17Å; P387-K424 WeakPolarHBondContact O-CE 3.28Å; P387-L427 HydrophobicContact CG-CD1 3.54Å
388	V	89.6	Confident	88.4	Confident	6 Å²	6	65.7 Å²	65.7	4%	0.036	36%	0.36	C	S	.	.			trans	-109.8	127.4	-178.1	-174.3	0	0	0	0	111.4	F386 D392 I393 L408 L411 K424 L427 L428	F386-V388 VanDerWaalsContact C-N 3.27Å; F386-V388 HydrophobicContact CD1-CB 4.47Å; F386-V388 WeakPolarHBondContact CD1-O 3.47Å; F386-V388 HydrophobicContact CE1-CB 3.73Å; F386-V388 WeakPolarHBondContact CE1-O 3.49Å; F386-V388 HydrophobicContact CZ-CB 3.83Å; F386-V388 HydrophobicContact CZ-CG2 4.34Å; F386-V388 PolarHBondContact O-N 2.81Å; V388-D392 HydrophobicContact CG1-CB 4.08Å; V388-I393 HydrophobicContact CG1-CD1 3.79Å; V388-I393 HydrophobicContact CG1-CG1 4.32Å; V388-L408 HydrophobicContact CG1-CD2 4.09Å; V388-L411 HydrophobicContact CB-CD1 4.27Å; V388-L411 HydrophobicContact CG1-CD1 3.91Å; V388-L411 HydrophobicContact CG2-CD1 4.12Å; V388-K424 HydrophobicContact CG2-CG 4.36Å; V388-L427 HydrophobicContact CG2-CB 3.8Å; V388-L427 HydrophobicContact CG2-CD1 3.95Å; V388-L428 HydrophobicContact CG1-CD2 3.8Å; V388-L428 HydrophobicContact CG1-CG 4.48Å; V388-L428 HydrophobicContact CG2-CG 4.42Å
389	S	91.8	Very high	87.8	Confident	50 Å²	50	70.3 Å²	70.3	35%	0.35	39%	0.392	S	S	.	.			trans	-101.8	162.7	176.6	73.7	0	0	0	0	112.1	H391 D392 I393	S389-H391 PolarHBondContact O-N 2.97Å; S389-H391 PolarHBondContact OG-N 3.16Å; S389-D392 WeakPolarHBondContact CB-OD2 3.36Å; S389-D392 PolarHBondContact N-OD2 3.2Å; S389-D392 WeakPolarHBondContact O-CB 3.3Å; S389-D392 PolarHBondContact O-N 3.33Å; S389-D392 VanDerWaalsContact OG-CG 3.24Å; S389-D392 PolarHBondContact OG-N 3.32Å; S389-D392 PolarHBondContact OG-OD2 3.4Å; S389-I393 PolarHBondContact O-N 2.87Å
390	G	88.7	Confident	87.6	Confident	25 Å²	25	67.5 Å²	67.5	26%	0.258	39%	0.385	S	S	.	.	H	α-helix	trans	-61.2	-24.6	172.1	0	0	0	0	0	113.5	R394	G390-R394 WeakPolarHBondContact O-CG 3.21Å; G390-R394 PolarHBondContact O-N 3.43Å; G390-R394 VanDerWaalsContact O-N 3.15Å
391	H	90.3	Very high	87.2	Confident	113 Å²	113	63.4 Å²	63.4	52%	0.523	38%	0.38	S	S	.	.	H	α-helix	trans	-71.1	-36.3	174	-179.3	71.9	0	0	0	112	S389 I393 R394 K395	S389-H391 PolarHBondContact O-N 2.97Å; S389-H391 PolarHBondContact OG-N 3.16Å; H391-I393 VanDerWaalsContact C-N 3.32Å; H391-I393 PolarHBondContact O-N 3.4Å; H391-R394 PolarHBondContact O-N 3.25Å; H391-K395 WeakPolarHBondContact NE2-CE 3.07Å; H391-K395 PolarHBondContact O-N 3.34Å; H391-K395 VanDerWaalsContact O-N 3.08Å
392	D	90.1	Very high	87.1	Confident	17 Å²	17	69.9 Å²	69.9	9%	0.091	41%	0.409	C	S	.	.	H	α-helix	trans	-63.3	-40.9	175.2	-58.8	-58.6	0	0	0	110.5	V388 S389 R394 K395 V396 K424 L428	V388-D392 HydrophobicContact CG1-CB 4.08Å; S389-D392 WeakPolarHBondContact CB-OD2 3.36Å; S389-D392 PolarHBondContact N-OD2 3.2Å; S389-D392 WeakPolarHBondContact O-CB 3.3Å; S389-D392 PolarHBondContact O-N 3.33Å; S389-D392 VanDerWaalsContact OG-CG 3.24Å; S389-D392 PolarHBondContact OG-N 3.32Å; S389-D392 PolarHBondContact OG-OD2 3.4Å; D392-R394 PolarHBondContact O-N 2.89Å; D392-K395 WeakPolarHBondContact O-CB 3.5Å; D392-K395 PolarHBondContact O-N 2.97Å; D392-V396 WeakPolarHBondContact O-CG2 3.33Å; D392-V396 PolarHBondContact O-N 3.11Å; D392-K424 VanDerWaalsContact CG-NZ 3.28Å; D392-K424 IonicContact OD1-NZ 2.91Å; D392-K424 PolarHBondContact OD1-NZ 3.37Å; D392-K424 WeakPolarHBondContact OD2-CE 3.3Å; D392-K424 IonicContact OD2-NZ 3.01Å; D392-K424 PolarHBondContact OD2-NZ 2.85Å; D392-L428 HydrophobicContact CB-CD1 4.27Å; D392-L428 HydrophobicContact CB-CD2 4.3Å
393	I	88.2	Confident	87.1	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-63.9	-39.4	175.1	-51.3	-61.3	0	0	0	111.8	V388 S389 H391 K395 V396 I398 I404 L407 L408 L411 L428 I431	V388-I393 HydrophobicContact CG1-CD1 3.79Å; V388-I393 HydrophobicContact CG1-CG1 4.32Å; S389-I393 PolarHBondContact O-N 2.87Å; H391-I393 VanDerWaalsContact C-N 3.32Å; H391-I393 PolarHBondContact O-N 3.4Å; I393-K395 VanDerWaalsContact C-N 3.31Å; I393-K395 PolarHBondContact O-N 3.26Å; I393-V396 PolarHBondContact O-N 3.43Å; I393-V396 VanDerWaalsContact O-N 3.09Å; I393-I398 HydrophobicContact CG2-CB 4.16Å; I393-I398 HydrophobicContact CG2-CG2 4.48Å; I393-I404 HydrophobicContact CB-CG1 4.39Å; I393-I404 HydrophobicContact CB-CG2 4.26Å; I393-I404 HydrophobicContact CG1-CG2 4.43Å; I393-I404 HydrophobicContact CG2-CB 4.44Å; I393-I404 HydrophobicContact CG2-CG1 3.96Å; I393-I404 HydrophobicContact CG2-CG2 4.42Å; I393-L407 HydrophobicContact CG2-CD1 4.04Å; I393-L408 HydrophobicContact CD1-CD2 4.28Å; I393-L408 HydrophobicContact CG1-CD2 3.85Å; I393-L408 HydrophobicContact CG1-CG 4.13Å; I393-L411 HydrophobicContact CD1-CD1 4.07Å; I393-L428 HydrophobicContact CD1-CD2 4.16Å; I393-I431 HydrophobicContact CD1-CD1 3.3Å
394	R	89.1	Confident	87.2	Confident	147 Å²	147	66 Å²	66	56%	0.555	38%	0.378	S	S	*	.	H	α-helix	trans	-62.4	-36.8	175.7	-74.3	175.5	-175.4	-114.9	2.3	112.7	G390 H391 D392 V396 G397 I398 I404	G390-R394 WeakPolarHBondContact O-CG 3.21Å; G390-R394 PolarHBondContact O-N 3.43Å; G390-R394 VanDerWaalsContact O-N 3.15Å; H391-R394 PolarHBondContact O-N 3.25Å; D392-R394 PolarHBondContact O-N 2.89Å; R394-V396 PolarHBondContact O-N 3.23Å; R394-G397 PolarHBondContact O-N 2.71Å; R394-I398 WeakPolarHBondContact CA-O 3.31Å; R394-I398 WeakPolarHBondContact CG-O 3.26Å; R394-I404 HydrophobicContact CG-CD1 3.65Å
395	K	87.4	Confident	87.3	Confident	156 Å²	156	66.3 Å²	66.3	68%	0.678	39%	0.387	S	S	*	.	H	α-helix	trans	-63.9	-23.1	175	-76.2	-177.9	172.5	167.9	0	113.2	H391 D392 I393	H391-K395 WeakPolarHBondContact NE2-CE 3.07Å; H391-K395 PolarHBondContact O-N 3.34Å; H391-K395 VanDerWaalsContact O-N 3.08Å; D392-K395 WeakPolarHBondContact O-CB 3.5Å; D392-K395 PolarHBondContact O-N 2.97Å; I393-K395 VanDerWaalsContact C-N 3.31Å; I393-K395 PolarHBondContact O-N 3.26Å
396	V	82.9	Confident	87.4	Confident	54 Å²	54	63.2 Å²	63.2	33%	0.327	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-1.4	176.2	-171.4	0	0	0	0	111.8	D392 I393 R394 L428 I431	D392-V396 WeakPolarHBondContact O-CG2 3.33Å; D392-V396 PolarHBondContact O-N 3.11Å; I393-V396 PolarHBondContact O-N 3.43Å; I393-V396 VanDerWaalsContact O-N 3.09Å; R394-V396 PolarHBondContact O-N 3.23Å; V396-L428 HydrophobicContact CG2-CD2 4.47Å; V396-I431 HydrophobicContact CG1-CG2 4.4Å
397	G	83.1	Confident	87.4	Confident	64 Å²	64	63 Å²	63	66%	0.66	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.5	5.9	171.3	0	0	0	0	0	115.3	R394	R394-G397 PolarHBondContact O-N 2.71Å
398	I	83.6	Confident	87.4	Confident	34 Å²	34	62.6 Å²	62.6	17%	0.174	37%	0.367	C	S	.	.			trans	-100	120.3	-177.7	-61.6	-177.8	0	0	0	110.6	I393 R394 E403 I404 L407	I393-I398 HydrophobicContact CG2-CB 4.16Å; I393-I398 HydrophobicContact CG2-CG2 4.48Å; R394-I398 WeakPolarHBondContact CA-O 3.31Å; R394-I398 WeakPolarHBondContact CG-O 3.26Å; I398-E403 HydrophobicContact CG2-CB 3.97Å; I398-E403 HydrophobicContact CG2-CG 3.84Å; I398-I404 HydrophobicContact CG2-CG1 4.06Å; I398-L407 HydrophobicContact CD1-CD1 3.17Å; I398-L407 HydrophobicContact CG1-CD1 4.5Å; I398-L407 HydrophobicContact CG2-CD1 4.5Å
399	S	82.6	Confident	87.2	Confident	97 Å²	97	66.9 Å²	66.9	68%	0.678	39%	0.387	S	S	*	.			trans	-107.2	-19.1	-172.5	57.3	0	0	0	0	114.2
400	S	88.1	Confident	87.1	Confident	55 Å²	55	69.3 Å²	69.3	39%	0.385	39%	0.392	S	S	.	.			trans	-75	123.5	-179.3	176.2	0	0	0	0	112	K402 E403 I404	S400-K402 VanDerWaalsContact C-N 3.29Å; S400-K402 PolarHBondContact O-N 2.78Å; S400-E403 PolarHBondContact O-N 2.85Å; S400-I404 VanDerWaalsContact O-CG1 3.28Å; S400-I404 WeakPolarHBondContact O-CG1 3.3Å; S400-I404 PolarHBondContact O-N 2.95Å
401	G	84.4	Confident	87.1	Confident	51 Å²	51	68.3 Å²	68.3	53%	0.526	38%	0.381	S	S	.	.	H	α-helix	trans	-60.2	-35.8	179.4	0	0	0	0	0	113.9	G405	G401-G405 PolarHBondContact O-N 3.43Å; G401-G405 VanDerWaalsContact O-N 3.09Å
402	K	88.3	Confident	87	Confident	187 Å²	187	66.7 Å²	66.7	81%	0.813	37%	0.37	S	S	*	.	H	α-helix	trans	-67.5	-39.8	178.1	-171.3	178.8	179	-177.7	0	111.6	S400 G405 A406	S400-K402 VanDerWaalsContact C-N 3.29Å; S400-K402 PolarHBondContact O-N 2.78Å; K402-G405 PolarHBondContact O-N 2.8Å; K402-A406 PolarHBondContact O-N 2.84Å; K402-A406 VanDerWaalsContact O-N 3.16Å
403	E	87.7	Confident	86.8	Confident	102 Å²	102	70.4 Å²	70.4	48%	0.477	39%	0.387	S	S	.	.	H	α-helix	trans	-73.3	-39.7	179.6	-165.6	172.1	-165	0	0	111.8	I398 S400 G405 A406 L407	I398-E403 HydrophobicContact CG2-CB 3.97Å; I398-E403 HydrophobicContact CG2-CG 3.84Å; S400-E403 PolarHBondContact O-N 2.85Å; E403-G405 VanDerWaalsContact C-N 3.31Å; E403-G405 PolarHBondContact O-N 3.37Å; E403-A406 PolarHBondContact O-N 2.68Å; E403-L407 HydrophobicContact CG-CD1 4.41Å; E403-L407 PolarHBondContact O-N 2.85Å
404	I	87.9	Confident	86.7	Confident	12 Å²	12	72.4 Å²	72.4	6%	0.062	40%	0.397	C	S	.	.	H	α-helix	trans	-57.1	-46.1	171.4	-67.6	164.1	0	0	0	110.5	I393 R394 I398 S400 A406 L407 L408	I393-I404 HydrophobicContact CB-CG1 4.39Å; I393-I404 HydrophobicContact CB-CG2 4.26Å; I393-I404 HydrophobicContact CG1-CG2 4.43Å; I393-I404 HydrophobicContact CG2-CB 4.44Å; I393-I404 HydrophobicContact CG2-CG1 3.96Å; I393-I404 HydrophobicContact CG2-CG2 4.42Å; R394-I404 HydrophobicContact CG-CD1 3.65Å; I398-I404 HydrophobicContact CG2-CG1 4.06Å; S400-I404 VanDerWaalsContact O-CG1 3.28Å; S400-I404 WeakPolarHBondContact O-CG1 3.3Å; S400-I404 PolarHBondContact O-N 2.95Å; I404-A406 PolarHBondContact O-N 3.02Å; I404-L407 PolarHBondContact O-N 3.47Å; I404-L408 HydrophobicContact CG2-CD1 3.78Å; I404-L408 HydrophobicContact CG2-CG 4.27Å; I404-L408 WeakPolarHBondContact O-CB 3.09Å; I404-L408 VanDerWaalsContact O-CG 3.26Å; I404-L408 WeakPolarHBondContact O-CG 3.22Å; I404-L408 PolarHBondContact O-N 3.13Å
405	G	86.3	Confident	86.7	Confident	39 Å²	39	65.9 Å²	65.9	40%	0.402	37%	0.372	S	S	.	.	H	α-helix	trans	-59.8	-44.9	177.7	0	0	0	0	0	112.9	G401 K402 E403 L408 Q409	G401-G405 PolarHBondContact O-N 3.43Å; G401-G405 VanDerWaalsContact O-N 3.09Å; K402-G405 PolarHBondContact O-N 2.8Å; E403-G405 VanDerWaalsContact C-N 3.31Å; E403-G405 PolarHBondContact O-N 3.37Å; G405-L408 PolarHBondContact O-N 3.07Å; G405-Q409 PolarHBondContact O-N 3.32Å
406	A	87.9	Confident	86.5	Confident	52 Å²	52	60.7 Å²	60.7	43%	0.43	35%	0.349	S	S	.	.	H	α-helix	trans	-63.6	-42.6	177.9	0	0	0	0	0	112.7	K402 E403 I404 Q409 Q410	K402-A406 PolarHBondContact O-N 2.84Å; K402-A406 VanDerWaalsContact O-N 3.16Å; E403-A406 PolarHBondContact O-N 2.68Å; I404-A406 PolarHBondContact O-N 3.02Å; A406-Q409 WeakPolarHBondContact O-CB 3.29Å; A406-Q409 PolarHBondContact O-N 2.91Å; A406-Q410 WeakPolarHBondContact O-CG 3.39Å; A406-Q410 PolarHBondContact O-N 2.86Å
407	L	88.9	Confident	86.6	Confident	26 Å²	26	65.1 Å²	65.1	14%	0.136	36%	0.364	C	S	.	.	H	α-helix	trans	-69.1	-40.5	177.6	-74	168.1	0	0	0	112.7	I393 I398 E403 I404 Q409 Q410 L411 I431	I393-L407 HydrophobicContact CG2-CD1 4.04Å; I398-L407 HydrophobicContact CD1-CD1 3.17Å; I398-L407 HydrophobicContact CG1-CD1 4.5Å; I398-L407 HydrophobicContact CG2-CD1 4.5Å; E403-L407 HydrophobicContact CG-CD1 4.41Å; E403-L407 PolarHBondContact O-N 2.85Å; I404-L407 PolarHBondContact O-N 3.47Å; L407-Q409 PolarHBondContact O-N 2.72Å; L407-Q410 PolarHBondContact O-N 3.09Å; L407-L411 WeakPolarHBondContact O-CB 3.38Å; L407-L411 WeakPolarHBondContact O-CG 3.48Å; L407-L411 PolarHBondContact O-N 3.43Å; L407-I431 HydrophobicContact CB-CD1 4.43Å
408	L	88.3	Confident	86.6	Confident	28 Å²	28	63.5 Å²	63.5	15%	0.147	34%	0.343	C	S	.	.	H	α-helix	trans	-60.1	-37.8	173.3	-72.9	171.3	0	0	0	111	F386 V388 I393 I404 G405 R412	F386-L408 HydrophobicContact CE1-CD2 3.88Å; V388-L408 HydrophobicContact CG1-CD2 4.09Å; I393-L408 HydrophobicContact CD1-CD2 4.28Å; I393-L408 HydrophobicContact CG1-CD2 3.85Å; I393-L408 HydrophobicContact CG1-CG 4.13Å; I404-L408 HydrophobicContact CG2-CD1 3.78Å; I404-L408 HydrophobicContact CG2-CG 4.27Å; I404-L408 WeakPolarHBondContact O-CB 3.09Å; I404-L408 VanDerWaalsContact O-CG 3.26Å; I404-L408 WeakPolarHBondContact O-CG 3.22Å; I404-L408 PolarHBondContact O-N 3.13Å; G405-L408 PolarHBondContact O-N 3.07Å; L408-R412 WeakPolarHBondContact O-CB 3.44Å; L408-R412 WeakPolarHBondContact O-CG 3.42Å; L408-R412 PolarHBondContact O-N 3.04Å
409	Q	86.4	Confident	86.4	Confident	96 Å²	96	63.2 Å²	63.2	45%	0.449	35%	0.348	S	S	.	.	H	α-helix	trans	-65.2	-46.3	175.3	-173.5	60.2	32.3	0	0	111.8	G405 A406 L407 L411 R412 E413	G405-Q409 PolarHBondContact O-N 3.32Å; A406-Q409 WeakPolarHBondContact O-CB 3.29Å; A406-Q409 PolarHBondContact O-N 2.91Å; L407-Q409 PolarHBondContact O-N 2.72Å; Q409-L411 VanDerWaalsContact C-N 3.35Å; Q409-L411 PolarHBondContact O-N 3.25Å; Q409-R412 WeakPolarHBondContact O-CB 3.31Å; Q409-R412 PolarHBondContact O-N 3.49Å; Q409-E413 PolarHBondContact O-N 3.05Å
410	Q	88.3	Confident	86.4	Confident	100 Å²	100	59.2 Å²	59.2	47%	0.467	32%	0.318	S	S	.	.	H	α-helix	trans	-60.5	-42.6	175.9	-72.2	177.3	4.6	0	0	112.4	A406 L407 E413 Q414	A406-Q410 WeakPolarHBondContact O-CG 3.39Å; A406-Q410 PolarHBondContact O-N 2.86Å; L407-Q410 PolarHBondContact O-N 3.09Å; Q410-E413 WeakPolarHBondContact O-CB 3.44Å; Q410-E413 PolarHBondContact O-N 3.04Å; Q410-Q414 PolarHBondContact O-N 3.17Å; Q410-Q414 VanDerWaalsContact O-N 3.08Å
411	L	90.1	Very high	86.2	Confident	4 Å²	4	62.1 Å²	62.1	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-67.2	-35.8	176.1	-73.4	-169.9	0	0	0	112.6	F386 V388 I393 L407 Q409 E413 Q414 W415 L427 I431	F386-L411 HydrophobicContact CE2-CB 4.37Å; F386-L411 HydrophobicContact CZ-CB 3.8Å; V388-L411 HydrophobicContact CB-CD1 4.27Å; V388-L411 HydrophobicContact CG1-CD1 3.91Å; V388-L411 HydrophobicContact CG2-CD1 4.12Å; I393-L411 HydrophobicContact CD1-CD1 4.07Å; L407-L411 WeakPolarHBondContact O-CB 3.38Å; L407-L411 WeakPolarHBondContact O-CG 3.48Å; L407-L411 PolarHBondContact O-N 3.43Å; Q409-L411 VanDerWaalsContact C-N 3.35Å; Q409-L411 PolarHBondContact O-N 3.25Å; L411-E413 VanDerWaalsContact C-N 3.3Å; L411-E413 PolarHBondContact O-N 3.22Å; L411-Q414 PolarHBondContact O-N 3.13Å; L411-W415 VanDerWaalsContact O-CB 3.29Å; L411-W415 WeakPolarHBondContact O-CB 3.25Å; L411-W415 PolarHBondContact O-N 3.08Å; L411-L427 HydrophobicContact CD1-CB 4.29Å; L411-L427 HydrophobicContact CD2-CB 4.19Å; L411-L427 HydrophobicContact CD2-CD2 4.35Å; L411-L427 WeakPolarHBondContact CD2-O 3.47Å; L411-I431 HydrophobicContact CD1-CD1 3.43Å; L411-I431 VanDerWaalsContact CD1-CD1 3.43Å; L411-I431 HydrophobicContact CD1-CG1 3.95Å; L411-I431 HydrophobicContact CD2-CD1 4.31Å; L411-I431 HydrophobicContact CD2-CG1 3.89Å; L411-I431 HydrophobicContact CG-CD1 3.93Å; L411-I431 HydrophobicContact CG-CG1 4.04Å
412	R	86.4	Confident	86.3	Confident	80 Å²	80	61.1 Å²	61.1	30%	0.302	31%	0.308	S	S	.	.	H	α-helix	trans	-61.9	-39.7	172.2	-77.4	172.9	-172.8	-74.6	-3.1	111.4	F386 L408 Q409 W415 K416	F386-R412 HydrophobicContact CD1-CG 4.09Å; F386-R412 HydrophobicContact CD2-CG 3.79Å; F386-R412 HydrophobicContact CE1-CG 3.87Å; F386-R412 HydrophobicContact CE2-CB 4.31Å; F386-R412 HydrophobicContact CE2-CG 3.59Å; F386-R412 HydrophobicContact CG-CG 4.04Å; F386-R412 HydrophobicContact CZ-CG 3.63Å; L408-R412 WeakPolarHBondContact O-CB 3.44Å; L408-R412 WeakPolarHBondContact O-CG 3.42Å; L408-R412 PolarHBondContact O-N 3.04Å; Q409-R412 WeakPolarHBondContact O-CB 3.31Å; Q409-R412 PolarHBondContact O-N 3.49Å; R412-W415 PolarHBondContact O-N 2.84Å; R412-K416 WeakPolarHBondContact O-CB 3.38Å; R412-K416 PolarHBondContact O-N 2.84Å
413	E	85.9	Confident	86.3	Confident	94 Å²	94	59 Å²	59	44%	0.439	30%	0.301	S	S	.	.	H	α-helix	trans	-64.6	-39.7	175.4	-72	170.9	-164.9	0	0	112.3	Q409 Q410 L411 K416 K417	Q409-E413 PolarHBondContact O-N 3.05Å; Q410-E413 WeakPolarHBondContact O-CB 3.44Å; Q410-E413 PolarHBondContact O-N 3.04Å; L411-E413 VanDerWaalsContact C-N 3.3Å; L411-E413 PolarHBondContact O-N 3.22Å; E413-K416 PolarHBondContact O-N 2.61Å; E413-K417 WeakPolarHBondContact O-CG 3.48Å; E413-K417 PolarHBondContact O-N 2.64Å
414	Q	87.7	Confident	86.5	Confident	43 Å²	43	57.8 Å²	57.8	20%	0.201	29%	0.294	C	S	.	.	H	α-helix	trans	-68.7	-44.7	175.5	-66.9	-59.8	-16	0	0	112.2	Q410 L411 K416 K417 S418 L427 Y430	Q410-Q414 PolarHBondContact O-N 3.17Å; Q410-Q414 VanDerWaalsContact O-N 3.08Å; L411-Q414 PolarHBondContact O-N 3.13Å; Q414-K416 VanDerWaalsContact C-N 3.26Å; Q414-K416 PolarHBondContact O-N 3.49Å; Q414-K417 WeakPolarHBondContact O-CB 3.1Å; Q414-K417 PolarHBondContact O-N 2.93Å; Q414-K417 VanDerWaalsContact O-N 3.14Å; Q414-S418 PolarHBondContact O-N 2.85Å; Q414-L427 HydrophobicContact CB-CD2 4.16Å; Q414-Y430 HydrophobicContact CG-CD1 4.28Å; Q414-Y430 HydrophobicContact CG-CE1 4.22Å
415	W	87.3	Confident	86.5	Confident	9 Å²	9	63.3 Å²	63.3	3%	0.034	32%	0.323	C	S	.	.	H	α-helix	trans	-58.5	-41	173.9	-177.1	61.5	0	0	0	111.4	I351 P384 F386 L411 R412 S418 Y420 M422 L427	I351-W415 HydrophobicContact CD1-CH2 4.14Å; I351-W415 HydrophobicContact CD1-CZ3 4.23Å; I351-W415 HydrophobicContact CG2-CZ3 4.16Å; P384-W415 HydrophobicContact CB-CH2 4.45Å; P384-W415 HydrophobicContact CB-CZ2 3.86Å; P384-W415 HydrophobicContact CG-CH2 3.95Å; P384-W415 HydrophobicContact CG-CZ2 3.6Å; P384-W415 WeakPolarHBondContact O-CH2 3.25Å; F386-W415 HydrophobicContact CB-CE3 4.45Å; F386-W415 HydrophobicContact CB-CH2 4.38Å; F386-W415 HydrophobicContact CB-CZ3 4.16Å; F386-W415 HydrophobicContact CD2-CB 4.31Å; F386-W415 AromaticContact CD2-CD2 3.77Å; F386-W415 HydrophobicContact CD2-CD2 3.77Å; F386-W415 AromaticContact CD2-CE3 3.58Å; F386-W415 HydrophobicContact CD2-CE3 3.58Å; F386-W415 HydrophobicContact CD2-CG 4.12Å; F386-W415 HydrophobicContact CD2-CZ3 4.14Å; F386-W415 HydrophobicContact CE2-CB 4.05Å; F386-W415 HydrophobicContact CE2-CD2 4.39Å; F386-W415 HydrophobicContact CE2-CE3 4.36Å; F386-W415 HydrophobicContact CE2-CG 4.29Å; F386-W415 HydrophobicContact CG-CE3 4.46Å; L411-W415 VanDerWaalsContact O-CB 3.29Å; L411-W415 WeakPolarHBondContact O-CB 3.25Å; L411-W415 PolarHBondContact O-N 3.08Å; R412-W415 PolarHBondContact O-N 2.84Å; W415-S418 WeakPolarHBondContact O-CB 3.41Å; W415-S418 PolarHBondContact O-N 2.9Å; W415-S418 PolarHBondContact O-OG 3.36Å; W415-Y420 AromaticContact CD2-CD1 3.79Å; W415-Y420 HydrophobicContact CD2-CD1 3.79Å; W415-Y420 AromaticContact CE2-CD1 3.95Å; W415-Y420 AromaticContact CE3-CD1 3.54Å; W415-Y420 HydrophobicContact CE3-CD1 3.54Å; W415-Y420 AromaticContact CE3-CE1 3.98Å; W415-Y420 HydrophobicContact CE3-CE1 3.98Å; W415-Y420 AromaticContact CH2-CD1 3.67Å; W415-Y420 HydrophobicContact CH2-CD1 3.67Å; W415-Y420 HydrophobicContact CH2-CE1 4.4Å; W415-Y420 HydrophobicContact CH2-CG 4.39Å; W415-Y420 AromaticContact CZ2-CD1 3.93Å; W415-Y420 HydrophobicContact CZ2-CD1 3.93Å; W415-Y420 HydrophobicContact CZ2-CG 4.39Å; W415-Y420 AromaticContact CZ3-CD1 3.48Å; W415-Y420 HydrophobicContact CZ3-CD1 3.48Å; W415-Y420 VanDerWaalsContact CZ3-CD1 3.48Å; W415-Y420 AromaticContact CZ3-CE1 3.87Å; W415-Y420 HydrophobicContact CZ3-CE1 3.87Å; W415-Y420 PolarHBondContact NE1-O 3.34Å; W415-Y420 VanDerWaalsContact NE1-O 3.16Å; W415-Y420 WeakPolarHBondContact O-CA 3.5Å; W415-Y420 PolarHBondContact O-N 3.09Å; W415-M422 PolarHBondContact NE1-O 3.41Å; W415-L427 HydrophobicContact CB-CD1 4Å; W415-L427 HydrophobicContact CB-CD2 3.9Å; W415-L427 HydrophobicContact CG-CD1 4.14Å
416	K	84.8	Confident	86.7	Confident	47 Å²	47	65.6 Å²	65.6	20%	0.204	32%	0.324	C	S	.	.	H	α-helix	trans	-64	-42.2	173.2	-176.3	177.2	-173.8	176.9	0	112.9	K344 D348 D352 R412 E413 Q414 S418 G419 Y420	K344-K416 VanDerWaalsContact CE-O 3.23Å; K344-K416 WeakPolarHBondContact CE-O 3.38Å; K344-K416 PolarHBondContact NZ-O 2.82Å; K344-K416 VanDerWaalsContact NZ-O 3.12Å; D348-K416 VanDerWaalsContact CB-CE 3.41Å; D348-K416 WeakPolarHBondContact OD1-CE 3.46Å; D348-K416 WeakPolarHBondContact OD1-CG 3.4Å; D348-K416 WeakPolarHBondContact OD2-CE 3.46Å; D348-K416 IonicContact OD2-NZ 2.63Å; D352-K416 IonicContact OD1-NZ 3.67Å; D352-K416 IonicContact OD2-NZ 3.12Å; D352-K416 PolarHBondContact OD2-NZ 2.94Å; R412-K416 WeakPolarHBondContact O-CB 3.38Å; R412-K416 PolarHBondContact O-N 2.84Å; E413-K416 PolarHBondContact O-N 2.61Å; Q414-K416 VanDerWaalsContact C-N 3.26Å; Q414-K416 PolarHBondContact O-N 3.49Å; K416-S418 PolarHBondContact O-N 3.27Å; K416-G419 PolarHBondContact O-N 3.37Å; K416-Y420 HydrophobicContact CB-CE1 4.02Å; K416-Y420 HydrophobicContact CG-CE1 4.1Å
417	K	84.1	Confident	86.8	Confident	148 Å²	148	63.1 Å²	63.1	64%	0.643	30%	0.303	S	S	*	.	H	α-helix	trans	-62.3	-30.9	174.9	-78.9	176.8	-178.3	178.7	0	112.3	E413 Q414 G419	E413-K417 WeakPolarHBondContact O-CG 3.48Å; E413-K417 PolarHBondContact O-N 2.64Å; Q414-K417 WeakPolarHBondContact O-CB 3.1Å; Q414-K417 PolarHBondContact O-N 2.93Å; Q414-K417 VanDerWaalsContact O-N 3.14Å; K417-G419 PolarHBondContact O-N 3.06Å
418	S	83.2	Confident	86.8	Confident	30 Å²	30	62.9 Å²	62.9	21%	0.21	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-11	178.6	85.1	0	0	0	0	114.3	Q414 W415 K416 Y420 Q421 M422	Q414-S418 PolarHBondContact O-N 2.85Å; W415-S418 WeakPolarHBondContact O-CB 3.41Å; W415-S418 PolarHBondContact O-N 2.9Å; W415-S418 PolarHBondContact O-OG 3.36Å; K416-S418 PolarHBondContact O-N 3.27Å; S418-Y420 PolarHBondContact OG-N 3.34Å; S418-Q421 WeakPolarHBondContact O-CG 3.22Å; S418-Q421 PolarHBondContact OG-N 3.27Å; S418-M422 VanDerWaalsContact CB-CG 3.47Å; S418-M422 PolarHBondContact OG-N 2.93Å
419	G	79.1	Confident	86.7	Confident	28 Å²	28	64 Å²	64	29%	0.289	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	32.8	-168.2	0	0	0	0	0	112	K416 K417 Q421	K416-G419 PolarHBondContact O-N 3.37Å; K417-G419 PolarHBondContact O-N 3.06Å; G419-Q421 PolarHBondContact O-N 3.23Å
420	Y	83.6	Confident	86.5	Confident	13 Å²	13	64.4 Å²	64.4	5%	0.051	31%	0.31	C	S	.	.	S	Bend	trans	64.6	17.4	176.2	-48.3	-68.8	0	0	0	116.3	Q347 D348 I351 W381 P384 W415 K416 S418	Q347-Y420 HydrophobicContact CB-CD2 4.31Å; Q347-Y420 HydrophobicContact CB-CE2 3.64Å; D348-Y420 WeakPolarHBondContact CA-OH 3.36Å; D348-Y420 PolarHBondContact N-OH 2.93Å; D348-Y420 PolarHBondContact OD1-OH 2.92Å; I351-Y420 HydrophobicContact CB-CE1 4.3Å; I351-Y420 HydrophobicContact CD1-CD1 3.44Å; I351-Y420 VanDerWaalsContact CD1-CD1 3.44Å; I351-Y420 HydrophobicContact CD1-CD2 3.93Å; I351-Y420 HydrophobicContact CD1-CE1 3.19Å; I351-Y420 HydrophobicContact CD1-CE2 3.72Å; I351-Y420 HydrophobicContact CD1-CG 3.76Å; I351-Y420 HydrophobicContact CG1-CE1 4.29Å; I351-Y420 HydrophobicContact CG2-CE1 4.06Å; W381-Y420 HydrophobicContact CZ2-CD2 4.24Å; P384-Y420 HydrophobicContact CG-CG 4.37Å; W415-Y420 AromaticContact CD2-CD1 3.79Å; W415-Y420 HydrophobicContact CD2-CD1 3.79Å; W415-Y420 AromaticContact CE2-CD1 3.95Å; W415-Y420 AromaticContact CE3-CD1 3.54Å; W415-Y420 HydrophobicContact CE3-CD1 3.54Å; W415-Y420 AromaticContact CE3-CE1 3.98Å; W415-Y420 HydrophobicContact CE3-CE1 3.98Å; W415-Y420 AromaticContact CH2-CD1 3.67Å; W415-Y420 HydrophobicContact CH2-CD1 3.67Å; W415-Y420 HydrophobicContact CH2-CE1 4.4Å; W415-Y420 HydrophobicContact CH2-CG 4.39Å; W415-Y420 AromaticContact CZ2-CD1 3.93Å; W415-Y420 HydrophobicContact CZ2-CD1 3.93Å; W415-Y420 HydrophobicContact CZ2-CG 4.39Å; W415-Y420 AromaticContact CZ3-CD1 3.48Å; W415-Y420 HydrophobicContact CZ3-CD1 3.48Å; W415-Y420 VanDerWaalsContact CZ3-CD1 3.48Å; W415-Y420 AromaticContact CZ3-CE1 3.87Å; W415-Y420 HydrophobicContact CZ3-CE1 3.87Å; W415-Y420 PolarHBondContact NE1-O 3.34Å; W415-Y420 VanDerWaalsContact NE1-O 3.16Å; W415-Y420 WeakPolarHBondContact O-CA 3.5Å; W415-Y420 PolarHBondContact O-N 3.09Å; K416-Y420 HydrophobicContact CB-CE1 4.02Å; K416-Y420 HydrophobicContact CG-CE1 4.1Å; S418-Y420 PolarHBondContact OG-N 3.34Å
421	Q	82.7	Confident	85.9	Confident	115 Å²	115	61.4 Å²	61.4	54%	0.537	30%	0.297	S	S	.	.			trans	-87.7	-29.5	-179.8	58.9	80.7	-1.3	0	0	113.7	S418 G419 E423	S418-Q421 WeakPolarHBondContact O-CG 3.22Å; S418-Q421 PolarHBondContact OG-N 3.27Å; G419-Q421 PolarHBondContact O-N 3.23Å; Q421-E423 PolarHBondContact O-N 3.46Å
422	M	86.3	Confident	84.7	Confident	30 Å²	30	68.4 Å²	68.4	15%	0.148	33%	0.327	C	S	.	.			trans	-64.2	133.7	-169.9	-76.4	177.2	84.3	0	0	112.1	W415 S418 E426 L427	W415-M422 PolarHBondContact NE1-O 3.41Å; S418-M422 VanDerWaalsContact CB-CG 3.47Å; S418-M422 PolarHBondContact OG-N 2.93Å; M422-E426 VanDerWaalsContact CA-OE2 3.26Å; M422-E426 WeakPolarHBondContact CA-OE2 3.49Å; M422-E426 HydrophobicContact CE-CB 3.74Å; M422-L427 HydrophobicContact CB-CD1 4.4Å; M422-L427 HydrophobicContact CB-CD2 4.15Å; M422-L427 HydrophobicContact CB-CG 4Å; M422-L427 HydrophobicContact CE-CD2 4.22Å; M422-L427 HydrophobicContact SD-CD2 4.14Å
423	E	89.3	Confident	83.2	Confident	143 Å²	143	73.2 Å²	73.2	67%	0.668	35%	0.345	S	S	*	.			trans	-87.7	172.4	-179.9	-64.4	-165.8	167.6	0	0	112.5	Q421 D425 E426 L427	Q421-E423 PolarHBondContact O-N 3.46Å; E423-D425 VanDerWaalsContact C-N 3.32Å; E423-D425 PolarHBondContact O-N 3.09Å; E423-E426 PolarHBondContact N-OE2 3.47Å; E423-E426 PolarHBondContact O-N 3.16Å; E423-L427 PolarHBondContact O-N 3.21Å; E423-L427 VanDerWaalsContact O-N 3.11Å
424	K	91.3	Very high	81.1	Confident	77 Å²	77	74 Å²	74	34%	0.335	36%	0.359	S	S	.	.	H	α-helix	trans	-52.3	-48.5	-175.9	175.9	178.7	-73.1	-164.9	0	112.1	P387 V388 D392 L427 L428	P387-K424 HydrophobicContact CB-CB 4.17Å; P387-K424 WeakPolarHBondContact O-CE 3.28Å; V388-K424 HydrophobicContact CG2-CG 4.36Å; D392-K424 VanDerWaalsContact CG-NZ 3.28Å; D392-K424 IonicContact OD1-NZ 2.91Å; D392-K424 PolarHBondContact OD1-NZ 3.37Å; D392-K424 WeakPolarHBondContact OD2-CE 3.3Å; D392-K424 IonicContact OD2-NZ 3.01Å; D392-K424 PolarHBondContact OD2-NZ 2.85Å; K424-L427 PolarHBondContact O-N 3.37Å; K424-L428 HydrophobicContact CD-CD1 4.2Å; K424-L428 HydrophobicContact CG-CD1 3.69Å; K424-L428 HydrophobicContact CG-CG 4.23Å; K424-L428 WeakPolarHBondContact O-CB 3.4Å; K424-L428 VanDerWaalsContact O-CG 3.3Å; K424-L428 WeakPolarHBondContact O-CG 3.41Å; K424-L428 PolarHBondContact O-N 3.03Å
425	D	89.4	Confident	79	Confident	127 Å²	127	80.2 Å²	80.2	68%	0.679	39%	0.385	S	S	*	.	H	α-helix	trans	-69	-37.4	-172.8	-69.4	-28.6	0	0	0	112	E423 L428 S429	E423-D425 VanDerWaalsContact C-N 3.32Å; E423-D425 PolarHBondContact O-N 3.09Å; D425-L428 PolarHBondContact O-N 3.48Å; D425-S429 WeakPolarHBondContact O-CB 3.39Å; D425-S429 PolarHBondContact O-N 3.29Å
426	E	90.2	Very high	76.7	Confident	88 Å²	88	86.4 Å²	86.4	41%	0.411	42%	0.424	S	S	.	.	H	α-helix	trans	-64.9	-43.6	176.1	-58.6	-178.8	126.1	0	0	111.1	M422 E423 S429 Y430	M422-E426 VanDerWaalsContact CA-OE2 3.26Å; M422-E426 WeakPolarHBondContact CA-OE2 3.49Å; M422-E426 HydrophobicContact CE-CB 3.74Å; E423-E426 PolarHBondContact N-OE2 3.47Å; E423-E426 PolarHBondContact O-N 3.16Å; E426-S429 WeakPolarHBondContact O-CB 3.32Å; E426-S429 PolarHBondContact O-N 2.92Å; E426-S429 PolarHBondContact O-OG 3.29Å; E426-Y430 PolarHBondContact O-N 3.3Å
427	L	89.4	Confident	74.4	Confident	0 Å²	0	90.4 Å²	90.4	0%	0	45%	0.448	C	S	.	.	H	α-helix	trans	-67.5	-44	177.1	-70.9	166.7	0	0	0	112.1	F386 P387 V388 L411 Q414 W415 M422 E423 K424 S429 Y430	F386-L427 HydrophobicContact CE2-CD1 4.11Å; P387-L427 HydrophobicContact CG-CD1 3.54Å; V388-L427 HydrophobicContact CG2-CB 3.8Å; V388-L427 HydrophobicContact CG2-CD1 3.95Å; L411-L427 HydrophobicContact CD1-CB 4.29Å; L411-L427 HydrophobicContact CD2-CB 4.19Å; L411-L427 HydrophobicContact CD2-CD2 4.35Å; L411-L427 WeakPolarHBondContact CD2-O 3.47Å; Q414-L427 HydrophobicContact CB-CD2 4.16Å; W415-L427 HydrophobicContact CB-CD1 4Å; W415-L427 HydrophobicContact CB-CD2 3.9Å; W415-L427 HydrophobicContact CG-CD1 4.14Å; M422-L427 HydrophobicContact CB-CD1 4.4Å; M422-L427 HydrophobicContact CB-CD2 4.15Å; M422-L427 HydrophobicContact CB-CG 4Å; M422-L427 HydrophobicContact CE-CD2 4.22Å; M422-L427 HydrophobicContact SD-CD2 4.14Å; E423-L427 PolarHBondContact O-N 3.21Å; E423-L427 VanDerWaalsContact O-N 3.11Å; K424-L427 PolarHBondContact O-N 3.37Å; L427-S429 PolarHBondContact O-N 3.2Å; L427-Y430 VanDerWaalsContact O-CB 3.22Å; L427-Y430 WeakPolarHBondContact O-CB 3.46Å; L427-Y430 PolarHBondContact O-N 2.79Å
428	L	89.1	Confident	72.1	Confident	21 Å²	21	87 Å²	87	11%	0.11	46%	0.455	C	S	.	.	H	α-helix	trans	-65.2	-29	176.7	-70.4	177.4	0	0	0	112.2	V388 D392 I393 V396 K424 D425 Y430 I431 K432	V388-L428 HydrophobicContact CG1-CD2 3.8Å; V388-L428 HydrophobicContact CG1-CG 4.48Å; V388-L428 HydrophobicContact CG2-CG 4.42Å; D392-L428 HydrophobicContact CB-CD1 4.27Å; D392-L428 HydrophobicContact CB-CD2 4.3Å; I393-L428 HydrophobicContact CD1-CD2 4.16Å; V396-L428 HydrophobicContact CG2-CD2 4.47Å; K424-L428 HydrophobicContact CD-CD1 4.2Å; K424-L428 HydrophobicContact CG-CD1 3.69Å; K424-L428 HydrophobicContact CG-CG 4.23Å; K424-L428 WeakPolarHBondContact O-CB 3.4Å; K424-L428 VanDerWaalsContact O-CG 3.3Å; K424-L428 WeakPolarHBondContact O-CG 3.41Å; K424-L428 PolarHBondContact O-N 3.03Å; D425-L428 PolarHBondContact O-N 3.48Å; L428-Y430 PolarHBondContact O-N 3.14Å; L428-I431 HydrophobicContact CD2-CD1 4.4Å; L428-I431 PolarHBondContact O-N 3.06Å; L428-K432 PolarHBondContact O-N 3.24Å
429	S	87.1	Confident	69.7	Low	50 Å²	50	99.9 Å²	99.9	35%	0.35	50%	0.501	S	S	.	.	H	α-helix	trans	-63.8	-28.4	172.9	85.1	0	0	0	0	112.6	D425 E426 L427 K432 R433	D425-S429 WeakPolarHBondContact O-CB 3.39Å; D425-S429 PolarHBondContact O-N 3.29Å; E426-S429 WeakPolarHBondContact O-CB 3.32Å; E426-S429 PolarHBondContact O-N 2.92Å; E426-S429 PolarHBondContact O-OG 3.29Å; L427-S429 PolarHBondContact O-N 3.2Å; S429-K432 PolarHBondContact O-N 3.22Å; S429-R433 PolarHBondContact O-N 2.87Å
430	Y	81.4	Confident	69.2	Low	106 Å²	106	103.5 Å²	103.5	42%	0.416	51%	0.512	S	S	.	.	H	α-helix	trans	-70.9	-29.5	178.6	-134.6	-80	0	0	0	112.8	Q414 E426 L427 L428	Q414-Y430 HydrophobicContact CG-CD1 4.28Å; Q414-Y430 HydrophobicContact CG-CE1 4.22Å; E426-Y430 PolarHBondContact O-N 3.3Å; L427-Y430 VanDerWaalsContact O-CB 3.22Å; L427-Y430 WeakPolarHBondContact O-CB 3.46Å; L427-Y430 PolarHBondContact O-N 2.79Å; L428-Y430 PolarHBondContact O-N 3.14Å
431	I	75.2	Confident	68.5	Low	37 Å²	37	108.3 Å²	108.3	19%	0.19	54%	0.536	C	S	.	.	H	α-helix	trans	-72.4	-34	172.8	-62.5	-176.5	0	0	0	110.9	I393 V396 L407 L411 L428 R433	I393-I431 HydrophobicContact CD1-CD1 3.3Å; V396-I431 HydrophobicContact CG1-CG2 4.4Å; L407-I431 HydrophobicContact CB-CD1 4.43Å; L411-I431 HydrophobicContact CD1-CD1 3.43Å; L411-I431 VanDerWaalsContact CD1-CD1 3.43Å; L411-I431 HydrophobicContact CD1-CG1 3.95Å; L411-I431 HydrophobicContact CD2-CD1 4.31Å; L411-I431 HydrophobicContact CD2-CG1 3.89Å; L411-I431 HydrophobicContact CG-CD1 3.93Å; L411-I431 HydrophobicContact CG-CG1 4.04Å; L428-I431 HydrophobicContact CD2-CD1 4.4Å; L428-I431 PolarHBondContact O-N 3.06Å; I431-R433 VanDerWaalsContact C-N 3.28Å; I431-R433 PolarHBondContact O-N 3.35Å
432	K	65.1	Low	67.7	Low	151 Å²	151	107.9 Å²	107.9	66%	0.657	54%	0.536	S	S	*	.	H	α-helix	trans	-76.2	-12.5	-177.6	-67.8	-178.7	-178.7	178.2	0	113.6	L428 S429 P434	L428-K432 PolarHBondContact O-N 3.24Å; S429-K432 PolarHBondContact O-N 3.22Å; K432-P434 WeakPolarHBondContact O-CD 3.27Å
433	R	55.7	Low	66.6	Low	180 Å²	180	112.5 Å²	112.5	68%	0.679	56%	0.559	S	S	*	*	S	Bend	trans	-82.6	114.9	172.5	-72.6	-176.9	-179.6	-179	1.2	108.6	S429 I431	S429-R433 PolarHBondContact O-N 2.87Å; I431-R433 VanDerWaalsContact C-N 3.28Å; I431-R433 PolarHBondContact O-N 3.35Å
434	P	42.5	Very low	65.2	Low	112 Å²	112	110.6 Å²	110.6	73%	0.727	55%	0.552	S	S	*	*			trans	-58.7	142.6	173.4	-14.2	26.9	0	0	0	109.2	K432 T436	K432-P434 WeakPolarHBondContact O-CD 3.27Å; P434-T436 PolarHBondContact O-N 3.36Å
435	K	42.5	Very low	63.5	Low	173 Å²	173	112.8 Å²	112.8	75%	0.752	57%	0.566	S	S	*	*			trans	-55.6	109	160	-83.4	-176.3	173	-176.1	0	107.1	D437	K435-D437 VanDerWaalsContact C-N 3.26Å; K435-D437 PolarHBondContact O-N 2.74Å; K435-D437 VanDerWaalsContact O-N 3.1Å
436	T	39.8	Very low	61.6	Low	138 Å²	138	111.8 Å²	111.8	85%	0.847	56%	0.558	S	S	*	*			trans	-71.7	95	155.6	47.2	0	0	0	0	105.5	P434 G438	P434-T436 PolarHBondContact O-N 3.36Å; T436-G438 PolarHBondContact O-N 2.99Å
437	D	36	Very low	59.4	Low	132 Å²	132	113.6 Å²	113.6	71%	0.706	57%	0.569	S	S	*	*			trans	-60	106.4	166.2	-72	-33.2	0	0	0	107.3	K435	K435-D437 VanDerWaalsContact C-N 3.26Å; K435-D437 PolarHBondContact O-N 2.74Å; K435-D437 VanDerWaalsContact O-N 3.1Å
438	G	35.8	Very low	56.9	Low	77 Å²	77	123.1 Å²	123.1	79%	0.794	62%	0.617	S	S	*	*			trans	-79.1	114	170.2	0	0	0	0	0	108.9	T436	T436-G438 PolarHBondContact O-N 2.99Å
439	Y	32.8	Very low	54	Low	300 Å²	300	132.4 Å²	132.4	100%	1.176	66%	0.663	S	S	*	*			trans	-68.5	0	159.9	-89.2	-87.9	0	0	0	111.4

Retrieved 439 of 439 residues in 885 ms (Link to these results)

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