A0A087YQS9_POEFO Loading...

Fumarate hydratase, mitochondrial

Catalyzes the hydration of fumarate to L-malate in the tricarboxylic acid (TCA) cycle to facilitate a transition step in the production of energy in the form of NADH.

AlphaFold DB , UniProt , Accession A0A087YQS9, Species POEFO (Poecilia formosa, Amazon molly), Gene FH, Length 499 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	33.2	Very low	30.8	Very low	233 Å²	233	174 Å²	174	100%	1.148	84%	0.84	S	S	*	*				0	121.5	0	-106.2	178.6	-160.2	0	0	108.1
2	F	30.6	Very low	30.7	Very low	173 Å²	173	171.2 Å²	171.2	76%	0.759	83%	0.833	S	S	*	*			trans	52.6	107.9	160.7	-74.4	-92.6	0	0	0	119.5
3	R	31.7	Very low	30.4	Very low	225 Å²	225	166.4 Å²	166.4	85%	0.849	83%	0.825	S	S	*	*				73.3	132.4	90.5	-84.1	-167.8	-178.1	-174.3	0.2	112.4
4	S	33.8	Very low	30.3	Very low	90 Å²	90	164.3 Å²	164.3	63%	0.629	82%	0.819	S	S	*	*			cis	-177.5	160.6	20	67.8	0	0	0	0	113.7
5	L	33.8	Very low	30.5	Very low	144 Å²	144	164.7 Å²	164.7	75%	0.754	82%	0.824	S	S	*	*			trans	72.6	141	139.6	-71.9	163.1	0	0	0	118.6
6	R	31.8	Very low	30.7	Very low	220 Å²	220	164.7 Å²	164.7	83%	0.83	83%	0.826	S	S	*	*			cis	-156.9	154.2	13.1	-93.3	150.8	-172.7	-138.5	3.6	106
7	S	28.9	Very low	30.8	Very low	111 Å²	111	163.1 Å²	163.1	78%	0.776	83%	0.827	S	S	*	*				-174.7	135.9	58.1	51.6	0	0	0	0	109.6
8	V	30	Very low	30.7	Very low	146 Å²	146	163.8 Å²	163.8	89%	0.885	83%	0.832	S	S	*	*			trans	-136.8	130.3	160.7	175.5	0	0	0	0	106.5
9	Q	30.3	Very low	30.9	Very low	190 Å²	190	164.8 Å²	164.8	89%	0.888	83%	0.834	S	S	*	*			trans	-64.8	133.9	-176.3	-79.6	168.7	-41.8	0	0	112.1
10	Q	28.2	Very low	31.1	Very low	172 Å²	172	168.9 Å²	168.9	80%	0.804	84%	0.838	S	S	*	*			trans	-74.8	136.6	165.3	-86.3	169.9	-41.1	0	0	110.5
11	F	26.8	Very low	31	Very low	210 Å²	210	168.6 Å²	168.6	92%	0.921	84%	0.839	S	S	*	*			trans	-133.4	106.5	145.6	-107.1	-86.8	0	0	0	108.3
12	N	29.3	Very low	31.1	Very low	140 Å²	140	167.1 Å²	167.1	75%	0.749	83%	0.829	S	S	*	*			trans	-91.6	134.6	159.4	-93	-21.7	0	0	0	107.2
13	C	27.5	Very low	31.5	Very low	109 Å²	109	162.9 Å²	162.9	74%	0.736	83%	0.826	S	S	*	*				175.1	137.2	114.8	-112.2	0	0	0	0	113.5
14	N	28.5	Very low	31.7	Very low	137 Å²	137	160.1 Å²	160.1	73%	0.733	83%	0.828	S	S	*	*			trans	84.8	83.7	144	-61.1	-14.5	0	0	0	119.8	L16	N14-L16 PolarHBondContact O-N 3.48Å
15	L	33.6	Very low	31.5	Very low	171 Å²	171	161.1 Å²	161.1	90%	0.895	84%	0.835	S	S	*	*			trans	-50.7	107.8	133.5	-96.4	77.9	0	0	0	109
16	L	33.3	Very low	31.3	Very low	164 Å²	164	163.4 Å²	163.4	86%	0.859	84%	0.839	S	S	*	*			trans	176.7	57.2	150.2	-97.2	161	0	0	0	110.4	N14	N14-L16 PolarHBondContact O-N 3.48Å
17	T	32	Very low	31.1	Very low	138 Å²	138	159.7 Å²	159.7	85%	0.847	84%	0.835	S	S	*	*			trans	-157.3	66.5	166.3	6.1	0	0	0	0	110.2
18	L	30.2	Very low	31.2	Very low	175 Å²	175	163.9 Å²	163.9	92%	0.916	84%	0.839	S	S	*	*			trans	-147.2	39.1	172.7	-110.2	158.4	0	0	0	111.8
19	Q	34.1	Very low	31.2	Very low	184 Å²	184	162.4 Å²	162.4	86%	0.86	83%	0.825	S	S	*	*	S	Bend	trans	-141.5	86.9	167.1	-82.4	-173.2	-20.3	0	0	109
20	R	34.4	Very low	31.1	Very low	245 Å²	245	158.5 Å²	158.5	93%	0.925	82%	0.818	S	S	*	*	S	Bend	trans	158.1	87.5	154.4	-91.1	165.9	-169.9	-147.6	3.7	107.6
21	L	30	Very low	31.2	Very low	164 Å²	164	155.7 Å²	155.7	86%	0.859	81%	0.813	S	S	*	*			trans	-177.3	65.9	154.3	-95.5	156.6	0	0	0	106.3
22	H	34.6	Very low	31.7	Very low	202 Å²	202	150.1 Å²	150.1	94%	0.935	80%	0.8	S	S	*	*			trans	-133.5	76.2	164.9	-99.7	52.4	0	0	0	106.7
23	A	39.8	Very low	31.9	Very low	84 Å²	84	152.9 Å²	152.9	69%	0.694	81%	0.805	S	S	*	*			trans	-157.4	130.4	162.2	0	0	0	0	0	106.8
24	N	34.3	Very low	32.5	Very low	166 Å²	166	156.3 Å²	156.3	89%	0.888	81%	0.812	S	S	*	*			trans	86.1	58.6	179.5	-55.4	-22.2	0	0	0	117.4
25	S	30.5	Very low	33.1	Very low	112 Å²	112	154.1 Å²	154.1	78%	0.783	81%	0.813	S	S	*	*			trans	-105.9	101.9	138	43.9	0	0	0	0	107.6	L27	S25-L27 VanDerWaalsContact C-N 3.34Å; S25-L27 PolarHBondContact O-N 3.33Å
26	K	29.7	Very low	33.6	Very low	192 Å²	192	149.2 Å²	149.2	84%	0.835	80%	0.804	S	S	*	*			trans	-60.5	103.3	165.3	-82.6	-178.9	177	178.2	0	106.7	F28	K26-F28 VanDerWaalsContact C-N 3.34Å; K26-F28 PolarHBondContact O-N 3.27Å
27	L	28	Very low	35	Very low	142 Å²	142	144.4 Å²	144.4	74%	0.743	78%	0.784	S	S	*	*			trans	-57.6	100.3	166.2	-154.6	75.5	0	0	0	106.3	S25 I29	S25-L27 VanDerWaalsContact C-N 3.34Å; S25-L27 PolarHBondContact O-N 3.33Å; L27-I29 HydrophobicContact CB-CG1 4.36Å; L27-I29 HydrophobicContact CD2-CD1 3.91Å; L27-I29 HydrophobicContact CD2-CG1 3.61Å; L27-I29 HydrophobicContact CG-CG1 3.94Å; L27-I29 PolarHBondContact O-N 2.98Å
28	F	29.9	Very low	37.8	Very low	199 Å²	199	145.4 Å²	145.4	87%	0.873	78%	0.779	S	S	*	*			trans	-66.6	82.4	160.4	-105.1	-89.1	0	0	0	105.8	K26 C30	K26-F28 VanDerWaalsContact C-N 3.34Å; K26-F28 PolarHBondContact O-N 3.27Å; F28-C30 PolarHBondContact O-N 3.33Å
29	I	30.1	Very low	40.9	Very low	115 Å²	115	142.1 Å²	142.1	59%	0.59	76%	0.757	S	S	*	*			trans	-66.9	91.8	157.6	-58	172.7	0	0	0	103.7	L27 T31	L27-I29 HydrophobicContact CB-CG1 4.36Å; L27-I29 HydrophobicContact CD2-CD1 3.91Å; L27-I29 HydrophobicContact CD2-CG1 3.61Å; L27-I29 HydrophobicContact CG-CG1 3.94Å; L27-I29 PolarHBondContact O-N 2.98Å; I29-T31 HydrophobicContact CG2-CG2 3.6Å; I29-T31 PolarHBondContact O-N 2.91Å
30	C	28.7	Very low	43.8	Very low	108 Å²	108	135 Å²	135	73%	0.73	72%	0.723	S	S	*	*			trans	-64.5	87.6	156.2	-160.2	0	0	0	0	104.9	F28 S32	F28-C30 PolarHBondContact O-N 3.33Å; C30-S32 PolarHBondContact O-N 3.27Å
31	T	30.6	Very low	46.8	Very low	113 Å²	113	127.9 Å²	127.9	69%	0.693	70%	0.702	S	S	*	*			trans	-67	75.8	157	41.4	0	0	0	0	105.7	I29 K33	I29-T31 HydrophobicContact CG2-CG2 3.6Å; I29-T31 PolarHBondContact O-N 2.91Å; T31-K33 PolarHBondContact O-N 2.98Å
32	S	36.1	Very low	50	Low	93 Å²	93	120.5 Å²	120.5	65%	0.65	66%	0.663	S	S	*	*			trans	-56.1	101.6	151	59.1	0	0	0	0	104.2	C30 M34	C30-S32 PolarHBondContact O-N 3.27Å; S32-M34 VanDerWaalsContact C-N 3.25Å; S32-M34 PolarHBondContact O-N 2.95Å
33	K	34.6	Very low	52.8	Low	198 Å²	198	119 Å²	119	86%	0.861	65%	0.649	S	S	*	*			trans	-48	105.3	158.2	-82	175.6	171.4	177.7	0	104.6	T31 A35	T31-K33 PolarHBondContact O-N 2.98Å; K33-A35 PolarHBondContact O-N 3.28Å
34	M	40	Very low	55.2	Low	181 Å²	181	116 Å²	116	89%	0.892	62%	0.622	S	S	*	*			trans	-56.7	102.2	150.5	-75.1	-166.4	-162.1	0	0	102.8	S32 G36	S32-M34 VanDerWaalsContact C-N 3.25Å; S32-M34 PolarHBondContact O-N 2.95Å; M34-G36 VanDerWaalsContact C-N 3.33Å; M34-G36 PolarHBondContact O-N 3.47Å
35	A	41.3	Very low	57.7	Low	91 Å²	91	114.6 Å²	114.6	75%	0.752	62%	0.619	S	S	*	*			trans	-52.3	110.9	164.4	0	0	0	0	0	104.2	K33 S37	K33-A35 PolarHBondContact O-N 3.28Å; A35-S37 PolarHBondContact O-N 3.36Å
36	G	42.5	Very low	60.4	Low	67 Å²	67	117.6 Å²	117.6	69%	0.691	62%	0.618	S	S	*	*			trans	-56.3	111.3	178.9	0	0	0	0	0	106	M34 E38	M34-G36 VanDerWaalsContact C-N 3.33Å; M34-G36 PolarHBondContact O-N 3.47Å; G36-E38 PolarHBondContact O-N 3.2Å
37	S	63.2	Low	63.4	Low	63 Å²	63	109.4 Å²	109.4	44%	0.441	59%	0.589	S	S	.	*			trans	-55.8	115.2	178.7	52.5	0	0	0	0	106.7	A35 F39	A35-S37 PolarHBondContact O-N 3.36Å; S37-F39 WeakPolarHBondContact O-CD2 3.33Å; S37-F39 WeakPolarHBondContact O-CE2 3.47Å; S37-F39 PolarHBondContact O-N 3.33Å; S37-F39 VanDerWaalsContact OG-CE2 3.26Å; S37-F39 WeakPolarHBondContact OG-CE2 3.2Å; S37-F39 WeakPolarHBondContact OG-CZ 3.38Å
38	E	90.9	Very high	66.6	Low	159 Å²	159	109.4 Å²	109.4	74%	0.743	59%	0.585	S	S	*	*			trans	-58.6	141.6	173	-69	-171	163.1	0	0	108	G36 A53	G36-E38 PolarHBondContact O-N 3.2Å; E38-A53 HydrophobicContact CB-CB 3.87Å; E38-A53 VanDerWaalsContact O-CB 3.25Å; E38-A53 WeakPolarHBondContact O-CB 3.17Å; E38-A53 PolarHBondContact O-N 3.47Å
39	F	95	Very high	69.8	Low	107 Å²	107	100.7 Å²	100.7	47%	0.469	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	141.8	179.3	-66	-84.5	0	0	0	109.3	S37 K50 V51 P52	S37-F39 WeakPolarHBondContact O-CD2 3.33Å; S37-F39 WeakPolarHBondContact O-CE2 3.47Å; S37-F39 PolarHBondContact O-N 3.33Å; S37-F39 VanDerWaalsContact OG-CE2 3.26Å; S37-F39 WeakPolarHBondContact OG-CE2 3.2Å; S37-F39 WeakPolarHBondContact OG-CZ 3.38Å; F39-K50 HydrophobicContact CB-CB 4.12Å; F39-K50 HydrophobicContact CB-CG 4.48Å; F39-K50 HydrophobicContact CD1-CB 3.84Å; F39-K50 HydrophobicContact CE1-CB 4.49Å; F39-K50 HydrophobicContact CG-CB 4.05Å; F39-V51 CarbonylContact C-O 3.23Å; F39-V51 VanDerWaalsContact CA-O 3.28Å; F39-V51 WeakPolarHBondContact CA-O 3.05Å; F39-P52 HydrophobicContact CD1-CG 4.31Å; F39-P52 HydrophobicContact CE1-CG 4.01Å
40	R	96.5	Very high	73	Confident	35 Å²	35	102 Å²	102	13%	0.132	55%	0.548	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	150.4	160.8	68.8	-179.1	-174	-80.1	-0.5	109.9	E42 V51 P52 K55 Y57	R40-E42 HydrophobicContact CG-CG 4.48Å; R40-E42 IonicContact CZ-OE1 2.86Å; R40-E42 IonicContact NE-OE1 2.68Å; R40-E42 PolarHBondContact NE-OE1 2.96Å; R40-E42 IonicContact NH2-OE1 3.37Å; R40-E42 PolarHBondContact NH2-OE1 3.04Å; R40-V51 HydrophobicContact CG-CB 4.01Å; R40-V51 PolarHBondContact N-O 3.35Å; R40-V51 PolarHBondContact O-N 3.07Å; R40-P52 PolarHBondContact NH1-O 3.44Å; R40-K55 VanDerWaalsContact CZ-O 3.32Å; R40-K55 PolarHBondContact NH1-O 2.96Å; R40-K55 PolarHBondContact NH2-O 3.23Å; R40-K55 VanDerWaalsContact NH2-O 3.07Å; R40-Y57 PolarHBondContact NH2-O 3.19Å
41	I	96.7	Very high	76.3	Confident	95 Å²	95	96.8 Å²	96.8	49%	0.487	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	122.2	174.2	-56.1	-57.5	0	0	0	108.2	E48 K50	I41-E48 HydrophobicContact CG2-CB 3.88Å; I41-E48 HydrophobicContact CG2-CG 3.96Å; I41-K50 HydrophobicContact CD1-CG 3.7Å
42	E	97.2	Very high	79.5	Confident	9 Å²	9	92.5 Å²	92.5	4%	0.042	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	162.8	168.5	-70.9	-170	-151.5	0	0	110	R40 E48 L49 V51 G58 A59 G159	R40-E42 HydrophobicContact CG-CG 4.48Å; R40-E42 IonicContact CZ-OE1 2.86Å; R40-E42 IonicContact NE-OE1 2.68Å; R40-E42 PolarHBondContact NE-OE1 2.96Å; R40-E42 IonicContact NH2-OE1 3.37Å; R40-E42 PolarHBondContact NH2-OE1 3.04Å; E42-E48 CarbonylContact O-C 3.41Å; E42-E48 WeakPolarHBondContact O-CA 3.4Å; E42-L49 PolarHBondContact N-O 3.42Å; E42-L49 PolarHBondContact O-N 3.36Å; E42-V51 HydrophobicContact CB-CG2 3.96Å; E42-V51 HydrophobicContact CG-CG2 4.04Å; E42-G58 WeakPolarHBondContact OE2-CA 3.42Å; E42-A59 HydrophobicContact CB-CB 3.83Å; E42-A59 PolarHBondContact OE2-N 2.84Å; E42-G159 WeakPolarHBondContact OE1-CA 3.33Å
43	R	92.3	Very high	82.3	Confident	171 Å²	171	90 Å²	90	65%	0.645	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	133.6	-177	-178.1	171.6	177.2	-176.4	0.1	112	G47 K161	R43-G47 WeakPolarHBondContact CA-O 3.4Å; R43-K161 PolarHBondContact O-NZ 3.08Å
44	D	91.5	Very high	85.3	Confident	21 Å²	21	85.8 Å²	85.8	11%	0.112	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-177.9	162.2	68.6	20.1	0	0	0	109.9	F46 G47 A59 R63	D44-F46 PolarHBondContact O-N 3.22Å; D44-F46 WeakPolarHBondContact OD1-CA 3.22Å; D44-F46 WeakPolarHBondContact OD1-CB 3.4Å; D44-F46 PolarHBondContact OD1-N 3.11Å; D44-G47 PolarHBondContact N-O 3.25Å; D44-G47 PolarHBondContact O-N 3.25Å; D44-G47 VanDerWaalsContact O-N 3.17Å; D44-G47 PolarHBondContact OD1-N 2.95Å; D44-A59 HydrophobicContact CB-CB 4.26Å; D44-R63 IonicContact OD1-NH2 2.98Å; D44-R63 PolarHBondContact OD1-NH2 3.06Å; D44-R63 VanDerWaalsContact OD1-NH2 3.11Å; D44-R63 IonicContact OD2-CZ 3.68Å; D44-R63 IonicContact OD2-NE 3.75Å; D44-R63 PolarHBondContact OD2-NE 3.38Å; D44-R63 IonicContact OD2-NH2 3.26Å; D44-R63 PolarHBondContact OD2-NH2 2.99Å
45	T	86.1	Confident	88	Confident	136 Å²	136	79.1 Å²	79.1	83%	0.834	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-16.7	179.6	50.3	0	0	0	0	113.7
46	F	86.8	Confident	90.8	Very high	174 Å²	174	76.5 Å²	76.5	76%	0.763	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-2	177.5	-62.6	-35.5	0	0	0	113.6	D44	D44-F46 PolarHBondContact O-N 3.22Å; D44-F46 WeakPolarHBondContact OD1-CA 3.22Å; D44-F46 WeakPolarHBondContact OD1-CB 3.4Å; D44-F46 PolarHBondContact OD1-N 3.11Å
47	G	93.4	Very high	93.4	Very high	21 Å²	21	74.7 Å²	74.7	22%	0.216	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	126.9	-162.1	171.1	0	0	0	0	0	113.6	R43 D44	R43-G47 WeakPolarHBondContact CA-O 3.4Å; D44-G47 PolarHBondContact N-O 3.25Å; D44-G47 PolarHBondContact O-N 3.25Å; D44-G47 VanDerWaalsContact O-N 3.17Å; D44-G47 PolarHBondContact OD1-N 2.95Å
48	E	95.8	Very high	95.1	Very high	141 Å²	141	71.7 Å²	71.7	66%	0.659	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	145.1	-175.3	-66	-176.8	172.4	0	0	112.3	I41 E42	I41-E48 HydrophobicContact CG2-CB 3.88Å; I41-E48 HydrophobicContact CG2-CG 3.96Å; E42-E48 CarbonylContact O-C 3.41Å; E42-E48 WeakPolarHBondContact O-CA 3.4Å
49	L	96.5	Very high	95.4	Very high	16 Å²	16	64.2 Å²	64.2	8%	0.084	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	143.1	175.5	-73.8	174.9	0	0	0	110.6	E42 A59 V62 R63 M66	E42-L49 PolarHBondContact N-O 3.42Å; E42-L49 PolarHBondContact O-N 3.36Å; L49-A59 HydrophobicContact CD1-CB 4.31Å; L49-A59 WeakPolarHBondContact CD1-O 3.35Å; L49-V62 HydrophobicContact CB-CG1 4.26Å; L49-V62 HydrophobicContact CD1-CB 4.2Å; L49-V62 HydrophobicContact CD1-CG1 4.11Å; L49-V62 HydrophobicContact CD2-CG1 4.31Å; L49-V62 HydrophobicContact CG-CG1 4.49Å; L49-R63 HydrophobicContact CD1-CB 3.87Å; L49-M66 HydrophobicContact CD2-SD 3.79Å
50	K	97.3	Very high	95.6	Very high	142 Å²	142	62.7 Å²	62.7	62%	0.617	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	117.2	172.3	-69.3	-179	179.2	-178.6	0	109.2	F39 I41	F39-K50 HydrophobicContact CB-CB 4.12Å; F39-K50 HydrophobicContact CB-CG 4.48Å; F39-K50 HydrophobicContact CD1-CB 3.84Å; F39-K50 HydrophobicContact CE1-CB 4.49Å; F39-K50 HydrophobicContact CG-CB 4.05Å; I41-K50 HydrophobicContact CD1-CG 3.7Å
51	V	97.9	Very high	95.7	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.4	177.5	-171.7	0	0	0	0	108.6	F39 R40 E42 A53 Y57 V62	F39-V51 CarbonylContact C-O 3.23Å; F39-V51 VanDerWaalsContact CA-O 3.28Å; F39-V51 WeakPolarHBondContact CA-O 3.05Å; R40-V51 HydrophobicContact CG-CB 4.01Å; R40-V51 PolarHBondContact N-O 3.35Å; R40-V51 PolarHBondContact O-N 3.07Å; E42-V51 HydrophobicContact CB-CG2 3.96Å; E42-V51 HydrophobicContact CG-CG2 4.04Å; V51-A53 PolarHBondContact O-N 3.45Å; V51-Y57 HydrophobicContact CG1-CD2 4.05Å; V51-Y57 HydrophobicContact CG1-CE2 4.03Å; V51-Y57 WeakPolarHBondContact CG1-O 3.37Å; V51-V62 HydrophobicContact CB-CG2 4.37Å; V51-V62 HydrophobicContact CG1-CG2 4.2Å; V51-V62 HydrophobicContact CG2-CG2 3.96Å
52	P	97.7	Very high	95.8	Very high	22 Å²	22	57.2 Å²	57.2	14%	0.143	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	132.5	176.9	-25.3	34.4	0	0	0	111.5	F39 R40 D54 K55	F39-P52 HydrophobicContact CD1-CG 4.31Å; F39-P52 HydrophobicContact CE1-CG 4.01Å; R40-P52 PolarHBondContact NH1-O 3.44Å; P52-D54 WeakPolarHBondContact CB-OD1 3.43Å; P52-D54 PolarHBondContact O-N 2.95Å; P52-K55 HydrophobicContact CB-CB 4.29Å; P52-K55 HydrophobicContact CB-CG 3.87Å; P52-K55 HydrophobicContact CG-CG 4.37Å; P52-K55 PolarHBondContact O-N 3.31Å; P52-K55 VanDerWaalsContact O-N 3.13Å
53	A	95.9	Very high	95.8	Very high	42 Å²	42	59.4 Å²	59.4	35%	0.347	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.4	-174.2	0	0	0	0	0	112.6	E38 V51 K55	E38-A53 HydrophobicContact CB-CB 3.87Å; E38-A53 VanDerWaalsContact O-CB 3.25Å; E38-A53 WeakPolarHBondContact O-CB 3.17Å; E38-A53 PolarHBondContact O-N 3.47Å; V51-A53 PolarHBondContact O-N 3.45Å; A53-K55 VanDerWaalsContact C-N 3.28Å; A53-K55 PolarHBondContact O-N 3.36Å
54	D	96.4	Very high	96.1	Very high	108 Å²	108	51.7 Å²	51.7	58%	0.578	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	5.8	178	69.1	-40.8	0	0	0	113.9	P52 H124	P52-D54 WeakPolarHBondContact CB-OD1 3.43Å; P52-D54 PolarHBondContact O-N 2.95Å; D54-H124 PolarHBondContact O-CE1 3.33Å
55	K	98.1	Very high	96.4	Very high	42 Å²	42	53 Å²	53	18%	0.183	27%	0.271	C	S	.	.			trans	-119.9	129.8	-176.5	-62.3	-63.9	178.6	-177.1	0	113	R40 P52 A53 Y57 D123	R40-K55 VanDerWaalsContact CZ-O 3.32Å; R40-K55 PolarHBondContact NH1-O 2.96Å; R40-K55 PolarHBondContact NH2-O 3.23Å; R40-K55 VanDerWaalsContact NH2-O 3.07Å; P52-K55 HydrophobicContact CB-CB 4.29Å; P52-K55 HydrophobicContact CB-CG 3.87Å; P52-K55 HydrophobicContact CG-CG 4.37Å; P52-K55 PolarHBondContact O-N 3.31Å; P52-K55 VanDerWaalsContact O-N 3.13Å; A53-K55 VanDerWaalsContact C-N 3.28Å; A53-K55 PolarHBondContact O-N 3.36Å; K55-Y57 HydrophobicContact CB-CD1 3.83Å; K55-Y57 HydrophobicContact CB-CD2 4.41Å; K55-Y57 HydrophobicContact CB-CE1 3.48Å; K55-Y57 VanDerWaalsContact CB-CE1 3.48Å; K55-Y57 HydrophobicContact CB-CE2 4.06Å; K55-Y57 HydrophobicContact CB-CG 4.3Å; K55-Y57 HydrophobicContact CD-CE1 3.82Å; K55-Y57 HydrophobicContact CG-CD1 4.38Å; K55-Y57 HydrophobicContact CG-CE1 3.58Å; K55-Y57 PolarHBondContact O-N 3.23Å; K55-D123 PolarHBondContact NZ-O 3.4Å
56	Y	98.8	Very high	96.9	Very high	36 Å²	36	50.8 Å²	50.8	14%	0.141	25%	0.253	C	S	.	.	S	Bend	trans	-74	-16.7	176.8	-64.8	-65.8	0	0	0	115.2	L121 H124 E144 N148 R149 E152 L158	Y56-L121 HydrophobicContact CD2-CD2 3.96Å; Y56-L121 HydrophobicContact CE2-CD2 3.75Å; Y56-H124 AromaticContact CD2-CD2 3.69Å; Y56-H124 AromaticContact CD2-CE1 3.34Å; Y56-H124 WeakPolarHBondContact CD2-CE1 3.32Å; Y56-H124 AromaticContact CD2-CG 3.86Å; Y56-H124 AromaticContact CD2-ND1 3.67Å; Y56-H124 AromaticContact CD2-NE2 3.36Å; Y56-H124 WeakPolarHBondContact CD2-NE2 3.41Å; Y56-H124 AromaticContact CE2-CE1 3.85Å; Y56-H124 AromaticContact CE2-NE2 3.69Å; Y56-H124 PolarHBondContact N-ND1 3.24Å; Y56-E144 CarbonylContact O-C 3.22Å; Y56-N148 HydrophobicContact CD1-CB 4.1Å; Y56-N148 WeakPolarHBondContact O-CB 2.96Å; Y56-N148 PolarHBondContact O-ND2 3.35Å; Y56-R149 HydrophobicContact CD1-CB 4.28Å; Y56-R149 HydrophobicContact CE1-CB 4.39Å; Y56-E152 VanDerWaalsContact CE1-OE2 3.27Å; Y56-E152 WeakPolarHBondContact CE1-OE2 3.41Å; Y56-E152 VanDerWaalsContact CZ-OE2 3.3Å; Y56-E152 PolarHBondContact OH-OE2 3.41Å; Y56-L158 HydrophobicContact CD1-CD2 3.92Å; Y56-L158 HydrophobicContact CE1-CD2 4.07Å
57	Y	98.6	Very high	97.5	Very high	29 Å²	29	47.6 Å²	47.6	11%	0.114	24%	0.244	C	C	.	.			trans	-70.8	160.2	173.8	60.9	-110.5	0	0	0	111.2	R40 V51 K55 T61 V62 H124 P126	R40-Y57 PolarHBondContact NH2-O 3.19Å; V51-Y57 HydrophobicContact CG1-CD2 4.05Å; V51-Y57 HydrophobicContact CG1-CE2 4.03Å; V51-Y57 WeakPolarHBondContact CG1-O 3.37Å; K55-Y57 HydrophobicContact CB-CD1 3.83Å; K55-Y57 HydrophobicContact CB-CD2 4.41Å; K55-Y57 HydrophobicContact CB-CE1 3.48Å; K55-Y57 VanDerWaalsContact CB-CE1 3.48Å; K55-Y57 HydrophobicContact CB-CE2 4.06Å; K55-Y57 HydrophobicContact CB-CG 4.3Å; K55-Y57 HydrophobicContact CD-CE1 3.82Å; K55-Y57 HydrophobicContact CG-CD1 4.38Å; K55-Y57 HydrophobicContact CG-CE1 3.58Å; K55-Y57 PolarHBondContact O-N 3.23Å; Y57-T61 HydrophobicContact CD1-CG2 4.36Å; Y57-T61 HydrophobicContact CD2-CG2 3.92Å; Y57-T61 HydrophobicContact CG-CG2 3.75Å; Y57-V62 HydrophobicContact CD2-CG2 4.08Å; Y57-V62 HydrophobicContact CE2-CG2 3.73Å; Y57-H124 HydrophobicContact CD1-CB 4.38Å; Y57-H124 WeakPolarHBondContact CD1-O 3.37Å; Y57-P126 HydrophobicContact CD1-CG 4.24Å; Y57-P126 HydrophobicContact CE1-CG 4.06Å
58	G	98.3	Very high	97.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.246	C	C	.	.			trans	-119.3	-158.4	-172.4	0	0	0	0	0	114.7	E42 Q60 T61 V62 E144	E42-G58 WeakPolarHBondContact OE2-CA 3.42Å; G58-Q60 PolarHBondContact O-N 3.49Å; G58-T61 PolarHBondContact O-N 2.97Å; G58-V62 PolarHBondContact O-N 2.84Å; G58-V62 VanDerWaalsContact O-N 3.1Å; G58-E144 VanDerWaalsContact C-OE1 3.23Å; G58-E144 WeakPolarHBondContact CA-OE1 3.28Å; G58-E144 WeakPolarHBondContact CA-OE2 3.25Å; G58-E144 VanDerWaalsContact N-CD 3.32Å; G58-E144 PolarHBondContact N-OE2 3.04Å
59	A	97.9	Very high	97.8	Very high	2 Å²	2	50.6 Å²	50.6	2%	0.017	25%	0.249	C	C	.	.	H	α-helix	trans	-56.8	-41.5	-177.4	0	0	0	0	0	113.7	E42 D44 L49 T61 V62 R63 E144	E42-A59 HydrophobicContact CB-CB 3.83Å; E42-A59 PolarHBondContact OE2-N 2.84Å; D44-A59 HydrophobicContact CB-CB 4.26Å; L49-A59 HydrophobicContact CD1-CB 4.31Å; L49-A59 WeakPolarHBondContact CD1-O 3.35Å; A59-T61 VanDerWaalsContact C-N 3.34Å; A59-T61 PolarHBondContact O-N 3.09Å; A59-V62 PolarHBondContact O-N 2.98Å; A59-R63 WeakPolarHBondContact O-CB 3.22Å; A59-R63 PolarHBondContact O-N 3.43Å; A59-E144 PolarHBondContact N-OE1 3.36Å
60	Q	98.1	Very high	97.9	Very high	74 Å²	74	54.3 Å²	54.3	35%	0.346	27%	0.268	S	S	.	.	H	α-helix	trans	-67.3	-38.3	-177.5	-62.3	-179.3	-38.8	0	0	111.2	G58 R63 S64 M140 E144	G58-Q60 PolarHBondContact O-N 3.49Å; Q60-R63 PolarHBondContact O-N 2.76Å; Q60-S64 WeakPolarHBondContact O-CB 3.42Å; Q60-S64 PolarHBondContact O-N 3.09Å; Q60-S64 PolarHBondContact O-OG 2.75Å; Q60-M140 HydrophobicContact CB-CB 4.34Å; Q60-M140 HydrophobicContact CB-CE 4.34Å; Q60-M140 HydrophobicContact CB-SD 4.33Å; Q60-M140 HydrophobicContact CG-SD 4.34Å; Q60-M140 PolarHBondContact OE1-SD 2.77Å; Q60-M140 VanDerWaalsContact OE1-SD 3.36Å; Q60-E144 VanDerWaalsContact CB-OE1 3.31Å; Q60-E144 WeakPolarHBondContact CB-OE1 3.42Å; Q60-E144 PolarHBondContact N-OE1 2.99Å
61	T	98.6	Very high	97.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.7	-45.2	174.8	-57.4	0	0	0	0	111.5	Y57 G58 A59 R63 S64 T65 P126 L127 N141 E144	Y57-T61 HydrophobicContact CD1-CG2 4.36Å; Y57-T61 HydrophobicContact CD2-CG2 3.92Å; Y57-T61 HydrophobicContact CG-CG2 3.75Å; G58-T61 PolarHBondContact O-N 2.97Å; A59-T61 VanDerWaalsContact C-N 3.34Å; A59-T61 PolarHBondContact O-N 3.09Å; T61-R63 PolarHBondContact O-N 3.26Å; T61-S64 WeakPolarHBondContact O-CB 3.21Å; T61-S64 PolarHBondContact O-N 2.91Å; T61-S64 VanDerWaalsContact O-N 3.09Å; T61-T65 PolarHBondContact O-N 3.5Å; T61-P126 HydrophobicContact CG2-CG 3.68Å; T61-L127 HydrophobicContact CG2-CD1 4.49Å; T61-L127 HydrophobicContact CG2-CD2 4.09Å; T61-L127 HydrophobicContact CG2-CG 4.19Å; T61-N141 HydrophobicContact CG2-CB 4.17Å; T61-N141 VanDerWaalsContact OG1-CA 3.24Å; T61-N141 WeakPolarHBondContact OG1-CA 3.45Å; T61-N141 VanDerWaalsContact OG1-CB 3.31Å; T61-N141 WeakPolarHBondContact OG1-CB 3.49Å; T61-N141 PolarHBondContact OG1-ND2 3.21Å; T61-E144 VanDerWaalsContact CB-OE2 3.29Å; T61-E144 WeakPolarHBondContact CB-OE2 3.26Å; T61-E144 PolarHBondContact N-OE2 3.4Å; T61-E144 PolarHBondContact OG1-OE2 3.01Å
62	V	98.3	Very high	97.9	Very high	16 Å²	16	51.7 Å²	51.7	10%	0.097	28%	0.281	C	S	.	.	H	α-helix	trans	-61.3	-43.8	176.4	172.6	0	0	0	0	111.3	L49 V51 Y57 G58 A59 S64 T65 M66	L49-V62 HydrophobicContact CB-CG1 4.26Å; L49-V62 HydrophobicContact CD1-CB 4.2Å; L49-V62 HydrophobicContact CD1-CG1 4.11Å; L49-V62 HydrophobicContact CD2-CG1 4.31Å; L49-V62 HydrophobicContact CG-CG1 4.49Å; V51-V62 HydrophobicContact CB-CG2 4.37Å; V51-V62 HydrophobicContact CG1-CG2 4.2Å; V51-V62 HydrophobicContact CG2-CG2 3.96Å; Y57-V62 HydrophobicContact CD2-CG2 4.08Å; Y57-V62 HydrophobicContact CE2-CG2 3.73Å; G58-V62 PolarHBondContact O-N 2.84Å; G58-V62 VanDerWaalsContact O-N 3.1Å; A59-V62 PolarHBondContact O-N 2.98Å; V62-S64 PolarHBondContact O-N 3.41Å; V62-T65 PolarHBondContact O-N 3.1Å; V62-T65 PolarHBondContact O-OG1 2.9Å; V62-M66 HydrophobicContact CG1-SD 4.26Å; V62-M66 VanDerWaalsContact O-CG 3.31Å; V62-M66 WeakPolarHBondContact O-CG 3.37Å; V62-M66 PolarHBondContact O-N 3.25Å; V62-M66 VanDerWaalsContact O-N 3.15Å
63	R	97.9	Very high	97.8	Very high	54 Å²	54	56 Å²	56	20%	0.204	31%	0.309	C	S	.	.	H	α-helix	trans	-56.7	-41.2	174.2	-173.2	69.2	66.1	-164.9	0.8	111.4	D44 L49 A59 Q60 T61 M66 N67	D44-R63 IonicContact OD1-NH2 2.98Å; D44-R63 PolarHBondContact OD1-NH2 3.06Å; D44-R63 VanDerWaalsContact OD1-NH2 3.11Å; D44-R63 IonicContact OD2-CZ 3.68Å; D44-R63 IonicContact OD2-NE 3.75Å; D44-R63 PolarHBondContact OD2-NE 3.38Å; D44-R63 IonicContact OD2-NH2 3.26Å; D44-R63 PolarHBondContact OD2-NH2 2.99Å; L49-R63 HydrophobicContact CD1-CB 3.87Å; A59-R63 WeakPolarHBondContact O-CB 3.22Å; A59-R63 PolarHBondContact O-N 3.43Å; Q60-R63 PolarHBondContact O-N 2.76Å; T61-R63 PolarHBondContact O-N 3.26Å; R63-M66 WeakPolarHBondContact O-CB 3.38Å; R63-M66 PolarHBondContact O-N 3.37Å; R63-N67 PolarHBondContact O-N 3.47Å; R63-N67 PolarHBondContact O-ND2 3.28Å
64	S	98.2	Very high	97.9	Very high	9 Å²	9	58.2 Å²	58.2	6%	0.063	32%	0.322	C	S	.	.	H	α-helix	trans	-68.4	-40.9	-178.6	-58	0	0	0	0	112.2	Q60 T61 V62 M66 N67 F68 Q137	Q60-S64 WeakPolarHBondContact O-CB 3.42Å; Q60-S64 PolarHBondContact O-N 3.09Å; Q60-S64 PolarHBondContact O-OG 2.75Å; T61-S64 WeakPolarHBondContact O-CB 3.21Å; T61-S64 PolarHBondContact O-N 2.91Å; T61-S64 VanDerWaalsContact O-N 3.09Å; V62-S64 PolarHBondContact O-N 3.41Å; S64-M66 PolarHBondContact O-N 3.11Å; S64-N67 PolarHBondContact O-N 3.39Å; S64-N67 VanDerWaalsContact O-N 3.17Å; S64-F68 WeakPolarHBondContact O-CD2 3.4Å; S64-F68 PolarHBondContact O-N 3.24Å; S64-Q137 WeakPolarHBondContact OG-CG 3.34Å
65	T	97.8	Very high	98	Very high	48 Å²	48	55.2 Å²	55.2	29%	0.294	31%	0.305	S	S	.	.	H	α-helix	trans	-65.6	-26.8	174.8	61	0	0	0	0	112.8	T61 V62 K69 P126 L127	T61-T65 PolarHBondContact O-N 3.5Å; V62-T65 PolarHBondContact O-N 3.1Å; V62-T65 PolarHBondContact O-OG1 2.9Å; T65-K69 VanDerWaalsContact O-CE 3.31Å; T65-K69 WeakPolarHBondContact O-CE 3.45Å; T65-K69 VanDerWaalsContact O-CG 3.24Å; T65-K69 WeakPolarHBondContact O-CG 3.47Å; T65-P126 HydrophobicContact CG2-CB 3.99Å; T65-P126 HydrophobicContact CG2-CG 3.65Å; T65-L127 HydrophobicContact CG2-CD2 3.64Å
66	M	97.6	Very high	98	Very high	90 Å²	90	57.2 Å²	57.2	44%	0.443	31%	0.311	S	S	.	.	H	α-helix	trans	-70.5	-34.7	174.1	-66.4	168.8	66.8	0	0	112.6	L49 V62 R63 S64 K69	L49-M66 HydrophobicContact CD2-SD 3.79Å; V62-M66 HydrophobicContact CG1-SD 4.26Å; V62-M66 VanDerWaalsContact O-CG 3.31Å; V62-M66 WeakPolarHBondContact O-CG 3.37Å; V62-M66 PolarHBondContact O-N 3.25Å; V62-M66 VanDerWaalsContact O-N 3.15Å; R63-M66 WeakPolarHBondContact O-CB 3.38Å; R63-M66 PolarHBondContact O-N 3.37Å; S64-M66 PolarHBondContact O-N 3.11Å; M66-K69 VanDerWaalsContact O-CE 3.29Å; M66-K69 WeakPolarHBondContact O-CE 3.29Å
67	N	98.3	Very high	98	Very high	107 Å²	107	56.1 Å²	56.1	57%	0.572	31%	0.307	S	S	*	.	H	α-helix	trans	-97.6	-26.2	-170.2	-67.5	-26.1	0	0	0	114.1	R63 S64	R63-N67 PolarHBondContact O-N 3.47Å; R63-N67 PolarHBondContact O-ND2 3.28Å; S64-N67 PolarHBondContact O-N 3.39Å; S64-N67 VanDerWaalsContact O-N 3.17Å
68	F	98.2	Very high	98	Very high	62 Å²	62	55.4 Å²	55.4	27%	0.272	31%	0.306	S	S	.	.			trans	-116.3	72.8	-176.7	-62.1	-79.3	0	0	0	111.3	S64 I70 V128 W130 Q131 Q137	S64-F68 WeakPolarHBondContact O-CD2 3.4Å; S64-F68 PolarHBondContact O-N 3.24Å; F68-I70 PolarHBondContact O-N 3.15Å; F68-V128 HydrophobicContact CB-CG2 4.32Å; F68-V128 WeakPolarHBondContact O-CG2 3.35Å; F68-W130 WeakPolarHBondContact CD1-O 3.49Å; F68-Q131 HydrophobicContact CD1-CB 4.43Å; F68-Q131 HydrophobicContact CG-CB 4.29Å; F68-Q137 HydrophobicContact CE2-CG 4.26Å
69	K	97.5	Very high	98	Very high	163 Å²	163	58 Å²	58	71%	0.709	32%	0.319	S	S	*	.			trans	-100.8	51.5	-178.3	-61.8	-177	-176.9	176.6	0	112.4	T65 M66	T65-K69 VanDerWaalsContact O-CE 3.31Å; T65-K69 WeakPolarHBondContact O-CE 3.45Å; T65-K69 VanDerWaalsContact O-CG 3.24Å; T65-K69 WeakPolarHBondContact O-CG 3.47Å; M66-K69 VanDerWaalsContact O-CE 3.29Å; M66-K69 WeakPolarHBondContact O-CE 3.29Å
70	I	98.5	Very high	98.1	Very high	94 Å²	94	59.3 Å²	59.3	48%	0.482	33%	0.325	S	S	.	.	S	Bend	trans	-106.4	119.6	-173.7	-58.7	164.4	0	0	0	108.6	F68 G72 W130	F68-I70 PolarHBondContact O-N 3.15Å; I70-G72 VanDerWaalsContact C-N 3.3Å; I70-G72 PolarHBondContact O-N 2.72Å; I70-W130 HydrophobicContact CB-CB 3.81Å; I70-W130 HydrophobicContact CB-CG 4.3Å; I70-W130 HydrophobicContact CD1-CB 4.1Å; I70-W130 HydrophobicContact CG2-CB 3.86Å; I70-W130 HydrophobicContact CG2-CG 3.9Å
71	G	97.8	Very high	98.1	Very high	55 Å²	55	55.8 Å²	55.8	57%	0.567	31%	0.309	S	S	*	.	S	Bend	trans	81.2	-15.1	173	0	0	0	0	0	117.2
72	G	96.6	Very high	98.1	Very high	32 Å²	32	55.9 Å²	55.9	33%	0.33	31%	0.309	S	S	.	.			trans	79.8	-165	173.7	0	0	0	0	0	114.5	I70 S74 E75	I70-G72 VanDerWaalsContact C-N 3.3Å; I70-G72 PolarHBondContact O-N 2.72Å; G72-S74 VanDerWaalsContact C-N 3.29Å; G72-S74 PolarHBondContact O-N 2.95Å; G72-E75 PolarHBondContact O-N 3.43Å
73	P	97	Very high	98.2	Very high	112 Å²	112	58.7 Å²	58.7	73%	0.727	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-62.7	-24.9	-170	-26.3	35.7	0	0	0	116.1	E75 R76	P73-E75 PolarHBondContact O-N 2.6Å; P73-R76 WeakPolarHBondContact O-CB 3.41Å; P73-R76 WeakPolarHBondContact O-CD 3.25Å; P73-R76 VanDerWaalsContact O-CG 3.22Å; P73-R76 WeakPolarHBondContact O-CG 3.33Å; P73-R76 PolarHBondContact O-N 3.04Å
74	S	97.7	Very high	98.2	Very high	89 Å²	89	56.2 Å²	56.2	62%	0.622	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-67.2	-23.1	175.2	57	0	0	0	0	112.7	G72 R76	G72-S74 VanDerWaalsContact C-N 3.29Å; G72-S74 PolarHBondContact O-N 2.95Å; S74-R76 VanDerWaalsContact C-N 3.32Å
75	E	98.5	Very high	98.3	Very high	46 Å²	46	55.8 Å²	55.8	22%	0.215	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-91.8	10	179.9	-62.5	-50.4	114	0	0	113.1	G72 P73 V128 V129 W130	G72-E75 PolarHBondContact O-N 3.43Å; P73-E75 PolarHBondContact O-N 2.6Å; E75-V128 HydrophobicContact CB-CB 4.22Å; E75-V128 HydrophobicContact CB-CG1 4.12Å; E75-V128 CarbonylContact O-C 3.51Å; E75-V128 WeakPolarHBondContact O-CA 3.25Å; E75-V128 VanDerWaalsContact O-CB 3.28Å; E75-V128 WeakPolarHBondContact O-CB 3.27Å; E75-V129 PolarHBondContact O-N 3.39Å; E75-W130 PolarHBondContact OE2-NE1 2.96Å
76	R	98.7	Very high	98.3	Very high	84 Å²	84	53.5 Å²	53.5	32%	0.317	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-51.4	147.6	170.8	-77.1	173.8	70.1	-165.7	-1.5	110.9	P73 S74 D122 F125 L127	P73-R76 WeakPolarHBondContact O-CB 3.41Å; P73-R76 WeakPolarHBondContact O-CD 3.25Å; P73-R76 VanDerWaalsContact O-CG 3.22Å; P73-R76 WeakPolarHBondContact O-CG 3.33Å; P73-R76 PolarHBondContact O-N 3.04Å; S74-R76 VanDerWaalsContact C-N 3.32Å; R76-D122 PolarHBondContact NH2-O 3.46Å; R76-F125 PolarHBondContact NE-O 3.39Å; R76-F125 PolarHBondContact NH2-O 3.21Å; R76-L127 WeakPolarHBondContact CA-O 3.22Å
77	M	98.9	Very high	98.4	Very high	12 Å²	12	50.6 Å²	50.6	6%	0.059	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-51.7	134.1	175.6	-173.4	61.4	62.7	0	0	109.9	I79 V81 I82 L127 T138 F180 P399	M77-I79 PolarHBondContact O-N 2.83Å; M77-V81 HydrophobicContact CG-CB 4.02Å; M77-V81 HydrophobicContact CG-CG1 4.05Å; M77-V81 HydrophobicContact SD-CB 4.23Å; M77-V81 HydrophobicContact SD-CG1 4.09Å; M77-V81 HydrophobicContact SD-CG2 4.29Å; M77-I82 HydrophobicContact CB-CD1 4.28Å; M77-I82 HydrophobicContact CG-CD1 4.07Å; M77-L127 PolarHBondContact N-O 3.24Å; M77-T138 HydrophobicContact CG-CG2 4.32Å; M77-F180 HydrophobicContact CE-CE2 3.82Å; M77-F180 HydrophobicContact CE-CZ 3.84Å; M77-F180 HydrophobicContact SD-CE2 4.18Å; M77-F180 HydrophobicContact SD-CZ 3.97Å; M77-P399 HydrophobicContact CE-CB 4.11Å
78	P	98.8	Very high	98.4	Very high	14 Å²	14	45.5 Å²	45.5	9%	0.091	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-54	137.8	178	-27.8	36.1	0	0	0	111.9	Q80 V81 I82 K403 L406	P78-Q80 PolarHBondContact O-N 2.98Å; P78-V81 HydrophobicContact CB-CG2 4.32Å; P78-V81 WeakPolarHBondContact O-CB 3.48Å; P78-V81 PolarHBondContact O-N 2.75Å; P78-I82 PolarHBondContact O-N 3.01Å; P78-K403 HydrophobicContact CG-CB 4.3Å; P78-K403 HydrophobicContact CG-CD 3.57Å; P78-L406 HydrophobicContact CB-CD1 3.79Å; P78-L406 HydrophobicContact CG-CD1 4.23Å
79	I	98.4	Very high	98.4	Very high	54 Å²	54	42.6 Å²	42.6	28%	0.277	24%	0.24	S	C	.	.	H	α-helix	trans	-65.5	-27.3	-174.9	-160.4	68.4	0	0	0	112.9	M77 V81 I82 K83 D122	M77-I79 PolarHBondContact O-N 2.83Å; I79-V81 PolarHBondContact O-N 3.19Å; I79-I82 HydrophobicContact CD1-CB 4.06Å; I79-I82 HydrophobicContact CD1-CG1 4.24Å; I79-I82 HydrophobicContact CD1-CG2 4.35Å; I79-I82 WeakPolarHBondContact O-CB 3.45Å; I79-I82 PolarHBondContact O-N 3.41Å; I79-I82 VanDerWaalsContact O-N 3.12Å; I79-K83 WeakPolarHBondContact O-CG 3.31Å; I79-K83 PolarHBondContact O-N 3.14Å; I79-D122 HydrophobicContact CD1-CB 3.65Å; I79-D122 WeakPolarHBondContact CD1-OD1 3.3Å; I79-D122 VanDerWaalsContact CD1-OD2 3.32Å; I79-D122 WeakPolarHBondContact CD1-OD2 3.46Å; I79-D122 VanDerWaalsContact CG1-OD2 3.3Å; I79-D122 WeakPolarHBondContact CG1-OD2 3.27Å
80	Q	98.8	Very high	98.5	Very high	31 Å²	31	37 Å²	37	15%	0.145	22%	0.215	C	C	.	.	H	α-helix	trans	-57.1	-39.9	172.6	-61.2	85	-19	0	0	111.6	P78 K83 A84 A187 E191 L406	P78-Q80 PolarHBondContact O-N 2.98Å; Q80-K83 PolarHBondContact O-N 3.3Å; Q80-A84 VanDerWaalsContact O-CB 3.27Å; Q80-A84 WeakPolarHBondContact O-CB 3.3Å; Q80-A84 PolarHBondContact O-N 3.05Å; Q80-A187 HydrophobicContact CB-CB 4.03Å; Q80-A187 WeakPolarHBondContact O-CB 3.47Å; Q80-E191 WeakPolarHBondContact CG-OE2 3.44Å; Q80-E191 PolarHBondContact NE2-OE1 2.86Å; Q80-E191 PolarHBondContact NE2-OE2 2.86Å; Q80-L406 HydrophobicContact CB-CD1 3.89Å; Q80-L406 HydrophobicContact CB-CD2 4.04Å; Q80-L406 HydrophobicContact CG-CD2 4.21Å
81	V	98.9	Very high	98.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.8	-41.6	176.8	177.9	0	0	0	0	110.4	M77 P78 I79 A84 F85 F180 A187 V402 L406	M77-V81 HydrophobicContact CG-CB 4.02Å; M77-V81 HydrophobicContact CG-CG1 4.05Å; M77-V81 HydrophobicContact SD-CB 4.23Å; M77-V81 HydrophobicContact SD-CG1 4.09Å; M77-V81 HydrophobicContact SD-CG2 4.29Å; P78-V81 HydrophobicContact CB-CG2 4.32Å; P78-V81 WeakPolarHBondContact O-CB 3.48Å; P78-V81 PolarHBondContact O-N 2.75Å; I79-V81 PolarHBondContact O-N 3.19Å; V81-A84 PolarHBondContact O-N 3.48Å; V81-F85 HydrophobicContact CG1-CD2 3.88Å; V81-F85 HydrophobicContact CG1-CE2 3.9Å; V81-F85 VanDerWaalsContact O-CD2 3.32Å; V81-F85 WeakPolarHBondContact O-CD2 3.23Å; V81-F85 PolarHBondContact O-N 3.1Å; V81-F180 HydrophobicContact CG1-CE2 4.07Å; V81-F180 HydrophobicContact CG1-CZ 4.26Å; V81-A187 HydrophobicContact CG2-CB 4.32Å; V81-V402 HydrophobicContact CG2-CG1 4.04Å; V81-V402 HydrophobicContact CG2-CG2 3.89Å; V81-L406 HydrophobicContact CG2-CD1 3.72Å
82	I	98.9	Very high	98.6	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-62.5	-46.1	177.4	-57.8	-52.1	0	0	0	111.2	M77 P78 I79 A84 F85 G86 V116 F125 T138	M77-I82 HydrophobicContact CB-CD1 4.28Å; M77-I82 HydrophobicContact CG-CD1 4.07Å; P78-I82 PolarHBondContact O-N 3.01Å; I79-I82 HydrophobicContact CD1-CB 4.06Å; I79-I82 HydrophobicContact CD1-CG1 4.24Å; I79-I82 HydrophobicContact CD1-CG2 4.35Å; I79-I82 WeakPolarHBondContact O-CB 3.45Å; I79-I82 PolarHBondContact O-N 3.41Å; I79-I82 VanDerWaalsContact O-N 3.12Å; I82-A84 PolarHBondContact O-N 3.23Å; I82-F85 WeakPolarHBondContact O-CB 3.25Å; I82-F85 PolarHBondContact O-N 2.7Å; I82-G86 PolarHBondContact O-N 3.41Å; I82-V116 HydrophobicContact CG2-CG1 3.94Å; I82-V116 WeakPolarHBondContact O-CG1 3.24Å; I82-F125 HydrophobicContact CD1-CB 4.03Å; I82-F125 HydrophobicContact CD1-CD1 3.79Å; I82-F125 HydrophobicContact CD1-CE1 4.48Å; I82-F125 HydrophobicContact CD1-CG 3.96Å; I82-F125 HydrophobicContact CG1-CB 4.16Å; I82-F125 HydrophobicContact CG1-CD1 4.43Å; I82-F125 HydrophobicContact CG1-CG 4.14Å; I82-F125 HydrophobicContact CG2-CD1 3.95Å; I82-F125 HydrophobicContact CG2-CD2 3.44Å; I82-F125 VanDerWaalsContact CG2-CD2 3.44Å; I82-F125 HydrophobicContact CG2-CE1 3.96Å; I82-F125 HydrophobicContact CG2-CE2 3.45Å; I82-F125 VanDerWaalsContact CG2-CE2 3.45Å; I82-F125 HydrophobicContact CG2-CG 3.69Å; I82-F125 HydrophobicContact CG2-CZ 3.71Å; I82-T138 HydrophobicContact CD1-CG2 3.93Å
83	K	98.9	Very high	98.7	Very high	75 Å²	75	28.6 Å²	28.6	33%	0.326	15%	0.151	S	C	.	.	H	α-helix	trans	-63	-42.3	177.1	-69.4	-179.4	176.7	-175.2	0	112	I79 Q80 F85 G86 I87 S117	I79-K83 WeakPolarHBondContact O-CG 3.31Å; I79-K83 PolarHBondContact O-N 3.14Å; Q80-K83 PolarHBondContact O-N 3.3Å; K83-F85 VanDerWaalsContact C-N 3.3Å; K83-F85 PolarHBondContact O-N 2.9Å; K83-G86 WeakPolarHBondContact O-CA 3.43Å; K83-G86 PolarHBondContact O-N 3.2Å; K83-I87 PolarHBondContact O-N 3.37Å; K83-I87 VanDerWaalsContact O-N 3.08Å; K83-S117 WeakPolarHBondContact CG-O 3.43Å
84	A	98.9	Very high	98.8	Very high	2 Å²	2	27.2 Å²	27.2	2%	0.017	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-36.7	175.3	0	0	0	0	0	112.9	Q80 V81 I82 I87 L88 A183 I186 A187	Q80-A84 VanDerWaalsContact O-CB 3.27Å; Q80-A84 WeakPolarHBondContact O-CB 3.3Å; Q80-A84 PolarHBondContact O-N 3.05Å; V81-A84 PolarHBondContact O-N 3.48Å; I82-A84 PolarHBondContact O-N 3.23Å; A84-I87 PolarHBondContact O-N 3.06Å; A84-L88 PolarHBondContact O-N 3.43Å; A84-A183 HydrophobicContact CB-CB 4.26Å; A84-A183 WeakPolarHBondContact CB-O 3.41Å; A84-I186 HydrophobicContact CB-CB 3.85Å; A84-I186 HydrophobicContact CB-CG2 3.67Å; A84-A187 HydrophobicContact CB-CB 3.78Å
85	F	98.9	Very high	98.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.2	-41.4	170.2	-98.6	-70	0	0	0	112.2	V81 I82 K83 I87 L88 K89 T138 N139 V142 F180 A183	V81-F85 HydrophobicContact CG1-CD2 3.88Å; V81-F85 HydrophobicContact CG1-CE2 3.9Å; V81-F85 VanDerWaalsContact O-CD2 3.32Å; V81-F85 WeakPolarHBondContact O-CD2 3.23Å; V81-F85 PolarHBondContact O-N 3.1Å; I82-F85 WeakPolarHBondContact O-CB 3.25Å; I82-F85 PolarHBondContact O-N 2.7Å; K83-F85 VanDerWaalsContact C-N 3.3Å; K83-F85 PolarHBondContact O-N 2.9Å; F85-I87 VanDerWaalsContact C-N 3.33Å; F85-I87 PolarHBondContact O-N 3.22Å; F85-L88 PolarHBondContact O-N 2.98Å; F85-K89 VanDerWaalsContact O-CG 3.29Å; F85-K89 WeakPolarHBondContact O-CG 3.43Å; F85-K89 PolarHBondContact O-N 3.5Å; F85-T138 HydrophobicContact CD2-CG2 3.98Å; F85-T138 HydrophobicContact CE2-CG2 3.65Å; F85-T138 HydrophobicContact CZ-CG2 4.38Å; F85-N139 HydrophobicContact CE1-CB 4.01Å; F85-N139 HydrophobicContact CZ-CB 4.11Å; F85-V142 HydrophobicContact CB-CB 4.35Å; F85-V142 HydrophobicContact CB-CG1 3.91Å; F85-V142 HydrophobicContact CB-CG2 3.66Å; F85-V142 HydrophobicContact CD1-CB 4.32Å; F85-V142 HydrophobicContact CD1-CG1 4.16Å; F85-V142 HydrophobicContact CD1-CG2 4.13Å; F85-V142 HydrophobicContact CD2-CG2 4.14Å; F85-V142 HydrophobicContact CG-CB 4.39Å; F85-V142 HydrophobicContact CG-CG1 4.3Å; F85-V142 HydrophobicContact CG-CG2 3.73Å; F85-F180 AromaticContact CE2-CD2 3.6Å; F85-F180 HydrophobicContact CE2-CD2 3.6Å; F85-F180 HydrophobicContact CE2-CE2 4.09Å; F85-F180 HydrophobicContact CE2-CG 4.4Å; F85-F180 HydrophobicContact CZ-CB 4.09Å; F85-F180 AromaticContact CZ-CD2 3.72Å; F85-F180 HydrophobicContact CZ-CD2 3.72Å; F85-F180 HydrophobicContact CZ-CG 4.29Å; F85-A183 HydrophobicContact CD1-CB 4.11Å; F85-A183 HydrophobicContact CD2-CB 3.49Å; F85-A183 VanDerWaalsContact CD2-CB 3.49Å; F85-A183 HydrophobicContact CE1-CB 4.19Å; F85-A183 HydrophobicContact CE2-CB 3.57Å; F85-A183 HydrophobicContact CG-CB 3.77Å; F85-A183 HydrophobicContact CZ-CB 3.94Å
86	G	98.9	Very high	98.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-53.6	-49.8	171.3	0	0	0	0	0	111.9	I82 K83 L88 K89 R90 A113	I82-G86 PolarHBondContact O-N 3.41Å; K83-G86 WeakPolarHBondContact O-CA 3.43Å; K83-G86 PolarHBondContact O-N 3.2Å; G86-L88 PolarHBondContact O-N 3.46Å; G86-K89 PolarHBondContact O-N 2.88Å; G86-R90 VanDerWaalsContact O-CB 3.24Å; G86-R90 WeakPolarHBondContact O-CB 3.45Å; G86-R90 PolarHBondContact O-N 3.29Å; G86-A113 WeakPolarHBondContact O-CB 3.34Å
87	I	98.9	Very high	98.8	Very high	28 Å²	28	20.7 Å²	20.7	14%	0.144	10%	0.097	C	C	.	.	H	α-helix	trans	-58.3	-47.7	177.1	-62.7	167.6	0	0	0	111.3	K83 A84 F85 R90 A91 I186 V286 L289 T290	K83-I87 PolarHBondContact O-N 3.37Å; K83-I87 VanDerWaalsContact O-N 3.08Å; A84-I87 PolarHBondContact O-N 3.06Å; F85-I87 VanDerWaalsContact C-N 3.33Å; F85-I87 PolarHBondContact O-N 3.22Å; I87-R90 PolarHBondContact O-N 3.04Å; I87-A91 WeakPolarHBondContact O-CB 3.44Å; I87-A91 PolarHBondContact O-N 3.46Å; I87-I186 HydrophobicContact CD1-CG2 3.98Å; I87-I186 HydrophobicContact CG2-CG2 4.5Å; I87-V286 HydrophobicContact CG2-CG1 4.27Å; I87-V286 HydrophobicContact CG2-CG2 4.39Å; I87-L289 HydrophobicContact CG2-CB 4.47Å; I87-L289 HydrophobicContact CG2-CD1 4.3Å; I87-T290 HydrophobicContact CD1-CG2 4.1Å; I87-T290 HydrophobicContact CG2-CG2 4.11Å
88	L	98.9	Very high	98.8	Very high	1 Å²	1	25 Å²	25	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-61.3	-47.9	179.3	173.4	58.4	0	0	0	112.1	A84 F85 G86 R90 A91 A92 T179 T182 I186 V282	A84-L88 PolarHBondContact O-N 3.43Å; F85-L88 PolarHBondContact O-N 2.98Å; G86-L88 PolarHBondContact O-N 3.46Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.35Å; L88-A91 PolarHBondContact O-N 3.3Å; L88-A92 WeakPolarHBondContact O-CB 3.48Å; L88-A92 PolarHBondContact O-N 2.97Å; L88-T179 HydrophobicContact CD2-CG2 4.19Å; L88-T179 WeakPolarHBondContact CD2-O 3.32Å; L88-T182 HydrophobicContact CD1-CG2 3.74Å; L88-T182 HydrophobicContact CD2-CG2 3.94Å; L88-T182 HydrophobicContact CG-CG2 4.34Å; L88-I186 HydrophobicContact CB-CD1 4.37Å; L88-V282 HydrophobicContact CD1-CG2 4.13Å
89	K	98.9	Very high	98.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-68.8	-35.4	-177.8	-63.8	-57.9	179.2	175.5	0	111.8	F85 G86 A92 A93 A113 N139 V142 N143 I146 V170 N171	F85-K89 VanDerWaalsContact O-CG 3.29Å; F85-K89 WeakPolarHBondContact O-CG 3.43Å; F85-K89 PolarHBondContact O-N 3.5Å; G86-K89 PolarHBondContact O-N 2.88Å; K89-A92 PolarHBondContact O-N 3.47Å; K89-A93 WeakPolarHBondContact O-CB 3.4Å; K89-A93 PolarHBondContact O-N 2.94Å; K89-A113 HydrophobicContact CB-CB 4.27Å; K89-N139 WeakPolarHBondContact CE-OD1 3.47Å; K89-N139 PolarHBondContact NZ-OD1 3.37Å; K89-V142 HydrophobicContact CG-CG1 3.74Å; K89-N143 WeakPolarHBondContact CE-OD1 3.45Å; K89-N143 PolarHBondContact NZ-OD1 3.37Å; K89-I146 HydrophobicContact CB-CD1 3.57Å; K89-I146 HydrophobicContact CG-CD1 3.77Å; K89-V170 HydrophobicContact CD-CG1 4.17Å; K89-V170 HydrophobicContact CG-CG1 4.4Å; K89-N171 PolarHBondContact NZ-OD1 2.98Å
90	R	98.8	Very high	98.7	Very high	46 Å²	46	26.1 Å²	26.1	17%	0.174	14%	0.14	C	C	.	.	H	α-helix	trans	-59.3	-51.4	170.9	-170.1	-145.7	171.8	-77.1	2.3	110.9	G86 I87 L88 A93 E94 V110 A113 D114	G86-R90 VanDerWaalsContact O-CB 3.24Å; G86-R90 WeakPolarHBondContact O-CB 3.45Å; G86-R90 PolarHBondContact O-N 3.29Å; I87-R90 PolarHBondContact O-N 3.04Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.35Å; R90-A93 PolarHBondContact O-N 3.15Å; R90-E94 IonicContact CZ-OE2 3.96Å; R90-E94 IonicContact NH1-OE2 2.66Å; R90-E94 PolarHBondContact NH1-OE2 3.41Å; R90-E94 IonicContact NH2-OE2 3.78Å; R90-E94 PolarHBondContact O-N 2.85Å; R90-V110 HydrophobicContact CG-CB 4.38Å; R90-V110 HydrophobicContact CG-CG1 3.91Å; R90-V110 HydrophobicContact CG-CG2 4.35Å; R90-A113 HydrophobicContact CB-CB 3.71Å; R90-A113 HydrophobicContact CG-CB 4.45Å; R90-D114 WeakPolarHBondContact CD-OD1 3.46Å; R90-D114 WeakPolarHBondContact CG-OD1 3.06Å; R90-D114 IonicContact NE-OD1 2.7Å; R90-D114 PolarHBondContact NE-OD1 3.08Å; R90-D114 IonicContact NE-OD2 2.75Å
91	A	98.9	Very high	98.7	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.4	-45.1	177.9	0	0	0	0	0	112.3	I87 L88 A93 E94 V95 V282 T285 V286 L289	I87-A91 WeakPolarHBondContact O-CB 3.44Å; I87-A91 PolarHBondContact O-N 3.46Å; L88-A91 PolarHBondContact O-N 3.3Å; A91-A93 VanDerWaalsContact C-N 3.35Å; A91-A93 PolarHBondContact O-N 3.18Å; A91-E94 PolarHBondContact O-N 3.26Å; A91-V95 WeakPolarHBondContact O-CG2 3.33Å; A91-V95 PolarHBondContact O-N 3.1Å; A91-V282 HydrophobicContact CB-CG2 3.96Å; A91-T285 HydrophobicContact CB-CG2 3.65Å; A91-V286 HydrophobicContact CB-CG2 3.71Å; A91-L289 HydrophobicContact CB-CD1 4.11Å
92	A	98.9	Very high	98.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.9	-38.2	179.8	0	0	0	0	0	112.4	L88 K89 N96 F278 V282	L88-A92 WeakPolarHBondContact O-CB 3.48Å; L88-A92 PolarHBondContact O-N 2.97Å; K89-A92 PolarHBondContact O-N 3.47Å; A92-N96 WeakPolarHBondContact O-CB 3.35Å; A92-N96 VanDerWaalsContact O-CG 3.28Å; A92-N96 PolarHBondContact O-N 2.87Å; A92-N96 PolarHBondContact O-ND2 3.38Å; A92-F278 HydrophobicContact CB-CE2 4.44Å; A92-F278 HydrophobicContact CB-CZ 4.15Å; A92-V282 HydrophobicContact CB-CG2 4.41Å
93	A	98.8	Very high	98.7	Very high	4 Å²	4	32 Å²	32	3%	0.033	18%	0.176	C	C	.	.	H	α-helix	trans	-66.1	-42.3	176.9	0	0	0	0	0	112.1	K89 R90 A91 N96 K97 L101 I109 V110	K89-A93 WeakPolarHBondContact O-CB 3.4Å; K89-A93 PolarHBondContact O-N 2.94Å; R90-A93 PolarHBondContact O-N 3.15Å; A91-A93 VanDerWaalsContact C-N 3.35Å; A91-A93 PolarHBondContact O-N 3.18Å; A93-N96 PolarHBondContact O-N 3.24Å; A93-K97 PolarHBondContact O-N 3.36Å; A93-L101 HydrophobicContact CB-CD2 4.44Å; A93-I109 HydrophobicContact CB-CB 3.97Å; A93-I109 HydrophobicContact CB-CG2 3.51Å; A93-V110 HydrophobicContact CB-CG2 4.02Å
94	E	98.7	Very high	98.7	Very high	83 Å²	83	36 Å²	36	39%	0.388	19%	0.193	S	C	.	.	H	α-helix	trans	-61.3	-50.6	175.7	-174.3	172.6	169.8	0	0	111.4	R90 A91 N96 K97	R90-E94 IonicContact CZ-OE2 3.96Å; R90-E94 IonicContact NH1-OE2 2.66Å; R90-E94 PolarHBondContact NH1-OE2 3.41Å; R90-E94 IonicContact NH2-OE2 3.78Å; R90-E94 PolarHBondContact O-N 2.85Å; A91-E94 PolarHBondContact O-N 3.26Å; E94-N96 VanDerWaalsContact C-N 3.31Å; E94-N96 PolarHBondContact O-N 3.09Å; E94-K97 WeakPolarHBondContact O-CB 3.45Å; E94-K97 WeakPolarHBondContact O-CG 3.46Å; E94-K97 PolarHBondContact O-N 3.04Å
95	V	98.8	Very high	98.6	Very high	7 Å²	7	37 Å²	37	4%	0.042	20%	0.198	C	C	.	.	H	α-helix	trans	-64.1	-35.9	178.7	171.5	0	0	0	0	112	A91 K97 D98 Y99 F278 K281 T285	A91-V95 WeakPolarHBondContact O-CG2 3.33Å; A91-V95 PolarHBondContact O-N 3.1Å; V95-K97 PolarHBondContact O-N 2.96Å; V95-D98 WeakPolarHBondContact O-CB 3.4Å; V95-D98 PolarHBondContact O-N 3.33Å; V95-D98 VanDerWaalsContact O-N 3.14Å; V95-Y99 HydrophobicContact CG1-CD2 4.16Å; V95-Y99 HydrophobicContact CG1-CE2 3.74Å; V95-Y99 WeakPolarHBondContact O-CD2 3.39Å; V95-F278 HydrophobicContact CG1-CD2 3.75Å; V95-F278 HydrophobicContact CG1-CE2 4.12Å; V95-K281 HydrophobicContact CB-CB 4.49Å; V95-K281 HydrophobicContact CG1-CB 3.7Å; V95-K281 HydrophobicContact CG1-CD 4.17Å; V95-K281 HydrophobicContact CG2-CB 3.9Å; V95-T285 WeakPolarHBondContact CG2-OG1 3.4Å
96	N	98.8	Very high	98.6	Very high	1 Å²	1	37 Å²	37	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-70.7	-10.6	-178.7	-85.4	-54.1	0	0	0	114.3	A92 A93 E94 D98 Y99 G100 L101 K172 S173	A92-N96 WeakPolarHBondContact O-CB 3.35Å; A92-N96 VanDerWaalsContact O-CG 3.28Å; A92-N96 PolarHBondContact O-N 2.87Å; A92-N96 PolarHBondContact O-ND2 3.38Å; A93-N96 PolarHBondContact O-N 3.24Å; E94-N96 VanDerWaalsContact C-N 3.31Å; E94-N96 PolarHBondContact O-N 3.09Å; N96-D98 PolarHBondContact O-N 3.45Å; N96-Y99 CarbonylContact O-C 3.51Å; N96-Y99 VanDerWaalsContact O-C 3.32Å; N96-Y99 WeakPolarHBondContact O-CA 3.47Å; N96-Y99 PolarHBondContact O-N 3.12Å; N96-G100 PolarHBondContact O-N 3.22Å; N96-L101 HydrophobicContact CB-CB 3.85Å; N96-L101 HydrophobicContact CB-CD2 3.94Å; N96-L101 VanDerWaalsContact O-CB 3.28Å; N96-L101 WeakPolarHBondContact O-CB 3.43Å; N96-L101 PolarHBondContact O-N 2.81Å; N96-K172 HydrophobicContact CB-CD 4.15Å; N96-K172 PolarHBondContact ND2-O 3.4Å; N96-S173 WeakPolarHBondContact OD1-CB 3.48Å; N96-S173 PolarHBondContact OD1-OG 2.82Å
97	K	98.6	Very high	98.6	Very high	75 Å²	75	40.4 Å²	40.4	33%	0.326	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-56.4	-39.8	167.1	-67.7	178.5	177.9	178.8	0	110.9	A93 E94 V95 Y99 G100 A106 D107	A93-K97 PolarHBondContact O-N 3.36Å; E94-K97 WeakPolarHBondContact O-CB 3.45Å; E94-K97 WeakPolarHBondContact O-CG 3.46Å; E94-K97 PolarHBondContact O-N 3.04Å; V95-K97 PolarHBondContact O-N 2.96Å; K97-Y99 PolarHBondContact O-N 2.89Å; K97-G100 PolarHBondContact O-N 3.46Å; K97-A106 HydrophobicContact CD-CB 4.16Å; K97-A106 VanDerWaalsContact CE-CB 3.4Å; K97-A106 HydrophobicContact CG-CB 3.64Å; K97-D107 WeakPolarHBondContact CE-OD1 3.25Å; K97-D107 IonicContact NZ-OD1 2.77Å; K97-D107 PolarHBondContact NZ-OD1 2.88Å
98	D	98.3	Very high	98.6	Very high	103 Å²	103	39.2 Å²	39.2	55%	0.551	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-65.5	-19.8	175.5	-63	-4.8	0	0	0	112.9	V95 N96 K281	V95-D98 WeakPolarHBondContact O-CB 3.4Å; V95-D98 PolarHBondContact O-N 3.33Å; V95-D98 VanDerWaalsContact O-N 3.14Å; N96-D98 PolarHBondContact O-N 3.45Å; D98-K281 IonicContact OD2-NZ 2.6Å; D98-K281 PolarHBondContact OD2-NZ 3.48Å
99	Y	98.1	Very high	98.6	Very high	26 Å²	26	39.1 Å²	39.1	10%	0.102	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-114.9	24.1	-174	-57.7	-58.4	0	0	0	112.8	V95 N96 K97 K172 R275 I276 G277 F278 K281	V95-Y99 HydrophobicContact CG1-CD2 4.16Å; V95-Y99 HydrophobicContact CG1-CE2 3.74Å; V95-Y99 WeakPolarHBondContact O-CD2 3.39Å; N96-Y99 CarbonylContact O-C 3.51Å; N96-Y99 VanDerWaalsContact O-C 3.32Å; N96-Y99 WeakPolarHBondContact O-CA 3.47Å; N96-Y99 PolarHBondContact O-N 3.12Å; K97-Y99 PolarHBondContact O-N 2.89Å; Y99-K172 WeakPolarHBondContact O-CE 3.4Å; Y99-R275 HydrophobicContact CD1-CB 3.68Å; Y99-R275 HydrophobicContact CD1-CG 3.78Å; Y99-R275 HydrophobicContact CD2-CB 4.31Å; Y99-R275 HydrophobicContact CD2-CG 4.43Å; Y99-R275 HydrophobicContact CE1-CB 3.66Å; Y99-R275 HydrophobicContact CE1-CG 4.29Å; Y99-R275 HydrophobicContact CE2-CB 4.32Å; Y99-R275 HydrophobicContact CG-CB 4.01Å; Y99-R275 HydrophobicContact CG-CG 3.84Å; Y99-I276 PolarHBondContact OH-O 3.5Å; Y99-G277 WeakPolarHBondContact OH-CA 3.43Å; Y99-F278 HydrophobicContact CD2-CD2 4.29Å; Y99-F278 HydrophobicContact CE2-CB 4.11Å; Y99-F278 HydrophobicContact CE2-CD2 4.22Å; Y99-F278 PolarHBondContact OH-N 2.88Å; Y99-K281 HydrophobicContact CE2-CD 4.43Å
100	G	97.6	Very high	98.6	Very high	65 Å²	65	40 Å²	40	67%	0.67	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.6	20.8	169.7	0	0	0	0	0	115	N96 K97	N96-G100 PolarHBondContact O-N 3.22Å; K97-G100 PolarHBondContact O-N 3.46Å
101	L	98.6	Very high	98.6	Very high	6 Å²	6	43.7 Å²	43.7	3%	0.031	23%	0.233	C	C	.	.			trans	-75.2	128.4	162.5	-176.9	61	0	0	0	108.9	A93 N96 L105 A106 I109 H169 K172	A93-L101 HydrophobicContact CB-CD2 4.44Å; N96-L101 HydrophobicContact CB-CB 3.85Å; N96-L101 HydrophobicContact CB-CD2 3.94Å; N96-L101 VanDerWaalsContact O-CB 3.28Å; N96-L101 WeakPolarHBondContact O-CB 3.43Å; N96-L101 PolarHBondContact O-N 2.81Å; L101-L105 HydrophobicContact CD1-CB 4.44Å; L101-A106 HydrophobicContact CD2-CB 3.73Å; L101-A106 HydrophobicContact CG-CB 4Å; L101-I109 HydrophobicContact CD2-CD1 4.32Å; L101-H169 HydrophobicContact CD1-CB 4.03Å; L101-K172 HydrophobicContact CB-CD 4.04Å; L101-K172 HydrophobicContact CD1-CD 4.3Å
102	D	98.6	Very high	98.6	Very high	75 Å²	75	43.7 Å²	43.7	40%	0.401	23%	0.233	S	C	.	.			trans	-54.3	129.8	177.1	172.8	-92.5	0	0	0	110.8	K104 L105 A106	D102-K104 VanDerWaalsContact C-N 3.29Å; D102-K104 PolarHBondContact O-N 3.39Å; D102-K104 WeakPolarHBondContact OD1-CA 3.12Å; D102-K104 VanDerWaalsContact OD1-CB 3.25Å; D102-K104 WeakPolarHBondContact OD1-CB 3.35Å; D102-K104 PolarHBondContact OD1-N 3.24Å; D102-L105 HydrophobicContact CB-CB 4.29Å; D102-L105 HydrophobicContact CB-CD1 4.1Å; D102-L105 HydrophobicContact CB-CG 3.94Å; D102-L105 PolarHBondContact O-N 3.25Å; D102-L105 PolarHBondContact OD1-N 3Å; D102-A106 WeakPolarHBondContact O-CB 3.5Å; D102-A106 PolarHBondContact O-N 2.66Å
103	P	98.4	Very high	98.6	Very high	74 Å²	74	43.7 Å²	43.7	48%	0.481	23%	0.233	S	C	.	.	H	α-helix	trans	-57.8	-35.9	-176.5	-29.1	36.2	0	0	0	114.5	A106 D107	P103-A106 PolarHBondContact O-N 3.31Å; P103-D107 WeakPolarHBondContact O-CB 3.22Å; P103-D107 PolarHBondContact O-N 3.45Å
104	K	98.5	Very high	98.6	Very high	159 Å²	159	46.3 Å²	46.3	69%	0.691	25%	0.247	S	C	*	.	H	α-helix	trans	-69.9	-40.4	179.8	-59.4	177.9	178.3	176.9	0	110.9	D102 A108	D102-K104 VanDerWaalsContact C-N 3.29Å; D102-K104 PolarHBondContact O-N 3.39Å; D102-K104 WeakPolarHBondContact OD1-CA 3.12Å; D102-K104 VanDerWaalsContact OD1-CB 3.25Å; D102-K104 WeakPolarHBondContact OD1-CB 3.35Å; D102-K104 PolarHBondContact OD1-N 3.24Å; K104-A108 PolarHBondContact O-N 3.14Å; K104-A108 VanDerWaalsContact O-N 3.15Å
105	L	98.7	Very high	98.6	Very high	23 Å²	23	44.2 Å²	44.2	12%	0.12	24%	0.237	C	C	.	.	H	α-helix	trans	-64.9	-45.3	173.7	-57	-172.8	0	0	0	111	L101 D102 D107 A108 I109 L154 P163 V164	L101-L105 HydrophobicContact CD1-CB 4.44Å; D102-L105 HydrophobicContact CB-CB 4.29Å; D102-L105 HydrophobicContact CB-CD1 4.1Å; D102-L105 HydrophobicContact CB-CG 3.94Å; D102-L105 PolarHBondContact O-N 3.25Å; D102-L105 PolarHBondContact OD1-N 3Å; L105-D107 VanDerWaalsContact C-N 3.34Å; L105-D107 PolarHBondContact O-N 3.43Å; L105-A108 PolarHBondContact O-N 3.41Å; L105-I109 VanDerWaalsContact O-CG1 3.23Å; L105-I109 WeakPolarHBondContact O-CG1 3.49Å; L105-I109 PolarHBondContact O-N 3.41Å; L105-L154 HydrophobicContact CD2-CD1 3.92Å; L105-P163 HydrophobicContact CD2-CB 3.83Å; L105-P163 HydrophobicContact CD2-CG 3.94Å; L105-V164 HydrophobicContact CD2-CG2 4.02Å
106	A	98.8	Very high	98.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58	-45.2	177	0	0	0	0	0	111.8	K97 L101 D102 P103 A108 I109 V110	K97-A106 HydrophobicContact CD-CB 4.16Å; K97-A106 VanDerWaalsContact CE-CB 3.4Å; K97-A106 HydrophobicContact CG-CB 3.64Å; L101-A106 HydrophobicContact CD2-CB 3.73Å; L101-A106 HydrophobicContact CG-CB 4Å; D102-A106 WeakPolarHBondContact O-CB 3.5Å; D102-A106 PolarHBondContact O-N 2.66Å; P103-A106 PolarHBondContact O-N 3.31Å; A106-A108 PolarHBondContact O-N 3Å; A106-I109 PolarHBondContact O-N 3Å; A106-V110 VanDerWaalsContact O-CG2 3.3Å; A106-V110 WeakPolarHBondContact O-CG2 3.18Å; A106-V110 PolarHBondContact O-N 2.84Å
107	D	98.7	Very high	98.6	Very high	72 Å²	72	45.3 Å²	45.3	39%	0.385	25%	0.245	S	C	.	.	H	α-helix	trans	-64.4	-37.6	179	-71	-20.4	0	0	0	112.7	K97 P103 L105 K111	K97-D107 WeakPolarHBondContact CE-OD1 3.25Å; K97-D107 IonicContact NZ-OD1 2.77Å; K97-D107 PolarHBondContact NZ-OD1 2.88Å; P103-D107 WeakPolarHBondContact O-CB 3.22Å; P103-D107 PolarHBondContact O-N 3.45Å; L105-D107 VanDerWaalsContact C-N 3.34Å; L105-D107 PolarHBondContact O-N 3.43Å; D107-K111 WeakPolarHBondContact O-CG 3.17Å; D107-K111 PolarHBondContact O-N 3.03Å; D107-K111 VanDerWaalsContact O-N 3.11Å
108	A	98.8	Very high	98.6	Very high	3 Å²	3	44.6 Å²	44.6	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-68.1	-40.4	174.6	0	0	0	0	0	111.9	K104 L105 A106 K111 A112 A150 I153 L154	K104-A108 PolarHBondContact O-N 3.14Å; K104-A108 VanDerWaalsContact O-N 3.15Å; L105-A108 PolarHBondContact O-N 3.41Å; A106-A108 PolarHBondContact O-N 3Å; A108-K111 PolarHBondContact O-N 3.23Å; A108-A112 WeakPolarHBondContact O-CB 3.48Å; A108-A112 PolarHBondContact O-N 2.73Å; A108-A150 HydrophobicContact CB-CB 3.97Å; A108-I153 HydrophobicContact CB-CG2 4.44Å; A108-L154 HydrophobicContact CB-CD1 3.8Å; A108-L154 HydrophobicContact CB-CD2 4.09Å; A108-L154 HydrophobicContact CB-CG 3.83Å
109	I	98.9	Very high	98.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-43.9	175.1	-67.2	165.3	0	0	0	110.5	A93 L101 L105 A106 K111 A112 A113 I146 A150 V164 H169 V170	A93-I109 HydrophobicContact CB-CB 3.97Å; A93-I109 HydrophobicContact CB-CG2 3.51Å; L101-I109 HydrophobicContact CD2-CD1 4.32Å; L105-I109 VanDerWaalsContact O-CG1 3.23Å; L105-I109 WeakPolarHBondContact O-CG1 3.49Å; L105-I109 PolarHBondContact O-N 3.41Å; A106-I109 PolarHBondContact O-N 3Å; I109-K111 PolarHBondContact O-N 3.46Å; I109-A112 PolarHBondContact O-N 3.32Å; I109-A113 WeakPolarHBondContact O-CB 3.37Å; I109-A113 PolarHBondContact O-N 3.32Å; I109-I146 HydrophobicContact CB-CG2 4.47Å; I109-I146 HydrophobicContact CG2-CG2 3.78Å; I109-A150 HydrophobicContact CG1-CB 4.34Å; I109-V164 HydrophobicContact CD1-CG1 3.86Å; I109-V164 HydrophobicContact CG1-CG1 3.75Å; I109-H169 HydrophobicContact CD1-CB 3.94Å; I109-V170 HydrophobicContact CD1-CG2 4.18Å; I109-V170 HydrophobicContact CG1-CG2 4.22Å; I109-V170 HydrophobicContact CG2-CG1 4.46Å
110	V	98.9	Very high	98.6	Very high	18 Å²	18	46.7 Å²	46.7	11%	0.109	26%	0.263	C	S	.	.	H	α-helix	trans	-56.5	-50.2	176	165	0	0	0	0	110.4	R90 A93 A106 A112 A113 D114	R90-V110 HydrophobicContact CG-CB 4.38Å; R90-V110 HydrophobicContact CG-CG1 3.91Å; R90-V110 HydrophobicContact CG-CG2 4.35Å; A93-V110 HydrophobicContact CB-CG2 4.02Å; A106-V110 VanDerWaalsContact O-CG2 3.3Å; A106-V110 WeakPolarHBondContact O-CG2 3.18Å; A106-V110 PolarHBondContact O-N 2.84Å; V110-A112 PolarHBondContact O-N 2.8Å; V110-A113 PolarHBondContact O-N 2.93Å; V110-D114 WeakPolarHBondContact O-CB 3.43Å; V110-D114 VanDerWaalsContact O-CG 3.31Å; V110-D114 PolarHBondContact O-N 3.12Å
111	K	98.8	Very high	98.7	Very high	123 Å²	123	44.1 Å²	44.1	54%	0.535	23%	0.234	S	C	.	.	H	α-helix	trans	-59.9	-45.3	178.5	-71.8	173.2	-176.8	178.8	0	112.8	D107 A108 I109 D114 E115 I153	D107-K111 WeakPolarHBondContact O-CG 3.17Å; D107-K111 PolarHBondContact O-N 3.03Å; D107-K111 VanDerWaalsContact O-N 3.11Å; A108-K111 PolarHBondContact O-N 3.23Å; I109-K111 PolarHBondContact O-N 3.46Å; K111-D114 PolarHBondContact O-N 3.37Å; K111-E115 PolarHBondContact O-N 3.31Å; K111-I153 HydrophobicContact CB-CD1 3.99Å
112	A	98.9	Very high	98.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.9	-39.7	177.9	0	0	0	0	0	112	A108 I109 V110 E115 V116 I146 R149 A150 I153	A108-A112 WeakPolarHBondContact O-CB 3.48Å; A108-A112 PolarHBondContact O-N 2.73Å; I109-A112 PolarHBondContact O-N 3.32Å; V110-A112 PolarHBondContact O-N 2.8Å; A112-E115 WeakPolarHBondContact O-CB 3.27Å; A112-E115 PolarHBondContact O-N 3.33Å; A112-V116 PolarHBondContact O-N 3.26Å; A112-V116 VanDerWaalsContact O-N 3.15Å; A112-I146 HydrophobicContact CB-CG2 4.02Å; A112-R149 HydrophobicContact CB-CB 3.87Å; A112-R149 HydrophobicContact CB-CG 3.75Å; A112-A150 HydrophobicContact CB-CB 4.24Å; A112-I153 HydrophobicContact CB-CD1 4.3Å
113	A	98.9	Very high	98.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.7	-35.8	176.9	0	0	0	0	0	112.2	G86 K89 R90 I109 V110 E115 V116 S117 I146	G86-A113 WeakPolarHBondContact O-CB 3.34Å; K89-A113 HydrophobicContact CB-CB 4.27Å; R90-A113 HydrophobicContact CB-CB 3.71Å; R90-A113 HydrophobicContact CG-CB 4.45Å; I109-A113 WeakPolarHBondContact O-CB 3.37Å; I109-A113 PolarHBondContact O-N 3.32Å; V110-A113 PolarHBondContact O-N 2.93Å; A113-E115 VanDerWaalsContact C-N 3.33Å; A113-E115 PolarHBondContact O-N 3.43Å; A113-V116 WeakPolarHBondContact O-CB 3.46Å; A113-V116 PolarHBondContact O-N 2.99Å; A113-S117 PolarHBondContact O-N 3.28Å; A113-S117 PolarHBondContact O-OG 2.83Å; A113-I146 HydrophobicContact CB-CD1 3.93Å
114	D	98.8	Very high	98.6	Very high	60 Å²	60	45.2 Å²	45.2	32%	0.321	24%	0.235	S	C	.	.	H	α-helix	trans	-59.8	-42.4	171.8	-76.1	-30.4	0	0	0	111	R90 V110 K111 V116 S117 A118	R90-D114 WeakPolarHBondContact CD-OD1 3.46Å; R90-D114 WeakPolarHBondContact CG-OD1 3.06Å; R90-D114 IonicContact NE-OD1 2.7Å; R90-D114 PolarHBondContact NE-OD1 3.08Å; R90-D114 IonicContact NE-OD2 2.75Å; V110-D114 WeakPolarHBondContact O-CB 3.43Å; V110-D114 VanDerWaalsContact O-CG 3.31Å; V110-D114 PolarHBondContact O-N 3.12Å; K111-D114 PolarHBondContact O-N 3.37Å; D114-V116 PolarHBondContact O-N 3.47Å; D114-S117 WeakPolarHBondContact CA-OG 2.8Å; D114-S117 PolarHBondContact O-N 2.91Å; D114-S117 PolarHBondContact O-OG 2.89Å; D114-A118 VanDerWaalsContact O-CB 3.27Å; D114-A118 WeakPolarHBondContact O-CB 3.28Å; D114-A118 PolarHBondContact O-N 3.04Å
115	E	98.9	Very high	98.6	Very high	38 Å²	38	37.9 Å²	37.9	18%	0.178	20%	0.203	C	C	.	.	H	α-helix	trans	-62.9	-39.1	175.1	-68.7	-178.3	-178.5	0	0	112.4	K111 A112 A113 A118 G119 K120 L121 R149	K111-E115 PolarHBondContact O-N 3.31Å; A112-E115 WeakPolarHBondContact O-CB 3.27Å; A112-E115 PolarHBondContact O-N 3.33Å; A113-E115 VanDerWaalsContact C-N 3.33Å; A113-E115 PolarHBondContact O-N 3.43Å; E115-A118 PolarHBondContact O-N 3.12Å; E115-G119 PolarHBondContact O-N 2.98Å; E115-K120 HydrophobicContact CB-CB 4.3Å; E115-K120 HydrophobicContact CB-CD 4.38Å; E115-K120 HydrophobicContact CG-CD 4.18Å; E115-K120 PolarHBondContact O-N 3.2Å; E115-L121 HydrophobicContact CB-CD1 3.99Å; E115-L121 HydrophobicContact CB-CG 4.22Å; E115-R149 IonicContact OE1-CZ 2.73Å; E115-R149 IonicContact OE1-NE 2.82Å; E115-R149 PolarHBondContact OE1-NE 3.39Å; E115-R149 IonicContact OE1-NH2 3.87Å; E115-R149 PolarHBondContact OE1-NH2 2.85Å; E115-R149 IonicContact OE2-CZ 3.8Å; E115-R149 IonicContact OE2-NE 3.21Å; E115-R149 PolarHBondContact OE2-NE 3.4Å; E115-R149 IonicContact OE2-NH2 2.87Å
116	V	98.8	Very high	98.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.9	-48.8	172.8	175.7	0	0	0	0	110.8	I82 A112 A113 D114 A118 G119 L121 F125 V145 I146	I82-V116 HydrophobicContact CG2-CG1 3.94Å; I82-V116 WeakPolarHBondContact O-CG1 3.24Å; A112-V116 PolarHBondContact O-N 3.26Å; A112-V116 VanDerWaalsContact O-N 3.15Å; A113-V116 WeakPolarHBondContact O-CB 3.46Å; A113-V116 PolarHBondContact O-N 2.99Å; D114-V116 PolarHBondContact O-N 3.47Å; V116-A118 PolarHBondContact O-N 2.85Å; V116-G119 PolarHBondContact O-N 2.99Å; V116-L121 HydrophobicContact CG2-CB 4.43Å; V116-L121 HydrophobicContact CG2-CD1 3.89Å; V116-F125 HydrophobicContact CG1-CE2 4.25Å; V116-F125 HydrophobicContact CG1-CZ 3.93Å; V116-F125 HydrophobicContact CG2-CE2 4.46Å; V116-F125 HydrophobicContact CG2-CZ 4.09Å; V116-V145 HydrophobicContact CG2-CG1 4.25Å; V116-I146 HydrophobicContact CG2-CD1 4.33Å; V116-I146 HydrophobicContact CG2-CG1 3.83Å
117	S	98.5	Very high	98.6	Very high	31 Å²	31	39 Å²	39	22%	0.217	21%	0.211	C	C	.	.	H	α-helix	trans	-64.4	-29.7	179.5	56.9	0	0	0	0	113.3	K83 A113 D114 G119	K83-S117 WeakPolarHBondContact CG-O 3.43Å; A113-S117 PolarHBondContact O-N 3.28Å; A113-S117 PolarHBondContact O-OG 2.83Å; D114-S117 WeakPolarHBondContact CA-OG 2.8Å; D114-S117 PolarHBondContact O-N 2.91Å; D114-S117 PolarHBondContact O-OG 2.89Å; S117-G119 VanDerWaalsContact C-N 3.27Å; S117-G119 PolarHBondContact O-N 3.35Å
118	A	98.4	Very high	98.6	Very high	60 Å²	60	36 Å²	36	50%	0.496	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-7.6	175.3	0	0	0	0	0	113.6	D114 E115 V116 K120	D114-A118 VanDerWaalsContact O-CB 3.27Å; D114-A118 WeakPolarHBondContact O-CB 3.28Å; D114-A118 PolarHBondContact O-N 3.04Å; E115-A118 PolarHBondContact O-N 3.12Å; V116-A118 PolarHBondContact O-N 2.85Å; A118-K120 HydrophobicContact CB-CG 4.25Å
119	G	98.2	Very high	98.6	Very high	19 Å²	19	36 Å²	36	20%	0.196	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	20.9	-179.3	0	0	0	0	0	115	E115 V116 S117 L121 D122	E115-G119 PolarHBondContact O-N 2.98Å; V116-G119 PolarHBondContact O-N 2.99Å; S117-G119 VanDerWaalsContact C-N 3.27Å; S117-G119 PolarHBondContact O-N 3.35Å; G119-L121 VanDerWaalsContact C-N 3.26Å; G119-L121 PolarHBondContact O-N 3.43Å; G119-D122 WeakPolarHBondContact CA-OD1 3.42Å; G119-D122 VanDerWaalsContact O-CG 3.3Å
120	K	98.7	Very high	98.6	Very high	154 Å²	154	40.9 Å²	40.9	67%	0.67	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-14.2	-179.4	-63.9	-179.3	-178.1	175.5	0	113.1	E115 A118	E115-K120 HydrophobicContact CB-CB 4.3Å; E115-K120 HydrophobicContact CB-CD 4.38Å; E115-K120 HydrophobicContact CG-CD 4.18Å; E115-K120 PolarHBondContact O-N 3.2Å; A118-K120 HydrophobicContact CB-CG 4.25Å
121	L	98.6	Very high	98.6	Very high	11 Å²	11	41 Å²	41	6%	0.058	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.1	20.4	-171.9	-60.3	179.4	0	0	0	112.8	Y56 E115 V116 G119 D123 H124 F125 V145 R149	Y56-L121 HydrophobicContact CD2-CD2 3.96Å; Y56-L121 HydrophobicContact CE2-CD2 3.75Å; E115-L121 HydrophobicContact CB-CD1 3.99Å; E115-L121 HydrophobicContact CB-CG 4.22Å; V116-L121 HydrophobicContact CG2-CB 4.43Å; V116-L121 HydrophobicContact CG2-CD1 3.89Å; G119-L121 VanDerWaalsContact C-N 3.26Å; G119-L121 PolarHBondContact O-N 3.43Å; L121-D123 PolarHBondContact O-N 3.34Å; L121-D123 VanDerWaalsContact O-N 3.1Å; L121-H124 WeakPolarHBondContact O-CB 3.44Å; L121-H124 PolarHBondContact O-CD2 3.05Å; L121-H124 VanDerWaalsContact O-CD2 3.28Å; L121-H124 PolarHBondContact O-N 3.07Å; L121-F125 HydrophobicContact CB-CE2 4.33Å; L121-F125 VanDerWaalsContact O-CD2 3.23Å; L121-F125 WeakPolarHBondContact O-CD2 3.48Å; L121-F125 VanDerWaalsContact O-CE2 3.23Å; L121-F125 WeakPolarHBondContact O-CE2 3.49Å; L121-V145 HydrophobicContact CB-CG1 4.45Å; L121-V145 HydrophobicContact CD1-CG1 4.07Å; L121-R149 HydrophobicContact CD1-CB 4.43Å; L121-R149 HydrophobicContact CD1-CG 4.17Å
122	D	97.9	Very high	98.6	Very high	44 Å²	44	37.3 Å²	37.3	24%	0.235	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-57.1	-30.6	-173.6	-70.5	-0.3	0	0	0	113.2	R76 I79 G119 H124 F125	R76-D122 PolarHBondContact NH2-O 3.46Å; I79-D122 HydrophobicContact CD1-CB 3.65Å; I79-D122 WeakPolarHBondContact CD1-OD1 3.3Å; I79-D122 VanDerWaalsContact CD1-OD2 3.32Å; I79-D122 WeakPolarHBondContact CD1-OD2 3.46Å; I79-D122 VanDerWaalsContact CG1-OD2 3.3Å; I79-D122 WeakPolarHBondContact CG1-OD2 3.27Å; G119-D122 WeakPolarHBondContact CA-OD1 3.42Å; G119-D122 VanDerWaalsContact O-CG 3.3Å; D122-H124 PolarHBondContact O-N 3.07Å; D122-H124 VanDerWaalsContact O-N 3.16Å; D122-F125 PolarHBondContact O-N 2.91Å
123	D	98.1	Very high	98.6	Very high	113 Å²	113	38.1 Å²	38.1	60%	0.604	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-72.8	-1.3	178.7	-73	-20.4	0	0	0	114.8	K55 L121	K55-D123 PolarHBondContact NZ-O 3.4Å; L121-D123 PolarHBondContact O-N 3.34Å; L121-D123 VanDerWaalsContact O-N 3.1Å
124	H	98.7	Very high	98.5	Very high	21 Å²	21	38.5 Å²	38.5	10%	0.097	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-103.3	11.4	178.1	-55.2	-79.4	0	0	0	113.4	D54 Y56 Y57 L121 D122 P126 N141 V145	D54-H124 PolarHBondContact O-CE1 3.33Å; Y56-H124 AromaticContact CD2-CD2 3.69Å; Y56-H124 AromaticContact CD2-CE1 3.34Å; Y56-H124 WeakPolarHBondContact CD2-CE1 3.32Å; Y56-H124 AromaticContact CD2-CG 3.86Å; Y56-H124 AromaticContact CD2-ND1 3.67Å; Y56-H124 AromaticContact CD2-NE2 3.36Å; Y56-H124 WeakPolarHBondContact CD2-NE2 3.41Å; Y56-H124 AromaticContact CE2-CE1 3.85Å; Y56-H124 AromaticContact CE2-NE2 3.69Å; Y56-H124 PolarHBondContact N-ND1 3.24Å; Y57-H124 HydrophobicContact CD1-CB 4.38Å; Y57-H124 WeakPolarHBondContact CD1-O 3.37Å; L121-H124 WeakPolarHBondContact O-CB 3.44Å; L121-H124 PolarHBondContact O-CD2 3.05Å; L121-H124 VanDerWaalsContact O-CD2 3.28Å; L121-H124 PolarHBondContact O-N 3.07Å; D122-H124 PolarHBondContact O-N 3.07Å; D122-H124 VanDerWaalsContact O-N 3.16Å; H124-P126 WeakPolarHBondContact O-CD 3.39Å; H124-N141 PolarHBondContact O-ND2 3.21Å; H124-V145 HydrophobicContact CB-CG1 4.23Å; H124-V145 HydrophobicContact CB-CG2 3.72Å
125	F	98.8	Very high	98.5	Very high	5 Å²	5	35.6 Å²	35.6	2%	0.022	20%	0.197	C	C	.	.			trans	-121.9	78.3	-179.3	-61	-81.1	0	0	0	111.5	R76 I82 V116 L121 D122 L127 N141 V142 V145	R76-F125 PolarHBondContact NE-O 3.39Å; R76-F125 PolarHBondContact NH2-O 3.21Å; I82-F125 HydrophobicContact CD1-CB 4.03Å; I82-F125 HydrophobicContact CD1-CD1 3.79Å; I82-F125 HydrophobicContact CD1-CE1 4.48Å; I82-F125 HydrophobicContact CD1-CG 3.96Å; I82-F125 HydrophobicContact CG1-CB 4.16Å; I82-F125 HydrophobicContact CG1-CD1 4.43Å; I82-F125 HydrophobicContact CG1-CG 4.14Å; I82-F125 HydrophobicContact CG2-CD1 3.95Å; I82-F125 HydrophobicContact CG2-CD2 3.44Å; I82-F125 VanDerWaalsContact CG2-CD2 3.44Å; I82-F125 HydrophobicContact CG2-CE1 3.96Å; I82-F125 HydrophobicContact CG2-CE2 3.45Å; I82-F125 VanDerWaalsContact CG2-CE2 3.45Å; I82-F125 HydrophobicContact CG2-CG 3.69Å; I82-F125 HydrophobicContact CG2-CZ 3.71Å; V116-F125 HydrophobicContact CG1-CE2 4.25Å; V116-F125 HydrophobicContact CG1-CZ 3.93Å; V116-F125 HydrophobicContact CG2-CE2 4.46Å; V116-F125 HydrophobicContact CG2-CZ 4.09Å; L121-F125 HydrophobicContact CB-CE2 4.33Å; L121-F125 VanDerWaalsContact O-CD2 3.23Å; L121-F125 WeakPolarHBondContact O-CD2 3.48Å; L121-F125 VanDerWaalsContact O-CE2 3.23Å; L121-F125 WeakPolarHBondContact O-CE2 3.49Å; D122-F125 PolarHBondContact O-N 2.91Å; F125-L127 VanDerWaalsContact C-N 3.34Å; F125-N141 WeakPolarHBondContact CA-OD1 3.47Å; F125-N141 WeakPolarHBondContact CD1-OD1 3.37Å; F125-V142 HydrophobicContact CD1-CG2 4.29Å; F125-V142 HydrophobicContact CE1-CB 4.29Å; F125-V142 HydrophobicContact CE1-CG2 3.6Å; F125-V142 HydrophobicContact CZ-CG2 4.43Å; F125-V145 HydrophobicContact CE1-CB 4.22Å; F125-V145 HydrophobicContact CE1-CG2 4.03Å; F125-V145 HydrophobicContact CE2-CG1 4.18Å; F125-V145 HydrophobicContact CZ-CB 3.93Å; F125-V145 HydrophobicContact CZ-CG1 3.75Å; F125-V145 HydrophobicContact CZ-CG2 4.02Å
126	P	98.5	Very high	98.5	Very high	39 Å²	39	35.1 Å²	35.1	25%	0.253	20%	0.196	S	C	.	.			trans	-83.9	-7.5	-172.1	34.6	-37.3	0	0	0	113.9	Y57 T61 T65 H124	Y57-P126 HydrophobicContact CD1-CG 4.24Å; Y57-P126 HydrophobicContact CE1-CG 4.06Å; T61-P126 HydrophobicContact CG2-CG 3.68Å; T65-P126 HydrophobicContact CG2-CB 3.99Å; T65-P126 HydrophobicContact CG2-CG 3.65Å; H124-P126 WeakPolarHBondContact O-CD 3.39Å
127	L	98.8	Very high	98.5	Very high	7 Å²	7	36.3 Å²	36.3	4%	0.037	20%	0.202	C	C	.	.			trans	-74.9	144.4	-170	-57.3	-176.2	0	0	0	112.6	T61 T65 R76 M77 F125 Q137 N141	T61-L127 HydrophobicContact CG2-CD1 4.49Å; T61-L127 HydrophobicContact CG2-CD2 4.09Å; T61-L127 HydrophobicContact CG2-CG 4.19Å; T65-L127 HydrophobicContact CG2-CD2 3.64Å; R76-L127 WeakPolarHBondContact CA-O 3.22Å; M77-L127 PolarHBondContact N-O 3.24Å; F125-L127 VanDerWaalsContact C-N 3.34Å; L127-Q137 VanDerWaalsContact CD1-C 3.49Å; L127-Q137 HydrophobicContact CD1-CB 3.66Å; L127-Q137 WeakPolarHBondContact CD1-O 3.5Å; L127-N141 HydrophobicContact CD1-CB 3.77Å; L127-N141 HydrophobicContact CG-CB 4.48Å
128	V	98.8	Very high	98.5	Very high	11 Å²	11	34.8 Å²	34.8	7%	0.067	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-87	162.2	179.1	-62.4	0	0	0	0	112.5	F68 E75 W130 Q131	F68-V128 HydrophobicContact CB-CG2 4.32Å; F68-V128 WeakPolarHBondContact O-CG2 3.35Å; E75-V128 HydrophobicContact CB-CB 4.22Å; E75-V128 HydrophobicContact CB-CG1 4.12Å; E75-V128 CarbonylContact O-C 3.51Å; E75-V128 WeakPolarHBondContact O-CA 3.25Å; E75-V128 VanDerWaalsContact O-CB 3.28Å; E75-V128 WeakPolarHBondContact O-CB 3.27Å; V128-W130 HydrophobicContact CG2-CB 4.19Å; V128-W130 PolarHBondContact O-N 3.02Å; V128-Q131 PolarHBondContact O-NE2 3.37Å
129	V	98.8	Very high	98.5	Very high	3 Å²	3	32 Å²	32	2%	0.018	17%	0.168	C	C	.	.	S	Bend	trans	-56.2	-39.6	170.4	172.9	0	0	0	0	111	E75 Q131 P399 M400 K403	E75-V129 PolarHBondContact O-N 3.39Å; V129-Q131 PolarHBondContact O-N 2.96Å; V129-P399 HydrophobicContact CG1-CB 3.95Å; V129-P399 WeakPolarHBondContact O-CB 3.39Å; V129-M400 HydrophobicContact CG1-CB 4.42Å; V129-K403 HydrophobicContact CG1-CB 4.02Å; V129-K403 HydrophobicContact CG1-CG 4.32Å; V129-K403 HydrophobicContact CG2-CB 4.03Å; V129-K403 HydrophobicContact CG2-CD 3.87Å; V129-K403 HydrophobicContact CG2-CG 3.96Å
130	W	98.8	Very high	98.5	Very high	101 Å²	101	33 Å²	33	38%	0.383	17%	0.168	S	C	.	.	S	Bend	trans	-79.2	60	-175.9	-45.9	112.6	0	0	0	112.2	F68 I70 E75 V128 M400	F68-W130 WeakPolarHBondContact CD1-O 3.49Å; I70-W130 HydrophobicContact CB-CB 3.81Å; I70-W130 HydrophobicContact CB-CG 4.3Å; I70-W130 HydrophobicContact CD1-CB 4.1Å; I70-W130 HydrophobicContact CG2-CB 3.86Å; I70-W130 HydrophobicContact CG2-CG 3.9Å; E75-W130 PolarHBondContact OE2-NE1 2.96Å; V128-W130 HydrophobicContact CG2-CB 4.19Å; V128-W130 PolarHBondContact O-N 3.02Å; W130-M400 HydrophobicContact CH2-CB 4.26Å; W130-M400 HydrophobicContact CZ3-CB 3.84Å
131	Q	98.6	Very high	98.6	Very high	21 Å²	21	25.7 Å²	25.7	10%	0.098	14%	0.137	C	C	.	.	S	Bend	trans	-112.7	-155.7	178.9	67.3	-179.1	-95.5	0	0	110.7	F68 V128 V129 G133 T138 P399	F68-Q131 HydrophobicContact CD1-CB 4.43Å; F68-Q131 HydrophobicContact CG-CB 4.29Å; V128-Q131 PolarHBondContact O-NE2 3.37Å; V129-Q131 PolarHBondContact O-N 2.96Å; Q131-G133 PolarHBondContact O-N 2.87Å; Q131-T138 PolarHBondContact NE2-OG1 3.06Å; Q131-T138 PolarHBondContact OE1-OG1 3.14Å; Q131-P399 HydrophobicContact CG-CG 4.31Å
132	T	98.2	Very high	98.6	Very high	45 Å²	45	25.2 Å²	25.2	28%	0.276	13%	0.134	S	C	.	.			trans	-58.7	142.5	168.8	-165.2	0	0	0	0	111.1	S134 G135	T132-S134 WeakPolarHBondContact CG2-OG 3.38Å; T132-S134 PolarHBondContact O-N 3.21Å; T132-S134 VanDerWaalsContact O-N 3.16Å; T132-G135 PolarHBondContact O-N 2.82Å
133	G	98.4	Very high	98.6	Very high	18 Å²	18	23.4 Å²	23.4	19%	0.186	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.8	-177.2	0	0	0	0	0	115.8	Q131 V396 K398 P399	Q131-G133 PolarHBondContact O-N 2.87Å; G133-V396 CarbonylContact C-O 3.24Å; G133-V396 WeakPolarHBondContact CA-O 3.27Å; G133-V396 CarbonylContact O-C 3.53Å; G133-V396 VanDerWaalsContact O-C 3.22Å; G133-V396 WeakPolarHBondContact O-CA 3.48Å; G133-K398 WeakPolarHBondContact O-CB 3.09Å; G133-K398 WeakPolarHBondContact O-CG 3.12Å; G133-K398 PolarHBondContact O-N 3.42Å; G133-K398 VanDerWaalsContact O-N 3.08Å; G133-P399 WeakPolarHBondContact O-CD 3.27Å
134	S	98.1	Very high	98.7	Very high	7 Å²	7	18.3 Å²	18.3	5%	0.049	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-12.1	173.9	63.9	0	0	0	0	113.5	T132 T136 F180	T132-S134 WeakPolarHBondContact CG2-OG 3.38Å; T132-S134 PolarHBondContact O-N 3.21Å; T132-S134 VanDerWaalsContact O-N 3.16Å; S134-T136 VanDerWaalsContact C-N 3.34Å; S134-T136 PolarHBondContact OG-OG1 2.69Å; S134-F180 WeakPolarHBondContact O-CB 3.46Å
135	G	98.6	Very high	98.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.093	C	C	.	.			trans	75.2	17.1	-174.3	0	0	0	0	0	115.1	T132 Q137 T138 N139 F180	T132-G135 PolarHBondContact O-N 2.82Å; G135-Q137 VanDerWaalsContact C-N 3.29Å; G135-Q137 PolarHBondContact O-N 2.67Å; G135-T138 PolarHBondContact O-N 2.99Å; G135-N139 PolarHBondContact O-N 3.23Å; G135-N139 VanDerWaalsContact O-N 3.14Å; G135-F180 VanDerWaalsContact CA-CD2 3.49Å; G135-F180 WeakPolarHBondContact O-CD2 3.41Å
136	T	98.3	Very high	98.7	Very high	27 Å²	27	17.1 Å²	17.1	17%	0.166	9%	0.091	C	C	.	.	H	α-helix	trans	-55.9	-38.1	-179.8	-58.9	0	0	0	0	113.1	S134 T138 N139 M140 S176	S134-T136 VanDerWaalsContact C-N 3.34Å; S134-T136 PolarHBondContact OG-OG1 2.69Å; T136-T138 PolarHBondContact O-N 2.86Å; T136-N139 PolarHBondContact O-N 3.17Å; T136-M140 HydrophobicContact CG2-CE 4.07Å; T136-M140 HydrophobicContact CG2-CG 4.27Å; T136-M140 HydrophobicContact CG2-SD 4.19Å; T136-M140 WeakPolarHBondContact O-CG 3.48Å; T136-M140 PolarHBondContact O-N 3.42Å; T136-S176 WeakPolarHBondContact CG2-OG 3.38Å; T136-S176 VanDerWaalsContact OG1-CB 3.31Å; T136-S176 WeakPolarHBondContact OG1-CB 3.21Å
137	Q	98.7	Very high	98.7	Very high	25 Å²	25	15.3 Å²	15.3	12%	0.117	8%	0.08	C	C	.	.	H	α-helix	trans	-65.8	-39.1	-179.5	-63.2	88.2	5.9	0	0	111.8	S64 F68 L127 G135 M140 N141	S64-Q137 WeakPolarHBondContact OG-CG 3.34Å; F68-Q137 HydrophobicContact CE2-CG 4.26Å; L127-Q137 VanDerWaalsContact CD1-C 3.49Å; L127-Q137 HydrophobicContact CD1-CB 3.66Å; L127-Q137 WeakPolarHBondContact CD1-O 3.5Å; G135-Q137 VanDerWaalsContact C-N 3.29Å; G135-Q137 PolarHBondContact O-N 2.67Å; Q137-M140 HydrophobicContact CB-CE 4.47Å; Q137-M140 HydrophobicContact CG-CE 4.17Å; Q137-M140 PolarHBondContact O-N 2.97Å; Q137-N141 WeakPolarHBondContact O-CB 3.43Å; Q137-N141 PolarHBondContact O-N 2.76Å
138	T	98.9	Very high	98.7	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-64.7	-40.4	172.5	-72.6	0	0	0	0	112.2	M77 I82 F85 Q131 G135 T136 M140 N141 V142 F180	M77-T138 HydrophobicContact CG-CG2 4.32Å; I82-T138 HydrophobicContact CD1-CG2 3.93Å; F85-T138 HydrophobicContact CD2-CG2 3.98Å; F85-T138 HydrophobicContact CE2-CG2 3.65Å; F85-T138 HydrophobicContact CZ-CG2 4.38Å; Q131-T138 PolarHBondContact NE2-OG1 3.06Å; Q131-T138 PolarHBondContact OE1-OG1 3.14Å; G135-T138 PolarHBondContact O-N 2.99Å; T136-T138 PolarHBondContact O-N 2.86Å; T138-M140 VanDerWaalsContact C-N 3.34Å; T138-M140 PolarHBondContact O-N 3.18Å; T138-N141 PolarHBondContact O-N 3.14Å; T138-V142 HydrophobicContact CG2-CG2 4.43Å; T138-V142 VanDerWaalsContact O-CG2 3.29Å; T138-V142 WeakPolarHBondContact O-CG2 3.37Å; T138-V142 PolarHBondContact O-N 2.79Å; T138-F180 HydrophobicContact CG2-CE2 4.23Å
139	N	98.8	Very high	98.7	Very high	1 Å²	1	17 Å²	17	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-58.1	-47.1	173	177.8	53.7	0	0	0	111.4	F85 K89 G135 T136 N141 V142 N143 N171 T179	F85-N139 HydrophobicContact CE1-CB 4.01Å; F85-N139 HydrophobicContact CZ-CB 4.11Å; K89-N139 WeakPolarHBondContact CE-OD1 3.47Å; K89-N139 PolarHBondContact NZ-OD1 3.37Å; G135-N139 PolarHBondContact O-N 3.23Å; G135-N139 VanDerWaalsContact O-N 3.14Å; T136-N139 PolarHBondContact O-N 3.17Å; N139-N141 PolarHBondContact O-N 3.18Å; N139-V142 PolarHBondContact O-N 3.37Å; N139-N143 PolarHBondContact ND2-ND2 3.43Å; N139-N143 PolarHBondContact O-N 3.19Å; N139-N143 PolarHBondContact O-ND2 3.22Å; N139-N171 PolarHBondContact ND2-OD1 3.25Å; N139-N171 PolarHBondContact OD1-OD1 3.41Å; N139-T179 VanDerWaalsContact CG-OG1 3.25Å; N139-T179 PolarHBondContact OD1-OG1 3.23Å
140	M	98.6	Very high	98.7	Very high	40 Å²	40	16.9 Å²	16.9	20%	0.197	8%	0.084	C	C	.	.	H	α-helix	trans	-62.5	-42.3	177	-70.3	-172.5	-54.4	0	0	112.2	Q60 T136 Q137 T138 V142 N143 E144	Q60-M140 HydrophobicContact CB-CB 4.34Å; Q60-M140 HydrophobicContact CB-CE 4.34Å; Q60-M140 HydrophobicContact CB-SD 4.33Å; Q60-M140 HydrophobicContact CG-SD 4.34Å; Q60-M140 PolarHBondContact OE1-SD 2.77Å; Q60-M140 VanDerWaalsContact OE1-SD 3.36Å; T136-M140 HydrophobicContact CG2-CE 4.07Å; T136-M140 HydrophobicContact CG2-CG 4.27Å; T136-M140 HydrophobicContact CG2-SD 4.19Å; T136-M140 WeakPolarHBondContact O-CG 3.48Å; T136-M140 PolarHBondContact O-N 3.42Å; Q137-M140 HydrophobicContact CB-CE 4.47Å; Q137-M140 HydrophobicContact CG-CE 4.17Å; Q137-M140 PolarHBondContact O-N 2.97Å; T138-M140 VanDerWaalsContact C-N 3.34Å; T138-M140 PolarHBondContact O-N 3.18Å; M140-V142 VanDerWaalsContact C-N 3.35Å; M140-V142 PolarHBondContact O-N 3Å; M140-N143 WeakPolarHBondContact O-CB 3.34Å; M140-N143 PolarHBondContact O-N 3.37Å; M140-E144 WeakPolarHBondContact O-CG 3.34Å; M140-E144 PolarHBondContact O-N 2.88Å
141	N	98.9	Very high	98.7	Very high	1 Å²	1	12.1 Å²	12.1	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-60.1	-44.5	176.3	178.1	-171.8	0	0	0	111.8	T61 H124 F125 L127 Q137 T138 N139 E144 V145	T61-N141 HydrophobicContact CG2-CB 4.17Å; T61-N141 VanDerWaalsContact OG1-CA 3.24Å; T61-N141 WeakPolarHBondContact OG1-CA 3.45Å; T61-N141 VanDerWaalsContact OG1-CB 3.31Å; T61-N141 WeakPolarHBondContact OG1-CB 3.49Å; T61-N141 PolarHBondContact OG1-ND2 3.21Å; H124-N141 PolarHBondContact O-ND2 3.21Å; F125-N141 WeakPolarHBondContact CA-OD1 3.47Å; F125-N141 WeakPolarHBondContact CD1-OD1 3.37Å; L127-N141 HydrophobicContact CD1-CB 3.77Å; L127-N141 HydrophobicContact CG-CB 4.48Å; Q137-N141 WeakPolarHBondContact O-CB 3.43Å; Q137-N141 PolarHBondContact O-N 2.76Å; T138-N141 PolarHBondContact O-N 3.14Å; N139-N141 PolarHBondContact O-N 3.18Å; N141-E144 PolarHBondContact O-N 3.34Å; N141-V145 WeakPolarHBondContact ND2-CG2 3.33Å; N141-V145 WeakPolarHBondContact O-CB 3.1Å; N141-V145 VanDerWaalsContact O-CG2 3.3Å; N141-V145 WeakPolarHBondContact O-CG2 3.36Å; N141-V145 PolarHBondContact O-N 2.99Å
142	V	98.9	Very high	98.7	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-60.1	-46.7	173.8	169.8	0	0	0	0	111.1	F85 K89 F125 T138 N139 M140 E144 V145 I146	F85-V142 HydrophobicContact CB-CB 4.35Å; F85-V142 HydrophobicContact CB-CG1 3.91Å; F85-V142 HydrophobicContact CB-CG2 3.66Å; F85-V142 HydrophobicContact CD1-CB 4.32Å; F85-V142 HydrophobicContact CD1-CG1 4.16Å; F85-V142 HydrophobicContact CD1-CG2 4.13Å; F85-V142 HydrophobicContact CD2-CG2 4.14Å; F85-V142 HydrophobicContact CG-CB 4.39Å; F85-V142 HydrophobicContact CG-CG1 4.3Å; F85-V142 HydrophobicContact CG-CG2 3.73Å; K89-V142 HydrophobicContact CG-CG1 3.74Å; F125-V142 HydrophobicContact CD1-CG2 4.29Å; F125-V142 HydrophobicContact CE1-CB 4.29Å; F125-V142 HydrophobicContact CE1-CG2 3.6Å; F125-V142 HydrophobicContact CZ-CG2 4.43Å; T138-V142 HydrophobicContact CG2-CG2 4.43Å; T138-V142 VanDerWaalsContact O-CG2 3.29Å; T138-V142 WeakPolarHBondContact O-CG2 3.37Å; T138-V142 PolarHBondContact O-N 2.79Å; N139-V142 PolarHBondContact O-N 3.37Å; M140-V142 VanDerWaalsContact C-N 3.35Å; M140-V142 PolarHBondContact O-N 3Å; V142-E144 VanDerWaalsContact C-N 3.34Å; V142-E144 PolarHBondContact O-N 2.87Å; V142-V145 PolarHBondContact O-N 3.06Å; V142-I146 HydrophobicContact CG1-CD1 3.62Å; V142-I146 HydrophobicContact CG1-CG1 4.42Å; V142-I146 WeakPolarHBondContact O-CB 3.2Å; V142-I146 WeakPolarHBondContact O-CG1 3.44Å; V142-I146 PolarHBondContact O-N 3.44Å
143	N	98.9	Very high	98.7	Very high	6 Å²	6	15.1 Å²	15.1	3%	0.032	8%	0.078	C	C	.	.	H	α-helix	trans	-59.7	-44.6	178.5	-67.4	-27.9	0	0	0	111.9	K89 N139 M140 S147 P166 V170 N171	K89-N143 WeakPolarHBondContact CE-OD1 3.45Å; K89-N143 PolarHBondContact NZ-OD1 3.37Å; N139-N143 PolarHBondContact ND2-ND2 3.43Å; N139-N143 PolarHBondContact O-N 3.19Å; N139-N143 PolarHBondContact O-ND2 3.22Å; M140-N143 WeakPolarHBondContact O-CB 3.34Å; M140-N143 PolarHBondContact O-N 3.37Å; N143-S147 WeakPolarHBondContact O-CB 3.49Å; N143-S147 PolarHBondContact O-N 3.43Å; N143-P166 HydrophobicContact CB-CB 3.96Å; N143-P166 WeakPolarHBondContact CB-O 3.46Å; N143-V170 HydrophobicContact CB-CB 4.4Å; N143-V170 HydrophobicContact CB-CG1 4.36Å; N143-N171 WeakPolarHBondContact ND2-CB 3.38Å; N143-N171 PolarHBondContact ND2-OD1 2.96Å
144	E	98.9	Very high	98.7	Very high	7 Å²	7	17.8 Å²	17.8	3%	0.033	9%	0.088	C	C	.	.	H	α-helix	trans	-64.6	-45	178.1	-72.2	-177.7	144.2	0	0	112.2	Y56 G58 A59 Q60 T61 M140 N141 V142 S147 N148 P166	Y56-E144 CarbonylContact O-C 3.22Å; G58-E144 VanDerWaalsContact C-OE1 3.23Å; G58-E144 WeakPolarHBondContact CA-OE1 3.28Å; G58-E144 WeakPolarHBondContact CA-OE2 3.25Å; G58-E144 VanDerWaalsContact N-CD 3.32Å; G58-E144 PolarHBondContact N-OE2 3.04Å; A59-E144 PolarHBondContact N-OE1 3.36Å; Q60-E144 VanDerWaalsContact CB-OE1 3.31Å; Q60-E144 WeakPolarHBondContact CB-OE1 3.42Å; Q60-E144 PolarHBondContact N-OE1 2.99Å; T61-E144 VanDerWaalsContact CB-OE2 3.29Å; T61-E144 WeakPolarHBondContact CB-OE2 3.26Å; T61-E144 PolarHBondContact N-OE2 3.4Å; T61-E144 PolarHBondContact OG1-OE2 3.01Å; M140-E144 WeakPolarHBondContact O-CG 3.34Å; M140-E144 PolarHBondContact O-N 2.88Å; N141-E144 PolarHBondContact O-N 3.34Å; V142-E144 VanDerWaalsContact C-N 3.34Å; V142-E144 PolarHBondContact O-N 2.87Å; E144-S147 PolarHBondContact O-N 3.45Å; E144-N148 WeakPolarHBondContact O-CB 3.06Å; E144-N148 PolarHBondContact O-N 2.94Å; E144-N148 PolarHBondContact O-ND2 2.85Å; E144-P166 HydrophobicContact CG-CB 4.45Å
145	V	98.9	Very high	98.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62	-49.6	178.7	169.1	0	0	0	0	111.1	V116 L121 H124 F125 N141 V142 N148 R149	V116-V145 HydrophobicContact CG2-CG1 4.25Å; L121-V145 HydrophobicContact CB-CG1 4.45Å; L121-V145 HydrophobicContact CD1-CG1 4.07Å; H124-V145 HydrophobicContact CB-CG1 4.23Å; H124-V145 HydrophobicContact CB-CG2 3.72Å; F125-V145 HydrophobicContact CE1-CB 4.22Å; F125-V145 HydrophobicContact CE1-CG2 4.03Å; F125-V145 HydrophobicContact CE2-CG1 4.18Å; F125-V145 HydrophobicContact CZ-CB 3.93Å; F125-V145 HydrophobicContact CZ-CG1 3.75Å; F125-V145 HydrophobicContact CZ-CG2 4.02Å; N141-V145 WeakPolarHBondContact ND2-CG2 3.33Å; N141-V145 WeakPolarHBondContact O-CB 3.1Å; N141-V145 VanDerWaalsContact O-CG2 3.3Å; N141-V145 WeakPolarHBondContact O-CG2 3.36Å; N141-V145 PolarHBondContact O-N 2.99Å; V142-V145 PolarHBondContact O-N 3.06Å; V145-N148 PolarHBondContact O-N 3.1Å; V145-R149 VanDerWaalsContact O-CB 3.32Å; V145-R149 WeakPolarHBondContact O-CB 3.32Å; V145-R149 PolarHBondContact O-N 3.31Å
146	I	98.9	Very high	98.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66.1	-40.5	180	-69.4	173.4	0	0	0	110.8	K89 I109 A112 A113 V116 V142 A150 V170	K89-I146 HydrophobicContact CB-CD1 3.57Å; K89-I146 HydrophobicContact CG-CD1 3.77Å; I109-I146 HydrophobicContact CB-CG2 4.47Å; I109-I146 HydrophobicContact CG2-CG2 3.78Å; A112-I146 HydrophobicContact CB-CG2 4.02Å; A113-I146 HydrophobicContact CB-CD1 3.93Å; V116-I146 HydrophobicContact CG2-CD1 4.33Å; V116-I146 HydrophobicContact CG2-CG1 3.83Å; V142-I146 HydrophobicContact CG1-CD1 3.62Å; V142-I146 HydrophobicContact CG1-CG1 4.42Å; V142-I146 WeakPolarHBondContact O-CB 3.2Å; V142-I146 WeakPolarHBondContact O-CG1 3.44Å; V142-I146 PolarHBondContact O-N 3.44Å; I146-A150 WeakPolarHBondContact O-CB 3.48Å; I146-A150 PolarHBondContact O-N 3.03Å; I146-V170 HydrophobicContact CB-CG1 4.02Å; I146-V170 HydrophobicContact CD1-CG1 4.48Å; I146-V170 HydrophobicContact CG2-CG1 3.76Å; I146-V170 HydrophobicContact CG2-CG2 4.14Å
147	S	98.9	Very high	98.6	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.014	16%	0.163	C	C	.	.	H	α-helix	trans	-57.7	-54.8	175.2	160.9	0	0	0	0	111.2	N143 E144 R149 A150 I151 V164	N143-S147 WeakPolarHBondContact O-CB 3.49Å; N143-S147 PolarHBondContact O-N 3.43Å; E144-S147 PolarHBondContact O-N 3.45Å; S147-R149 VanDerWaalsContact C-N 3.34Å; S147-R149 PolarHBondContact O-N 3.16Å; S147-A150 PolarHBondContact O-N 2.62Å; S147-I151 VanDerWaalsContact O-CG1 3.25Å; S147-I151 WeakPolarHBondContact O-CG1 3.15Å; S147-I151 PolarHBondContact O-N 3.11Å; S147-V164 PolarHBondContact OG-O 3.22Å
148	N	98.9	Very high	98.6	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-66.2	-36.8	-177.4	-80.3	-42.9	0	0	0	112.6	Y56 E144 V145 I151 E152 L158 G159	Y56-N148 HydrophobicContact CD1-CB 4.1Å; Y56-N148 WeakPolarHBondContact O-CB 2.96Å; Y56-N148 PolarHBondContact O-ND2 3.35Å; E144-N148 WeakPolarHBondContact O-CB 3.06Å; E144-N148 PolarHBondContact O-N 2.94Å; E144-N148 PolarHBondContact O-ND2 2.85Å; V145-N148 PolarHBondContact O-N 3.1Å; N148-I151 PolarHBondContact O-N 2.82Å; N148-E152 PolarHBondContact O-N 2.74Å; N148-L158 HydrophobicContact CB-CG 4.27Å; N148-G159 PolarHBondContact OD1-N 3.48Å
149	R	98.8	Very high	98.4	Very high	50 Å²	50	30.7 Å²	30.7	19%	0.189	18%	0.176	C	C	.	.	H	α-helix	trans	-67.6	-40.4	175	-178.3	59.1	-176.4	135.1	8.3	112	Y56 A112 E115 L121 V145 S147 E152 I153	Y56-R149 HydrophobicContact CD1-CB 4.28Å; Y56-R149 HydrophobicContact CE1-CB 4.39Å; A112-R149 HydrophobicContact CB-CB 3.87Å; A112-R149 HydrophobicContact CB-CG 3.75Å; E115-R149 IonicContact OE1-CZ 2.73Å; E115-R149 IonicContact OE1-NE 2.82Å; E115-R149 PolarHBondContact OE1-NE 3.39Å; E115-R149 IonicContact OE1-NH2 3.87Å; E115-R149 PolarHBondContact OE1-NH2 2.85Å; E115-R149 IonicContact OE2-CZ 3.8Å; E115-R149 IonicContact OE2-NE 3.21Å; E115-R149 PolarHBondContact OE2-NE 3.4Å; E115-R149 IonicContact OE2-NH2 2.87Å; L121-R149 HydrophobicContact CD1-CB 4.43Å; L121-R149 HydrophobicContact CD1-CG 4.17Å; V145-R149 VanDerWaalsContact O-CB 3.32Å; V145-R149 WeakPolarHBondContact O-CB 3.32Å; V145-R149 PolarHBondContact O-N 3.31Å; S147-R149 VanDerWaalsContact C-N 3.34Å; S147-R149 PolarHBondContact O-N 3.16Å; R149-E152 IonicContact CZ-OE2 3.32Å; R149-E152 IonicContact NE-OE2 3.93Å; R149-E152 IonicContact NH1-OE2 3.57Å; R149-E152 PolarHBondContact NH1-OE2 3.22Å; R149-E152 PolarHBondContact O-N 2.89Å; R149-I153 HydrophobicContact CG-CD1 4.25Å; R149-I153 VanDerWaalsContact O-CG1 3.3Å; R149-I153 WeakPolarHBondContact O-CG1 3.4Å; R149-I153 PolarHBondContact O-N 3.24Å
150	A	98.8	Very high	98.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-38.2	174.7	0	0	0	0	0	112.2	A108 I109 A112 I146 S147 E152 I153 L154 V164	A108-A150 HydrophobicContact CB-CB 3.97Å; I109-A150 HydrophobicContact CG1-CB 4.34Å; A112-A150 HydrophobicContact CB-CB 4.24Å; I146-A150 WeakPolarHBondContact O-CB 3.48Å; I146-A150 PolarHBondContact O-N 3.03Å; S147-A150 PolarHBondContact O-N 2.62Å; A150-E152 VanDerWaalsContact C-N 3.35Å; A150-I153 PolarHBondContact O-N 2.99Å; A150-L154 VanDerWaalsContact O-CG 3.31Å; A150-L154 WeakPolarHBondContact O-CG 3.41Å; A150-L154 PolarHBondContact O-N 3.3Å; A150-L154 VanDerWaalsContact O-N 3.08Å; A150-V164 HydrophobicContact CB-CB 4.28Å; A150-V164 HydrophobicContact CB-CG1 4.2Å; A150-V164 HydrophobicContact CB-CG2 3.9Å
151	I	98.8	Very high	98.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.2	-47	172.4	-72.6	168.2	0	0	0	110.4	S147 N148 I153 L154 G155 G156 D162 V164	S147-I151 VanDerWaalsContact O-CG1 3.25Å; S147-I151 WeakPolarHBondContact O-CG1 3.15Å; S147-I151 PolarHBondContact O-N 3.11Å; N148-I151 PolarHBondContact O-N 2.82Å; I151-I153 PolarHBondContact O-N 3.36Å; I151-L154 CarbonylContact O-C 3.52Å; I151-L154 WeakPolarHBondContact O-CA 3.44Å; I151-L154 PolarHBondContact O-N 2.9Å; I151-L154 VanDerWaalsContact O-N 3.1Å; I151-G155 PolarHBondContact O-N 3.47Å; I151-G155 VanDerWaalsContact O-N 3.13Å; I151-G156 VanDerWaalsContact CG2-C 3.4Å; I151-G156 PolarHBondContact O-N 3.41Å; I151-D162 WeakPolarHBondContact CG1-O 3.46Å; I151-V164 HydrophobicContact CG1-CB 4Å; I151-V164 HydrophobicContact CG1-CG2 4.48Å
152	E	98.6	Very high	98.3	Very high	74 Å²	74	39.9 Å²	39.9	35%	0.346	23%	0.227	S	C	.	.	H	α-helix	trans	-62.6	-42.1	178	-172.1	-178.6	-125.7	0	0	112.2	Y56 N148 R149 A150 L154 G155 L158	Y56-E152 VanDerWaalsContact CE1-OE2 3.27Å; Y56-E152 WeakPolarHBondContact CE1-OE2 3.41Å; Y56-E152 VanDerWaalsContact CZ-OE2 3.3Å; Y56-E152 PolarHBondContact OH-OE2 3.41Å; N148-E152 PolarHBondContact O-N 2.74Å; R149-E152 IonicContact CZ-OE2 3.32Å; R149-E152 IonicContact NE-OE2 3.93Å; R149-E152 IonicContact NH1-OE2 3.57Å; R149-E152 PolarHBondContact NH1-OE2 3.22Å; R149-E152 PolarHBondContact O-N 2.89Å; A150-E152 VanDerWaalsContact C-N 3.35Å; E152-L154 PolarHBondContact O-N 3.23Å; E152-G155 PolarHBondContact O-N 3.08Å; E152-L158 HydrophobicContact CB-CD1 4.03Å; E152-L158 HydrophobicContact CG-CD1 4.36Å
153	I	98.6	Very high	98.2	Very high	56 Å²	56	41.9 Å²	41.9	29%	0.287	24%	0.24	S	C	.	.	H	α-helix	trans	-57.3	-33.7	173.6	-71.1	165.5	0	0	0	111.5	A108 K111 A112 R149 A150 I151 G155	A108-I153 HydrophobicContact CB-CG2 4.44Å; K111-I153 HydrophobicContact CB-CD1 3.99Å; A112-I153 HydrophobicContact CB-CD1 4.3Å; R149-I153 HydrophobicContact CG-CD1 4.25Å; R149-I153 VanDerWaalsContact O-CG1 3.3Å; R149-I153 WeakPolarHBondContact O-CG1 3.4Å; R149-I153 PolarHBondContact O-N 3.24Å; A150-I153 PolarHBondContact O-N 2.99Å; I151-I153 PolarHBondContact O-N 3.36Å; I153-G155 VanDerWaalsContact C-N 3.33Å
154	L	98.5	Very high	98.2	Very high	74 Å²	74	41.6 Å²	41.6	39%	0.387	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	4.6	178.2	-64.7	172.8	0	0	0	113.4	L105 A108 A150 I151 E152 G156 P163 V164	L105-L154 HydrophobicContact CD2-CD1 3.92Å; A108-L154 HydrophobicContact CB-CD1 3.8Å; A108-L154 HydrophobicContact CB-CD2 4.09Å; A108-L154 HydrophobicContact CB-CG 3.83Å; A150-L154 VanDerWaalsContact O-CG 3.31Å; A150-L154 WeakPolarHBondContact O-CG 3.41Å; A150-L154 PolarHBondContact O-N 3.3Å; A150-L154 VanDerWaalsContact O-N 3.08Å; I151-L154 CarbonylContact O-C 3.52Å; I151-L154 WeakPolarHBondContact O-CA 3.44Å; I151-L154 PolarHBondContact O-N 2.9Å; I151-L154 VanDerWaalsContact O-N 3.1Å; E152-L154 PolarHBondContact O-N 3.23Å; L154-G156 VanDerWaalsContact C-N 3.31Å; L154-G156 PolarHBondContact O-N 3.3Å; L154-P163 HydrophobicContact CB-CG 4.41Å; L154-P163 HydrophobicContact CD1-CG 3.63Å; L154-V164 HydrophobicContact CD1-CG2 3.95Å
155	G	98.2	Very high	98.2	Very high	70 Å²	70	43.8 Å²	43.8	72%	0.722	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.4	18	179.9	0	0	0	0	0	114.6	I151 E152 I153	I151-G155 PolarHBondContact O-N 3.47Å; I151-G155 VanDerWaalsContact O-N 3.13Å; E152-G155 PolarHBondContact O-N 3.08Å; I153-G155 VanDerWaalsContact C-N 3.33Å
156	G	97.4	Very high	98.2	Very high	33 Å²	33	44.2 Å²	44.2	34%	0.34	25%	0.252	S	S	.	.			trans	-86	-174.2	178.4	0	0	0	0	0	113.8	I151 L154	I151-G156 VanDerWaalsContact CG2-C 3.4Å; I151-G156 PolarHBondContact O-N 3.41Å; L154-G156 VanDerWaalsContact C-N 3.31Å; L154-G156 PolarHBondContact O-N 3.3Å
157	K	97.5	Very high	98.1	Very high	168 Å²	168	48.7 Å²	48.7	73%	0.73	28%	0.276	S	S	*	.			trans	-101.2	122	-177.5	-174.9	-177.9	179.4	-178.6	0	111.4	S160	K157-S160 WeakPolarHBondContact O-CB 3.34Å; K157-S160 PolarHBondContact O-N 2.76Å; K157-S160 PolarHBondContact O-OG 3.07Å
158	L	96.8	Very high	98.1	Very high	40 Å²	40	52.8 Å²	52.8	21%	0.209	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	140.6	175.2	-78.9	67.5	0	0	0	111.8	Y56 N148 E152 S160	Y56-L158 HydrophobicContact CD1-CD2 3.92Å; Y56-L158 HydrophobicContact CE1-CD2 4.07Å; N148-L158 HydrophobicContact CB-CG 4.27Å; E152-L158 HydrophobicContact CB-CD1 4.03Å; E152-L158 HydrophobicContact CG-CD1 4.36Å; L158-S160 PolarHBondContact O-N 2.99Å
159	G	96.5	Very high	98.1	Very high	18 Å²	18	55 Å²	55	19%	0.186	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	79	-7.4	-179.6	0	0	0	0	0	114.9	E42 N148 K161	E42-G159 WeakPolarHBondContact OE1-CA 3.33Å; N148-G159 PolarHBondContact OD1-N 3.48Å; G159-K161 VanDerWaalsContact C-N 3.29Å; G159-K161 PolarHBondContact O-N 3.42Å
160	S	97.2	Very high	98.1	Very high	54 Å²	54	52.7 Å²	52.7	38%	0.378	30%	0.299	S	S	.	.	S	Bend	trans	-71.1	-24.7	178.8	64.8	0	0	0	0	113.5	K157 L158 D162	K157-S160 WeakPolarHBondContact O-CB 3.34Å; K157-S160 PolarHBondContact O-N 2.76Å; K157-S160 PolarHBondContact O-OG 3.07Å; L158-S160 PolarHBondContact O-N 2.99Å; S160-D162 PolarHBondContact O-N 3.13Å; S160-D162 PolarHBondContact OG-N 3.05Å; S160-D162 VanDerWaalsContact OG-N 3.13Å; S160-D162 PolarHBondContact OG-O 3.44Å
161	K	98.1	Very high	98.1	Very high	70 Å²	70	53.2 Å²	53.2	30%	0.304	30%	0.302	S	S	.	.			trans	61.9	17.4	-168.9	-50	172.7	-173.5	164.9	0	113.2	R43 G159 V164 H165 P166	R43-K161 PolarHBondContact O-NZ 3.08Å; G159-K161 VanDerWaalsContact C-N 3.29Å; G159-K161 PolarHBondContact O-N 3.42Å; K161-V164 CarbonylContact O-C 3.57Å; K161-H165 WeakPolarHBondContact O-CA 3.35Å; K161-H165 PolarHBondContact O-N 3.43Å; K161-P166 HydrophobicContact CD-CG 4.43Å; K161-P166 HydrophobicContact CG-CG 4.37Å
162	D	97.3	Very high	98.1	Very high	111 Å²	111	56 Å²	56	59%	0.594	31%	0.314	S	S	*	.			trans	-128.1	130.9	-179.9	-176.6	67.1	0	0	0	110.2	I151 S160	I151-D162 WeakPolarHBondContact CG1-O 3.46Å; S160-D162 PolarHBondContact O-N 3.13Å; S160-D162 PolarHBondContact OG-N 3.05Å; S160-D162 VanDerWaalsContact OG-N 3.13Å; S160-D162 PolarHBondContact OG-O 3.44Å
163	P	98.2	Very high	98.1	Very high	42 Å²	42	53.3 Å²	53.3	27%	0.273	30%	0.303	S	S	.	.	S	Bend	cis	-84.8	-1.5	1.2	35.8	-37.8	0	0	0	114.3	L105 L154 H169	L105-P163 HydrophobicContact CD2-CB 3.83Å; L105-P163 HydrophobicContact CD2-CG 3.94Å; L154-P163 HydrophobicContact CB-CG 4.41Å; L154-P163 HydrophobicContact CD1-CG 3.63Å; P163-H169 PolarHBondContact O-CE1 2.77Å; P163-H169 PolarHBondContact O-ND1 3.07Å; P163-H169 VanDerWaalsContact O-ND1 3.15Å
164	V	98.8	Very high	98.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.294	C	S	.	.			trans	-107.7	102.6	-176.8	-175	0	0	0	0	111.2	L105 I109 S147 A150 I151 L154 K161 H169 V170	L105-V164 HydrophobicContact CD2-CG2 4.02Å; I109-V164 HydrophobicContact CD1-CG1 3.86Å; I109-V164 HydrophobicContact CG1-CG1 3.75Å; S147-V164 PolarHBondContact OG-O 3.22Å; A150-V164 HydrophobicContact CB-CB 4.28Å; A150-V164 HydrophobicContact CB-CG1 4.2Å; A150-V164 HydrophobicContact CB-CG2 3.9Å; I151-V164 HydrophobicContact CG1-CB 4Å; I151-V164 HydrophobicContact CG1-CG2 4.48Å; L154-V164 HydrophobicContact CD1-CG2 3.95Å; K161-V164 CarbonylContact O-C 3.57Å; V164-H169 HydrophobicContact CG1-CB 4.22Å; V164-V170 HydrophobicContact CG1-CG2 3.8Å
165	H	98.7	Very high	98	Very high	53 Å²	53	49.1 Å²	49.1	25%	0.245	28%	0.283	C	S	.	.			trans	-80.8	132.6	176.3	-166.2	-86.1	0	0	0	111.7	K161 N167 D168 H169 V170	K161-H165 WeakPolarHBondContact O-CA 3.35Å; K161-H165 PolarHBondContact O-N 3.43Å; H165-N167 VanDerWaalsContact C-N 3.33Å; H165-N167 PolarHBondContact ND1-N 3.26Å; H165-N167 VanDerWaalsContact ND1-N 3.18Å; H165-N167 PolarHBondContact O-N 2.91Å; H165-D168 HydrophobicContact CB-CB 4.13Å; H165-D168 IonicContact CE1-OD1 3.11Å; H165-D168 IonicContact CG-OD2 2.69Å; H165-D168 PolarHBondContact ND1-N 3.46Å; H165-D168 IonicContact ND1-OD1 2.67Å; H165-D168 IonicContact ND1-OD2 3.13Å; H165-H169 PolarHBondContact N-ND1 3.46Å; H165-H169 WeakPolarHBondContact O-CB 3.33Å; H165-H169 PolarHBondContact O-N 3.01Å; H165-H169 VanDerWaalsContact O-N 3.09Å; H165-V170 PolarHBondContact O-N 3.42Å
166	P	98.4	Very high	97.5	Very high	10 Å²	10	47.3 Å²	47.3	7%	0.065	26%	0.259	C	S	.	.	I	π-helix	trans	-63.7	-35	-176	23.7	-33.3	0	0	0	113.2	N143 E144 K161 V170 N171	N143-P166 HydrophobicContact CB-CB 3.96Å; N143-P166 WeakPolarHBondContact CB-O 3.46Å; E144-P166 HydrophobicContact CG-CB 4.45Å; K161-P166 HydrophobicContact CD-CG 4.43Å; K161-P166 HydrophobicContact CG-CG 4.37Å; P166-V170 WeakPolarHBondContact O-CB 3.48Å; P166-N171 PolarHBondContact O-N 2.9Å; P166-N171 VanDerWaalsContact O-N 3.07Å
167	N	98.1	Very high	97.5	Very high	94 Å²	94	47.3 Å²	47.3	50%	0.503	25%	0.251	S	S	.	.	I	π-helix	trans	-82.8	-64.6	176.3	-174.9	76	0	0	0	111.6	H165 H169 N171 K172	H165-N167 VanDerWaalsContact C-N 3.33Å; H165-N167 PolarHBondContact ND1-N 3.26Å; H165-N167 VanDerWaalsContact ND1-N 3.18Å; H165-N167 PolarHBondContact O-N 2.91Å; N167-H169 VanDerWaalsContact C-N 3.27Å; N167-H169 PolarHBondContact O-N 3.37Å; N167-N171 CarbonylContact O-C 3.32Å; N167-N171 VanDerWaalsContact O-C 3.23Å; N167-N171 VanDerWaalsContact O-CA 3.29Å; N167-N171 WeakPolarHBondContact O-CA 3.29Å; N167-N171 VanDerWaalsContact O-CB 3.25Å; N167-N171 WeakPolarHBondContact O-CB 3.16Å; N167-N171 PolarHBondContact O-N 3.13Å; N167-N171 VanDerWaalsContact O-N 3.11Å; N167-K172 PolarHBondContact O-N 3.45Å
168	D	98.4	Very high	97.5	Very high	87 Å²	87	39.4 Å²	39.4	47%	0.465	22%	0.217	S	C	.	.	I	π-helix	trans	-65.2	-24.1	-169.5	-50.1	-4.6	0	0	0	114.8	H165 K172	H165-D168 HydrophobicContact CB-CB 4.13Å; H165-D168 IonicContact CE1-OD1 3.11Å; H165-D168 IonicContact CG-OD2 2.69Å; H165-D168 PolarHBondContact ND1-N 3.46Å; H165-D168 IonicContact ND1-OD1 2.67Å; H165-D168 IonicContact ND1-OD2 3.13Å; D168-K172 WeakPolarHBondContact O-CB 3.28Å
169	H	98.8	Very high	97.6	Very high	50 Å²	50	37.5 Å²	37.5	23%	0.231	21%	0.207	C	C	.	.	I	π-helix	trans	-110.2	-58.6	177.7	-54.7	150.9	0	0	0	112.2	L101 I109 P163 V164 H165 N167 K172	L101-H169 HydrophobicContact CD1-CB 4.03Å; I109-H169 HydrophobicContact CD1-CB 3.94Å; P163-H169 PolarHBondContact O-CE1 2.77Å; P163-H169 PolarHBondContact O-ND1 3.07Å; P163-H169 VanDerWaalsContact O-ND1 3.15Å; V164-H169 HydrophobicContact CG1-CB 4.22Å; H165-H169 PolarHBondContact N-ND1 3.46Å; H165-H169 WeakPolarHBondContact O-CB 3.33Å; H165-H169 PolarHBondContact O-N 3.01Å; H165-H169 VanDerWaalsContact O-N 3.09Å; N167-H169 VanDerWaalsContact C-N 3.27Å; N167-H169 PolarHBondContact O-N 3.37Å; H169-K172 VanDerWaalsContact O-CB 3.28Å; H169-K172 WeakPolarHBondContact O-CB 3.47Å; H169-K172 PolarHBondContact O-N 3.23Å
170	V	98.8	Very high	97.7	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.018	20%	0.198	C	C	.	.	I	π-helix	trans	-72	-35.2	-174.5	-170	0	0	0	0	112.1	K89 I109 N143 I146 V164 H165 P166 Q174	K89-V170 HydrophobicContact CD-CG1 4.17Å; K89-V170 HydrophobicContact CG-CG1 4.4Å; I109-V170 HydrophobicContact CD1-CG2 4.18Å; I109-V170 HydrophobicContact CG1-CG2 4.22Å; I109-V170 HydrophobicContact CG2-CG1 4.46Å; N143-V170 HydrophobicContact CB-CB 4.4Å; N143-V170 HydrophobicContact CB-CG1 4.36Å; I146-V170 HydrophobicContact CB-CG1 4.02Å; I146-V170 HydrophobicContact CD1-CG1 4.48Å; I146-V170 HydrophobicContact CG2-CG1 3.76Å; I146-V170 HydrophobicContact CG2-CG2 4.14Å; V164-V170 HydrophobicContact CG1-CG2 3.8Å; H165-V170 PolarHBondContact O-N 3.42Å; P166-V170 WeakPolarHBondContact O-CB 3.48Å; V170-Q174 PolarHBondContact O-NE2 3.31Å
171	N	98.8	Very high	97.8	Very high	10 Å²	10	34.2 Å²	34.2	5%	0.053	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	13	175.9	-151.8	72.4	0	0	0	113.3	K89 N139 N143 P166 N167 S173 Q174	K89-N171 PolarHBondContact NZ-OD1 2.98Å; N139-N171 PolarHBondContact ND2-OD1 3.25Å; N139-N171 PolarHBondContact OD1-OD1 3.41Å; N143-N171 WeakPolarHBondContact ND2-CB 3.38Å; N143-N171 PolarHBondContact ND2-OD1 2.96Å; P166-N171 PolarHBondContact O-N 2.9Å; P166-N171 VanDerWaalsContact O-N 3.07Å; N167-N171 CarbonylContact O-C 3.32Å; N167-N171 VanDerWaalsContact O-C 3.23Å; N167-N171 VanDerWaalsContact O-CA 3.29Å; N167-N171 WeakPolarHBondContact O-CA 3.29Å; N167-N171 VanDerWaalsContact O-CB 3.25Å; N167-N171 WeakPolarHBondContact O-CB 3.16Å; N167-N171 PolarHBondContact O-N 3.13Å; N167-N171 VanDerWaalsContact O-N 3.11Å; N171-S173 PolarHBondContact O-N 3.17Å; N171-Q174 PolarHBondContact ND2-O 2.75Å; N171-Q174 WeakPolarHBondContact O-CB 3.41Å; N171-Q174 PolarHBondContact O-N 3.3Å
172	K	98.7	Very high	97.9	Very high	60 Å²	60	30.9 Å²	30.9	26%	0.261	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	135.8	-179.9	-170.8	178.3	172.1	73	0	110.9	N96 Y99 L101 N167 D168 H169 Q174	N96-K172 HydrophobicContact CB-CD 4.15Å; N96-K172 PolarHBondContact ND2-O 3.4Å; Y99-K172 WeakPolarHBondContact O-CE 3.4Å; L101-K172 HydrophobicContact CB-CD 4.04Å; L101-K172 HydrophobicContact CD1-CD 4.3Å; N167-K172 PolarHBondContact O-N 3.45Å; D168-K172 WeakPolarHBondContact O-CB 3.28Å; H169-K172 VanDerWaalsContact O-CB 3.28Å; H169-K172 WeakPolarHBondContact O-CB 3.47Å; H169-K172 PolarHBondContact O-N 3.23Å; K172-Q174 PolarHBondContact O-N 3.05Å; K172-Q174 PolarHBondContact O-NE2 3.41Å
173	S	98.4	Very high	97.9	Very high	17 Å²	17	25.6 Å²	25.6	12%	0.119	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	9.5	179.5	-50.4	0	0	0	0	115.5	N96 N171 T274 F278	N96-S173 WeakPolarHBondContact OD1-CB 3.48Å; N96-S173 PolarHBondContact OD1-OG 2.82Å; N171-S173 PolarHBondContact O-N 3.17Å; S173-T274 WeakPolarHBondContact O-CB 3.09Å; S173-T274 PolarHBondContact O-OG1 3.11Å; S173-F278 WeakPolarHBondContact O-CE1 3.31Å
174	Q	98.7	Very high	98	Very high	21 Å²	21	23.6 Å²	23.6	10%	0.098	13%	0.125	C	C	.	.			trans	-119.1	163.6	-176.5	-66.1	158.5	80.1	0	0	111.2	V170 N171 K172 T179 F278	V170-Q174 PolarHBondContact O-NE2 3.31Å; N171-Q174 PolarHBondContact ND2-O 2.75Å; N171-Q174 WeakPolarHBondContact O-CB 3.41Å; N171-Q174 PolarHBondContact O-N 3.3Å; K172-Q174 PolarHBondContact O-N 3.05Å; K172-Q174 PolarHBondContact O-NE2 3.41Å; Q174-T179 HydrophobicContact CB-CG2 3.66Å; Q174-T179 HydrophobicContact CG-CG2 4.03Å; Q174-F278 HydrophobicContact CG-CE1 4.2Å; Q174-F278 HydrophobicContact CG-CZ 3.9Å
175	S	97.3	Very high	98	Very high	21 Å²	21	24.4 Å²	24.4	15%	0.147	13%	0.129	C	C	.	.			trans	-121	157.7	171	175.2	0	0	0	0	110.6	N177 D178 T179 T266	S175-N177 PolarHBondContact O-N 2.94Å; S175-N177 PolarHBondContact OG-N 2.94Å; S175-N177 VanDerWaalsContact OG-N 3.16Å; S175-D178 WeakPolarHBondContact CA-OD1 3.26Å; S175-D178 WeakPolarHBondContact CB-OD1 3.46Å; S175-D178 PolarHBondContact N-OD1 3.48Å; S175-T179 WeakPolarHBondContact O-CB 3.25Å; S175-T179 WeakPolarHBondContact O-CG2 3.43Å; S175-T179 PolarHBondContact O-N 3.13Å; S175-T179 PolarHBondContact O-OG1 3.12Å; S175-T266 VanDerWaalsContact CB-CA 3.45Å; S175-T266 VanDerWaalsContact CB-O 3.3Å; S175-T266 WeakPolarHBondContact CB-O 3.25Å; S175-T266 PolarHBondContact OG-O 2.92Å
176	S	86.1	Confident	98	Very high	31 Å²	31	21.9 Å²	21.9	22%	0.217	12%	0.117	C	C	.	.	H	α-helix	trans	-60.1	-26.6	168.9	-56	0	0	0	0	112.6	T136 T179	T136-S176 WeakPolarHBondContact CG2-OG 3.38Å; T136-S176 VanDerWaalsContact OG1-CB 3.31Å; T136-S176 WeakPolarHBondContact OG1-CB 3.21Å; S176-T179 PolarHBondContact O-OG1 2.64Å
177	N	97.8	Very high	98	Very high	34 Å²	34	21.5 Å²	21.5	18%	0.182	12%	0.115	C	C	.	.	H	α-helix	trans	-85.1	-26.4	-174.1	-68	-7	0	0	0	113.8	S175 P181 T266 A267 L304 L394	S175-N177 PolarHBondContact O-N 2.94Å; S175-N177 PolarHBondContact OG-N 2.94Å; S175-N177 VanDerWaalsContact OG-N 3.16Å; N177-P181 WeakPolarHBondContact O-CD 3.34Å; N177-P181 WeakPolarHBondContact O-CG 3.29Å; N177-T266 WeakPolarHBondContact CB-O 3.36Å; N177-A267 PolarHBondContact ND2-O 3.49Å; N177-L304 WeakPolarHBondContact O-CD2 3.33Å; N177-L394 HydrophobicContact CB-CD1 3.89Å; N177-L394 HydrophobicContact CB-CD2 4.37Å
178	D	98.4	Very high	98.1	Very high	1 Å²	1	17 Å²	17	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-102.4	-12.6	-179.3	71.4	-10.6	0	0	0	114.2	S175 T182 G264 G265 T266 L304	S175-D178 WeakPolarHBondContact CA-OD1 3.26Å; S175-D178 WeakPolarHBondContact CB-OD1 3.46Å; S175-D178 PolarHBondContact N-OD1 3.48Å; D178-T182 WeakPolarHBondContact O-CB 3.49Å; D178-T182 PolarHBondContact O-OG1 3.23Å; D178-G264 PolarHBondContact OD2-N 3.27Å; D178-G265 PolarHBondContact OD2-N 2.85Å; D178-T266 WeakPolarHBondContact OD2-CA 3.43Å; D178-T266 PolarHBondContact OD2-N 2.93Å; D178-L304 HydrophobicContact CB-CD2 4.04Å
179	T	98.8	Very high	98.1	Very high	1 Å²	1	12.9 Å²	12.9	1%	0.006	7%	0.069	C	C	.	.	H	α-helix	trans	-78.3	-51.8	178.4	45.4	0	0	0	0	113.1	L88 N139 Q174 S175 S176 T182 A183	L88-T179 HydrophobicContact CD2-CG2 4.19Å; L88-T179 WeakPolarHBondContact CD2-O 3.32Å; N139-T179 VanDerWaalsContact CG-OG1 3.25Å; N139-T179 PolarHBondContact OD1-OG1 3.23Å; Q174-T179 HydrophobicContact CB-CG2 3.66Å; Q174-T179 HydrophobicContact CG-CG2 4.03Å; S175-T179 WeakPolarHBondContact O-CB 3.25Å; S175-T179 WeakPolarHBondContact O-CG2 3.43Å; S175-T179 PolarHBondContact O-N 3.13Å; S175-T179 PolarHBondContact O-OG1 3.12Å; S176-T179 PolarHBondContact O-OG1 2.64Å; T179-T182 WeakPolarHBondContact O-CB 3.31Å; T179-T182 PolarHBondContact O-N 3.36Å; T179-A183 PolarHBondContact O-N 3.33Å
180	F	98.9	Very high	98.1	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-57.8	-50.8	178.7	-163.8	-88.5	0	0	0	112.9	M77 V81 F85 S134 G135 T138 T182 A183 M184 K398 P399 V402	M77-F180 HydrophobicContact CE-CE2 3.82Å; M77-F180 HydrophobicContact CE-CZ 3.84Å; M77-F180 HydrophobicContact SD-CE2 4.18Å; M77-F180 HydrophobicContact SD-CZ 3.97Å; V81-F180 HydrophobicContact CG1-CE2 4.07Å; V81-F180 HydrophobicContact CG1-CZ 4.26Å; F85-F180 AromaticContact CE2-CD2 3.6Å; F85-F180 HydrophobicContact CE2-CD2 3.6Å; F85-F180 HydrophobicContact CE2-CE2 4.09Å; F85-F180 HydrophobicContact CE2-CG 4.4Å; F85-F180 HydrophobicContact CZ-CB 4.09Å; F85-F180 AromaticContact CZ-CD2 3.72Å; F85-F180 HydrophobicContact CZ-CD2 3.72Å; F85-F180 HydrophobicContact CZ-CG 4.29Å; S134-F180 WeakPolarHBondContact O-CB 3.46Å; G135-F180 VanDerWaalsContact CA-CD2 3.49Å; G135-F180 WeakPolarHBondContact O-CD2 3.41Å; T138-F180 HydrophobicContact CG2-CE2 4.23Å; F180-T182 VanDerWaalsContact C-N 3.27Å; F180-T182 PolarHBondContact O-N 2.97Å; F180-A183 WeakPolarHBondContact O-CB 3.39Å; F180-A183 PolarHBondContact O-N 3.47Å; F180-M184 HydrophobicContact CD1-CG 3.6Å; F180-M184 HydrophobicContact CD1-SD 3.73Å; F180-M184 HydrophobicContact CE1-CG 3.5Å; F180-M184 VanDerWaalsContact CE1-CG 3.5Å; F180-M184 HydrophobicContact CE1-SD 3.52Å; F180-M184 VanDerWaalsContact CE1-SD 3.52Å; F180-M184 HydrophobicContact CZ-CG 4.43Å; F180-M184 VanDerWaalsContact O-CG 3.29Å; F180-M184 WeakPolarHBondContact O-CG 3.38Å; F180-M184 PolarHBondContact O-N 3.24Å; F180-K398 HydrophobicContact CD1-CB 3.73Å; F180-K398 HydrophobicContact CD1-CD 4.35Å; F180-K398 HydrophobicContact CE1-CB 3.83Å; F180-P399 HydrophobicContact CE1-CG 4.1Å; F180-P399 HydrophobicContact CZ-CB 4.17Å; F180-P399 HydrophobicContact CZ-CG 3.93Å; F180-V402 HydrophobicContact CE1-CG1 4.1Å; F180-V402 HydrophobicContact CZ-CG1 4.2Å
181	P	98.9	Very high	98.1	Very high	2 Å²	2	13 Å²	13	1%	0.013	7%	0.073	C	C	.	.	H	α-helix	trans	-60.5	-35.2	178	24.1	-34.7	0	0	0	113.9	N177 M184 H185 A262 L304 K398	N177-P181 WeakPolarHBondContact O-CD 3.34Å; N177-P181 WeakPolarHBondContact O-CG 3.29Å; P181-M184 HydrophobicContact CB-CE 3.85Å; P181-M184 WeakPolarHBondContact O-CB 3.4Å; P181-M184 PolarHBondContact O-N 3Å; P181-H185 PolarHBondContact O-CD2 3.37Å; P181-H185 PolarHBondContact O-N 3.02Å; P181-H185 VanDerWaalsContact O-N 3.09Å; P181-A262 HydrophobicContact CB-CB 4.04Å; P181-A262 HydrophobicContact CG-CB 3.75Å; P181-L304 HydrophobicContact CG-CD2 4.06Å; P181-K398 HydrophobicContact CB-CD 4.44Å; P181-K398 HydrophobicContact CG-CD 4.5Å
182	T	98.9	Very high	98.1	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61.4	-46.8	172	-60.7	0	0	0	0	111.6	L88 D178 T179 F180 M184 H185 I186 L261 A262 A263	L88-T182 HydrophobicContact CD1-CG2 3.74Å; L88-T182 HydrophobicContact CD2-CG2 3.94Å; L88-T182 HydrophobicContact CG-CG2 4.34Å; D178-T182 WeakPolarHBondContact O-CB 3.49Å; D178-T182 PolarHBondContact O-OG1 3.23Å; T179-T182 WeakPolarHBondContact O-CB 3.31Å; T179-T182 PolarHBondContact O-N 3.36Å; F180-T182 VanDerWaalsContact C-N 3.27Å; F180-T182 PolarHBondContact O-N 2.97Å; T182-M184 VanDerWaalsContact C-N 3.32Å; T182-M184 PolarHBondContact O-N 2.65Å; T182-H185 PolarHBondContact O-N 3.03Å; T182-I186 HydrophobicContact CG2-CD1 3.87Å; T182-I186 VanDerWaalsContact O-CG1 3.31Å; T182-I186 WeakPolarHBondContact O-CG1 3.4Å; T182-I186 PolarHBondContact O-N 3.5Å; T182-L261 HydrophobicContact CG2-CB 4.16Å; T182-L261 HydrophobicContact CG2-CD1 4.04Å; T182-L261 HydrophobicContact CG2-CD2 4.1Å; T182-L261 HydrophobicContact CG2-CG 4.32Å; T182-A262 PolarHBondContact OG1-N 3.46Å; T182-A263 HydrophobicContact CG2-CB 4.07Å; T182-A263 WeakPolarHBondContact OG1-CB 3.34Å; T182-A263 PolarHBondContact OG1-N 3.39Å
183	A	98.9	Very high	98.1	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-63.7	-35.5	176.1	0	0	0	0	0	112.6	A84 F85 T179 F180 A187	A84-A183 HydrophobicContact CB-CB 4.26Å; A84-A183 WeakPolarHBondContact CB-O 3.41Å; F85-A183 HydrophobicContact CD1-CB 4.11Å; F85-A183 HydrophobicContact CD2-CB 3.49Å; F85-A183 VanDerWaalsContact CD2-CB 3.49Å; F85-A183 HydrophobicContact CE1-CB 4.19Å; F85-A183 HydrophobicContact CE2-CB 3.57Å; F85-A183 HydrophobicContact CG-CB 3.77Å; F85-A183 HydrophobicContact CZ-CB 3.94Å; T179-A183 PolarHBondContact O-N 3.33Å; F180-A183 WeakPolarHBondContact O-CB 3.39Å; F180-A183 PolarHBondContact O-N 3.47Å; A183-A187 VanDerWaalsContact O-CB 3.24Å; A183-A187 WeakPolarHBondContact O-CB 3.29Å; A183-A187 PolarHBondContact O-N 3.45Å
184	M	98.8	Very high	98.1	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.8	-49.2	174.9	-61.8	-166.8	-59.6	0	0	111.5	F180 P181 T182 A187 V188 H307 L310 K398 V402	F180-M184 HydrophobicContact CD1-CG 3.6Å; F180-M184 HydrophobicContact CD1-SD 3.73Å; F180-M184 HydrophobicContact CE1-CG 3.5Å; F180-M184 VanDerWaalsContact CE1-CG 3.5Å; F180-M184 HydrophobicContact CE1-SD 3.52Å; F180-M184 VanDerWaalsContact CE1-SD 3.52Å; F180-M184 HydrophobicContact CZ-CG 4.43Å; F180-M184 VanDerWaalsContact O-CG 3.29Å; F180-M184 WeakPolarHBondContact O-CG 3.38Å; F180-M184 PolarHBondContact O-N 3.24Å; P181-M184 HydrophobicContact CB-CE 3.85Å; P181-M184 WeakPolarHBondContact O-CB 3.4Å; P181-M184 PolarHBondContact O-N 3Å; T182-M184 VanDerWaalsContact C-N 3.32Å; T182-M184 PolarHBondContact O-N 2.65Å; M184-A187 PolarHBondContact O-N 3.29Å; M184-V188 WeakPolarHBondContact O-CB 3.45Å; M184-V188 VanDerWaalsContact O-CG2 3.25Å; M184-V188 WeakPolarHBondContact O-CG2 3.29Å; M184-V188 PolarHBondContact O-N 3.24Å; M184-H307 WeakPolarHBondContact CE-CE1 3.23Å; M184-H307 WeakPolarHBondContact CE-ND1 3.46Å; M184-L310 HydrophobicContact CE-CD1 4.04Å; M184-L310 HydrophobicContact SD-CD1 4.23Å; M184-K398 HydrophobicContact CE-CB 3.83Å; M184-K398 HydrophobicContact CE-CD 4.29Å; M184-K398 HydrophobicContact CE-CG 4.35Å; M184-K398 HydrophobicContact SD-CB 3.64Å; M184-V402 HydrophobicContact CB-CB 4.03Å; M184-V402 HydrophobicContact CB-CG2 3.75Å; M184-V402 HydrophobicContact CG-CB 3.73Å; M184-V402 HydrophobicContact CG-CG1 3.9Å; M184-V402 HydrophobicContact CG-CG2 3.89Å; M184-V402 HydrophobicContact SD-CB 3.67Å; M184-V402 HydrophobicContact SD-CG1 3.9Å; M184-V402 HydrophobicContact SD-CG2 4.44Å
185	H	98.9	Very high	98.1	Very high	17 Å²	17	18.3 Å²	18.3	8%	0.079	10%	0.098	C	C	.	.	H	α-helix	trans	-66.5	-41.8	-177.3	-82	-142.2	0	0	0	111.6	P181 T182 V188 A189 V258 E260 L261	P181-H185 PolarHBondContact O-CD2 3.37Å; P181-H185 PolarHBondContact O-N 3.02Å; P181-H185 VanDerWaalsContact O-N 3.09Å; T182-H185 PolarHBondContact O-N 3.03Å; H185-V188 PolarHBondContact O-N 3.27Å; H185-A189 WeakPolarHBondContact O-CB 3.34Å; H185-A189 PolarHBondContact O-N 3.2Å; H185-V258 VanDerWaalsContact CB-O 3.31Å; H185-V258 WeakPolarHBondContact CB-O 3.34Å; H185-V258 PolarHBondContact ND1-O 3.24Å; H185-E260 PolarHBondContact ND1-O 3.16Å; H185-L261 HydrophobicContact CB-CD2 3.81Å
186	I	98.9	Very high	98.2	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-59.9	-48.5	173.2	-65.8	166.1	0	0	0	110.8	A84 I87 L88 T182 V188 T190 L261 V286 F294	A84-I186 HydrophobicContact CB-CB 3.85Å; A84-I186 HydrophobicContact CB-CG2 3.67Å; I87-I186 HydrophobicContact CD1-CG2 3.98Å; I87-I186 HydrophobicContact CG2-CG2 4.5Å; L88-I186 HydrophobicContact CB-CD1 4.37Å; T182-I186 HydrophobicContact CG2-CD1 3.87Å; T182-I186 VanDerWaalsContact O-CG1 3.31Å; T182-I186 WeakPolarHBondContact O-CG1 3.4Å; T182-I186 PolarHBondContact O-N 3.5Å; I186-V188 PolarHBondContact O-N 2.93Å; I186-T190 VanDerWaalsContact O-CB 3.26Å; I186-T190 WeakPolarHBondContact O-CB 3.49Å; I186-T190 PolarHBondContact O-N 2.9Å; I186-T190 PolarHBondContact O-OG1 2.98Å; I186-L261 HydrophobicContact CG1-CD2 4.12Å; I186-V286 HydrophobicContact CD1-CG1 3.6Å; I186-V286 HydrophobicContact CD1-CG2 4.1Å; I186-V286 HydrophobicContact CG1-CG1 3.78Å; I186-F294 HydrophobicContact CB-CZ 4.29Å; I186-F294 HydrophobicContact CG1-CE1 4.16Å; I186-F294 HydrophobicContact CG1-CZ 4.1Å
187	A	98.9	Very high	98.8	Very high	2 Å²	2	16.8 Å²	16.8	2%	0.017	9%	0.085	C	C	.	.	H	α-helix	trans	-60.3	-48	-179.8	0	0	0	0	0	111.7	Q80 V81 A84 A183 M184 T190 E191 L406	Q80-A187 HydrophobicContact CB-CB 4.03Å; Q80-A187 WeakPolarHBondContact O-CB 3.47Å; V81-A187 HydrophobicContact CG2-CB 4.32Å; A84-A187 HydrophobicContact CB-CB 3.78Å; A183-A187 VanDerWaalsContact O-CB 3.24Å; A183-A187 WeakPolarHBondContact O-CB 3.29Å; A183-A187 PolarHBondContact O-N 3.45Å; M184-A187 PolarHBondContact O-N 3.29Å; A187-T190 PolarHBondContact O-N 3.23Å; A187-E191 WeakPolarHBondContact O-CB 3.48Å; A187-E191 PolarHBondContact O-N 3.45Å; A187-L406 HydrophobicContact CB-CD1 4.35Å; A187-L406 HydrophobicContact CB-CD2 4.33Å
188	V	98.9	Very high	98.9	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.006	9%	0.094	C	C	.	.	H	α-helix	trans	-65.7	-47.3	-177.7	168.3	0	0	0	0	111.3	M184 H185 I186 T190 E191 V192 V258 L310 L313 V402 V405 L406	M184-V188 WeakPolarHBondContact O-CB 3.45Å; M184-V188 VanDerWaalsContact O-CG2 3.25Å; M184-V188 WeakPolarHBondContact O-CG2 3.29Å; M184-V188 PolarHBondContact O-N 3.24Å; H185-V188 PolarHBondContact O-N 3.27Å; I186-V188 PolarHBondContact O-N 2.93Å; V188-T190 VanDerWaalsContact C-N 3.32Å; V188-T190 PolarHBondContact O-N 3.2Å; V188-E191 PolarHBondContact O-N 3.35Å; V188-V192 HydrophobicContact CG1-CG2 4.44Å; V188-V192 VanDerWaalsContact O-CG2 3.3Å; V188-V192 WeakPolarHBondContact O-CG2 3.43Å; V188-V192 PolarHBondContact O-N 3.4Å; V188-V258 HydrophobicContact CB-CG1 4.33Å; V188-V258 HydrophobicContact CG1-CG1 3.97Å; V188-L310 HydrophobicContact CB-CD2 4.43Å; V188-L310 HydrophobicContact CG1-CD2 4.25Å; V188-L310 HydrophobicContact CG2-CD2 4.07Å; V188-L313 HydrophobicContact CG1-CD2 3.18Å; V188-V402 HydrophobicContact CG2-CG2 3.96Å; V188-V405 HydrophobicContact CG1-CG1 3.83Å; V188-V405 HydrophobicContact CG2-CB 4.42Å; V188-V405 HydrophobicContact CG2-CG1 3.84Å; V188-L406 HydrophobicContact CG2-CD2 4.03Å; V188-L406 HydrophobicContact CG2-CG 4.2Å
189	A	98.9	Very high	98.9	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62.9	-40.2	178.2	0	0	0	0	0	112.3	H185 V192 H193 M255 V258 Y259 L292 F294	H185-A189 WeakPolarHBondContact O-CB 3.34Å; H185-A189 PolarHBondContact O-N 3.2Å; A189-V192 PolarHBondContact O-N 2.92Å; A189-H193 WeakPolarHBondContact O-CB 3.21Å; A189-H193 PolarHBondContact O-CD2 2.96Å; A189-H193 VanDerWaalsContact O-CD2 3.31Å; A189-H193 PolarHBondContact O-N 3.47Å; A189-M255 HydrophobicContact CB-CE 3.63Å; A189-V258 HydrophobicContact CB-CG1 4.12Å; A189-Y259 HydrophobicContact CB-CD1 4.19Å; A189-Y259 HydrophobicContact CB-CE1 3.95Å; A189-L292 HydrophobicContact CB-CD1 4.25Å; A189-F294 HydrophobicContact CB-CE1 3.94Å; A189-F294 HydrophobicContact CB-CZ 3.65Å
190	T	98.8	Very high	98.9	Very high	41 Å²	41	17.8 Å²	17.8	25%	0.252	9%	0.094	S	C	.	.	H	α-helix	trans	-62.1	-46.2	175.4	-56.7	0	0	0	0	111.1	I186 A187 V188 V192 H193 H194	I186-T190 VanDerWaalsContact O-CB 3.26Å; I186-T190 WeakPolarHBondContact O-CB 3.49Å; I186-T190 PolarHBondContact O-N 2.9Å; I186-T190 PolarHBondContact O-OG1 2.98Å; A187-T190 PolarHBondContact O-N 3.23Å; V188-T190 VanDerWaalsContact C-N 3.32Å; V188-T190 PolarHBondContact O-N 3.2Å; T190-V192 PolarHBondContact O-N 3.49Å; T190-H193 PolarHBondContact O-N 3.27Å; T190-H194 WeakPolarHBondContact O-CB 3.21Å; T190-H194 PolarHBondContact O-CD2 3.03Å; T190-H194 PolarHBondContact O-N 3.3Å
191	E	98.9	Very high	98.9	Very high	15 Å²	15	21.3 Å²	21.3	7%	0.07	11%	0.111	C	C	.	.	H	α-helix	trans	-64.5	-40.5	178.6	-162.5	76.9	169.2	0	0	111.7	Q80 A187 V188 V195 L196 L406 A409 R410	Q80-E191 WeakPolarHBondContact CG-OE2 3.44Å; Q80-E191 PolarHBondContact NE2-OE1 2.86Å; Q80-E191 PolarHBondContact NE2-OE2 2.86Å; A187-E191 WeakPolarHBondContact O-CB 3.48Å; A187-E191 PolarHBondContact O-N 3.45Å; V188-E191 PolarHBondContact O-N 3.35Å; E191-V195 HydrophobicContact CG-CB 4.42Å; E191-V195 HydrophobicContact CG-CG2 4.48Å; E191-V195 WeakPolarHBondContact O-CA 3.49Å; E191-V195 VanDerWaalsContact O-CB 3.32Å; E191-V195 WeakPolarHBondContact O-CB 3.44Å; E191-V195 PolarHBondContact O-N 3.4Å; E191-L196 PolarHBondContact O-N 2.99Å; E191-L196 VanDerWaalsContact O-N 3.17Å; E191-L406 HydrophobicContact CB-CD2 3.79Å; E191-L406 HydrophobicContact CG-CD2 4.1Å; E191-A409 HydrophobicContact CG-CB 4.17Å; E191-R410 WeakPolarHBondContact OE1-CB 3.4Å; E191-R410 WeakPolarHBondContact OE1-CD 3.33Å
192	V	98.9	Very high	98.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.126	C	C	.	.	I	π-helix	trans	-62.6	-46.5	177.4	169.7	0	0	0	0	111	V188 A189 T190 L196 L197 V251 M255 L313	V188-V192 HydrophobicContact CG1-CG2 4.44Å; V188-V192 VanDerWaalsContact O-CG2 3.3Å; V188-V192 WeakPolarHBondContact O-CG2 3.43Å; V188-V192 PolarHBondContact O-N 3.4Å; A189-V192 PolarHBondContact O-N 2.92Å; T190-V192 PolarHBondContact O-N 3.49Å; V192-L196 HydrophobicContact CG1-CD2 4.49Å; V192-L196 HydrophobicContact CG2-CD2 4.3Å; V192-L197 HydrophobicContact CG1-CD1 3.95Å; V192-L197 HydrophobicContact CG1-CG 3.92Å; V192-L197 WeakPolarHBondContact O-CB 3.25Å; V192-L197 WeakPolarHBondContact O-CG 3.49Å; V192-L197 PolarHBondContact O-N 3.07Å; V192-V251 HydrophobicContact CG1-CG1 3.62Å; V192-M255 HydrophobicContact CB-CE 4.44Å; V192-M255 HydrophobicContact CB-SD 4.08Å; V192-M255 HydrophobicContact CG1-CE 4.5Å; V192-M255 HydrophobicContact CG1-CG 4.35Å; V192-M255 HydrophobicContact CG1-SD 3.75Å; V192-M255 HydrophobicContact CG2-SD 4.1Å; V192-L313 HydrophobicContact CG2-CD1 4.43Å; V192-L313 HydrophobicContact CG2-CD2 4.07Å
193	H	98.9	Very high	98.9	Very high	62 Å²	62	23.9 Å²	23.9	29%	0.287	13%	0.126	S	C	.	.	I	π-helix	trans	-70	-40.5	-177.9	-91.6	-84.9	0	0	0	114	A189 T190 P198 Y259 L292	A189-H193 WeakPolarHBondContact O-CB 3.21Å; A189-H193 PolarHBondContact O-CD2 2.96Å; A189-H193 VanDerWaalsContact O-CD2 3.31Å; A189-H193 PolarHBondContact O-N 3.47Å; T190-H193 PolarHBondContact O-N 3.27Å; H193-P198 WeakPolarHBondContact O-CD 3.18Å; H193-P198 VanDerWaalsContact O-CG 3.29Å; H193-P198 WeakPolarHBondContact O-CG 3.45Å; H193-Y259 AromaticContact NE2-CZ 3.85Å; H193-Y259 PolarHBondContact NE2-OH 3Å; H193-L292 HydrophobicContact CB-CD2 4.36Å
194	H	98.6	Very high	98.9	Very high	122 Å²	122	25.4 Å²	25.4	57%	0.565	13%	0.133	S	C	*	.	I	π-helix	trans	-99.1	-18.4	-170.3	-61.8	-56.3	0	0	0	114.3	T190	T190-H194 WeakPolarHBondContact O-CB 3.21Å; T190-H194 PolarHBondContact O-CD2 3.03Å; T190-H194 PolarHBondContact O-N 3.3Å
195	V	98.9	Very high	98.9	Very high	35 Å²	35	29.3 Å²	29.3	21%	0.212	15%	0.154	C	C	.	.	I	π-helix	trans	-119.1	-59.5	-176.8	-178.6	0	0	0	0	111.1	E191 G199	E191-V195 HydrophobicContact CG-CB 4.42Å; E191-V195 HydrophobicContact CG-CG2 4.48Å; E191-V195 WeakPolarHBondContact O-CA 3.49Å; E191-V195 VanDerWaalsContact O-CB 3.32Å; E191-V195 WeakPolarHBondContact O-CB 3.44Å; E191-V195 PolarHBondContact O-N 3.4Å; V195-G199 PolarHBondContact O-N 3.09Å; V195-G199 VanDerWaalsContact O-N 3.12Å
196	L	98.9	Very high	98.9	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-68.1	-57.1	-171.3	176.8	64.1	0	0	0	112.9	E191 V192 G199 L200 V251 L317 A409 L412	E191-L196 PolarHBondContact O-N 2.99Å; E191-L196 VanDerWaalsContact O-N 3.17Å; V192-L196 HydrophobicContact CG1-CD2 4.49Å; V192-L196 HydrophobicContact CG2-CD2 4.3Å; L196-G199 PolarHBondContact O-N 3.05Å; L196-L200 HydrophobicContact CD1-CD1 3.86Å; L196-L200 HydrophobicContact CD1-CG 4.07Å; L196-L200 HydrophobicContact CG-CD1 4.03Å; L196-L200 WeakPolarHBondContact O-CG 3.38Å; L196-L200 PolarHBondContact O-N 3.32Å; L196-V251 HydrophobicContact CD2-CG1 3.95Å; L196-V251 HydrophobicContact CD2-CG2 4.2Å; L196-L317 HydrophobicContact CD2-CD2 3.26Å; L196-A409 HydrophobicContact CD2-CB 4.39Å; L196-L412 HydrophobicContact CD1-CB 3.55Å; L196-L412 HydrophobicContact CD1-CD1 4.4Å
197	L	98.9	Very high	98.9	Very high	19 Å²	19	29 Å²	29	10%	0.099	16%	0.155	C	C	.	.	H	α-helix	trans	-62.2	-43.5	-175.8	-69.9	177.2	0	0	0	112.1	V192 G199 L200 Q201 I248 V251 K252	V192-L197 HydrophobicContact CG1-CD1 3.95Å; V192-L197 HydrophobicContact CG1-CG 3.92Å; V192-L197 WeakPolarHBondContact O-CB 3.25Å; V192-L197 WeakPolarHBondContact O-CG 3.49Å; V192-L197 PolarHBondContact O-N 3.07Å; L197-G199 PolarHBondContact O-N 2.92Å; L197-L200 PolarHBondContact O-N 3.32Å; L197-Q201 WeakPolarHBondContact O-CB 3.26Å; L197-Q201 PolarHBondContact O-N 3Å; L197-I248 HydrophobicContact CD2-CG2 4.15Å; L197-V251 HydrophobicContact CD2-CB 4.19Å; L197-V251 HydrophobicContact CD2-CG1 3.86Å; L197-V251 HydrophobicContact CG-CG1 4.42Å; L197-K252 HydrophobicContact CD1-CG 4.19Å; L197-K252 HydrophobicContact CD2-CG 4.31Å
198	P	98.9	Very high	98.9	Very high	56 Å²	56	30.6 Å²	30.6	36%	0.364	17%	0.168	S	C	.	.	H	α-helix	trans	-62.2	-39.3	174	-25.5	37	0	0	0	113.2	H193 Q201 T202	H193-P198 WeakPolarHBondContact O-CD 3.18Å; H193-P198 VanDerWaalsContact O-CG 3.29Å; H193-P198 WeakPolarHBondContact O-CG 3.45Å; P198-Q201 PolarHBondContact O-N 3.4Å; P198-T202 WeakPolarHBondContact O-CB 3.25Å; P198-T202 PolarHBondContact O-N 2.97Å; P198-T202 PolarHBondContact O-OG1 3.28Å
199	G	98.9	Very high	98.9	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-63.8	-44.9	176.7	0	0	0	0	0	112.5	V195 L196 L197 T202 L203 S416	V195-G199 PolarHBondContact O-N 3.09Å; V195-G199 VanDerWaalsContact O-N 3.12Å; L196-G199 PolarHBondContact O-N 3.05Å; L197-G199 PolarHBondContact O-N 2.92Å; G199-T202 PolarHBondContact O-N 3.37Å; G199-L203 PolarHBondContact O-N 3.37Å; G199-L203 VanDerWaalsContact O-N 3.13Å; G199-S416 VanDerWaalsContact C-CB 3.5Å; G199-S416 VanDerWaalsContact O-CB 3.25Å; G199-S416 WeakPolarHBondContact O-CB 3.42Å
200	L	98.9	Very high	98.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.6	-39.1	175.2	-68.8	175.2	0	0	0	112.2	L196 L197 L203 H204 V244 I248 V320	L196-L200 HydrophobicContact CD1-CD1 3.86Å; L196-L200 HydrophobicContact CD1-CG 4.07Å; L196-L200 HydrophobicContact CG-CD1 4.03Å; L196-L200 WeakPolarHBondContact O-CG 3.38Å; L196-L200 PolarHBondContact O-N 3.32Å; L197-L200 PolarHBondContact O-N 3.32Å; L200-L203 PolarHBondContact O-N 2.87Å; L200-H204 WeakPolarHBondContact O-CB 3.3Å; L200-H204 PolarHBondContact O-N 3.09Å; L200-V244 HydrophobicContact CB-CG1 4.38Å; L200-V244 WeakPolarHBondContact O-CG1 3.39Å; L200-I248 HydrophobicContact CB-CD1 4.08Å; L200-I248 HydrophobicContact CB-CG1 3.73Å; L200-I248 HydrophobicContact CD1-CG1 4.24Å; L200-V320 HydrophobicContact CD1-CG1 4.22Å; L200-V320 HydrophobicContact CD2-CG1 3.81Å
201	Q	98.9	Very high	98.9	Very high	75 Å²	75	33 Å²	33	35%	0.35	19%	0.189	S	C	.	.	H	α-helix	trans	-63.5	-43.7	176.7	-172.1	62.1	56.4	0	0	111.2	L197 P198 L203 H204 D205	L197-Q201 WeakPolarHBondContact O-CB 3.26Å; L197-Q201 PolarHBondContact O-N 3Å; P198-Q201 PolarHBondContact O-N 3.4Å; Q201-L203 VanDerWaalsContact C-N 3.3Å; Q201-L203 PolarHBondContact O-N 2.85Å; Q201-H204 WeakPolarHBondContact O-CB 3.43Å; Q201-H204 PolarHBondContact O-N 2.79Å; Q201-D205 PolarHBondContact NE2-OD1 3.33Å; Q201-D205 PolarHBondContact NE2-OD2 2.92Å; Q201-D205 PolarHBondContact O-N 3.08Å
202	T	98.9	Very high	98.9	Very high	55 Å²	55	37.7 Å²	37.7	34%	0.337	21%	0.211	S	C	.	.	H	α-helix	trans	-56.7	-44.9	175.6	-59	0	0	0	0	111.4	P198 G199 A206 T420	P198-T202 WeakPolarHBondContact O-CB 3.25Å; P198-T202 PolarHBondContact O-N 2.97Å; P198-T202 PolarHBondContact O-OG1 3.28Å; G199-T202 PolarHBondContact O-N 3.37Å; T202-A206 PolarHBondContact O-N 2.73Å; T202-T420 HydrophobicContact CG2-CG2 3.85Å
203	L	98.9	Very high	98.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.1	-43.6	176.6	177.6	59.8	0	0	0	112.9	G199 L200 Q201 D205 A206 L207 V244 M324 F419 T420 V424	G199-L203 PolarHBondContact O-N 3.37Å; G199-L203 VanDerWaalsContact O-N 3.13Å; L200-L203 PolarHBondContact O-N 2.87Å; Q201-L203 VanDerWaalsContact C-N 3.3Å; Q201-L203 PolarHBondContact O-N 2.85Å; L203-D205 VanDerWaalsContact C-N 3.3Å; L203-D205 PolarHBondContact O-N 3.37Å; L203-A206 PolarHBondContact O-N 3.49Å; L203-L207 HydrophobicContact CD1-CD1 3.86Å; L203-L207 HydrophobicContact CD1-CG 3.99Å; L203-L207 HydrophobicContact CG-CD1 3.9Å; L203-L207 HydrophobicContact CG-CG 4.46Å; L203-L207 WeakPolarHBondContact O-CB 3.4Å; L203-L207 WeakPolarHBondContact O-CG 3.45Å; L203-L207 PolarHBondContact O-N 2.85Å; L203-V244 HydrophobicContact CD2-CG2 4.38Å; L203-V244 HydrophobicContact CG-CG2 4.41Å; L203-M324 HydrophobicContact CD2-CE 4.49Å; L203-M324 HydrophobicContact CD2-SD 3.51Å; L203-M324 VanDerWaalsContact CD2-SD 3.51Å; L203-F419 HydrophobicContact CD1-CD1 3.77Å; L203-F419 HydrophobicContact CD1-CE1 4.27Å; L203-F419 HydrophobicContact CD2-CD1 4.5Å; L203-T420 WeakPolarHBondContact CA-OG1 3.49Å; L203-T420 WeakPolarHBondContact CB-OG1 3.25Å; L203-T420 WeakPolarHBondContact CD1-OG1 3.31Å; L203-V424 HydrophobicContact CD1-CG2 3.9Å
204	H	98.9	Very high	98.9	Very high	33 Å²	33	40 Å²	40	15%	0.153	22%	0.222	C	C	.	.	H	α-helix	trans	-54.3	-49.6	176	168.9	-84.8	0	0	0	110.9	L200 Q201 L207 A208 V241 V244 I248	L200-H204 WeakPolarHBondContact O-CB 3.3Å; L200-H204 PolarHBondContact O-N 3.09Å; Q201-H204 WeakPolarHBondContact O-CB 3.43Å; Q201-H204 PolarHBondContact O-N 2.79Å; H204-L207 PolarHBondContact O-N 3.38Å; H204-A208 WeakPolarHBondContact O-CB 3.27Å; H204-A208 PolarHBondContact O-N 2.68Å; H204-V241 WeakPolarHBondContact NE2-CG1 3.27Å; H204-V244 HydrophobicContact CB-CB 4.17Å; H204-V244 HydrophobicContact CB-CG1 3.77Å; H204-I248 HydrophobicContact CB-CD1 4.4Å
205	D	98.9	Very high	98.9	Very high	81 Å²	81	38.9 Å²	38.9	43%	0.433	22%	0.215	S	C	.	.	H	α-helix	trans	-68.5	-38.7	-174.3	-62.6	-18.8	0	0	0	111.7	Q201 L203 A208 A209	Q201-D205 PolarHBondContact NE2-OD1 3.33Å; Q201-D205 PolarHBondContact NE2-OD2 2.92Å; Q201-D205 PolarHBondContact O-N 3.08Å; L203-D205 VanDerWaalsContact C-N 3.3Å; L203-D205 PolarHBondContact O-N 3.37Å; D205-A208 PolarHBondContact O-N 3.27Å; D205-A209 PolarHBondContact O-N 3.22Å
206	A	98.9	Very high	98.8	Very high	12 Å²	12	43.4 Å²	43.4	10%	0.099	24%	0.238	C	C	.	.	H	α-helix	trans	-67	-40.8	175.3	0	0	0	0	0	112.9	T202 L203 A208 A209 K210 T420 V424 V425	T202-A206 PolarHBondContact O-N 2.73Å; L203-A206 PolarHBondContact O-N 3.49Å; A206-A208 VanDerWaalsContact C-N 3.31Å; A206-A209 PolarHBondContact O-N 3.41Å; A206-K210 PolarHBondContact O-N 3.49Å; A206-T420 HydrophobicContact CB-CG2 3.36Å; A206-V424 HydrophobicContact CB-CG1 3.89Å; A206-V425 HydrophobicContact CB-CG1 3.98Å
207	L	98.9	Very high	98.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.7	-37.4	173.7	-72.9	169.1	0	0	0	111.3	L203 H204 K210 A211 F237 Y240 V241 V244 V327 I331 V424	L203-L207 HydrophobicContact CD1-CD1 3.86Å; L203-L207 HydrophobicContact CD1-CG 3.99Å; L203-L207 HydrophobicContact CG-CD1 3.9Å; L203-L207 HydrophobicContact CG-CG 4.46Å; L203-L207 WeakPolarHBondContact O-CB 3.4Å; L203-L207 WeakPolarHBondContact O-CG 3.45Å; L203-L207 PolarHBondContact O-N 2.85Å; H204-L207 PolarHBondContact O-N 3.38Å; L207-K210 PolarHBondContact O-N 3.03Å; L207-A211 WeakPolarHBondContact O-CB 3.46Å; L207-A211 PolarHBondContact O-N 3.44Å; L207-F237 HydrophobicContact CD2-CD1 3.98Å; L207-F237 HydrophobicContact CD2-CE1 4.06Å; L207-Y240 HydrophobicContact CD2-CD2 4.38Å; L207-V241 VanDerWaalsContact C-CG2 3.47Å; L207-V241 HydrophobicContact CB-CG2 3.75Å; L207-V244 HydrophobicContact CD1-CG2 3.72Å; L207-V327 HydrophobicContact CD1-CG1 4.39Å; L207-I331 HydrophobicContact CD2-CD1 4.49Å; L207-V424 HydrophobicContact CD2-CG1 3.85Å; L207-V424 HydrophobicContact CD2-CG2 4.31Å; L207-V424 HydrophobicContact CG-CG1 4.16Å
208	A	98.9	Very high	98.8	Very high	35 Å²	35	45.4 Å²	45.4	29%	0.289	25%	0.249	S	C	.	.	H	α-helix	trans	-66.7	-41.9	177.6	0	0	0	0	0	111.5	H204 D205 A206 K210 A211 E212 V241	H204-A208 WeakPolarHBondContact O-CB 3.27Å; H204-A208 PolarHBondContact O-N 2.68Å; D205-A208 PolarHBondContact O-N 3.27Å; A206-A208 VanDerWaalsContact C-N 3.31Å; A208-K210 VanDerWaalsContact C-N 3.33Å; A208-K210 PolarHBondContact O-N 3.27Å; A208-A211 WeakPolarHBondContact O-CB 3.46Å; A208-A211 PolarHBondContact O-N 2.87Å; A208-E212 PolarHBondContact O-N 3.24Å; A208-E212 VanDerWaalsContact O-N 3.08Å; A208-V241 HydrophobicContact CB-CG1 4.15Å; A208-V241 HydrophobicContact CB-CG2 4.02Å
209	A	98.9	Very high	98.8	Very high	62 Å²	62	42.9 Å²	42.9	51%	0.512	23%	0.232	S	C	.	.	H	α-helix	trans	-59.8	-43.5	172.9	0	0	0	0	0	111.7	D205 A206 E212 E213	D205-A209 PolarHBondContact O-N 3.22Å; A206-A209 PolarHBondContact O-N 3.41Å; A209-E212 PolarHBondContact O-N 2.91Å; A209-E213 WeakPolarHBondContact O-CB 3.46Å; A209-E213 PolarHBondContact O-N 3.37Å
210	K	98.9	Very high	98.8	Very high	16 Å²	16	43.3 Å²	43.3	7%	0.07	23%	0.234	C	C	.	.	H	α-helix	trans	-68	-35.2	175.7	-72	-65.7	174.4	-168.7	0	113.4	A206 L207 A208 E212 E213 F214 F237 V424 V425 I427	A206-K210 PolarHBondContact O-N 3.49Å; L207-K210 PolarHBondContact O-N 3.03Å; A208-K210 VanDerWaalsContact C-N 3.33Å; A208-K210 PolarHBondContact O-N 3.27Å; K210-E212 VanDerWaalsContact C-N 3.3Å; K210-E212 PolarHBondContact O-N 3.43Å; K210-E213 WeakPolarHBondContact CD-OE2 3.37Å; K210-E213 WeakPolarHBondContact CE-OE2 3.43Å; K210-E213 IonicContact NZ-OE1 3.61Å; K210-E213 PolarHBondContact NZ-OE1 2.91Å; K210-E213 IonicContact NZ-OE2 2.99Å; K210-E213 PolarHBondContact NZ-OE2 3.31Å; K210-E213 PolarHBondContact O-N 2.86Å; K210-F214 HydrophobicContact CB-CD2 4.34Å; K210-F214 HydrophobicContact CB-CE2 4.08Å; K210-F214 HydrophobicContact CD-CE1 4.41Å; K210-F214 HydrophobicContact CD-CE2 3.9Å; K210-F214 HydrophobicContact CD-CZ 3.7Å; K210-F214 HydrophobicContact CG-CE2 4.45Å; K210-F214 WeakPolarHBondContact O-CB 3.48Å; K210-F214 VanDerWaalsContact O-CD2 3.25Å; K210-F214 WeakPolarHBondContact O-CD2 3.35Å; K210-F214 VanDerWaalsContact O-CG 3.22Å; K210-F214 WeakPolarHBondContact O-CG 3.31Å; K210-F214 PolarHBondContact O-N 3.39Å; K210-F237 HydrophobicContact CB-CD1 3.79Å; K210-F237 HydrophobicContact CB-CE1 3.92Å; K210-V424 WeakPolarHBondContact CE-O 3.37Å; K210-V424 HydrophobicContact CG-CG1 4.24Å; K210-V425 WeakPolarHBondContact CE-O 3.42Å; K210-V425 PolarHBondContact NZ-O 2.94Å; K210-V425 VanDerWaalsContact NZ-O 3.14Å; K210-I427 HydrophobicContact CD-CB 4.5Å; K210-I427 VanDerWaalsContact CE-O 3.32Å; K210-I427 WeakPolarHBondContact CE-O 3.23Å; K210-I427 PolarHBondContact NZ-O 3.45Å
211	A	98.9	Very high	98.7	Very high	14 Å²	14	43.5 Å²	43.5	12%	0.116	24%	0.236	C	C	.	.	H	α-helix	trans	-60.2	-43.3	174.1	0	0	0	0	0	111.3	L207 A208 F214 K215 G234 F237 V241	L207-A211 WeakPolarHBondContact O-CB 3.46Å; L207-A211 PolarHBondContact O-N 3.44Å; A208-A211 WeakPolarHBondContact O-CB 3.46Å; A208-A211 PolarHBondContact O-N 2.87Å; A211-F214 PolarHBondContact O-N 2.78Å; A211-K215 PolarHBondContact O-N 3.39Å; A211-G234 WeakPolarHBondContact O-CA 3.43Å; A211-F237 HydrophobicContact CB-CB 3.76Å; A211-V241 HydrophobicContact CB-CG2 4.36Å
212	E	98.8	Very high	98.7	Very high	114 Å²	114	43.4 Å²	43.4	53%	0.533	23%	0.232	S	C	.	.	H	α-helix	trans	-68.6	-43.9	176.2	-177.7	59.4	-159	0	0	112.1	A208 A209 K210 F214 K215	A208-E212 PolarHBondContact O-N 3.24Å; A208-E212 VanDerWaalsContact O-N 3.08Å; A209-E212 PolarHBondContact O-N 2.91Å; K210-E212 VanDerWaalsContact C-N 3.3Å; K210-E212 PolarHBondContact O-N 3.43Å; E212-F214 PolarHBondContact O-N 3.18Å; E212-K215 WeakPolarHBondContact O-CB 3.18Å; E212-K215 WeakPolarHBondContact O-CG 3.43Å; E212-K215 PolarHBondContact O-N 3.02Å; E212-K215 WeakPolarHBondContact OE1-CD 3.32Å; E212-K215 WeakPolarHBondContact OE1-CE 3.4Å; E212-K215 IonicContact OE1-NZ 3.2Å; E212-K215 PolarHBondContact OE1-NZ 3.49Å
213	E	98.8	Very high	98.7	Very high	109 Å²	109	44.8 Å²	44.8	51%	0.509	24%	0.241	S	C	.	.	H	α-helix	trans	-56.7	-36.5	175.7	-173.6	-176.3	147.6	0	0	112	A209 K210	A209-E213 WeakPolarHBondContact O-CB 3.46Å; A209-E213 PolarHBondContact O-N 3.37Å; K210-E213 WeakPolarHBondContact CD-OE2 3.37Å; K210-E213 WeakPolarHBondContact CE-OE2 3.43Å; K210-E213 IonicContact NZ-OE1 3.61Å; K210-E213 PolarHBondContact NZ-OE1 2.91Å; K210-E213 IonicContact NZ-OE2 2.99Å; K210-E213 PolarHBondContact NZ-OE2 3.31Å; K210-E213 PolarHBondContact O-N 2.86Å
214	F	98.8	Very high	98.6	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.009	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	8.8	-174.8	-57.3	-26	0	0	0	114.6	K210 A211 E212 D216 I217 L233 G234 F237 I427 A429	K210-F214 HydrophobicContact CB-CD2 4.34Å; K210-F214 HydrophobicContact CB-CE2 4.08Å; K210-F214 HydrophobicContact CD-CE1 4.41Å; K210-F214 HydrophobicContact CD-CE2 3.9Å; K210-F214 HydrophobicContact CD-CZ 3.7Å; K210-F214 HydrophobicContact CG-CE2 4.45Å; K210-F214 WeakPolarHBondContact O-CB 3.48Å; K210-F214 VanDerWaalsContact O-CD2 3.25Å; K210-F214 WeakPolarHBondContact O-CD2 3.35Å; K210-F214 VanDerWaalsContact O-CG 3.22Å; K210-F214 WeakPolarHBondContact O-CG 3.31Å; K210-F214 PolarHBondContact O-N 3.39Å; A211-F214 PolarHBondContact O-N 2.78Å; E212-F214 PolarHBondContact O-N 3.18Å; F214-D216 PolarHBondContact O-N 3.17Å; F214-D216 VanDerWaalsContact O-N 3.14Å; F214-I217 HydrophobicContact CB-CD1 4.28Å; F214-I217 HydrophobicContact CD1-CD1 3.74Å; F214-I217 HydrophobicContact CG-CD1 4.33Å; F214-I217 PolarHBondContact O-N 2.98Å; F214-I217 VanDerWaalsContact O-N 3.09Å; F214-L233 HydrophobicContact CB-CB 3.66Å; F214-L233 HydrophobicContact CD2-CB 4.38Å; F214-L233 HydrophobicContact CG-CB 4.29Å; F214-G234 PolarHBondContact O-N 3.33Å; F214-F237 HydrophobicContact CD2-CD2 4.24Å; F214-F237 HydrophobicContact CD2-CE2 4.16Å; F214-F237 HydrophobicContact CD2-CG 4.5Å; F214-F237 HydrophobicContact CD2-CZ 4.34Å; F214-F237 HydrophobicContact CE2-CE1 4.34Å; F214-F237 HydrophobicContact CE2-CE2 4.28Å; F214-F237 HydrophobicContact CE2-CZ 4.06Å; F214-I427 HydrophobicContact CE2-CG2 3.92Å; F214-I427 HydrophobicContact CZ-CG2 3.93Å; F214-A429 HydrophobicContact CD1-CB 4.38Å; F214-A429 HydrophobicContact CE1-CB 4.2Å
215	K	98.4	Very high	98.5	Very high	98 Å²	98	57.3 Å²	57.3	43%	0.426	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-33.5	-172.4	73.3	-175.3	176.9	-175	0	114.3	A211 E212 S232	A211-K215 PolarHBondContact O-N 3.39Å; E212-K215 WeakPolarHBondContact O-CB 3.18Å; E212-K215 WeakPolarHBondContact O-CG 3.43Å; E212-K215 PolarHBondContact O-N 3.02Å; E212-K215 WeakPolarHBondContact OE1-CD 3.32Å; E212-K215 WeakPolarHBondContact OE1-CE 3.4Å; E212-K215 IonicContact OE1-NZ 3.2Å; E212-K215 PolarHBondContact OE1-NZ 3.49Å; K215-S232 WeakPolarHBondContact O-CB 3.45Å; K215-S232 PolarHBondContact O-OG 2.88Å
216	D	98.2	Very high	98.5	Very high	130 Å²	130	59.6 Å²	59.6	70%	0.695	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-1.5	-176	-61.3	-46.6	0	0	0	113.1	F214 I218	F214-D216 PolarHBondContact O-N 3.17Å; F214-D216 VanDerWaalsContact O-N 3.14Å; D216-I218 PolarHBondContact O-N 2.98Å
217	I	98.7	Very high	98.4	Very high	30 Å²	30	63.2 Å²	63.2	15%	0.154	33%	0.333	C	S	.	.			trans	-89.5	97.4	-177.1	-53.2	178	0	0	0	109.5	F214 S232 L233 A429 T431 I434	F214-I217 HydrophobicContact CB-CD1 4.28Å; F214-I217 HydrophobicContact CD1-CD1 3.74Å; F214-I217 HydrophobicContact CG-CD1 4.33Å; F214-I217 PolarHBondContact O-N 2.98Å; F214-I217 VanDerWaalsContact O-N 3.09Å; I217-S232 CarbonylContact O-C 3.47Å; I217-S232 VanDerWaalsContact O-CA 3.22Å; I217-S232 WeakPolarHBondContact O-CA 3.41Å; I217-L233 HydrophobicContact CB-CB 4.38Å; I217-L233 HydrophobicContact CB-CD1 4.31Å; I217-L233 HydrophobicContact CG2-CD1 3.88Å; I217-L233 HydrophobicContact CG2-CG 4.45Å; I217-L233 PolarHBondContact O-N 3.25Å; I217-A429 HydrophobicContact CD1-CB 3.56Å; I217-T431 HydrophobicContact CD1-CG2 4.01Å; I217-T431 HydrophobicContact CG1-CG2 4.48Å; I217-T431 HydrophobicContact CG2-CG2 4.29Å; I217-I434 HydrophobicContact CG2-CD1 3.98Å; I217-I434 HydrophobicContact CG2-CG2 4.35Å
218	I	98.6	Very high	98.3	Very high	31 Å²	31	63.8 Å²	63.8	16%	0.159	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	131.3	-179.5	-52.1	176.3	0	0	0	110.5	D216 P230 I434 M438 P492 L496	D216-I218 PolarHBondContact O-N 2.98Å; I218-P230 HydrophobicContact CG2-CB 3.75Å; I218-I434 WeakPolarHBondContact O-CG2 3.42Å; I218-M438 HydrophobicContact CG2-CE 3.72Å; I218-M438 HydrophobicContact CG2-SD 4.29Å; I218-P492 HydrophobicContact CD1-CB 3.98Å; I218-P492 HydrophobicContact CG2-CB 4.02Å; I218-L496 HydrophobicContact CD1-CD1 3.89Å; I218-L496 HydrophobicContact CG1-CD1 4.02Å; I218-L496 HydrophobicContact CG2-CD2 4.2Å
219	K	98.7	Very high	98.2	Very high	2 Å²	2	66.4 Å²	66.4	1%	0.009	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	168.1	176.9	58.2	157.2	-78.3	-178	0	111.5	P230 L231 L233 E236 E344 I434	K219-P230 VanDerWaalsContact O-CA 3.24Å; K219-P230 WeakPolarHBondContact O-CA 3.46Å; K219-L231 VanDerWaalsContact CG-O 3.28Å; K219-L231 WeakPolarHBondContact CG-O 3.41Å; K219-L231 PolarHBondContact N-O 2.81Å; K219-L231 PolarHBondContact O-N 2.97Å; K219-L231 VanDerWaalsContact O-N 3.1Å; K219-L233 HydrophobicContact CD-CD2 3.53Å; K219-L233 HydrophobicContact CD-CG 3.89Å; K219-L233 HydrophobicContact CG-CD2 4.35Å; K219-L233 HydrophobicContact CG-CG 4.17Å; K219-E236 IonicContact NZ-OE1 2.75Å; K219-E236 PolarHBondContact NZ-OE1 2.93Å; K219-E236 IonicContact NZ-OE2 3.59Å; K219-E236 PolarHBondContact NZ-OE2 2.9Å; K219-E344 VanDerWaalsContact CD-OE2 3.27Å; K219-E344 WeakPolarHBondContact CD-OE2 3.14Å; K219-E344 WeakPolarHBondContact CE-OE2 3.42Å; K219-E344 IonicContact NZ-OE1 2.77Å; K219-E344 IonicContact NZ-OE2 3.56Å; K219-E344 PolarHBondContact NZ-OE2 3.39Å; K219-I434 HydrophobicContact CB-CG2 4.01Å
220	I	98.4	Very high	98.1	Very high	10 Å²	10	63.8 Å²	63.8	5%	0.051	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	125.8	171.6	-66.6	-58.3	0	0	0	109.8	D227 M438 S441	I220-D227 HydrophobicContact CG2-CB 3.97Å; I220-M438 HydrophobicContact CB-SD 4.47Å; I220-M438 HydrophobicContact CD1-CE 4.29Å; I220-M438 HydrophobicContact CD1-SD 3.46Å; I220-M438 WeakPolarHBondContact CD1-SD 3.45Å; I220-M438 HydrophobicContact CG1-SD 3.59Å; I220-M438 VanDerWaalsContact CG1-SD 3.59Å; I220-M438 PolarHBondContact N-SD 3.49Å; I220-M438 VanDerWaalsContact N-SD 3.41Å; I220-S441 VanDerWaalsContact CD1-CB 3.49Å; I220-S441 VanDerWaalsContact CD1-OG 3.3Å; I220-S441 WeakPolarHBondContact CD1-OG 3.38Å
221	G	98.2	Very high	98.1	Very high	4 Å²	4	65.1 Å²	65.1	4%	0.041	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	160.5	172.4	0	0	0	0	0	112	A228 V229	G221-A228 WeakPolarHBondContact O-CB 3.48Å; G221-A228 PolarHBondContact O-N 3.13Å; G221-V229 WeakPolarHBondContact CA-O 3.47Å; G221-V229 PolarHBondContact N-O 3.43Å
222	R	98.7	Very high	98.1	Very high	73 Å²	73	64.8 Å²	64.8	28%	0.275	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	124.5	172.2	-65.8	-173	-173.2	78.4	10.4	111.5	Q226 E344	R222-Q226 VanDerWaalsContact CA-O 3.27Å; R222-Q226 WeakPolarHBondContact CA-O 3.44Å; R222-E344 IonicContact CZ-OE1 2.8Å; R222-E344 IonicContact NH1-OE1 3.43Å; R222-E344 PolarHBondContact NH1-OE1 3.49Å; R222-E344 IonicContact NH1-OE2 3.66Å; R222-E344 IonicContact NH2-OE1 2.75Å; R222-E344 PolarHBondContact NH2-OE1 2.92Å
223	T	97.6	Very high	98.1	Very high	85 Å²	85	59.3 Å²	59.3	52%	0.521	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132.6	170.4	57.2	0	0	0	0	108	T225 Q226 A228	T223-T225 PolarHBondContact O-N 3.48Å; T223-Q226 PolarHBondContact N-O 3.26Å; T223-Q226 PolarHBondContact O-N 3.47Å; T223-A228 HydrophobicContact CG2-CB 4.32Å
224	H	97.6	Very high	98.1	Very high	174 Å²	174	54.4 Å²	54.4	81%	0.806	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	28	-170.4	-49.4	-88.8	0	0	0	113.3	Q226	H224-Q226 PolarHBondContact O-N 2.89Å; H224-Q226 VanDerWaalsContact O-N 3.14Å
225	T	97.3	Very high	98.1	Very high	121 Å²	121	58.1 Å²	58.1	74%	0.742	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	2.9	-173.4	72.8	0	0	0	0	115.8	T223	T223-T225 PolarHBondContact O-N 3.48Å
226	Q	97.9	Very high	98.1	Very high	130 Å²	130	55.3 Å²	55.3	61%	0.607	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	154.7	174.7	-60.4	-60.9	-62.5	0	0	110.8	R222 T223 H224 A228	R222-Q226 VanDerWaalsContact CA-O 3.27Å; R222-Q226 WeakPolarHBondContact CA-O 3.44Å; T223-Q226 PolarHBondContact N-O 3.26Å; T223-Q226 PolarHBondContact O-N 3.47Å; H224-Q226 PolarHBondContact O-N 2.89Å; H224-Q226 VanDerWaalsContact O-N 3.14Å; Q226-A228 PolarHBondContact O-N 3.3Å
227	D	98.2	Very high	98.1	Very high	88 Å²	88	49.1 Å²	49.1	47%	0.471	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	134.4	171.8	-67.8	-4.4	0	0	0	110.4	I220 M443	I220-D227 HydrophobicContact CG2-CB 3.97Å; D227-M443 HydrophobicContact CB-CG 3.9Å
228	A	96.4	Very high	98.2	Very high	12 Å²	12	50.6 Å²	50.6	10%	0.099	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	-174.7	179.6	0	0	0	0	0	111.2	G221 T223 Q226 M443	G221-A228 WeakPolarHBondContact O-CB 3.48Å; G221-A228 PolarHBondContact O-N 3.13Å; T223-A228 HydrophobicContact CG2-CB 4.32Å; Q226-A228 PolarHBondContact O-N 3.3Å; A228-M443 WeakPolarHBondContact O-CB 3.41Å; A228-M443 WeakPolarHBondContact O-CG 3.4Å
229	V	95.8	Very high	98.2	Very high	89 Å²	89	50.7 Å²	50.7	54%	0.539	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	158.1	176.2	-63.9	0	0	0	0	112.1	G221	G221-V229 WeakPolarHBondContact CA-O 3.47Å; G221-V229 PolarHBondContact N-O 3.43Å
230	P	97.7	Very high	98.2	Very high	8 Å²	8	50.6 Å²	50.6	5%	0.052	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	154.1	-176.5	-20.3	33.9	0	0	0	114.3	I218 K219 M438 L444 L496	I218-P230 HydrophobicContact CG2-CB 3.75Å; K219-P230 VanDerWaalsContact O-CA 3.24Å; K219-P230 WeakPolarHBondContact O-CA 3.46Å; P230-M438 HydrophobicContact CB-CE 4.22Å; P230-M438 HydrophobicContact CG-CE 4.09Å; P230-L444 HydrophobicContact CG-CD2 3.41Å; P230-L444 VanDerWaalsContact CG-CD2 3.41Å; P230-L496 HydrophobicContact CB-CD2 4.13Å
231	L	98.6	Very high	98.2	Very high	44 Å²	44	51 Å²	51	23%	0.23	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	164.3	160	67.1	151.5	0	0	0	108.4	K219 Q235 E236	K219-L231 VanDerWaalsContact CG-O 3.28Å; K219-L231 WeakPolarHBondContact CG-O 3.41Å; K219-L231 PolarHBondContact N-O 2.81Å; K219-L231 PolarHBondContact O-N 2.97Å; K219-L231 VanDerWaalsContact O-N 3.1Å; L231-Q235 HydrophobicContact CB-CB 4.44Å; L231-Q235 HydrophobicContact CD1-CB 4.23Å; L231-E236 HydrophobicContact CD1-CB 3.79Å; L231-E236 HydrophobicContact CD1-CG 4.48Å
232	S	98.8	Very high	98.2	Very high	6 Å²	6	54 Å²	54	4%	0.042	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	152.8	169.2	78.1	0	0	0	0	112.2	K215 I217 G234 Q235 E236	K215-S232 WeakPolarHBondContact O-CB 3.45Å; K215-S232 PolarHBondContact O-OG 2.88Å; I217-S232 CarbonylContact O-C 3.47Å; I217-S232 VanDerWaalsContact O-CA 3.22Å; I217-S232 WeakPolarHBondContact O-CA 3.41Å; S232-G234 PolarHBondContact O-N 3.3Å; S232-G234 PolarHBondContact OG-N 3.5Å; S232-Q235 WeakPolarHBondContact O-CB 3.39Å; S232-Q235 PolarHBondContact O-N 3.46Å; S232-Q235 VanDerWaalsContact O-N 3.1Å; S232-Q235 WeakPolarHBondContact OG-CG 3.43Å; S232-Q235 PolarHBondContact OG-N 2.68Å; S232-E236 PolarHBondContact O-N 3.31Å
233	L	98.8	Very high	98.3	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-57.4	-35.5	169.2	-86.5	177.7	0	0	0	110.8	F214 I217 K219 E236 F237 L345 A429 I434	F214-L233 HydrophobicContact CB-CB 3.66Å; F214-L233 HydrophobicContact CD2-CB 4.38Å; F214-L233 HydrophobicContact CG-CB 4.29Å; I217-L233 HydrophobicContact CB-CB 4.38Å; I217-L233 HydrophobicContact CB-CD1 4.31Å; I217-L233 HydrophobicContact CG2-CD1 3.88Å; I217-L233 HydrophobicContact CG2-CG 4.45Å; I217-L233 PolarHBondContact O-N 3.25Å; K219-L233 HydrophobicContact CD-CD2 3.53Å; K219-L233 HydrophobicContact CD-CG 3.89Å; K219-L233 HydrophobicContact CG-CD2 4.35Å; K219-L233 HydrophobicContact CG-CG 4.17Å; L233-E236 WeakPolarHBondContact O-CB 3.28Å; L233-E236 PolarHBondContact O-N 2.89Å; L233-F237 WeakPolarHBondContact O-CB 3.48Å; L233-F237 WeakPolarHBondContact O-CD2 3.34Å; L233-F237 PolarHBondContact O-N 3.43Å; L233-L345 HydrophobicContact CD1-CD2 4.22Å; L233-L345 HydrophobicContact CD2-CD2 4.45Å; L233-A429 HydrophobicContact CD1-CB 3.77Å; L233-I434 HydrophobicContact CD1-CD1 3.67Å
234	G	98.8	Very high	98.3	Very high	6 Å²	6	49 Å²	49	6%	0.062	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-40.9	173.3	0	0	0	0	0	113.3	A211 F214 S232 F237 S238	A211-G234 WeakPolarHBondContact O-CA 3.43Å; F214-G234 PolarHBondContact O-N 3.33Å; S232-G234 PolarHBondContact O-N 3.3Å; S232-G234 PolarHBondContact OG-N 3.5Å; G234-F237 PolarHBondContact O-N 3.08Å; G234-S238 WeakPolarHBondContact O-CB 3.49Å; G234-S238 PolarHBondContact O-N 3Å
235	Q	98.8	Very high	98.4	Very high	80 Å²	80	45 Å²	45	37%	0.374	25%	0.249	S	C	.	.	H	α-helix	trans	-62.1	-43.1	172.5	-73.8	173	-43	0	0	111.4	L231 S232 S238 G239	L231-Q235 HydrophobicContact CB-CB 4.44Å; L231-Q235 HydrophobicContact CD1-CB 4.23Å; S232-Q235 WeakPolarHBondContact O-CB 3.39Å; S232-Q235 PolarHBondContact O-N 3.46Å; S232-Q235 VanDerWaalsContact O-N 3.1Å; S232-Q235 WeakPolarHBondContact OG-CG 3.43Å; S232-Q235 PolarHBondContact OG-N 2.68Å; Q235-S238 PolarHBondContact O-N 3.46Å; Q235-S238 PolarHBondContact O-OG 2.96Å; Q235-G239 PolarHBondContact O-N 3.47Å
236	E	98.9	Very high	98.5	Very high	38 Å²	38	44.2 Å²	44.2	18%	0.178	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-48	176.4	-168	173.8	-117.2	0	0	111.4	K219 L231 S232 L233 S238 G239 Y240 L334	K219-E236 IonicContact NZ-OE1 2.75Å; K219-E236 PolarHBondContact NZ-OE1 2.93Å; K219-E236 IonicContact NZ-OE2 3.59Å; K219-E236 PolarHBondContact NZ-OE2 2.9Å; L231-E236 HydrophobicContact CD1-CB 3.79Å; L231-E236 HydrophobicContact CD1-CG 4.48Å; S232-E236 PolarHBondContact O-N 3.31Å; L233-E236 WeakPolarHBondContact O-CB 3.28Å; L233-E236 PolarHBondContact O-N 2.89Å; E236-S238 VanDerWaalsContact C-N 3.33Å; E236-S238 PolarHBondContact O-N 3.02Å; E236-G239 PolarHBondContact O-N 3.42Å; E236-G239 VanDerWaalsContact O-N 3.14Å; E236-Y240 HydrophobicContact CG-CE2 4.45Å; E236-Y240 WeakPolarHBondContact CG-OH 3.48Å; E236-L334 WeakPolarHBondContact OE2-CD1 3.41Å
237	F	98.9	Very high	98.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.8	-32.9	177.6	-88.5	-112.9	0	0	0	113	L207 K210 A211 F214 L233 G234 G239 Y240 V241 I331 L345 I427	L207-F237 HydrophobicContact CD2-CD1 3.98Å; L207-F237 HydrophobicContact CD2-CE1 4.06Å; K210-F237 HydrophobicContact CB-CD1 3.79Å; K210-F237 HydrophobicContact CB-CE1 3.92Å; A211-F237 HydrophobicContact CB-CB 3.76Å; F214-F237 HydrophobicContact CD2-CD2 4.24Å; F214-F237 HydrophobicContact CD2-CE2 4.16Å; F214-F237 HydrophobicContact CD2-CG 4.5Å; F214-F237 HydrophobicContact CD2-CZ 4.34Å; F214-F237 HydrophobicContact CE2-CE1 4.34Å; F214-F237 HydrophobicContact CE2-CE2 4.28Å; F214-F237 HydrophobicContact CE2-CZ 4.06Å; L233-F237 WeakPolarHBondContact O-CB 3.48Å; L233-F237 WeakPolarHBondContact O-CD2 3.34Å; L233-F237 PolarHBondContact O-N 3.43Å; G234-F237 PolarHBondContact O-N 3.08Å; F237-G239 PolarHBondContact O-N 2.91Å; F237-Y240 HydrophobicContact CB-CD2 4.18Å; F237-Y240 AromaticContact CD1-CD2 3.97Å; F237-Y240 HydrophobicContact CD1-CD2 3.97Å; F237-Y240 HydrophobicContact CD1-CE2 4.32Å; F237-Y240 HydrophobicContact CD2-CD2 4.11Å; F237-Y240 AromaticContact CD2-CE2 3.71Å; F237-Y240 HydrophobicContact CD2-CE2 3.71Å; F237-Y240 HydrophobicContact CE1-CD2 4.38Å; F237-Y240 HydrophobicContact CE1-CE2 4.48Å; F237-Y240 AromaticContact CE2-CE2 3.91Å; F237-Y240 HydrophobicContact CE2-CE2 3.91Å; F237-Y240 AromaticContact CG-CD2 3.82Å; F237-Y240 HydrophobicContact CG-CD2 3.82Å; F237-Y240 AromaticContact CG-CE2 3.94Å; F237-Y240 HydrophobicContact CG-CE2 3.94Å; F237-Y240 HydrophobicContact CZ-CE2 4.29Å; F237-Y240 WeakPolarHBondContact O-CA 3.45Å; F237-Y240 WeakPolarHBondContact O-CB 3.32Å; F237-Y240 PolarHBondContact O-N 3.29Å; F237-V241 WeakPolarHBondContact O-CG2 3.19Å; F237-V241 PolarHBondContact O-N 3.31Å; F237-I331 HydrophobicContact CZ-CG1 4.49Å; F237-L345 HydrophobicContact CE2-CD1 4.26Å; F237-L345 HydrophobicContact CZ-CD1 4.1Å; F237-I427 HydrophobicContact CE1-CD1 4.3Å; F237-I427 HydrophobicContact CZ-CD1 4.19Å; F237-I427 HydrophobicContact CZ-CG2 4.49Å
238	S	98.9	Very high	98.5	Very high	62 Å²	62	34.4 Å²	34.4	43%	0.434	19%	0.185	S	C	.	.	H	α-helix	trans	-60	-30.7	174.2	81.7	0	0	0	0	112.2	G234 Q235 E236 V241 Q242	G234-S238 WeakPolarHBondContact O-CB 3.49Å; G234-S238 PolarHBondContact O-N 3Å; Q235-S238 PolarHBondContact O-N 3.46Å; Q235-S238 PolarHBondContact O-OG 2.96Å; E236-S238 VanDerWaalsContact C-N 3.33Å; E236-S238 PolarHBondContact O-N 3.02Å; S238-V241 PolarHBondContact O-N 3.44Å; S238-Q242 WeakPolarHBondContact O-CB 3.27Å; S238-Q242 PolarHBondContact O-N 3.43Å
239	G	98.9	Very high	98.7	Very high	32 Å²	32	38.3 Å²	38.3	33%	0.33	20%	0.201	S	C	.	.	H	α-helix	trans	-63.4	-43.4	171.1	0	0	0	0	0	112	Q235 E236 F237 Q242 Q243	Q235-G239 PolarHBondContact O-N 3.47Å; E236-G239 PolarHBondContact O-N 3.42Å; E236-G239 VanDerWaalsContact O-N 3.14Å; F237-G239 PolarHBondContact O-N 2.91Å; G239-Q242 PolarHBondContact O-N 3.01Å; G239-Q243 WeakPolarHBondContact O-CG 3.41Å; G239-Q243 PolarHBondContact O-N 3.36Å
240	Y	98.9	Very high	98.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-46.9	175.3	-49.2	-35.5	0	0	0	111.4	L207 E236 F237 Q242 Q243 V244 K326 V327 D330	L207-Y240 HydrophobicContact CD2-CD2 4.38Å; E236-Y240 HydrophobicContact CG-CE2 4.45Å; E236-Y240 WeakPolarHBondContact CG-OH 3.48Å; F237-Y240 HydrophobicContact CB-CD2 4.18Å; F237-Y240 AromaticContact CD1-CD2 3.97Å; F237-Y240 HydrophobicContact CD1-CD2 3.97Å; F237-Y240 HydrophobicContact CD1-CE2 4.32Å; F237-Y240 HydrophobicContact CD2-CD2 4.11Å; F237-Y240 AromaticContact CD2-CE2 3.71Å; F237-Y240 HydrophobicContact CD2-CE2 3.71Å; F237-Y240 HydrophobicContact CE1-CD2 4.38Å; F237-Y240 HydrophobicContact CE1-CE2 4.48Å; F237-Y240 AromaticContact CE2-CE2 3.91Å; F237-Y240 HydrophobicContact CE2-CE2 3.91Å; F237-Y240 AromaticContact CG-CD2 3.82Å; F237-Y240 HydrophobicContact CG-CD2 3.82Å; F237-Y240 AromaticContact CG-CE2 3.94Å; F237-Y240 HydrophobicContact CG-CE2 3.94Å; F237-Y240 HydrophobicContact CZ-CE2 4.29Å; F237-Y240 WeakPolarHBondContact O-CA 3.45Å; F237-Y240 WeakPolarHBondContact O-CB 3.32Å; F237-Y240 PolarHBondContact O-N 3.29Å; Y240-Q242 VanDerWaalsContact C-N 3.27Å; Y240-Q242 PolarHBondContact O-N 3.06Å; Y240-Q243 WeakPolarHBondContact O-CB 3.49Å; Y240-Q243 PolarHBondContact O-N 3.06Å; Y240-Q243 VanDerWaalsContact O-N 3.07Å; Y240-V244 WeakPolarHBondContact O-CG2 3.37Å; Y240-V244 PolarHBondContact O-N 2.94Å; Y240-K326 HydrophobicContact CE1-CD 4.33Å; Y240-K326 VanDerWaalsContact CE1-NZ 3.27Å; Y240-V327 HydrophobicContact CD1-CB 4.32Å; Y240-V327 HydrophobicContact CD1-CG1 4.25Å; Y240-V327 HydrophobicContact CD1-CG2 3.72Å; Y240-V327 HydrophobicContact CD2-CG1 4.3Å; Y240-V327 HydrophobicContact CG-CB 4.49Å; Y240-V327 HydrophobicContact CG-CG1 3.96Å; Y240-V327 HydrophobicContact CG-CG2 3.99Å; Y240-D330 HydrophobicContact CE1-CB 4.08Å; Y240-D330 WeakPolarHBondContact CE1-OD2 3.04Å; Y240-D330 VanDerWaalsContact OH-CB 3.25Å; Y240-D330 WeakPolarHBondContact OH-CB 3.46Å; Y240-D330 PolarHBondContact OH-OD2 3.01Å
241	V	98.9	Very high	98.9	Very high	20 Å²	20	38.6 Å²	38.6	12%	0.121	19%	0.191	C	C	.	.	H	α-helix	trans	-52.3	-49.1	176.1	174.9	0	0	0	0	110.5	H204 L207 A208 A211 F237 S238 Q243 V244 K245	H204-V241 WeakPolarHBondContact NE2-CG1 3.27Å; L207-V241 VanDerWaalsContact C-CG2 3.47Å; L207-V241 HydrophobicContact CB-CG2 3.75Å; A208-V241 HydrophobicContact CB-CG1 4.15Å; A208-V241 HydrophobicContact CB-CG2 4.02Å; A211-V241 HydrophobicContact CB-CG2 4.36Å; F237-V241 WeakPolarHBondContact O-CG2 3.19Å; F237-V241 PolarHBondContact O-N 3.31Å; S238-V241 PolarHBondContact O-N 3.44Å; V241-Q243 VanDerWaalsContact C-N 3.33Å; V241-Q243 PolarHBondContact O-N 3.22Å; V241-V244 PolarHBondContact O-N 3.44Å; V241-K245 WeakPolarHBondContact O-CB 3.34Å; V241-K245 PolarHBondContact O-N 2.9Å
242	Q	98.9	Very high	98.9	Very high	67 Å²	67	42 Å²	42	31%	0.313	20%	0.204	S	C	.	.	H	α-helix	trans	-63.4	-38.1	180	-166.9	61.1	38.3	0	0	112.5	S238 G239 Y240 K245 Y246	S238-Q242 WeakPolarHBondContact O-CB 3.27Å; S238-Q242 PolarHBondContact O-N 3.43Å; G239-Q242 PolarHBondContact O-N 3.01Å; Y240-Q242 VanDerWaalsContact C-N 3.27Å; Y240-Q242 PolarHBondContact O-N 3.06Å; Q242-K245 PolarHBondContact O-N 2.96Å; Q242-Y246 HydrophobicContact CG-CD2 4.21Å; Q242-Y246 HydrophobicContact CG-CE2 3.91Å; Q242-Y246 PolarHBondContact NE2-OH 3.48Å; Q242-Y246 PolarHBondContact O-N 3.41Å
243	Q	98.9	Very high	98.9	Very high	52 Å²	52	44.5 Å²	44.5	24%	0.243	23%	0.225	C	C	.	.	H	α-helix	trans	-64.4	-40.2	175.5	-70.6	-177.8	-80.7	0	0	112.3	G239 Y240 V241 S247	G239-Q243 WeakPolarHBondContact O-CG 3.41Å; G239-Q243 PolarHBondContact O-N 3.36Å; Y240-Q243 WeakPolarHBondContact O-CB 3.49Å; Y240-Q243 PolarHBondContact O-N 3.06Å; Y240-Q243 VanDerWaalsContact O-N 3.07Å; V241-Q243 VanDerWaalsContact C-N 3.33Å; V241-Q243 PolarHBondContact O-N 3.22Å; Q243-S247 WeakPolarHBondContact O-CB 3.42Å; Q243-S247 PolarHBondContact O-N 2.82Å; Q243-S247 PolarHBondContact O-OG 3.47Å
244	V	98.9	Very high	98.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-69.3	-42.4	176.1	-170.6	0	0	0	0	111.1	L200 L203 H204 L207 Y240 V241 Y246 S247 I248 M324	L200-V244 HydrophobicContact CB-CG1 4.38Å; L200-V244 WeakPolarHBondContact O-CG1 3.39Å; L203-V244 HydrophobicContact CD2-CG2 4.38Å; L203-V244 HydrophobicContact CG-CG2 4.41Å; H204-V244 HydrophobicContact CB-CB 4.17Å; H204-V244 HydrophobicContact CB-CG1 3.77Å; L207-V244 HydrophobicContact CD1-CG2 3.72Å; Y240-V244 WeakPolarHBondContact O-CG2 3.37Å; Y240-V244 PolarHBondContact O-N 2.94Å; V241-V244 PolarHBondContact O-N 3.44Å; V244-Y246 PolarHBondContact O-N 2.77Å; V244-S247 WeakPolarHBondContact O-CA 3.43Å; V244-S247 VanDerWaalsContact O-CB 3.28Å; V244-S247 WeakPolarHBondContact O-CB 3.46Å; V244-S247 PolarHBondContact O-N 3.01Å; V244-I248 HydrophobicContact CG1-CD1 4.38Å; V244-I248 PolarHBondContact O-N 2.93Å; V244-M324 HydrophobicContact CG2-CE 3.74Å
245	K	98.9	Very high	98.9	Very high	89 Å²	89	44.6 Å²	44.6	39%	0.387	23%	0.225	S	C	.	.	H	α-helix	trans	-54.6	-51.8	174.4	177.6	178.5	173.2	179.6	0	111.6	V241 Q242 S247 I248 E249	V241-K245 WeakPolarHBondContact O-CB 3.34Å; V241-K245 PolarHBondContact O-N 2.9Å; Q242-K245 PolarHBondContact O-N 2.96Å; K245-S247 VanDerWaalsContact C-N 3.26Å; K245-S247 PolarHBondContact O-N 2.94Å; K245-I248 WeakPolarHBondContact O-CB 3.3Å; K245-I248 PolarHBondContact O-N 3.47Å; K245-E249 WeakPolarHBondContact CE-OE1 3.44Å; K245-E249 PolarHBondContact O-N 3.3Å
246	Y	98.9	Very high	98.9	Very high	106 Å²	106	43.5 Å²	43.5	42%	0.416	22%	0.224	S	C	.	.	H	α-helix	trans	-66.6	-27.1	177.3	-71.1	-20.1	0	0	0	113.3	Q242 V244 E249 R250	Q242-Y246 HydrophobicContact CG-CD2 4.21Å; Q242-Y246 HydrophobicContact CG-CE2 3.91Å; Q242-Y246 PolarHBondContact NE2-OH 3.48Å; Q242-Y246 PolarHBondContact O-N 3.41Å; V244-Y246 PolarHBondContact O-N 2.77Å; Y246-E249 WeakPolarHBondContact CD1-OE2 3.44Å; Y246-R250 WeakPolarHBondContact O-CB 3.37Å; Y246-R250 WeakPolarHBondContact O-CD 3.44Å; Y246-R250 WeakPolarHBondContact O-CG 3.04Å; Y246-R250 PolarHBondContact O-N 2.92Å
247	S	98.9	Very high	98.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.9	-44.8	172.4	-64.9	0	0	0	0	111.4	Q243 V244 K245 R250 V251	Q243-S247 WeakPolarHBondContact O-CB 3.42Å; Q243-S247 PolarHBondContact O-N 2.82Å; Q243-S247 PolarHBondContact O-OG 3.47Å; V244-S247 WeakPolarHBondContact O-CA 3.43Å; V244-S247 VanDerWaalsContact O-CB 3.28Å; V244-S247 WeakPolarHBondContact O-CB 3.46Å; V244-S247 PolarHBondContact O-N 3.01Å; K245-S247 VanDerWaalsContact C-N 3.26Å; K245-S247 PolarHBondContact O-N 2.94Å; S247-R250 PolarHBondContact O-N 2.93Å; S247-V251 WeakPolarHBondContact O-CG2 3.26Å; S247-V251 PolarHBondContact O-N 3.4Å; S247-V251 VanDerWaalsContact O-N 3.08Å
248	I	98.9	Very high	98.9	Very high	12 Å²	12	46.3 Å²	46.3	6%	0.062	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-46.4	174.4	-69	165.2	0	0	0	110.9	L197 L200 H204 V244 K245 V251 K252	L197-I248 HydrophobicContact CD2-CG2 4.15Å; L200-I248 HydrophobicContact CB-CD1 4.08Å; L200-I248 HydrophobicContact CB-CG1 3.73Å; L200-I248 HydrophobicContact CD1-CG1 4.24Å; H204-I248 HydrophobicContact CB-CD1 4.4Å; V244-I248 HydrophobicContact CG1-CD1 4.38Å; V244-I248 PolarHBondContact O-N 2.93Å; K245-I248 WeakPolarHBondContact O-CB 3.3Å; K245-I248 PolarHBondContact O-N 3.47Å; I248-V251 PolarHBondContact O-N 3.05Å; I248-K252 HydrophobicContact CG2-CD 4.11Å; I248-K252 WeakPolarHBondContact O-CG 3.45Å; I248-K252 PolarHBondContact O-N 3.46Å
249	E	98.9	Very high	98.9	Very high	93 Å²	93	44.7 Å²	44.7	44%	0.435	22%	0.218	S	C	.	.	H	α-helix	trans	-61.2	-44.4	179	-70.9	173.3	-167	0	0	112.2	K245 Y246 K252 A253	K245-E249 WeakPolarHBondContact CE-OE1 3.44Å; K245-E249 PolarHBondContact O-N 3.3Å; Y246-E249 WeakPolarHBondContact CD1-OE2 3.44Å; E249-K252 PolarHBondContact O-N 2.92Å; E249-A253 WeakPolarHBondContact O-CB 3.41Å; E249-A253 PolarHBondContact O-N 3.37Å
250	R	98.9	Very high	98.9	Very high	103 Å²	103	45.1 Å²	45.1	39%	0.389	21%	0.212	S	C	.	.	H	α-helix	trans	-62.3	-43.8	177.3	-73.4	169.2	-173.2	126.1	-0.4	112.5	Y246 S247 A253 A254 A316	Y246-R250 WeakPolarHBondContact O-CB 3.37Å; Y246-R250 WeakPolarHBondContact O-CD 3.44Å; Y246-R250 WeakPolarHBondContact O-CG 3.04Å; Y246-R250 PolarHBondContact O-N 2.92Å; S247-R250 PolarHBondContact O-N 2.93Å; R250-A253 PolarHBondContact O-N 3.07Å; R250-A254 PolarHBondContact O-N 2.77Å; R250-A316 HydrophobicContact CB-CB 4.41Å
251	V	98.9	Very high	98.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-47.7	176.1	170.9	0	0	0	0	110	V192 L196 L197 S247 I248 A253 A254 M255 L313 A316 L317 V320	V192-V251 HydrophobicContact CG1-CG1 3.62Å; L196-V251 HydrophobicContact CD2-CG1 3.95Å; L196-V251 HydrophobicContact CD2-CG2 4.2Å; L197-V251 HydrophobicContact CD2-CB 4.19Å; L197-V251 HydrophobicContact CD2-CG1 3.86Å; L197-V251 HydrophobicContact CG-CG1 4.42Å; S247-V251 WeakPolarHBondContact O-CG2 3.26Å; S247-V251 PolarHBondContact O-N 3.4Å; S247-V251 VanDerWaalsContact O-N 3.08Å; I248-V251 PolarHBondContact O-N 3.05Å; V251-A253 VanDerWaalsContact C-N 3.3Å; V251-A253 PolarHBondContact O-N 3.27Å; V251-A254 PolarHBondContact O-N 2.83Å; V251-M255 WeakPolarHBondContact O-CG 3.46Å; V251-M255 PolarHBondContact O-N 2.91Å; V251-L313 HydrophobicContact CG1-CD1 4.28Å; V251-A316 HydrophobicContact CG2-CB 4.47Å; V251-L317 HydrophobicContact CG2-CD2 4.18Å; V251-V320 HydrophobicContact CG2-CG2 3.84Å
252	K	98.9	Very high	98.9	Very high	116 Å²	116	44.4 Å²	44.4	50%	0.504	21%	0.207	S	C	.	.	H	α-helix	trans	-60.2	-38.2	177.4	-72.7	178.1	178.6	178.2	0	112.5	L197 I248 E249 A254 M255	L197-K252 HydrophobicContact CD1-CG 4.19Å; L197-K252 HydrophobicContact CD2-CG 4.31Å; I248-K252 HydrophobicContact CG2-CD 4.11Å; I248-K252 WeakPolarHBondContact O-CG 3.45Å; I248-K252 PolarHBondContact O-N 3.46Å; E249-K252 PolarHBondContact O-N 2.92Å; K252-A254 VanDerWaalsContact C-N 3.3Å; K252-A254 PolarHBondContact O-N 2.72Å; K252-M255 WeakPolarHBondContact O-CB 3.2Å; K252-M255 PolarHBondContact O-N 3.16Å
253	A	98.9	Very high	98.9	Very high	59 Å²	59	41.4 Å²	41.4	49%	0.488	19%	0.194	S	C	.	.	H	α-helix	trans	-65.4	-30.5	179.1	0	0	0	0	0	113.5	E249 R250 V251 M255 P256 R257	E249-A253 WeakPolarHBondContact O-CB 3.41Å; E249-A253 PolarHBondContact O-N 3.37Å; R250-A253 PolarHBondContact O-N 3.07Å; V251-A253 VanDerWaalsContact C-N 3.3Å; V251-A253 PolarHBondContact O-N 3.27Å; A253-M255 VanDerWaalsContact C-N 3.35Å; A253-P256 VanDerWaalsContact O-CD 3.25Å; A253-P256 WeakPolarHBondContact O-CD 3.46Å; A253-R257 PolarHBondContact O-NH2 3.35Å
254	A	98.8	Very high	98.9	Very high	3 Å²	3	39.3 Å²	39.3	3%	0.025	19%	0.186	C	C	.	.	H	α-helix	trans	-78.9	-14.7	176.8	0	0	0	0	0	113.6	R250 V251 K252 E312 L313 A316	R250-A254 PolarHBondContact O-N 2.77Å; V251-A254 PolarHBondContact O-N 2.83Å; K252-A254 VanDerWaalsContact C-N 3.3Å; K252-A254 PolarHBondContact O-N 2.72Å; A254-E312 HydrophobicContact CB-CG 4.11Å; A254-L313 HydrophobicContact CB-CB 4.31Å; A254-L313 HydrophobicContact CB-CD1 4.14Å; A254-A316 HydrophobicContact CB-CB 4.27Å
255	M	98.9	Very high	98.9	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.02	19%	0.186	C	C	.	.	H	α-helix	trans	-70.2	-32.4	-173.8	-71.7	-51.8	-58.7	0	0	117.3	A189 V192 V251 K252 A253 R257 V258 Y259 L313	A189-M255 HydrophobicContact CB-CE 3.63Å; V192-M255 HydrophobicContact CB-CE 4.44Å; V192-M255 HydrophobicContact CB-SD 4.08Å; V192-M255 HydrophobicContact CG1-CE 4.5Å; V192-M255 HydrophobicContact CG1-CG 4.35Å; V192-M255 HydrophobicContact CG1-SD 3.75Å; V192-M255 HydrophobicContact CG2-SD 4.1Å; V251-M255 WeakPolarHBondContact O-CG 3.46Å; V251-M255 PolarHBondContact O-N 2.91Å; K252-M255 WeakPolarHBondContact O-CB 3.2Å; K252-M255 PolarHBondContact O-N 3.16Å; A253-M255 VanDerWaalsContact C-N 3.35Å; M255-R257 VanDerWaalsContact C-N 3.3Å; M255-R257 PolarHBondContact O-N 3.01Å; M255-V258 HydrophobicContact CE-CB 3.88Å; M255-V258 HydrophobicContact CE-CG1 3.88Å; M255-V258 HydrophobicContact CE-CG2 4.43Å; M255-V258 WeakPolarHBondContact O-CA 3.39Å; M255-V258 WeakPolarHBondContact O-CB 3.35Å; M255-V258 PolarHBondContact O-N 3.33Å; M255-V258 HydrophobicContact SD-CB 4.44Å; M255-V258 HydrophobicContact SD-CG2 4.36Å; M255-Y259 HydrophobicContact CB-CE2 3.78Å; M255-Y259 HydrophobicContact CE-CE1 3.92Å; M255-Y259 VanDerWaalsContact O-CD2 3.3Å; M255-Y259 WeakPolarHBondContact O-CD2 3.45Å; M255-Y259 PolarHBondContact O-N 3.08Å; M255-L313 HydrophobicContact SD-CD1 4.19Å; M255-L313 HydrophobicContact SD-CD2 4.49Å
256	P	98.9	Very high	98.8	Very high	57 Å²	57	35.3 Å²	35.3	37%	0.37	17%	0.169	S	C	.	.	H	α-helix	trans	-55.2	-41	-172.7	-27.6	33.6	0	0	0	114.5	A253 V258 Y259	A253-P256 VanDerWaalsContact O-CD 3.25Å; A253-P256 WeakPolarHBondContact O-CD 3.46Å; P256-V258 VanDerWaalsContact C-N 3.34Å; P256-Y259 PolarHBondContact O-N 2.95Å
257	R	98.8	Very high	98.8	Very high	98 Å²	98	32.5 Å²	32.5	37%	0.37	17%	0.168	S	C	.	.	H	α-helix	trans	-73.4	-24.2	176.3	-66.3	121.4	-74.2	-84	13.4	113.5	A253 M255 Y259 E260 A309 E312	A253-R257 PolarHBondContact O-NH2 3.35Å; M255-R257 VanDerWaalsContact C-N 3.3Å; M255-R257 PolarHBondContact O-N 3.01Å; R257-Y259 VanDerWaalsContact C-N 3.25Å; R257-Y259 PolarHBondContact O-N 2.96Å; R257-E260 WeakPolarHBondContact O-CB 3.49Å; R257-E260 PolarHBondContact O-N 3.39Å; R257-A309 HydrophobicContact CB-CB 3.71Å; R257-E312 VanDerWaalsContact CD-OE2 3.31Å; R257-E312 WeakPolarHBondContact CD-OE2 3.31Å; R257-E312 IonicContact NE-OE2 2.72Å; R257-E312 PolarHBondContact NE-OE2 3.29Å
258	V	98.9	Very high	98.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-68.6	-28	173.2	-177.1	0	0	0	0	110.9	H185 V188 A189 M255 P256 E260 A309 L313	H185-V258 VanDerWaalsContact CB-O 3.31Å; H185-V258 WeakPolarHBondContact CB-O 3.34Å; H185-V258 PolarHBondContact ND1-O 3.24Å; V188-V258 HydrophobicContact CB-CG1 4.33Å; V188-V258 HydrophobicContact CG1-CG1 3.97Å; A189-V258 HydrophobicContact CB-CG1 4.12Å; M255-V258 HydrophobicContact CE-CB 3.88Å; M255-V258 HydrophobicContact CE-CG1 3.88Å; M255-V258 HydrophobicContact CE-CG2 4.43Å; M255-V258 WeakPolarHBondContact O-CA 3.39Å; M255-V258 WeakPolarHBondContact O-CB 3.35Å; M255-V258 PolarHBondContact O-N 3.33Å; M255-V258 HydrophobicContact SD-CB 4.44Å; M255-V258 HydrophobicContact SD-CG2 4.36Å; P256-V258 VanDerWaalsContact C-N 3.34Å; V258-E260 PolarHBondContact O-N 2.92Å; V258-A309 HydrophobicContact CG2-CB 4.31Å; V258-L313 HydrophobicContact CG2-CB 4.43Å; V258-L313 HydrophobicContact CG2-CD2 4.26Å
259	Y	98.9	Very high	98.7	Very high	27 Å²	27	35.1 Å²	35.1	11%	0.106	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-10.4	176	-60.6	-53.2	0	0	0	114.1	A189 H193 M255 P256 R257 L261 L292 P293 F294 I295	A189-Y259 HydrophobicContact CB-CD1 4.19Å; A189-Y259 HydrophobicContact CB-CE1 3.95Å; H193-Y259 AromaticContact NE2-CZ 3.85Å; H193-Y259 PolarHBondContact NE2-OH 3Å; M255-Y259 HydrophobicContact CB-CE2 3.78Å; M255-Y259 HydrophobicContact CE-CE1 3.92Å; M255-Y259 VanDerWaalsContact O-CD2 3.3Å; M255-Y259 WeakPolarHBondContact O-CD2 3.45Å; M255-Y259 PolarHBondContact O-N 3.08Å; P256-Y259 PolarHBondContact O-N 2.95Å; R257-Y259 VanDerWaalsContact C-N 3.25Å; R257-Y259 PolarHBondContact O-N 2.96Å; Y259-L261 PolarHBondContact O-N 3.25Å; Y259-L292 HydrophobicContact CE1-CB 4.35Å; Y259-P293 WeakPolarHBondContact CB-O 3.21Å; Y259-P293 HydrophobicContact CD1-CG 4.23Å; Y259-P293 HydrophobicContact CD2-CG 3.8Å; Y259-P293 HydrophobicContact CE1-CG 4.13Å; Y259-P293 HydrophobicContact CE2-CG 3.7Å; Y259-P293 HydrophobicContact CG-CG 4.09Å; Y259-F294 HydrophobicContact CD1-CD1 4.11Å; Y259-F294 HydrophobicContact CD1-CE1 4.01Å; Y259-F294 HydrophobicContact CD1-CZ 4.42Å; Y259-F294 WeakPolarHBondContact O-CA 3.34Å; Y259-F294 WeakPolarHBondContact O-CD1 3.48Å; Y259-I295 PolarHBondContact O-N 2.9Å
260	E	98.9	Very high	98.7	Very high	42 Å²	42	34.8 Å²	34.8	20%	0.196	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	119.8	178.8	-66	178.2	-157.3	0	0	110	H185 R257 V258 I295 A297 P298	H185-E260 PolarHBondContact ND1-O 3.16Å; R257-E260 WeakPolarHBondContact O-CB 3.49Å; R257-E260 PolarHBondContact O-N 3.39Å; V258-E260 PolarHBondContact O-N 2.92Å; E260-I295 WeakPolarHBondContact CA-O 3.26Å; E260-I295 HydrophobicContact CG-CD1 4.03Å; E260-I295 HydrophobicContact CG-CG1 3.97Å; E260-A297 HydrophobicContact CB-CB 3.94Å; E260-P298 WeakPolarHBondContact OE2-CD 3.41Å
261	L	98.9	Very high	98.7	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	135.3	-174.2	-59.2	-175.9	0	0	0	112.1	T182 H185 I186 Y259 A263 A283 V286 F294 I295 A297	T182-L261 HydrophobicContact CG2-CB 4.16Å; T182-L261 HydrophobicContact CG2-CD1 4.04Å; T182-L261 HydrophobicContact CG2-CD2 4.1Å; T182-L261 HydrophobicContact CG2-CG 4.32Å; H185-L261 HydrophobicContact CB-CD2 3.81Å; I186-L261 HydrophobicContact CG1-CD2 4.12Å; Y259-L261 PolarHBondContact O-N 3.25Å; L261-A263 VanDerWaalsContact C-N 3.33Å; L261-A263 PolarHBondContact O-N 3.31Å; L261-A283 HydrophobicContact CD1-CB 4.27Å; L261-V286 HydrophobicContact CD1-CB 4.22Å; L261-V286 HydrophobicContact CD1-CG1 4.02Å; L261-V286 HydrophobicContact CD1-CG2 4.49Å; L261-F294 HydrophobicContact CD1-CB 3.92Å; L261-F294 HydrophobicContact CD1-CD1 4.1Å; L261-F294 HydrophobicContact CD1-CG 4.18Å; L261-F294 HydrophobicContact CD2-CD1 3.63Å; L261-F294 HydrophobicContact CD2-CE1 4.05Å; L261-F294 HydrophobicContact CG-CB 4.3Å; L261-F294 HydrophobicContact CG-CD1 3.95Å; L261-F294 HydrophobicContact CG-CG 4.46Å; L261-I295 PolarHBondContact N-O 3.34Å; L261-A297 WeakPolarHBondContact O-CB 3.46Å; L261-A297 PolarHBondContact O-N 2.71Å
262	A	98.9	Very high	98.6	Very high	3 Å²	3	36.6 Å²	36.6	3%	0.025	21%	0.211	C	C	.	.			trans	-75	-17.6	179.5	0	0	0	0	0	114	P181 T182 G264 G265 K300 A303 L304	P181-A262 HydrophobicContact CB-CB 4.04Å; P181-A262 HydrophobicContact CG-CB 3.75Å; T182-A262 PolarHBondContact OG1-N 3.46Å; A262-G264 PolarHBondContact O-N 3.07Å; A262-G265 PolarHBondContact O-N 3.3Å; A262-K300 WeakPolarHBondContact O-CD 3.41Å; A262-K300 WeakPolarHBondContact O-CE 3.42Å; A262-A303 HydrophobicContact CB-CB 4.04Å; A262-L304 HydrophobicContact CB-CD2 4.02Å
263	A	98.8	Very high	98.5	Very high	4 Å²	4	38 Å²	38	3%	0.033	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	130.7	-177.3	0	0	0	0	0	112.1	T182 L261 A279 V282 K300	T182-A263 HydrophobicContact CG2-CB 4.07Å; T182-A263 WeakPolarHBondContact OG1-CB 3.34Å; T182-A263 PolarHBondContact OG1-N 3.39Å; L261-A263 VanDerWaalsContact C-N 3.33Å; L261-A263 PolarHBondContact O-N 3.31Å; A263-A279 WeakPolarHBondContact O-CB 3.36Å; A263-V282 HydrophobicContact CB-CG1 3.8Å; A263-K300 VanDerWaalsContact O-CE 3.29Å; A263-K300 WeakPolarHBondContact O-CE 3.5Å
264	G	98.6	Very high	98.5	Very high	7 Å²	7	36.4 Å²	36.4	7%	0.072	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.2	-9.6	-172.4	0	0	0	0	0	113.8	D178 A262 T266 G271	D178-G264 PolarHBondContact OD2-N 3.27Å; A262-G264 PolarHBondContact O-N 3.07Å; G264-T266 VanDerWaalsContact C-N 3.27Å; G264-G271 VanDerWaalsContact O-CA 3.23Å; G264-G271 WeakPolarHBondContact O-CA 3.44Å
265	G	98.6	Very high	98.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.231	C	C	.	.			trans	-70.6	-22	169.4	0	0	0	0	0	113.3	D178 A262 G269 T270 G271	D178-G265 PolarHBondContact OD2-N 2.85Å; A262-G265 PolarHBondContact O-N 3.3Å; G265-G269 CarbonylContact O-C 3.35Å; G265-G269 VanDerWaalsContact O-C 3.24Å; G265-G269 WeakPolarHBondContact O-CA 3.4Å; G265-G269 PolarHBondContact O-N 3.07Å; G265-T270 PolarHBondContact O-N 2.88Å; G265-G271 PolarHBondContact O-N 3.22Å
266	T	98.4	Very high	98.5	Very high	6 Å²	6	50.5 Å²	50.5	4%	0.037	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	-129.7	179.2	68	0	0	0	0	113.6	S175 N177 D178 G264 G271 L272 T274	S175-T266 VanDerWaalsContact CB-CA 3.45Å; S175-T266 VanDerWaalsContact CB-O 3.3Å; S175-T266 WeakPolarHBondContact CB-O 3.25Å; S175-T266 PolarHBondContact OG-O 2.92Å; N177-T266 WeakPolarHBondContact CB-O 3.36Å; D178-T266 WeakPolarHBondContact OD2-CA 3.43Å; D178-T266 PolarHBondContact OD2-N 2.93Å; G264-T266 VanDerWaalsContact C-N 3.27Å; T266-G271 WeakPolarHBondContact OG1-CA 3.33Å; T266-G271 PolarHBondContact OG1-N 3.27Å; T266-L272 WeakPolarHBondContact CB-O 3.38Å; T266-L272 WeakPolarHBondContact CG2-O 3.49Å; T266-L272 PolarHBondContact OG1-N 3Å; T266-L272 PolarHBondContact OG1-O 2.71Å; T266-T274 HydrophobicContact CG2-CG2 3.7Å
267	A	97.6	Very high	98.5	Very high	46 Å²	46	48.7 Å²	48.7	38%	0.38	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-44	-172	0	0	0	0	0	113.1	N177	N177-A267 PolarHBondContact ND2-O 3.49Å
268	V	98.3	Very high	98.5	Very high	60 Å²	60	44 Å²	44	36%	0.364	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137.3	7.6	-167.5	-64.5	0	0	0	0	113.9	T270 F301 E393	V268-T270 HydrophobicContact CG2-CG2 4.09Å; V268-F301 WeakPolarHBondContact O-CD1 3.17Å; V268-F301 WeakPolarHBondContact O-CE1 3.45Å; V268-E393 HydrophobicContact CB-CB 4.05Å; V268-E393 HydrophobicContact CB-CG 4.05Å; V268-E393 HydrophobicContact CG1-CB 4.18Å; V268-E393 HydrophobicContact CG1-CG 4.37Å
269	G	98.5	Very high	98.5	Very high	7 Å²	7	44.6 Å²	44.6	7%	0.072	25%	0.251	C	S	.	.	S	Bend	trans	104.9	-11.3	176.9	0	0	0	0	0	115	G265 K300 L304	G265-G269 CarbonylContact O-C 3.35Å; G265-G269 VanDerWaalsContact O-C 3.24Å; G265-G269 WeakPolarHBondContact O-CA 3.4Å; G265-G269 PolarHBondContact O-N 3.07Å; G269-K300 VanDerWaalsContact O-CB 3.25Å; G269-K300 WeakPolarHBondContact O-CB 3.29Å; G269-L304 VanDerWaalsContact N-CD1 3.3Å
270	T	98.6	Very high	98.5	Very high	87 Å²	87	48.4 Å²	48.4	53%	0.534	27%	0.27	S	S	.	.	S	Bend	trans	-79.6	-17.6	-175	56.4	0	0	0	0	114.9	G265 V268 L272 F301	G265-T270 PolarHBondContact O-N 2.88Å; V268-T270 HydrophobicContact CG2-CG2 4.09Å; T270-L272 VanDerWaalsContact C-N 3.33Å; T270-L272 PolarHBondContact OG1-N 3.36Å; T270-F301 HydrophobicContact CG2-CE1 3.95Å; T270-F301 HydrophobicContact CG2-CZ 4.02Å
271	G	98.4	Very high	98.5	Very high	20 Å²	20	50.2 Å²	50.2	21%	0.206	28%	0.277	C	S	.	.			trans	76.2	14.9	-170.2	0	0	0	0	0	115	G264 G265 T266 N273 T274	G264-G271 VanDerWaalsContact O-CA 3.23Å; G264-G271 WeakPolarHBondContact O-CA 3.44Å; G265-G271 PolarHBondContact O-N 3.22Å; T266-G271 WeakPolarHBondContact OG1-CA 3.33Å; T266-G271 PolarHBondContact OG1-N 3.27Å; G271-N273 PolarHBondContact O-N 3.42Å; G271-T274 VanDerWaalsContact O-CG2 3.23Å; G271-T274 WeakPolarHBondContact O-CG2 3.47Å; G271-T274 PolarHBondContact O-N 3.34Å
272	L	97.4	Very high	98.5	Very high	120 Å²	120	50.1 Å²	50.1	63%	0.628	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	133.2	173.7	-178	66.2	0	0	0	110.8	T266 T270 T274	T266-L272 WeakPolarHBondContact CB-O 3.38Å; T266-L272 WeakPolarHBondContact CG2-O 3.49Å; T266-L272 PolarHBondContact OG1-N 3Å; T266-L272 PolarHBondContact OG1-O 2.71Å; T270-L272 VanDerWaalsContact C-N 3.33Å; T270-L272 PolarHBondContact OG1-N 3.36Å; L272-T274 VanDerWaalsContact C-N 3.27Å; L272-T274 PolarHBondContact O-N 3.03Å
273	N	97.4	Very high	98.5	Very high	146 Å²	146	50 Å²	50	78%	0.781	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	13	-177.8	-54.7	-29.3	0	0	0	115.8	G271	G271-N273 PolarHBondContact O-N 3.42Å
274	T	98.4	Very high	98.5	Very high	26 Å²	26	52.8 Å²	52.8	16%	0.16	30%	0.298	C	S	.	.	S	Bend	trans	-104.8	-171.8	159.4	-161.6	0	0	0	0	111.2	S173 T266 G271 L272 F278	S173-T274 WeakPolarHBondContact O-CB 3.09Å; S173-T274 PolarHBondContact O-OG1 3.11Å; T266-T274 HydrophobicContact CG2-CG2 3.7Å; G271-T274 VanDerWaalsContact O-CG2 3.23Å; G271-T274 WeakPolarHBondContact O-CG2 3.47Å; G271-T274 PolarHBondContact O-N 3.34Å; L272-T274 VanDerWaalsContact C-N 3.27Å; L272-T274 PolarHBondContact O-N 3.03Å; T274-F278 WeakPolarHBondContact OG1-CD1 3.21Å
275	R	98.4	Very high	98.5	Very high	130 Å²	130	53.6 Å²	53.6	49%	0.491	30%	0.302	S	S	.	.			trans	-113.4	143.5	-178.5	-56.1	-62.3	-65.2	-80.5	-0	110.7	Y99 G277 F278	Y99-R275 HydrophobicContact CD1-CB 3.68Å; Y99-R275 HydrophobicContact CD1-CG 3.78Å; Y99-R275 HydrophobicContact CD2-CB 4.31Å; Y99-R275 HydrophobicContact CD2-CG 4.43Å; Y99-R275 HydrophobicContact CE1-CB 3.66Å; Y99-R275 HydrophobicContact CE1-CG 4.29Å; Y99-R275 HydrophobicContact CE2-CB 4.32Å; Y99-R275 HydrophobicContact CG-CB 4.01Å; Y99-R275 HydrophobicContact CG-CG 3.84Å; R275-G277 PolarHBondContact O-N 2.86Å; R275-F278 HydrophobicContact CB-CB 4.38Å; R275-F278 WeakPolarHBondContact O-CB 3.33Å; R275-F278 PolarHBondContact O-N 3.22Å
276	I	98.7	Very high	98.5	Very high	173 Å²	173	53.6 Å²	53.6	89%	0.887	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	129.1	169.9	-62.1	173.1	0	0	0	108.7	Y99	Y99-I276 PolarHBondContact OH-O 3.5Å
277	G	98.4	Very high	98.5	Very high	19 Å²	19	54.2 Å²	54.2	20%	0.196	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	-10.2	-176.1	0	0	0	0	0	115.1	Y99 R275 E280 K281	Y99-G277 WeakPolarHBondContact OH-CA 3.43Å; R275-G277 PolarHBondContact O-N 2.86Å; G277-E280 WeakPolarHBondContact CA-OE2 3.48Å; G277-K281 VanDerWaalsContact O-CB 3.27Å; G277-K281 WeakPolarHBondContact O-CB 3.48Å; G277-K281 WeakPolarHBondContact O-CG 3.35Å; G277-K281 PolarHBondContact O-N 3.02Å; G277-K281 VanDerWaalsContact O-N 3.08Å
278	F	98.9	Very high	98.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.6	-44	179.8	177.4	-98.2	0	0	0	111.6	A92 V95 Y99 S173 Q174 T274 R275 E280 K281 V282	A92-F278 HydrophobicContact CB-CE2 4.44Å; A92-F278 HydrophobicContact CB-CZ 4.15Å; V95-F278 HydrophobicContact CG1-CD2 3.75Å; V95-F278 HydrophobicContact CG1-CE2 4.12Å; Y99-F278 HydrophobicContact CD2-CD2 4.29Å; Y99-F278 HydrophobicContact CE2-CB 4.11Å; Y99-F278 HydrophobicContact CE2-CD2 4.22Å; Y99-F278 PolarHBondContact OH-N 2.88Å; S173-F278 WeakPolarHBondContact O-CE1 3.31Å; Q174-F278 HydrophobicContact CG-CE1 4.2Å; Q174-F278 HydrophobicContact CG-CZ 3.9Å; T274-F278 WeakPolarHBondContact OG1-CD1 3.21Å; R275-F278 HydrophobicContact CB-CB 4.38Å; R275-F278 WeakPolarHBondContact O-CB 3.33Å; R275-F278 PolarHBondContact O-N 3.22Å; F278-E280 PolarHBondContact O-N 3.14Å; F278-K281 PolarHBondContact O-N 2.99Å; F278-V282 HydrophobicContact CD1-CG1 4.45Å; F278-V282 HydrophobicContact CE1-CB 4.47Å; F278-V282 HydrophobicContact CE1-CG1 4.17Å; F278-V282 HydrophobicContact CZ-CB 4.32Å; F278-V282 HydrophobicContact CZ-CG1 4.48Å; F278-V282 HydrophobicContact CZ-CG2 4.38Å; F278-V282 WeakPolarHBondContact O-CB 3.43Å; F278-V282 VanDerWaalsContact O-CG1 3.26Å; F278-V282 WeakPolarHBondContact O-CG1 3.26Å; F278-V282 PolarHBondContact O-N 2.74Å
279	A	98.9	Very high	98.6	Very high	11 Å²	11	57.1 Å²	57.1	9%	0.091	32%	0.323	C	S	.	.	H	α-helix	trans	-62.5	-43.8	-176	0	0	0	0	0	112.2	A263 A283 T296	A263-A279 WeakPolarHBondContact O-CB 3.36Å; A279-A283 WeakPolarHBondContact O-CB 3.17Å; A279-A283 PolarHBondContact O-N 3.22Å; A279-T296 WeakPolarHBondContact CB-OG1 3.37Å; A279-T296 PolarHBondContact O-OG1 2.88Å
280	E	98.9	Very high	98.6	Very high	107 Å²	107	58.2 Å²	58.2	50%	0.5	33%	0.328	S	S	.	.	H	α-helix	trans	-70.7	-46.9	179.4	-61.3	72.7	-160.8	0	0	110.8	G277 F278 A283 A284 T296	G277-E280 WeakPolarHBondContact CA-OE2 3.48Å; F278-E280 PolarHBondContact O-N 3.14Å; E280-A283 PolarHBondContact O-N 3.02Å; E280-A284 WeakPolarHBondContact O-CB 3.45Å; E280-A284 PolarHBondContact O-N 3.19Å; E280-T296 HydrophobicContact CG-CG2 4.15Å
281	K	98.9	Very high	98.6	Very high	80 Å²	80	57.3 Å²	57.3	35%	0.348	34%	0.336	S	S	.	.	H	α-helix	trans	-64.2	-45.7	-179.4	-73.6	178.2	178.9	-172.9	0	111.9	V95 D98 Y99 G277 F278 A283 A284 T285	V95-K281 HydrophobicContact CB-CB 4.49Å; V95-K281 HydrophobicContact CG1-CB 3.7Å; V95-K281 HydrophobicContact CG1-CD 4.17Å; V95-K281 HydrophobicContact CG2-CB 3.9Å; D98-K281 IonicContact OD2-NZ 2.6Å; D98-K281 PolarHBondContact OD2-NZ 3.48Å; Y99-K281 HydrophobicContact CE2-CD 4.43Å; G277-K281 VanDerWaalsContact O-CB 3.27Å; G277-K281 WeakPolarHBondContact O-CB 3.48Å; G277-K281 WeakPolarHBondContact O-CG 3.35Å; G277-K281 PolarHBondContact O-N 3.02Å; G277-K281 VanDerWaalsContact O-N 3.08Å; F278-K281 PolarHBondContact O-N 2.99Å; K281-A283 VanDerWaalsContact C-N 3.34Å; K281-A283 PolarHBondContact O-N 3.33Å; K281-A284 PolarHBondContact O-N 3.43Å; K281-T285 PolarHBondContact O-N 3.15Å; K281-T285 PolarHBondContact O-OG1 2.68Å
282	V	98.9	Very high	98.6	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.006	33%	0.33	C	S	.	.	H	α-helix	trans	-65.5	-38.8	-179	75.6	0	0	0	0	111.5	L88 A91 A92 A263 F278 T285 V286	L88-V282 HydrophobicContact CD1-CG2 4.13Å; A91-V282 HydrophobicContact CB-CG2 3.96Å; A92-V282 HydrophobicContact CB-CG2 4.41Å; A263-V282 HydrophobicContact CB-CG1 3.8Å; F278-V282 HydrophobicContact CD1-CG1 4.45Å; F278-V282 HydrophobicContact CE1-CB 4.47Å; F278-V282 HydrophobicContact CE1-CG1 4.17Å; F278-V282 HydrophobicContact CZ-CB 4.32Å; F278-V282 HydrophobicContact CZ-CG1 4.48Å; F278-V282 HydrophobicContact CZ-CG2 4.38Å; F278-V282 WeakPolarHBondContact O-CB 3.43Å; F278-V282 VanDerWaalsContact O-CG1 3.26Å; F278-V282 WeakPolarHBondContact O-CG1 3.26Å; F278-V282 PolarHBondContact O-N 2.74Å; V282-T285 PolarHBondContact O-N 3.34Å; V282-V286 WeakPolarHBondContact O-CB 3.49Å; V282-V286 VanDerWaalsContact O-CG2 3.28Å; V282-V286 WeakPolarHBondContact O-CG2 3.26Å; V282-V286 PolarHBondContact O-N 3.48Å
283	A	98.9	Very high	98.7	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.008	33%	0.325	C	S	.	.	H	α-helix	trans	-64.3	-43.8	174.8	0	0	0	0	0	111.9	L261 A279 E280 K281 T285 V286 A287	L261-A283 HydrophobicContact CD1-CB 4.27Å; A279-A283 WeakPolarHBondContact O-CB 3.17Å; A279-A283 PolarHBondContact O-N 3.22Å; E280-A283 PolarHBondContact O-N 3.02Å; K281-A283 VanDerWaalsContact C-N 3.34Å; K281-A283 PolarHBondContact O-N 3.33Å; A283-T285 PolarHBondContact O-N 2.87Å; A283-V286 PolarHBondContact O-N 3.49Å; A283-A287 WeakPolarHBondContact O-CB 3.38Å; A283-A287 PolarHBondContact O-N 2.91Å
284	A	98.9	Very high	98.8	Very high	61 Å²	61	48.5 Å²	48.5	50%	0.504	29%	0.289	S	S	.	.	H	α-helix	trans	-63.1	-40.2	176	0	0	0	0	0	112.5	E280 K281 A287 S288	E280-A284 WeakPolarHBondContact O-CB 3.45Å; E280-A284 PolarHBondContact O-N 3.19Å; K281-A284 PolarHBondContact O-N 3.43Å; A284-A287 WeakPolarHBondContact O-CB 3.28Å; A284-A287 PolarHBondContact O-N 2.93Å; A284-S288 PolarHBondContact O-N 3.04Å
285	T	98.9	Very high	98.8	Very high	24 Å²	24	51.6 Å²	51.6	15%	0.147	30%	0.303	C	S	.	.	H	α-helix	trans	-65.6	-44.1	174.9	-57.2	0	0	0	0	111	A91 V95 K281 V282 A283 A287 S288 L289	A91-T285 HydrophobicContact CB-CG2 3.65Å; V95-T285 WeakPolarHBondContact CG2-OG1 3.4Å; K281-T285 PolarHBondContact O-N 3.15Å; K281-T285 PolarHBondContact O-OG1 2.68Å; V282-T285 PolarHBondContact O-N 3.34Å; A283-T285 PolarHBondContact O-N 2.87Å; T285-A287 VanDerWaalsContact C-N 3.32Å; T285-A287 PolarHBondContact O-N 3.32Å; T285-S288 PolarHBondContact O-N 2.93Å; T285-L289 HydrophobicContact CG2-CD1 4Å; T285-L289 HydrophobicContact CG2-CG 4.43Å; T285-L289 WeakPolarHBondContact O-CG 3.24Å; T285-L289 PolarHBondContact O-N 3.5Å
286	V	98.9	Very high	98.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.3	-43.3	173.9	169.4	0	0	0	0	111.2	I87 A91 I186 L261 V282 A283 L289 T290 F294	I87-V286 HydrophobicContact CG2-CG1 4.27Å; I87-V286 HydrophobicContact CG2-CG2 4.39Å; A91-V286 HydrophobicContact CB-CG2 3.71Å; I186-V286 HydrophobicContact CD1-CG1 3.6Å; I186-V286 HydrophobicContact CD1-CG2 4.1Å; I186-V286 HydrophobicContact CG1-CG1 3.78Å; L261-V286 HydrophobicContact CD1-CB 4.22Å; L261-V286 HydrophobicContact CD1-CG1 4.02Å; L261-V286 HydrophobicContact CD1-CG2 4.49Å; V282-V286 WeakPolarHBondContact O-CB 3.49Å; V282-V286 VanDerWaalsContact O-CG2 3.28Å; V282-V286 WeakPolarHBondContact O-CG2 3.26Å; V282-V286 PolarHBondContact O-N 3.48Å; A283-V286 PolarHBondContact O-N 3.49Å; V286-L289 PolarHBondContact O-N 3.48Å; V286-T290 HydrophobicContact CG1-CG2 4.47Å; V286-T290 WeakPolarHBondContact O-CG2 3.45Å; V286-T290 PolarHBondContact O-N 3.49Å; V286-T290 VanDerWaalsContact O-N 3.08Å; V286-T290 PolarHBondContact O-OG1 3Å; V286-F294 HydrophobicContact CG1-CB 4.29Å; V286-F294 HydrophobicContact CG1-CD2 3.7Å; V286-F294 HydrophobicContact CG1-CE2 4.15Å; V286-F294 HydrophobicContact CG1-CG 4.01Å
287	A	98.9	Very high	98.8	Very high	20 Å²	20	38.6 Å²	38.6	17%	0.165	25%	0.247	C	C	.	.	H	α-helix	trans	-59.6	-46.5	175.6	0	0	0	0	0	111.7	A283 A284 T285 L289 T290 G291 L292 F294	A283-A287 WeakPolarHBondContact O-CB 3.38Å; A283-A287 PolarHBondContact O-N 2.91Å; A284-A287 WeakPolarHBondContact O-CB 3.28Å; A284-A287 PolarHBondContact O-N 2.93Å; T285-A287 VanDerWaalsContact C-N 3.32Å; T285-A287 PolarHBondContact O-N 3.32Å; A287-L289 VanDerWaalsContact C-N 3.31Å; A287-L289 PolarHBondContact O-N 3.44Å; A287-T290 PolarHBondContact O-N 2.94Å; A287-T290 PolarHBondContact O-OG1 3.26Å; A287-G291 WeakPolarHBondContact O-CA 3.23Å; A287-G291 PolarHBondContact O-N 3.36Å; A287-L292 WeakPolarHBondContact CA-O 3.45Å; A287-L292 WeakPolarHBondContact CB-O 3.31Å; A287-F294 HydrophobicContact CB-CB 4.12Å
288	S	98.8	Very high	98.8	Very high	102 Å²	102	43 Å²	43	71%	0.713	27%	0.272	S	S	*	.	H	α-helix	trans	-61.5	-37.2	177	-175.6	0	0	0	0	113	A284 T285	A284-S288 PolarHBondContact O-N 3.04Å; T285-S288 PolarHBondContact O-N 2.93Å
289	L	98.6	Very high	98.8	Very high	65 Å²	65	46.8 Å²	46.8	34%	0.34	29%	0.292	S	S	.	.	H	α-helix	trans	-74.4	-32.7	-178.1	-69.7	167	0	0	0	113.2	I87 A91 T285 V286 A287	I87-L289 HydrophobicContact CG2-CB 4.47Å; I87-L289 HydrophobicContact CG2-CD1 4.3Å; A91-L289 HydrophobicContact CB-CD1 4.11Å; T285-L289 HydrophobicContact CG2-CD1 4Å; T285-L289 HydrophobicContact CG2-CG 4.43Å; T285-L289 WeakPolarHBondContact O-CG 3.24Å; T285-L289 PolarHBondContact O-N 3.5Å; V286-L289 PolarHBondContact O-N 3.48Å; A287-L289 VanDerWaalsContact C-N 3.31Å; A287-L289 PolarHBondContact O-N 3.44Å
290	T	98.7	Very high	98.8	Very high	30 Å²	30	47.5 Å²	47.5	18%	0.184	29%	0.293	C	S	.	.	H	α-helix	trans	-96.6	-20.2	-175.5	55.7	0	0	0	0	112.7	I87 V286 A287 L292 F294	I87-T290 HydrophobicContact CD1-CG2 4.1Å; I87-T290 HydrophobicContact CG2-CG2 4.11Å; V286-T290 HydrophobicContact CG1-CG2 4.47Å; V286-T290 WeakPolarHBondContact O-CG2 3.45Å; V286-T290 PolarHBondContact O-N 3.49Å; V286-T290 VanDerWaalsContact O-N 3.08Å; V286-T290 PolarHBondContact O-OG1 3Å; A287-T290 PolarHBondContact O-N 2.94Å; A287-T290 PolarHBondContact O-OG1 3.26Å; T290-L292 PolarHBondContact O-N 2.94Å; T290-L292 PolarHBondContact OG1-N 2.97Å; T290-F294 HydrophobicContact CG2-CE2 4.11Å; T290-F294 WeakPolarHBondContact OG1-CD2 3.16Å; T290-F294 WeakPolarHBondContact OG1-CE2 3.44Å
291	G	98.6	Very high	98.8	Very high	68 Å²	68	47.3 Å²	47.3	70%	0.701	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	11.4	-168.5	0	0	0	0	0	113.4	A287	A287-G291 WeakPolarHBondContact O-CA 3.23Å; A287-G291 PolarHBondContact O-N 3.36Å
292	L	98.8	Very high	98.8	Very high	15 Å²	15	47.3 Å²	47.3	8%	0.079	29%	0.292	C	S	.	.	S	Bend	trans	-105.4	150	-179.8	-61	-178.2	0	0	0	110.6	A189 H193 Y259 A287 T290 F294	A189-L292 HydrophobicContact CB-CD1 4.25Å; H193-L292 HydrophobicContact CB-CD2 4.36Å; Y259-L292 HydrophobicContact CE1-CB 4.35Å; A287-L292 WeakPolarHBondContact CA-O 3.45Å; A287-L292 WeakPolarHBondContact CB-O 3.31Å; T290-L292 PolarHBondContact O-N 2.94Å; T290-L292 PolarHBondContact OG1-N 2.97Å; L292-F294 HydrophobicContact CB-CD2 3.87Å; L292-F294 HydrophobicContact CB-CE2 3.6Å; L292-F294 HydrophobicContact CB-CZ 4.39Å; L292-F294 HydrophobicContact CD1-CE2 3.99Å; L292-F294 HydrophobicContact CD1-CZ 4.25Å; L292-F294 HydrophobicContact CG-CE2 4.36Å; L292-F294 PolarHBondContact O-N 2.99Å
293	P	98.7	Very high	98.8	Very high	80 Å²	80	47.8 Å²	47.8	52%	0.519	30%	0.296	S	S	.	.			trans	-81.3	52.5	-169.2	35.3	-38.4	0	0	0	113	Y259	Y259-P293 WeakPolarHBondContact CB-O 3.21Å; Y259-P293 HydrophobicContact CD1-CG 4.23Å; Y259-P293 HydrophobicContact CD2-CG 3.8Å; Y259-P293 HydrophobicContact CE1-CG 4.13Å; Y259-P293 HydrophobicContact CE2-CG 3.7Å; Y259-P293 HydrophobicContact CG-CG 4.09Å
294	F	98.9	Very high	98.8	Very high	5 Å²	5	47.8 Å²	47.8	2%	0.022	30%	0.296	C	S	.	.			trans	-64.3	138	176	-68.8	-74.7	0	0	0	111.8	I186 A189 Y259 L261 V286 A287 T290 L292	I186-F294 HydrophobicContact CB-CZ 4.29Å; I186-F294 HydrophobicContact CG1-CE1 4.16Å; I186-F294 HydrophobicContact CG1-CZ 4.1Å; A189-F294 HydrophobicContact CB-CE1 3.94Å; A189-F294 HydrophobicContact CB-CZ 3.65Å; Y259-F294 HydrophobicContact CD1-CD1 4.11Å; Y259-F294 HydrophobicContact CD1-CE1 4.01Å; Y259-F294 HydrophobicContact CD1-CZ 4.42Å; Y259-F294 WeakPolarHBondContact O-CA 3.34Å; Y259-F294 WeakPolarHBondContact O-CD1 3.48Å; L261-F294 HydrophobicContact CD1-CB 3.92Å; L261-F294 HydrophobicContact CD1-CD1 4.1Å; L261-F294 HydrophobicContact CD1-CG 4.18Å; L261-F294 HydrophobicContact CD2-CD1 3.63Å; L261-F294 HydrophobicContact CD2-CE1 4.05Å; L261-F294 HydrophobicContact CG-CB 4.3Å; L261-F294 HydrophobicContact CG-CD1 3.95Å; L261-F294 HydrophobicContact CG-CG 4.46Å; V286-F294 HydrophobicContact CG1-CB 4.29Å; V286-F294 HydrophobicContact CG1-CD2 3.7Å; V286-F294 HydrophobicContact CG1-CE2 4.15Å; V286-F294 HydrophobicContact CG1-CG 4.01Å; A287-F294 HydrophobicContact CB-CB 4.12Å; T290-F294 HydrophobicContact CG2-CE2 4.11Å; T290-F294 WeakPolarHBondContact OG1-CD2 3.16Å; T290-F294 WeakPolarHBondContact OG1-CE2 3.44Å; L292-F294 HydrophobicContact CB-CD2 3.87Å; L292-F294 HydrophobicContact CB-CE2 3.6Å; L292-F294 HydrophobicContact CB-CZ 4.39Å; L292-F294 HydrophobicContact CD1-CE2 3.99Å; L292-F294 HydrophobicContact CD1-CZ 4.25Å; L292-F294 HydrophobicContact CG-CE2 4.36Å; L292-F294 PolarHBondContact O-N 2.99Å
295	I	98.9	Very high	98.8	Very high	91 Å²	91	46 Å²	46	47%	0.467	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	162	176.1	60.5	168.6	0	0	0	109.7	Y259 E260 L261	Y259-I295 PolarHBondContact O-N 2.9Å; E260-I295 WeakPolarHBondContact CA-O 3.26Å; E260-I295 HydrophobicContact CG-CD1 4.03Å; E260-I295 HydrophobicContact CG-CG1 3.97Å; L261-I295 PolarHBondContact N-O 3.34Å
296	T	98.9	Very high	98.8	Very high	29 Å²	29	45.8 Å²	45.8	18%	0.178	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	137	171.4	-157.5	0	0	0	0	109.4	A279 E280 K300	A279-T296 WeakPolarHBondContact CB-OG1 3.37Å; A279-T296 PolarHBondContact O-OG1 2.88Å; E280-T296 HydrophobicContact CG-CG2 4.15Å; T296-K300 WeakPolarHBondContact OG1-CE 3.22Å; T296-K300 PolarHBondContact OG1-NZ 3.49Å
297	A	98.9	Very high	98.8	Very high	2 Å²	2	46 Å²	46	2%	0.017	28%	0.283	C	S	.	.			trans	-62.4	132.6	-179.9	0	0	0	0	0	110.5	E260 L261 N299 K300 A303	E260-A297 HydrophobicContact CB-CB 3.94Å; L261-A297 WeakPolarHBondContact O-CB 3.46Å; L261-A297 PolarHBondContact O-N 2.71Å; A297-N299 PolarHBondContact O-N 3.06Å; A297-K300 HydrophobicContact CB-CD 4.34Å; A297-K300 PolarHBondContact O-NZ 3.34Å; A297-A303 HydrophobicContact CB-CB 3.81Å
298	P	98.8	Very high	98.8	Very high	111 Å²	111	49.4 Å²	49.4	72%	0.721	30%	0.298	S	S	*	.	S	Bend	trans	-65.8	-28	-177.6	27	-33	0	0	0	112.1	E260	E260-P298 WeakPolarHBondContact OE2-CD 3.41Å
299	N	98.9	Very high	98.8	Very high	79 Å²	79	45 Å²	45	42%	0.422	27%	0.268	S	S	.	.			trans	-124.8	111.5	174.1	-169.9	-45.8	0	0	0	110.4	A297 F301 E302 A303	A297-N299 PolarHBondContact O-N 3.06Å; N299-F301 WeakPolarHBondContact OD1-CA 3.44Å; N299-F301 WeakPolarHBondContact OD1-CB 3.35Å; N299-F301 WeakPolarHBondContact OD1-CD2 3.25Å; N299-F301 PolarHBondContact OD1-N 3.43Å; N299-E302 HydrophobicContact CB-CB 4.23Å; N299-E302 PolarHBondContact OD1-N 3.09Å; N299-E302 VanDerWaalsContact OD1-N 3.07Å; N299-A303 PolarHBondContact O-N 3.44Å
300	K	98.8	Very high	98.8	Very high	27 Å²	27	41.9 Å²	41.9	12%	0.117	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-19.6	-179.3	-66.8	-59.7	-172.1	-59.3	0	113.9	A262 A263 G269 T296 A297 L304	A262-K300 WeakPolarHBondContact O-CD 3.41Å; A262-K300 WeakPolarHBondContact O-CE 3.42Å; A263-K300 VanDerWaalsContact O-CE 3.29Å; A263-K300 WeakPolarHBondContact O-CE 3.5Å; G269-K300 VanDerWaalsContact O-CB 3.25Å; G269-K300 WeakPolarHBondContact O-CB 3.29Å; T296-K300 WeakPolarHBondContact OG1-CE 3.22Å; T296-K300 PolarHBondContact OG1-NZ 3.49Å; A297-K300 HydrophobicContact CB-CD 4.34Å; A297-K300 PolarHBondContact O-NZ 3.34Å; K300-L304 WeakPolarHBondContact O-CB 3.28Å; K300-L304 WeakPolarHBondContact O-CG 3.38Å; K300-L304 PolarHBondContact O-N 2.96Å
301	F	98.8	Very high	98.8	Very high	102 Å²	102	42.1 Å²	42.1	45%	0.447	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-47.9	174.5	-55	-80.1	0	0	0	109.6	V268 T270 N299 L304 A305	V268-F301 WeakPolarHBondContact O-CD1 3.17Å; V268-F301 WeakPolarHBondContact O-CE1 3.45Å; T270-F301 HydrophobicContact CG2-CE1 3.95Å; T270-F301 HydrophobicContact CG2-CZ 4.02Å; N299-F301 WeakPolarHBondContact OD1-CA 3.44Å; N299-F301 WeakPolarHBondContact OD1-CB 3.35Å; N299-F301 WeakPolarHBondContact OD1-CD2 3.25Å; N299-F301 PolarHBondContact OD1-N 3.43Å; F301-L304 PolarHBondContact O-N 3.29Å; F301-A305 WeakPolarHBondContact O-CB 3.46Å; F301-A305 PolarHBondContact O-N 3.28Å
302	E	98.9	Very high	98.9	Very high	80 Å²	80	43 Å²	43	37%	0.374	24%	0.239	S	C	.	.	H	α-helix	trans	-57.9	-51.8	174.7	-176.1	-77.9	150.9	0	0	111.1	N299 L304 A305 A306	N299-E302 HydrophobicContact CB-CB 4.23Å; N299-E302 PolarHBondContact OD1-N 3.09Å; N299-E302 VanDerWaalsContact OD1-N 3.07Å; E302-L304 PolarHBondContact O-N 3.28Å; E302-A305 PolarHBondContact O-N 2.87Å; E302-A306 PolarHBondContact O-N 3.42Å
303	A	98.8	Very high	98.9	Very high	12 Å²	12	42.3 Å²	42.3	10%	0.099	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-15	-177.7	0	0	0	0	0	115.2	A262 A297 N299	A262-A303 HydrophobicContact CB-CB 4.04Å; A297-A303 HydrophobicContact CB-CB 3.81Å; N299-A303 PolarHBondContact O-N 3.44Å
304	L	98.8	Very high	98.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-102.9	-43.1	176	-67.5	179.8	0	0	0	112.3	N177 D178 P181 A262 G269 K300 F301 E302 L394 N395 K398	N177-L304 WeakPolarHBondContact O-CD2 3.33Å; D178-L304 HydrophobicContact CB-CD2 4.04Å; P181-L304 HydrophobicContact CG-CD2 4.06Å; A262-L304 HydrophobicContact CB-CD2 4.02Å; G269-L304 VanDerWaalsContact N-CD1 3.3Å; K300-L304 WeakPolarHBondContact O-CB 3.28Å; K300-L304 WeakPolarHBondContact O-CG 3.38Å; K300-L304 PolarHBondContact O-N 2.96Å; F301-L304 PolarHBondContact O-N 3.29Å; E302-L304 PolarHBondContact O-N 3.28Å; L304-L394 HydrophobicContact CB-CD1 4.15Å; L304-L394 WeakPolarHBondContact O-CA 3.3Å; L304-N395 PolarHBondContact O-N 2.92Å; L304-K398 PolarHBondContact O-NZ 3.5Å
305	A	98.8	Very high	98.9	Very high	24 Å²	24	39.2 Å²	39.2	20%	0.198	22%	0.219	C	C	.	.	H	α-helix	trans	-78.5	-23.1	-174.8	0	0	0	0	0	113.4	F301 E302 F392 N395	F301-A305 WeakPolarHBondContact O-CB 3.46Å; F301-A305 PolarHBondContact O-N 3.28Å; E302-A305 PolarHBondContact O-N 2.87Å; A305-F392 VanDerWaalsContact CB-O 3.23Å; A305-F392 WeakPolarHBondContact CB-O 3.16Å; A305-N395 VanDerWaalsContact O-CB 3.3Å; A305-N395 WeakPolarHBondContact O-CB 3.46Å; A305-N395 PolarHBondContact O-N 3.44Å
306	A	98.8	Very high	98.9	Very high	19 Å²	19	35.4 Å²	35.4	16%	0.157	20%	0.201	C	C	.	.			trans	-135.4	168.8	179.2	0	0	0	0	0	111.2	E302	E302-A306 PolarHBondContact O-N 3.42Å
307	H	98.9	Very high	98.9	Very high	4 Å²	4	34 Å²	34	2%	0.019	19%	0.193	C	C	.	.			trans	-139.3	46.3	173.7	-71.9	-55.1	0	0	0	109.8	M184 A309 L310 V311 K398 M401	M184-H307 WeakPolarHBondContact CE-CE1 3.23Å; M184-H307 WeakPolarHBondContact CE-ND1 3.46Å; H307-A309 VanDerWaalsContact C-N 3.25Å; H307-A309 PolarHBondContact O-N 3.34Å; H307-L310 HydrophobicContact CB-CB 4.41Å; H307-L310 HydrophobicContact CB-CD1 4.31Å; H307-L310 HydrophobicContact CB-CG 4.43Å; H307-L310 WeakPolarHBondContact O-CB 3.23Å; H307-L310 PolarHBondContact O-N 3.13Å; H307-V311 PolarHBondContact O-N 2.95Å; H307-K398 WeakPolarHBondContact NE2-CD 3.34Å; H307-K398 VanDerWaalsContact NE2-CG 3.34Å; H307-K398 WeakPolarHBondContact NE2-CG 3.39Å; H307-K398 PolarHBondContact NE2-NZ 3.45Å; H307-M401 HydrophobicContact CB-CE 3.53Å; H307-M401 HydrophobicContact CB-SD 3.78Å
308	D	98.9	Very high	98.9	Very high	92 Å²	92	35.8 Å²	35.8	49%	0.492	20%	0.202	S	C	.	.	H	α-helix	trans	-65.7	-31.8	-172	-68	-5.1	0	0	0	111.5	L310 V311 E312	D308-L310 PolarHBondContact O-N 2.96Å; D308-V311 PolarHBondContact O-N 3.3Å; D308-V311 VanDerWaalsContact O-N 3.08Å; D308-E312 WeakPolarHBondContact O-CB 3.29Å; D308-E312 PolarHBondContact O-N 2.95Å
309	A	98.9	Very high	98.9	Very high	9 Å²	9	32.9 Å²	32.9	7%	0.074	18%	0.182	C	C	.	.	H	α-helix	trans	-55.9	-38.5	171.1	0	0	0	0	0	112.7	R257 V258 H307 L313	R257-A309 HydrophobicContact CB-CB 3.71Å; V258-A309 HydrophobicContact CG2-CB 4.31Å; H307-A309 VanDerWaalsContact C-N 3.25Å; H307-A309 PolarHBondContact O-N 3.34Å; A309-L313 WeakPolarHBondContact O-CB 3.44Å; A309-L313 PolarHBondContact O-N 2.83Å
310	L	98.9	Very high	98.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-74.6	-33.6	177	-63	-172.3	0	0	0	111.9	M184 V188 H307 D308 S314 M401 V405	M184-L310 HydrophobicContact CE-CD1 4.04Å; M184-L310 HydrophobicContact SD-CD1 4.23Å; V188-L310 HydrophobicContact CB-CD2 4.43Å; V188-L310 HydrophobicContact CG1-CD2 4.25Å; V188-L310 HydrophobicContact CG2-CD2 4.07Å; H307-L310 HydrophobicContact CB-CB 4.41Å; H307-L310 HydrophobicContact CB-CD1 4.31Å; H307-L310 HydrophobicContact CB-CG 4.43Å; H307-L310 WeakPolarHBondContact O-CB 3.23Å; H307-L310 PolarHBondContact O-N 3.13Å; D308-L310 PolarHBondContact O-N 2.96Å; L310-S314 WeakPolarHBondContact O-CB 3.19Å; L310-S314 PolarHBondContact O-N 3.03Å; L310-M401 HydrophobicContact CB-CE 4.32Å; L310-M401 HydrophobicContact CD1-CB 4.34Å; L310-V405 HydrophobicContact CB-CG2 4.29Å
311	V	98.9	Very high	98.9	Very high	35 Å²	35	27.8 Å²	27.8	21%	0.212	16%	0.157	C	C	.	.	H	α-helix	trans	-67.2	-46.1	173.7	-178.5	0	0	0	0	110.6	H307 D308 S314 G315 V383 M401	H307-V311 PolarHBondContact O-N 2.95Å; D308-V311 PolarHBondContact O-N 3.3Å; D308-V311 VanDerWaalsContact O-N 3.08Å; V311-S314 WeakPolarHBondContact O-CB 3.39Å; V311-S314 PolarHBondContact O-N 3.39Å; V311-G315 PolarHBondContact O-N 3.17Å; V311-V383 HydrophobicContact CG2-CG1 4.12Å; V311-M401 HydrophobicContact CG2-CE 3.74Å
312	E	98.9	Very high	98.9	Very high	87 Å²	87	26.7 Å²	26.7	41%	0.407	16%	0.158	S	C	.	.	H	α-helix	trans	-59.3	-51.4	177.1	-176	-173.6	-174.4	0	0	110.9	A254 R257 D308 S314 G315 A316	A254-E312 HydrophobicContact CB-CG 4.11Å; R257-E312 VanDerWaalsContact CD-OE2 3.31Å; R257-E312 WeakPolarHBondContact CD-OE2 3.31Å; R257-E312 IonicContact NE-OE2 2.72Å; R257-E312 PolarHBondContact NE-OE2 3.29Å; D308-E312 WeakPolarHBondContact O-CB 3.29Å; D308-E312 PolarHBondContact O-N 2.95Å; E312-S314 VanDerWaalsContact C-N 3.31Å; E312-S314 PolarHBondContact O-N 2.98Å; E312-G315 WeakPolarHBondContact O-CA 3.16Å; E312-G315 PolarHBondContact O-N 3.18Å; E312-G315 VanDerWaalsContact O-N 3.07Å; E312-A316 PolarHBondContact O-N 3.38Å
313	L	98.9	Very high	98.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.3	-44.4	176.2	177.8	64	0	0	0	111	V188 V192 V251 A254 M255 V258 A309 G315 A316 L317 V405	V188-L313 HydrophobicContact CG1-CD2 3.18Å; V192-L313 HydrophobicContact CG2-CD1 4.43Å; V192-L313 HydrophobicContact CG2-CD2 4.07Å; V251-L313 HydrophobicContact CG1-CD1 4.28Å; A254-L313 HydrophobicContact CB-CB 4.31Å; A254-L313 HydrophobicContact CB-CD1 4.14Å; M255-L313 HydrophobicContact SD-CD1 4.19Å; M255-L313 HydrophobicContact SD-CD2 4.49Å; V258-L313 HydrophobicContact CG2-CB 4.43Å; V258-L313 HydrophobicContact CG2-CD2 4.26Å; A309-L313 WeakPolarHBondContact O-CB 3.44Å; A309-L313 PolarHBondContact O-N 2.83Å; L313-G315 VanDerWaalsContact C-N 3.25Å; L313-G315 PolarHBondContact O-N 3.4Å; L313-A316 WeakPolarHBondContact O-CB 3.09Å; L313-A316 PolarHBondContact O-N 3.24Å; L313-A316 VanDerWaalsContact O-N 3.09Å; L313-L317 WeakPolarHBondContact O-CG 3.39Å; L313-L317 PolarHBondContact O-N 3.26Å; L313-V405 HydrophobicContact CD2-CG1 3.92Å
314	S	98.9	Very high	98.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.9	-36.8	175.9	-174.3	0	0	0	0	112.3	L310 V311 E312 L317 N318 H380	L310-S314 WeakPolarHBondContact O-CB 3.19Å; L310-S314 PolarHBondContact O-N 3.03Å; V311-S314 WeakPolarHBondContact O-CB 3.39Å; V311-S314 PolarHBondContact O-N 3.39Å; E312-S314 VanDerWaalsContact C-N 3.31Å; E312-S314 PolarHBondContact O-N 2.98Å; S314-L317 PolarHBondContact O-N 2.85Å; S314-N318 WeakPolarHBondContact O-CB 3.19Å; S314-N318 PolarHBondContact O-N 3.24Å; S314-H380 WeakPolarHBondContact OG-CA 3.37Å; S314-H380 PolarHBondContact OG-ND1 2.93Å
315	G	98.9	Very high	98.9	Very high	20 Å²	20	25.5 Å²	25.5	21%	0.206	15%	0.152	C	C	.	.	H	α-helix	trans	-65.7	-38.4	173.2	0	0	0	0	0	113.3	V311 E312 L313 N318 T319	V311-G315 PolarHBondContact O-N 3.17Å; E312-G315 WeakPolarHBondContact O-CA 3.16Å; E312-G315 PolarHBondContact O-N 3.18Å; E312-G315 VanDerWaalsContact O-N 3.07Å; L313-G315 VanDerWaalsContact C-N 3.25Å; L313-G315 PolarHBondContact O-N 3.4Å; G315-N318 WeakPolarHBondContact O-CB 3.43Å; G315-N318 PolarHBondContact O-N 3.26Å; G315-T319 PolarHBondContact O-N 3.01Å; G315-T319 PolarHBondContact O-OG1 3.39Å; G315-T319 VanDerWaalsContact O-OG1 3.07Å
316	A	98.9	Very high	98.9	Very high	11 Å²	11	28.3 Å²	28.3	9%	0.091	16%	0.16	C	C	.	.	H	α-helix	trans	-62.5	-46.4	171.1	0	0	0	0	0	111	R250 V251 A254 E312 L313 N318 T319 V320	R250-A316 HydrophobicContact CB-CB 4.41Å; V251-A316 HydrophobicContact CG2-CB 4.47Å; A254-A316 HydrophobicContact CB-CB 4.27Å; E312-A316 PolarHBondContact O-N 3.38Å; L313-A316 WeakPolarHBondContact O-CB 3.09Å; L313-A316 PolarHBondContact O-N 3.24Å; L313-A316 VanDerWaalsContact O-N 3.09Å; A316-N318 VanDerWaalsContact C-N 3.31Å; A316-N318 PolarHBondContact O-N 3.44Å; A316-T319 WeakPolarHBondContact O-CB 3.5Å; A316-T319 PolarHBondContact O-N 3.38Å; A316-T319 VanDerWaalsContact O-N 3.09Å; A316-V320 VanDerWaalsContact O-CG2 3.32Å; A316-V320 WeakPolarHBondContact O-CG2 3.34Å; A316-V320 PolarHBondContact O-N 2.88Å
317	L	98.9	Very high	98.9	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.3	-38.8	175.2	-60.5	-179.6	0	0	0	112.4	L196 V251 L313 S314 T319 V320 A321 V376 V405 A409 L412	L196-L317 HydrophobicContact CD2-CD2 3.26Å; V251-L317 HydrophobicContact CG2-CD2 4.18Å; L313-L317 WeakPolarHBondContact O-CG 3.39Å; L313-L317 PolarHBondContact O-N 3.26Å; S314-L317 PolarHBondContact O-N 2.85Å; L317-T319 VanDerWaalsContact C-N 3.31Å; L317-T319 PolarHBondContact O-N 2.84Å; L317-V320 WeakPolarHBondContact O-CB 3.3Å; L317-V320 PolarHBondContact O-N 3.32Å; L317-A321 PolarHBondContact O-N 3.08Å; L317-V376 HydrophobicContact CB-CG1 4.28Å; L317-V405 HydrophobicContact CD1-CG1 4.46Å; L317-A409 HydrophobicContact CD1-CB 4.32Å; L317-L412 HydrophobicContact CB-CD1 4.15Å; L317-L412 HydrophobicContact CD2-CD1 4.14Å
318	N	99	Very high	98.9	Very high	39 Å²	39	27.3 Å²	27.3	21%	0.209	15%	0.152	C	C	.	.	H	α-helix	trans	-60.5	-41.5	173.8	179.1	66.6	0	0	0	111.4	S314 G315 A316 V320 A321 V322 M377 H380	S314-N318 WeakPolarHBondContact O-CB 3.19Å; S314-N318 PolarHBondContact O-N 3.24Å; G315-N318 WeakPolarHBondContact O-CB 3.43Å; G315-N318 PolarHBondContact O-N 3.26Å; A316-N318 VanDerWaalsContact C-N 3.31Å; A316-N318 PolarHBondContact O-N 3.44Å; N318-V320 VanDerWaalsContact C-N 3.34Å; N318-V320 PolarHBondContact O-N 2.8Å; N318-A321 WeakPolarHBondContact O-CB 3.19Å; N318-A321 PolarHBondContact O-N 2.82Å; N318-V322 WeakPolarHBondContact O-CG2 3.44Å; N318-V322 PolarHBondContact O-N 3.11Å; N318-M377 WeakPolarHBondContact OD1-CG 3.33Å; N318-H380 HydrophobicContact CB-CB 4.09Å
319	T	98.9	Very high	98.9	Very high	50 Å²	50	25.8 Å²	25.8	31%	0.307	14%	0.144	S	C	.	.	H	α-helix	trans	-66.3	-36.5	175.4	-54.5	0	0	0	0	112.2	G315 A316 L317 V322 S323	G315-T319 PolarHBondContact O-N 3.01Å; G315-T319 PolarHBondContact O-OG1 3.39Å; G315-T319 VanDerWaalsContact O-OG1 3.07Å; A316-T319 WeakPolarHBondContact O-CB 3.5Å; A316-T319 PolarHBondContact O-N 3.38Å; A316-T319 VanDerWaalsContact O-N 3.09Å; L317-T319 VanDerWaalsContact C-N 3.31Å; L317-T319 PolarHBondContact O-N 2.84Å; T319-V322 PolarHBondContact O-N 3.33Å; T319-S323 PolarHBondContact O-N 3.24Å; T319-S323 VanDerWaalsContact O-N 3.13Å; T319-S323 PolarHBondContact O-OG 3.48Å; T319-S323 VanDerWaalsContact O-OG 3.07Å
320	V	98.9	Very high	98.9	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.7	-47.7	171.4	-178.5	0	0	0	0	110	L200 V251 A316 L317 N318 V322 S323 M324 L412	L200-V320 HydrophobicContact CD1-CG1 4.22Å; L200-V320 HydrophobicContact CD2-CG1 3.81Å; V251-V320 HydrophobicContact CG2-CG2 3.84Å; A316-V320 VanDerWaalsContact O-CG2 3.32Å; A316-V320 WeakPolarHBondContact O-CG2 3.34Å; A316-V320 PolarHBondContact O-N 2.88Å; L317-V320 WeakPolarHBondContact O-CB 3.3Å; L317-V320 PolarHBondContact O-N 3.32Å; N318-V320 VanDerWaalsContact C-N 3.34Å; N318-V320 PolarHBondContact O-N 2.8Å; V320-V322 PolarHBondContact O-N 3.02Å; V320-S323 WeakPolarHBondContact O-CB 3.47Å; V320-S323 PolarHBondContact O-N 3.47Å; V320-S323 VanDerWaalsContact O-N 3.08Å; V320-M324 HydrophobicContact CG1-CG 4.11Å; V320-M324 WeakPolarHBondContact O-CG 3.23Å; V320-M324 PolarHBondContact O-N 3.02Å; V320-L412 HydrophobicContact CB-CD1 4.27Å; V320-L412 HydrophobicContact CG1-CD1 4.22Å; V320-L412 HydrophobicContact CG1-CD2 4.28Å
321	A	98.9	Very high	98.9	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.4	-41.8	178.4	0	0	0	0	0	113	L317 N318 S323 M324 M325 A373 V376 M377	L317-A321 PolarHBondContact O-N 3.08Å; N318-A321 WeakPolarHBondContact O-CB 3.19Å; N318-A321 PolarHBondContact O-N 2.82Å; A321-S323 VanDerWaalsContact C-N 3.3Å; A321-S323 PolarHBondContact O-N 3.27Å; A321-M324 PolarHBondContact O-N 3.2Å; A321-M325 VanDerWaalsContact O-CB 3.31Å; A321-M325 WeakPolarHBondContact O-CB 3.45Å; A321-M325 PolarHBondContact O-N 3.32Å; A321-A373 HydrophobicContact CB-CB 4.06Å; A321-A373 WeakPolarHBondContact O-CB 3.28Å; A321-V376 HydrophobicContact CB-CB 3.81Å; A321-V376 HydrophobicContact CB-CG1 3.7Å; A321-M377 HydrophobicContact CB-CE 4.27Å; A321-M377 HydrophobicContact CB-CG 4.5Å
322	V	98.9	Very high	98.9	Very high	78 Å²	78	28.2 Å²	28.2	47%	0.473	15%	0.151	S	C	.	.	H	α-helix	trans	-58.5	-43.8	173.5	172.9	0	0	0	0	111.1	N318 T319 V320 K326 M377	N318-V322 WeakPolarHBondContact O-CG2 3.44Å; N318-V322 PolarHBondContact O-N 3.11Å; T319-V322 PolarHBondContact O-N 3.33Å; V320-V322 PolarHBondContact O-N 3.02Å; V322-K326 PolarHBondContact O-N 3.46Å; V322-M377 HydrophobicContact CB-CE 4.44Å; V322-M377 HydrophobicContact CG2-CE 3.79Å
323	S	98.9	Very high	98.9	Very high	8 Å²	8	29.6 Å²	29.6	6%	0.056	16%	0.156	C	C	.	.	H	α-helix	trans	-65.2	-47.9	178.2	-58.6	0	0	0	0	111.4	T319 V320 A321 M325 K326 V327	T319-S323 PolarHBondContact O-N 3.24Å; T319-S323 VanDerWaalsContact O-N 3.13Å; T319-S323 PolarHBondContact O-OG 3.48Å; T319-S323 VanDerWaalsContact O-OG 3.07Å; V320-S323 WeakPolarHBondContact O-CB 3.47Å; V320-S323 PolarHBondContact O-N 3.47Å; V320-S323 VanDerWaalsContact O-N 3.08Å; A321-S323 VanDerWaalsContact C-N 3.3Å; A321-S323 PolarHBondContact O-N 3.27Å; S323-M325 VanDerWaalsContact C-N 3.33Å; S323-M325 PolarHBondContact O-N 2.95Å; S323-K326 PolarHBondContact O-N 3.45Å; S323-V327 WeakPolarHBondContact O-CG2 3.37Å; S323-V327 PolarHBondContact O-N 3.42Å
324	M	98.8	Very high	98.9	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-64.2	-37.3	180	-66	-50.6	96.9	0	0	112.4	L203 V244 V320 A321 K326 V327 A328 M369 L412	L203-M324 HydrophobicContact CD2-CE 4.49Å; L203-M324 HydrophobicContact CD2-SD 3.51Å; L203-M324 VanDerWaalsContact CD2-SD 3.51Å; V244-M324 HydrophobicContact CG2-CE 3.74Å; V320-M324 HydrophobicContact CG1-CG 4.11Å; V320-M324 WeakPolarHBondContact O-CG 3.23Å; V320-M324 PolarHBondContact O-N 3.02Å; A321-M324 PolarHBondContact O-N 3.2Å; M324-K326 VanDerWaalsContact C-N 3.34Å; M324-K326 PolarHBondContact O-N 3.18Å; M324-V327 PolarHBondContact O-N 3.45Å; M324-A328 VanDerWaalsContact O-CB 3.27Å; M324-A328 WeakPolarHBondContact O-CB 3.3Å; M324-A328 PolarHBondContact O-N 3.47Å; M324-M369 HydrophobicContact CB-CG 4.16Å; M324-M369 HydrophobicContact CB-SD 3.74Å; M324-M369 HydrophobicContact CG-SD 4.04Å; M324-L412 HydrophobicContact CG-CD2 4.45Å
325	M	98.9	Very high	98.9	Very high	57 Å²	57	30.8 Å²	30.8	28%	0.281	17%	0.166	S	C	.	.	H	α-helix	trans	-56.6	-49.1	174.2	-178.7	67.4	79.4	0	0	110.8	A321 S323 N329 T370 A373 A374	A321-M325 VanDerWaalsContact O-CB 3.31Å; A321-M325 WeakPolarHBondContact O-CB 3.45Å; A321-M325 PolarHBondContact O-N 3.32Å; S323-M325 VanDerWaalsContact C-N 3.33Å; S323-M325 PolarHBondContact O-N 2.95Å; M325-N329 WeakPolarHBondContact O-CB 3.41Å; M325-N329 PolarHBondContact O-N 3.2Å; M325-T370 WeakPolarHBondContact CE-O 3.12Å; M325-T370 HydrophobicContact SD-CG2 3.46Å; M325-T370 WeakPolarHBondContact SD-CG2 3.38Å; M325-A373 HydrophobicContact CB-CB 4.06Å; M325-A373 HydrophobicContact CE-CB 3.79Å; M325-A374 HydrophobicContact CE-CB 4.45Å
326	K	98.9	Very high	98.9	Very high	84 Å²	84	31.6 Å²	31.6	37%	0.365	17%	0.169	S	C	.	.	H	α-helix	trans	-62.5	-51.9	179	-174.1	-82.7	-166.9	177.2	0	111.3	Y240 V322 S323 M324 A328 N329 D330	Y240-K326 HydrophobicContact CE1-CD 4.33Å; Y240-K326 VanDerWaalsContact CE1-NZ 3.27Å; V322-K326 PolarHBondContact O-N 3.46Å; S323-K326 PolarHBondContact O-N 3.45Å; M324-K326 VanDerWaalsContact C-N 3.34Å; M324-K326 PolarHBondContact O-N 3.18Å; K326-A328 PolarHBondContact O-N 3.34Å; K326-N329 PolarHBondContact O-N 3.22Å; K326-D330 VanDerWaalsContact CD-OD2 3.29Å; K326-D330 WeakPolarHBondContact CD-OD2 3.39Å; K326-D330 WeakPolarHBondContact CE-OD2 3.49Å; K326-D330 IonicContact NZ-OD2 3.7Å; K326-D330 PolarHBondContact NZ-OD2 3.42Å; K326-D330 PolarHBondContact O-N 2.97Å
327	V	98.9	Very high	98.8	Very high	2 Å²	2	33 Å²	33	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-58.6	-49.6	-178.5	176.3	0	0	0	0	111.4	L207 Y240 S323 M324 N329 D330 I331	L207-V327 HydrophobicContact CD1-CG1 4.39Å; Y240-V327 HydrophobicContact CD1-CB 4.32Å; Y240-V327 HydrophobicContact CD1-CG1 4.25Å; Y240-V327 HydrophobicContact CD1-CG2 3.72Å; Y240-V327 HydrophobicContact CD2-CG1 4.3Å; Y240-V327 HydrophobicContact CG-CB 4.49Å; Y240-V327 HydrophobicContact CG-CG1 3.96Å; Y240-V327 HydrophobicContact CG-CG2 3.99Å; S323-V327 WeakPolarHBondContact O-CG2 3.37Å; S323-V327 PolarHBondContact O-N 3.42Å; M324-V327 PolarHBondContact O-N 3.45Å; V327-N329 VanDerWaalsContact C-N 3.33Å; V327-N329 PolarHBondContact O-N 2.92Å; V327-D330 PolarHBondContact O-N 3.25Å; V327-I331 HydrophobicContact CG1-CD1 3.97Å; V327-I331 WeakPolarHBondContact O-CG1 3.27Å; V327-I331 PolarHBondContact O-N 2.65Å; V327-I331 VanDerWaalsContact O-N 3.1Å
328	A	98.9	Very high	98.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66.8	-34.2	-179.6	0	0	0	0	0	112.4	M324 K326 R332 C366 M369 T370 F419	M324-A328 VanDerWaalsContact O-CB 3.27Å; M324-A328 WeakPolarHBondContact O-CB 3.3Å; M324-A328 PolarHBondContact O-N 3.47Å; K326-A328 PolarHBondContact O-N 3.34Å; A328-R332 VanDerWaalsContact O-CB 3.27Å; A328-R332 WeakPolarHBondContact O-CB 2.99Å; A328-R332 PolarHBondContact O-N 3.13Å; A328-C366 HydrophobicContact CB-CB 4.41Å; A328-M369 HydrophobicContact CB-CB 4.03Å; A328-M369 HydrophobicContact CB-CG 3.79Å; A328-T370 HydrophobicContact CB-CG2 3.92Å; A328-F419 HydrophobicContact CB-CE2 4.47Å; A328-F419 HydrophobicContact CB-CZ 4.31Å
329	N	98.9	Very high	98.5	Very high	59 Å²	59	45 Å²	45	32%	0.316	24%	0.236	S	C	.	.	H	α-helix	trans	-72.6	-39.6	177.3	-164.9	68.4	0	0	0	112.5	M325 K326 V327 R332 F333	M325-N329 WeakPolarHBondContact O-CB 3.41Å; M325-N329 PolarHBondContact O-N 3.2Å; K326-N329 PolarHBondContact O-N 3.22Å; V327-N329 VanDerWaalsContact C-N 3.33Å; V327-N329 PolarHBondContact O-N 2.92Å; N329-R332 WeakPolarHBondContact O-CB 3.48Å; N329-R332 PolarHBondContact O-N 2.99Å; N329-F333 WeakPolarHBondContact O-CD2 3.36Å; N329-F333 PolarHBondContact O-N 3.48Å
330	D	98.9	Very high	98.5	Very high	46 Å²	46	48.9 Å²	48.9	25%	0.246	27%	0.265	C	S	.	.	H	α-helix	trans	-60	-50.7	174.1	-75.5	-3.4	0	0	0	110.1	Y240 K326 V327 R332 F333 L334	Y240-D330 HydrophobicContact CE1-CB 4.08Å; Y240-D330 WeakPolarHBondContact CE1-OD2 3.04Å; Y240-D330 VanDerWaalsContact OH-CB 3.25Å; Y240-D330 WeakPolarHBondContact OH-CB 3.46Å; Y240-D330 PolarHBondContact OH-OD2 3.01Å; K326-D330 VanDerWaalsContact CD-OD2 3.29Å; K326-D330 WeakPolarHBondContact CD-OD2 3.39Å; K326-D330 WeakPolarHBondContact CE-OD2 3.49Å; K326-D330 IonicContact NZ-OD2 3.7Å; K326-D330 PolarHBondContact NZ-OD2 3.42Å; K326-D330 PolarHBondContact O-N 2.97Å; V327-D330 PolarHBondContact O-N 3.25Å; D330-R332 VanDerWaalsContact C-N 3.29Å; D330-R332 PolarHBondContact O-N 2.78Å; D330-F333 PolarHBondContact O-N 2.98Å; D330-F333 VanDerWaalsContact O-N 3.16Å; D330-L334 WeakPolarHBondContact O-CB 3.41Å; D330-L334 WeakPolarHBondContact O-CG 3.28Å; D330-L334 PolarHBondContact O-N 2.88Å
331	I	98.9	Very high	98.5	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.6	-41.3	178.2	-70.3	169.1	0	0	0	111.5	L207 F237 V327 L334 G335 L347 F419 I427	L207-I331 HydrophobicContact CD2-CD1 4.49Å; F237-I331 HydrophobicContact CZ-CG1 4.49Å; V327-I331 HydrophobicContact CG1-CD1 3.97Å; V327-I331 WeakPolarHBondContact O-CG1 3.27Å; V327-I331 PolarHBondContact O-N 2.65Å; V327-I331 VanDerWaalsContact O-N 3.1Å; I331-L334 PolarHBondContact O-N 3.48Å; I331-G335 PolarHBondContact O-N 2.89Å; I331-L347 HydrophobicContact CG2-CD1 4.44Å; I331-L347 HydrophobicContact CG2-CD2 3.78Å; I331-F419 HydrophobicContact CD1-CE1 4.07Å; I331-F419 HydrophobicContact CD1-CZ 3.76Å; I331-F419 HydrophobicContact CG2-CZ 4.49Å; I331-I427 HydrophobicContact CD1-CD1 4.14Å; I331-I427 HydrophobicContact CG1-CD1 4.46Å; I331-I427 HydrophobicContact CG2-CD1 3.96Å
332	R	98.8	Very high	98.4	Very high	49 Å²	49	52.1 Å²	52.1	19%	0.185	29%	0.288	C	S	.	.	H	α-helix	trans	-58.5	-48.3	175.5	-171.8	-163.3	-49.4	-111.4	-7.4	112.5	A328 N329 D330 G335 S336 P363 C366 T370	A328-R332 VanDerWaalsContact O-CB 3.27Å; A328-R332 WeakPolarHBondContact O-CB 2.99Å; A328-R332 PolarHBondContact O-N 3.13Å; N329-R332 WeakPolarHBondContact O-CB 3.48Å; N329-R332 PolarHBondContact O-N 2.99Å; D330-R332 VanDerWaalsContact C-N 3.29Å; D330-R332 PolarHBondContact O-N 2.78Å; R332-G335 PolarHBondContact O-N 3.48Å; R332-S336 PolarHBondContact O-N 2.91Å; R332-P363 HydrophobicContact CB-CB 4.45Å; R332-P363 HydrophobicContact CB-CG 4.45Å; R332-P363 HydrophobicContact CG-CB 3.92Å; R332-P363 HydrophobicContact CG-CG 3.44Å; R332-P363 VanDerWaalsContact CG-CG 3.44Å; R332-C366 HydrophobicContact CB-CB 3.97Å; R332-C366 HydrophobicContact CG-CB 4.34Å; R332-C366 PolarHBondContact NH2-O 3.26Å; R332-T370 PolarHBondContact NH2-OG1 2.64Å
333	F	98.9	Very high	98.4	Very high	117 Å²	117	48.7 Å²	48.7	51%	0.513	27%	0.268	S	S	.	.	H	α-helix	trans	-71.1	-40.7	-179.1	-91.9	-94.6	0	0	0	111.7	N329 D330 G335 S336 L342	N329-F333 WeakPolarHBondContact O-CD2 3.36Å; N329-F333 PolarHBondContact O-N 3.48Å; D330-F333 PolarHBondContact O-N 2.98Å; D330-F333 VanDerWaalsContact O-N 3.16Å; F333-G335 PolarHBondContact O-N 3.31Å; F333-S336 VanDerWaalsContact O-CB 3.26Å; F333-S336 WeakPolarHBondContact O-CB 3.5Å; F333-S336 PolarHBondContact O-N 3.29Å; F333-S336 PolarHBondContact O-OG 3.32Å; F333-L342 HydrophobicContact CB-CD1 4.28Å; F333-L342 WeakPolarHBondContact O-CB 3.36Å
334	L	98.8	Very high	98.4	Very high	6 Å²	6	48.5 Å²	48.5	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-62.2	-32.8	175.6	-67.8	170	0	0	0	111.9	E236 D330 I331 L342 G343 E344 L345	E236-L334 WeakPolarHBondContact OE2-CD1 3.41Å; D330-L334 WeakPolarHBondContact O-CB 3.41Å; D330-L334 WeakPolarHBondContact O-CG 3.28Å; D330-L334 PolarHBondContact O-N 2.88Å; I331-L334 PolarHBondContact O-N 3.48Å; L334-L342 HydrophobicContact CD2-CD1 4.26Å; L334-G343 CarbonylContact O-C 3.43Å; L334-G343 PolarHBondContact O-N 3.19Å; L334-E344 HydrophobicContact CD2-CB 4.21Å; L334-E344 HydrophobicContact CD2-CG 4.42Å; L334-E344 VanDerWaalsContact CD2-OE2 3.26Å; L334-E344 WeakPolarHBondContact CD2-OE2 3.45Å; L334-E344 PolarHBondContact O-N 3.38Å; L334-L345 HydrophobicContact CB-CB 4.39Å; L334-L345 HydrophobicContact CB-CD1 3.7Å; L334-L345 HydrophobicContact CB-CG 3.83Å; L334-L345 HydrophobicContact CD1-CD1 4.04Å; L334-L345 PolarHBondContact O-N 3.42Å
335	G	98.6	Very high	98.4	Very high	19 Å²	19	48.7 Å²	48.7	20%	0.196	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-1.4	172.7	0	0	0	0	0	115.8	I331 R332 F333 G337 L345	I331-G335 PolarHBondContact O-N 2.89Å; R332-G335 PolarHBondContact O-N 3.48Å; F333-G335 PolarHBondContact O-N 3.31Å; G335-G337 PolarHBondContact O-N 3.39Å; G335-L345 WeakPolarHBondContact CA-O 3.47Å
336	S	98.6	Very high	98.4	Very high	37 Å²	37	49.6 Å²	49.6	26%	0.259	27%	0.273	S	S	.	.			trans	-67.9	131.4	-177.6	65	0	0	0	0	112	R332 F333 G341 L342 G343	R332-S336 PolarHBondContact O-N 2.91Å; F333-S336 VanDerWaalsContact O-CB 3.26Å; F333-S336 WeakPolarHBondContact O-CB 3.5Å; F333-S336 PolarHBondContact O-N 3.29Å; F333-S336 PolarHBondContact O-OG 3.32Å; S336-G341 CarbonylContact O-C 3.57Å; S336-G341 WeakPolarHBondContact O-CA 3.45Å; S336-G341 WeakPolarHBondContact OG-CA 3.18Å; S336-L342 PolarHBondContact O-N 3.47Å; S336-L342 PolarHBondContact OG-N 3.21Å; S336-G343 WeakPolarHBondContact O-CA 3.24Å; S336-G343 PolarHBondContact O-N 2.96Å
337	G	97.4	Very high	98.4	Very high	41 Å²	41	46.3 Å²	46.3	42%	0.423	26%	0.259	S	S	.	.			trans	172.9	-161.1	-172.6	0	0	0	0	0	113.7	G335	G335-G337 PolarHBondContact O-N 3.39Å
338	P	95.4	Very high	98.3	Very high	68 Å²	68	47.8 Å²	47.8	44%	0.442	27%	0.269	S	S	.	.	S	Bend	cis	-83.2	-17.9	12.8	29.7	-34.8	0	0	0	114.9
339	R	97.1	Very high	97.9	Very high	222 Å²	222	53.4 Å²	53.4	84%	0.838	30%	0.295	S	S	*	.	S	Bend	trans	-128.6	-19.1	-171.1	-65	-174.8	-179.9	-179.6	-0.1	116.1
340	S	98.1	Very high	97.3	Very high	131 Å²	131	54.2 Å²	54.2	92%	0.916	30%	0.299	S	S	*	.	S	Bend	trans	-116.4	25.5	-174.8	-56.6	0	0	0	0	113
341	G	97.9	Very high	96.4	Very high	25 Å²	25	56.1 Å²	56.1	26%	0.258	31%	0.307	S	S	.	.	S	Bend	trans	-132.4	-156.9	175.7	0	0	0	0	0	111.3	S336 R433	S336-G341 CarbonylContact O-C 3.57Å; S336-G341 WeakPolarHBondContact O-CA 3.45Å; S336-G341 WeakPolarHBondContact OG-CA 3.18Å; G341-R433 PolarHBondContact O-NH2 2.93Å
342	L	98.6	Very high	95.3	Very high	44 Å²	44	62.6 Å²	62.6	23%	0.23	35%	0.349	C	S	.	.			trans	-74.9	-49.6	175.8	-57.1	-174.8	0	0	0	111.2	F333 L334 S336 E344 R433	F333-L342 HydrophobicContact CB-CD1 4.28Å; F333-L342 WeakPolarHBondContact O-CB 3.36Å; L334-L342 HydrophobicContact CD2-CD1 4.26Å; S336-L342 PolarHBondContact O-N 3.47Å; S336-L342 PolarHBondContact OG-N 3.21Å; L342-E344 VanDerWaalsContact C-N 3.29Å; L342-E344 PolarHBondContact O-N 3.26Å; L342-R433 PolarHBondContact O-NE 3.34Å; L342-R433 PolarHBondContact O-NH2 3.47Å; L342-R433 VanDerWaalsContact O-NH2 3.11Å
343	G	98.4	Very high	94.1	Very high	6 Å²	6	62.2 Å²	62.2	6%	0.062	36%	0.36	C	S	.	.			trans	63.3	27.9	175.4	0	0	0	0	0	114.8	L334 S336 N430 R433	L334-G343 CarbonylContact O-C 3.43Å; L334-G343 PolarHBondContact O-N 3.19Å; S336-G343 WeakPolarHBondContact O-CA 3.24Å; S336-G343 PolarHBondContact O-N 2.96Å; G343-N430 WeakPolarHBondContact O-CB 3.4Å; G343-R433 VanDerWaalsContact O-CD 3.29Å; G343-R433 WeakPolarHBondContact O-CD 3.49Å
344	E	98.8	Very high	92.6	Very high	4 Å²	4	60 Å²	60	2%	0.019	36%	0.359	C	S	.	.			trans	-76.7	-31.5	177.5	-68	-179.1	-156	0	0	111.7	K219 R222 L334 L342 N430 I434	K219-E344 VanDerWaalsContact CD-OE2 3.27Å; K219-E344 WeakPolarHBondContact CD-OE2 3.14Å; K219-E344 WeakPolarHBondContact CE-OE2 3.42Å; K219-E344 IonicContact NZ-OE1 2.77Å; K219-E344 IonicContact NZ-OE2 3.56Å; K219-E344 PolarHBondContact NZ-OE2 3.39Å; R222-E344 IonicContact CZ-OE1 2.8Å; R222-E344 IonicContact NH1-OE1 3.43Å; R222-E344 PolarHBondContact NH1-OE1 3.49Å; R222-E344 IonicContact NH1-OE2 3.66Å; R222-E344 IonicContact NH2-OE1 2.75Å; R222-E344 PolarHBondContact NH2-OE1 2.92Å; L334-E344 HydrophobicContact CD2-CB 4.21Å; L334-E344 HydrophobicContact CD2-CG 4.42Å; L334-E344 VanDerWaalsContact CD2-OE2 3.26Å; L334-E344 WeakPolarHBondContact CD2-OE2 3.45Å; L334-E344 PolarHBondContact O-N 3.38Å; L342-E344 VanDerWaalsContact C-N 3.29Å; L342-E344 PolarHBondContact O-N 3.26Å; E344-N430 PolarHBondContact O-N 3.47Å; E344-I434 HydrophobicContact CB-CD1 4.26Å; E344-I434 HydrophobicContact CB-CG1 4.1Å; E344-I434 HydrophobicContact CG-CG1 4.06Å; E344-I434 WeakPolarHBondContact O-CD1 3.47Å
345	L	98.8	Very high	91.4	Very high	5 Å²	5	65.8 Å²	65.8	3%	0.026	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	148.3	178	-60.3	-179.8	0	0	0	111.3	L233 F237 L334 G335 L347 I427 Q428	L233-L345 HydrophobicContact CD1-CD2 4.22Å; L233-L345 HydrophobicContact CD2-CD2 4.45Å; F237-L345 HydrophobicContact CE2-CD1 4.26Å; F237-L345 HydrophobicContact CZ-CD1 4.1Å; L334-L345 HydrophobicContact CB-CB 4.39Å; L334-L345 HydrophobicContact CB-CD1 3.7Å; L334-L345 HydrophobicContact CB-CG 3.83Å; L334-L345 HydrophobicContact CD1-CD1 4.04Å; L334-L345 PolarHBondContact O-N 3.42Å; G335-L345 WeakPolarHBondContact CA-O 3.47Å; L345-L347 HydrophobicContact CB-CD2 4.26Å; L345-I427 HydrophobicContact CB-CG2 4.28Å; L345-I427 HydrophobicContact CD1-CG2 4Å; L345-I427 HydrophobicContact CD2-CG2 3.75Å; L345-I427 HydrophobicContact CG-CG2 4.22Å; L345-Q428 CarbonylContact C-O 3.57Å; L345-Q428 WeakPolarHBondContact CA-O 3.42Å
346	I	98.6	Very high	90.8	Very high	76 Å²	76	71.5 Å²	71.5	39%	0.39	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	115.5	167.9	-55.3	172.2	0	0	0	105.9	Q428 N430	I346-Q428 HydrophobicContact CB-CB 4.32Å; I346-Q428 PolarHBondContact N-O 3.01Å; I346-Q428 PolarHBondContact O-N 3.34Å; I346-N430 HydrophobicContact CD1-CB 4.13Å; I346-N430 HydrophobicContact CG1-CB 4.05Å
347	L	98.3	Very high	90.4	Very high	15 Å²	15	74.2 Å²	74.2	8%	0.079	43%	0.434	C	S	.	.			trans	-91.3	151	-179.6	-53.6	-176.7	0	0	0	110.4	I331 L345 V361 P363 I427	I331-L347 HydrophobicContact CG2-CD1 4.44Å; I331-L347 HydrophobicContact CG2-CD2 3.78Å; L345-L347 HydrophobicContact CB-CD2 4.26Å; L347-V361 HydrophobicContact CB-CG1 4.5Å; L347-P363 HydrophobicContact CD1-CB 3.75Å; L347-I427 HydrophobicContact CD2-CD1 4.31Å; L347-I427 HydrophobicContact CD2-CG1 3.93Å
348	P	96.6	Very high	89.8	Confident	34 Å²	34	77.6 Å²	77.6	22%	0.221	45%	0.449	C	S	.	.			trans	-59	140.3	173.6	-25.1	36.1	0	0	0	112.7	V361 C423	P348-V361 WeakPolarHBondContact O-CG1 3.41Å; P348-C423 WeakPolarHBondContact CG-O 3.18Å
349	E	91.6	Very high	89.3	Confident	117 Å²	117	77 Å²	77	55%	0.547	46%	0.456	S	S	.	.			trans	-96.7	103.8	172.7	-172.2	178	-164.6	0	0	109.1	G353 V361	E349-G353 VanDerWaalsContact OE1-CA 3.31Å; E349-G353 WeakPolarHBondContact OE1-CA 3.34Å; E349-G353 PolarHBondContact OE1-N 3.19Å; E349-G353 VanDerWaalsContact OE1-N 3.11Å; E349-V361 HydrophobicContact CB-CG1 4.22Å; E349-V361 HydrophobicContact CB-CG2 4.06Å; E349-V361 HydrophobicContact CG-CG2 4.4Å
350	N	85.7	Confident	89.2	Confident	76 Å²	76	71.2 Å²	71.2	41%	0.406	44%	0.437	S	S	.	.			trans	-99	-24.3	-177.8	-53.7	-57.8	0	0	0	113.2	N422	N350-N422 PolarHBondContact ND2-O 3.09Å
351	E	79.8	Confident	89.1	Confident	86 Å²	86	67 Å²	67	40%	0.402	41%	0.405	S	S	.	.	S	Bend	trans	-110	142.1	178.4	-57.4	85	-179.9	0	0	110	G353 T364	E351-G353 PolarHBondContact O-N 2.91Å; E351-T364 PolarHBondContact OE1-OG1 3.46Å; E351-T364 PolarHBondContact OE2-OG1 3.5Å
352	P	76.8	Confident	89	Confident	136 Å²	136	70.1 Å²	70.1	88%	0.883	42%	0.416	S	S	*	.			trans	-57	113.9	-178.6	-24.5	33	0	0	0	112.6
353	G	72.9	Confident	88.9	Confident	41 Å²	41	69.3 Å²	69.3	42%	0.423	41%	0.414	S	S	.	.			trans	-69.4	166.1	164.9	0	0	0	0	0	112.4	E349 E351	E349-G353 VanDerWaalsContact OE1-CA 3.31Å; E349-G353 WeakPolarHBondContact OE1-CA 3.34Å; E349-G353 PolarHBondContact OE1-N 3.19Å; E349-G353 VanDerWaalsContact OE1-N 3.11Å; E351-G353 PolarHBondContact O-N 2.91Å
354	S	68	Low	88.9	Confident	70 Å²	70	70.8 Å²	70.8	49%	0.49	42%	0.421	S	S	.	.			trans	-75.2	128	169.9	-171.3	0	0	0	0	109.4	I356 M357	S354-I356 PolarHBondContact O-N 3.4Å; S354-I356 WeakPolarHBondContact OG-CG2 3.37Å; S354-M357 PolarHBondContact O-N 2.97Å
355	S	73.9	Confident	88.9	Confident	128 Å²	128	71.9 Å²	71.9	90%	0.895	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.7	179.7	57.3	0	0	0	0	114.2	M357	S355-M357 VanDerWaalsContact C-N 3.33Å
356	I	85.2	Confident	88.9	Confident	139 Å²	139	71.7 Å²	71.7	71%	0.713	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-7.9	174.9	-154.9	171.3	0	0	0	113.4	S354 P358	S354-I356 PolarHBondContact O-N 3.4Å; S354-I356 WeakPolarHBondContact OG-CG2 3.37Å; I356-P358 VanDerWaalsContact C-CD 3.41Å; I356-P358 WeakPolarHBondContact O-CD 3.33Å
357	M	89.6	Confident	88.9	Confident	94 Å²	94	71.9 Å²	71.9	46%	0.463	43%	0.425	S	S	.	.	S	Bend	trans	-120.8	62.5	-175.9	-61.2	-171.8	-174.6	0	0	112.4	S354 S355 G359 K360	S354-M357 PolarHBondContact O-N 2.97Å; S355-M357 VanDerWaalsContact C-N 3.33Å; M357-G359 PolarHBondContact O-N 2.85Å; M357-K360 HydrophobicContact CB-CB 4.13Å; M357-K360 HydrophobicContact CB-CD 4.21Å; M357-K360 WeakPolarHBondContact O-CB 3.45Å; M357-K360 PolarHBondContact O-N 2.84Å; M357-K360 HydrophobicContact SD-CD 3.68Å
358	P	85.6	Confident	88.9	Confident	112 Å²	112	73 Å²	73	73%	0.727	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	138.2	-178	27.6	-35.4	0	0	0	112.1	I356 K360	I356-P358 VanDerWaalsContact C-CD 3.41Å; I356-P358 WeakPolarHBondContact O-CD 3.33Å; P358-K360 PolarHBondContact O-N 3.49Å
359	G	85.4	Confident	89.1	Confident	57 Å²	57	71.5 Å²	71.5	59%	0.588	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	0.3	179.4	0	0	0	0	0	115	M357 V361	M357-G359 PolarHBondContact O-N 2.85Å; G359-V361 PolarHBondContact O-N 2.96Å
360	K	94.6	Very high	89.4	Confident	99 Å²	99	66.9 Å²	66.9	43%	0.43	41%	0.406	S	S	.	.			trans	-84.2	105.6	170	-179.1	-170.4	173.2	-175.9	0	109.3	M357 P358	M357-K360 HydrophobicContact CB-CB 4.13Å; M357-K360 HydrophobicContact CB-CD 4.21Å; M357-K360 WeakPolarHBondContact O-CB 3.45Å; M357-K360 PolarHBondContact O-N 2.84Å; M357-K360 HydrophobicContact SD-CD 3.68Å; P358-K360 PolarHBondContact O-N 3.49Å
361	V	95.5	Very high	90	Very high	42 Å²	42	69.5 Å²	69.5	26%	0.255	42%	0.417	S	S	.	.			trans	-116	120.2	174.3	-177	0	0	0	0	108.9	L347 P348 E349 G359	L347-V361 HydrophobicContact CB-CG1 4.5Å; P348-V361 WeakPolarHBondContact O-CG1 3.41Å; E349-V361 HydrophobicContact CB-CG1 4.22Å; E349-V361 HydrophobicContact CB-CG2 4.06Å; E349-V361 HydrophobicContact CG-CG2 4.4Å; G359-V361 PolarHBondContact O-N 2.96Å
362	N	95.9	Very high	90.9	Very high	92 Å²	92	66.4 Å²	66.4	49%	0.492	40%	0.404	S	S	.	.			trans	-77.4	135	174.3	-67	-22.5	0	0	0	109.3	T364	N362-T364 HydrophobicContact CB-CG2 4.17Å; N362-T364 PolarHBondContact O-N 3.31Å
363	P	97.7	Very high	92	Very high	27 Å²	27	59.9 Å²	59.9	18%	0.175	36%	0.362	C	S	.	.			trans	-80.6	58.1	-177.8	33.4	-36	0	0	0	112.2	R332 L347 Q365 C366 E367	R332-P363 HydrophobicContact CB-CB 4.45Å; R332-P363 HydrophobicContact CB-CG 4.45Å; R332-P363 HydrophobicContact CG-CB 3.92Å; R332-P363 HydrophobicContact CG-CG 3.44Å; R332-P363 VanDerWaalsContact CG-CG 3.44Å; L347-P363 HydrophobicContact CD1-CB 3.75Å; P363-Q365 VanDerWaalsContact C-N 3.34Å; P363-Q365 PolarHBondContact O-N 2.92Å; P363-C366 HydrophobicContact CB-CB 4.08Å; P363-C366 WeakPolarHBondContact O-CA 3.29Å; P363-C366 VanDerWaalsContact O-CB 3.26Å; P363-C366 WeakPolarHBondContact O-CB 3.27Å; P363-C366 PolarHBondContact O-N 3.35Å; P363-E367 PolarHBondContact O-N 3.3Å
364	T	98.1	Very high	93.2	Very high	36 Å²	36	60.5 Å²	60.5	22%	0.221	36%	0.363	C	S	.	.	H	α-helix	trans	-56.9	-40.1	-170.1	55.5	0	0	0	0	113.7	E351 N362 C366 E367 A368	E351-T364 PolarHBondContact OE1-OG1 3.46Å; E351-T364 PolarHBondContact OE2-OG1 3.5Å; N362-T364 HydrophobicContact CB-CG2 4.17Å; N362-T364 PolarHBondContact O-N 3.31Å; T364-C366 VanDerWaalsContact C-N 3.33Å; T364-C366 PolarHBondContact O-N 3.42Å; T364-E367 WeakPolarHBondContact O-CB 3.41Å; T364-E367 PolarHBondContact O-N 3.08Å; T364-A368 PolarHBondContact O-N 3.07Å
365	Q	98.8	Very high	94.7	Very high	28 Å²	28	61.8 Å²	61.8	13%	0.131	36%	0.361	C	S	.	.	H	α-helix	trans	-69	-32	177.1	-62.5	-62.2	-42.1	0	0	112.3	P363 M369 S418 F419 N422 C423	P363-Q365 VanDerWaalsContact C-N 3.34Å; P363-Q365 PolarHBondContact O-N 2.92Å; Q365-M369 WeakPolarHBondContact O-CB 3.4Å; Q365-M369 PolarHBondContact O-N 2.96Å; Q365-S418 PolarHBondContact OE1-O 3.46Å; Q365-S418 PolarHBondContact OE1-OG 2.88Å; Q365-F419 HydrophobicContact CB-CD2 3.83Å; Q365-F419 HydrophobicContact CB-CE2 4.46Å; Q365-N422 HydrophobicContact CG-CB 3.79Å; Q365-C423 HydrophobicContact CB-CB 3.84Å; Q365-C423 HydrophobicContact CG-CB 4.2Å
366	C	98.8	Very high	95.9	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65.8	-44.4	171.9	-55.9	0	0	0	0	109.9	A328 R332 P363 T364 M369 T370 F419	A328-C366 HydrophobicContact CB-CB 4.41Å; R332-C366 HydrophobicContact CB-CB 3.97Å; R332-C366 HydrophobicContact CG-CB 4.34Å; R332-C366 PolarHBondContact NH2-O 3.26Å; P363-C366 HydrophobicContact CB-CB 4.08Å; P363-C366 WeakPolarHBondContact O-CA 3.29Å; P363-C366 VanDerWaalsContact O-CB 3.26Å; P363-C366 WeakPolarHBondContact O-CB 3.27Å; P363-C366 PolarHBondContact O-N 3.35Å; T364-C366 VanDerWaalsContact C-N 3.33Å; T364-C366 PolarHBondContact O-N 3.42Å; C366-M369 PolarHBondContact O-N 3.42Å; C366-T370 WeakPolarHBondContact O-CG2 3.32Å; C366-T370 PolarHBondContact O-N 2.96Å; C366-T370 PolarHBondContact O-OG1 3.45Å; C366-F419 HydrophobicContact CB-CE2 4.4Å
367	E	98.8	Very high	96.6	Very high	81 Å²	81	51.9 Å²	51.9	38%	0.379	30%	0.298	S	S	.	.	H	α-helix	trans	-55.8	-51.5	176.7	-68.2	166.2	-168.8	0	0	111.4	P363 T364 M369 T370 M371	P363-E367 PolarHBondContact O-N 3.3Å; T364-E367 WeakPolarHBondContact O-CB 3.41Å; T364-E367 PolarHBondContact O-N 3.08Å; E367-M369 PolarHBondContact O-N 3.49Å; E367-T370 PolarHBondContact O-N 3.34Å; E367-T370 PolarHBondContact O-OG1 2.94Å; E367-M371 WeakPolarHBondContact O-CG 3.49Å; E367-M371 PolarHBondContact O-N 3.05Å
368	A	98.8	Very high	97	Very high	39 Å²	39	49.4 Å²	49.4	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-57.1	-50.2	176.9	0	0	0	0	0	112.3	T364 T370 M371 V372	T364-A368 PolarHBondContact O-N 3.07Å; A368-T370 VanDerWaalsContact C-N 3.32Å; A368-T370 PolarHBondContact O-N 3.06Å; A368-M371 PolarHBondContact O-N 3.48Å; A368-V372 WeakPolarHBondContact O-CG2 3.35Å; A368-V372 PolarHBondContact O-N 3.37Å
369	M	98.9	Very high	97.6	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-58.5	-42.3	178.5	178.6	58.9	80.7	0	0	112.1	M324 A328 Q365 C366 E367 V372 A373 A415 F419	M324-M369 HydrophobicContact CB-CG 4.16Å; M324-M369 HydrophobicContact CB-SD 3.74Å; M324-M369 HydrophobicContact CG-SD 4.04Å; A328-M369 HydrophobicContact CB-CB 4.03Å; A328-M369 HydrophobicContact CB-CG 3.79Å; Q365-M369 WeakPolarHBondContact O-CB 3.4Å; Q365-M369 PolarHBondContact O-N 2.96Å; C366-M369 PolarHBondContact O-N 3.42Å; E367-M369 PolarHBondContact O-N 3.49Å; M369-V372 WeakPolarHBondContact O-CB 3.46Å; M369-V372 PolarHBondContact O-N 2.9Å; M369-A373 PolarHBondContact O-N 3.21Å; M369-A415 VanDerWaalsContact CE-C 3.45Å; M369-A415 HydrophobicContact CE-CB 3.79Å; M369-A415 WeakPolarHBondContact CE-O 3.29Å; M369-A415 HydrophobicContact SD-CB 3.97Å; M369-F419 HydrophobicContact CB-CD2 4.41Å; M369-F419 HydrophobicContact CE-CB 3.82Å; M369-F419 HydrophobicContact CE-CD1 4.34Å; M369-F419 HydrophobicContact CE-CG 4.2Å
370	T	98.9	Very high	98.3	Very high	19 Å²	19	43.4 Å²	43.4	12%	0.117	24%	0.244	C	C	.	.	H	α-helix	trans	-71.6	-33.2	179.6	52.8	0	0	0	0	113.7	M325 A328 R332 C366 E367 A368 A373 A374	M325-T370 WeakPolarHBondContact CE-O 3.12Å; M325-T370 HydrophobicContact SD-CG2 3.46Å; M325-T370 WeakPolarHBondContact SD-CG2 3.38Å; A328-T370 HydrophobicContact CB-CG2 3.92Å; R332-T370 PolarHBondContact NH2-OG1 2.64Å; C366-T370 WeakPolarHBondContact O-CG2 3.32Å; C366-T370 PolarHBondContact O-N 2.96Å; C366-T370 PolarHBondContact O-OG1 3.45Å; E367-T370 PolarHBondContact O-N 3.34Å; E367-T370 PolarHBondContact O-OG1 2.94Å; A368-T370 VanDerWaalsContact C-N 3.32Å; A368-T370 PolarHBondContact O-N 3.06Å; T370-A373 PolarHBondContact O-N 2.79Å; T370-A374 PolarHBondContact O-N 3.12Å; T370-A374 VanDerWaalsContact O-N 3.07Å
371	M	98.9	Very high	98.5	Very high	132 Å²	132	43 Å²	43	65%	0.65	25%	0.249	S	C	*	.	H	α-helix	trans	-65.3	-42	171.4	-72.2	-171.2	-67.4	0	0	111	E367 A368 A374 Q375	E367-M371 WeakPolarHBondContact O-CG 3.49Å; E367-M371 PolarHBondContact O-N 3.05Å; A368-M371 PolarHBondContact O-N 3.48Å; M371-A374 PolarHBondContact O-N 3Å; M371-Q375 PolarHBondContact O-N 3.18Å
372	V	98.9	Very high	98.7	Very high	20 Å²	20	42.7 Å²	42.7	12%	0.121	25%	0.251	C	S	.	.	H	α-helix	trans	-59.4	-46.7	173.6	163.8	0	0	0	0	111.1	A368 M369 A374 Q375 V376 L411 L412 A415	A368-V372 WeakPolarHBondContact O-CG2 3.35Å; A368-V372 PolarHBondContact O-N 3.37Å; M369-V372 WeakPolarHBondContact O-CB 3.46Å; M369-V372 PolarHBondContact O-N 2.9Å; V372-A374 VanDerWaalsContact C-N 3.31Å; V372-A374 PolarHBondContact O-N 2.93Å; V372-Q375 WeakPolarHBondContact O-CB 3.29Å; V372-Q375 PolarHBondContact O-N 3.45Å; V372-Q375 VanDerWaalsContact O-N 3.16Å; V372-V376 HydrophobicContact CG1-CG2 4.27Å; V372-V376 VanDerWaalsContact O-CG2 3.26Å; V372-V376 WeakPolarHBondContact O-CG2 3.21Å; V372-V376 PolarHBondContact O-N 3Å; V372-L411 HydrophobicContact CG1-CB 3.71Å; V372-L411 HydrophobicContact CG2-CB 4.16Å; V372-L411 HydrophobicContact CG2-CD2 4.37Å; V372-L412 HydrophobicContact CG1-CD2 4.14Å; V372-L412 HydrophobicContact CG1-CG 4.45Å; V372-A415 HydrophobicContact CB-CB 4.38Å; V372-A415 HydrophobicContact CG1-CB 4.24Å; V372-A415 HydrophobicContact CG2-CB 4.14Å
373	A	98.9	Very high	98.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.7	-42.5	178	0	0	0	0	0	112.2	A321 M325 M369 T370 V376 M377	A321-A373 HydrophobicContact CB-CB 4.06Å; A321-A373 WeakPolarHBondContact O-CB 3.28Å; M325-A373 HydrophobicContact CB-CB 4.06Å; M325-A373 HydrophobicContact CE-CB 3.79Å; M369-A373 PolarHBondContact O-N 3.21Å; T370-A373 PolarHBondContact O-N 2.79Å; A373-V376 PolarHBondContact O-N 3.42Å; A373-M377 WeakPolarHBondContact O-CG 3.33Å; A373-M377 PolarHBondContact O-N 3.26Å; A373-M377 VanDerWaalsContact O-N 3.16Å
374	A	98.9	Very high	98.9	Very high	53 Å²	53	39.8 Å²	39.8	44%	0.438	24%	0.237	S	C	.	.	H	α-helix	trans	-63.9	-42.8	174.8	0	0	0	0	0	112.5	M325 T370 M371 V372 V376 M377 G378	M325-A374 HydrophobicContact CE-CB 4.45Å; T370-A374 PolarHBondContact O-N 3.12Å; T370-A374 VanDerWaalsContact O-N 3.07Å; M371-A374 PolarHBondContact O-N 3Å; V372-A374 VanDerWaalsContact C-N 3.31Å; V372-A374 PolarHBondContact O-N 2.93Å; A374-V376 VanDerWaalsContact C-N 3.33Å; A374-V376 PolarHBondContact O-N 3.31Å; A374-M377 PolarHBondContact O-N 2.87Å; A374-G378 PolarHBondContact O-N 2.82Å; A374-G378 VanDerWaalsContact O-N 3.11Å
375	Q	98.9	Very high	98.9	Very high	98 Å²	98	41.8 Å²	41.8	46%	0.458	25%	0.248	S	C	.	.	H	α-helix	trans	-60	-43.1	176.2	-174.2	64	59.6	0	0	111.5	M371 V372 M377 G378 N379 L411	M371-Q375 PolarHBondContact O-N 3.18Å; V372-Q375 WeakPolarHBondContact O-CB 3.29Å; V372-Q375 PolarHBondContact O-N 3.45Å; V372-Q375 VanDerWaalsContact O-N 3.16Å; Q375-M377 VanDerWaalsContact C-N 3.35Å; Q375-M377 PolarHBondContact O-N 3.4Å; Q375-G378 PolarHBondContact O-N 3.18Å; Q375-N379 PolarHBondContact NE2-OD1 3.22Å; Q375-N379 WeakPolarHBondContact O-CB 3.3Å; Q375-N379 PolarHBondContact O-N 3.37Å; Q375-N379 PolarHBondContact O-OD1 3.16Å; Q375-L411 HydrophobicContact CB-CD1 4.43Å; Q375-L411 HydrophobicContact CG-CD1 3.95Å
376	V	98.9	Very high	98.9	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-62.9	-40.8	179.1	172.3	0	0	0	0	111.6	L317 A321 V372 A373 A374 N379 H380 L412	L317-V376 HydrophobicContact CB-CG1 4.28Å; A321-V376 HydrophobicContact CB-CB 3.81Å; A321-V376 HydrophobicContact CB-CG1 3.7Å; V372-V376 HydrophobicContact CG1-CG2 4.27Å; V372-V376 VanDerWaalsContact O-CG2 3.26Å; V372-V376 WeakPolarHBondContact O-CG2 3.21Å; V372-V376 PolarHBondContact O-N 3Å; A373-V376 PolarHBondContact O-N 3.42Å; A374-V376 VanDerWaalsContact C-N 3.33Å; A374-V376 PolarHBondContact O-N 3.31Å; V376-N379 PolarHBondContact O-N 3.35Å; V376-H380 PolarHBondContact O-N 2.73Å; V376-L412 HydrophobicContact CG1-CD1 4.21Å; V376-L412 HydrophobicContact CG2-CD1 4.06Å; V376-L412 HydrophobicContact CG2-CD2 4.2Å; V376-L412 HydrophobicContact CG2-CG 3.84Å
377	M	98.9	Very high	98.9	Very high	58 Å²	58	40.9 Å²	40.9	29%	0.286	25%	0.247	S	C	.	.	H	α-helix	trans	-62.5	-42.6	175.5	-66.5	166.1	-171.1	0	0	111.3	N318 A321 V322 A373 A374 Q375 H380 V381	N318-M377 WeakPolarHBondContact OD1-CG 3.33Å; A321-M377 HydrophobicContact CB-CE 4.27Å; A321-M377 HydrophobicContact CB-CG 4.5Å; V322-M377 HydrophobicContact CB-CE 4.44Å; V322-M377 HydrophobicContact CG2-CE 3.79Å; A373-M377 WeakPolarHBondContact O-CG 3.33Å; A373-M377 PolarHBondContact O-N 3.26Å; A373-M377 VanDerWaalsContact O-N 3.16Å; A374-M377 PolarHBondContact O-N 2.87Å; Q375-M377 VanDerWaalsContact C-N 3.35Å; Q375-M377 PolarHBondContact O-N 3.4Å; M377-H380 PolarHBondContact O-N 3.18Å; M377-V381 PolarHBondContact O-N 3.26Å
378	G	98.9	Very high	98.9	Very high	41 Å²	41	41.2 Å²	41.2	42%	0.423	26%	0.258	S	S	.	.	H	α-helix	trans	-64.7	-44.9	174.8	0	0	0	0	0	113	A374 Q375 H380 V381 A382	A374-G378 PolarHBondContact O-N 2.82Å; A374-G378 VanDerWaalsContact O-N 3.11Å; Q375-G378 PolarHBondContact O-N 3.18Å; G378-H380 VanDerWaalsContact C-N 3.25Å; G378-H380 PolarHBondContact O-N 3.08Å; G378-V381 PolarHBondContact O-N 3.09Å; G378-A382 PolarHBondContact O-N 3.35Å
379	N	98.9	Very high	98.9	Very high	6 Å²	6	42.2 Å²	42.2	3%	0.032	26%	0.258	C	S	.	.	H	α-helix	trans	-58.1	-39.6	175.2	-72.4	1	0	0	0	111.3	Q375 V376 V381 A382 V383 N404 N407 S408	Q375-N379 PolarHBondContact NE2-OD1 3.22Å; Q375-N379 WeakPolarHBondContact O-CB 3.3Å; Q375-N379 PolarHBondContact O-N 3.37Å; Q375-N379 PolarHBondContact O-OD1 3.16Å; V376-N379 PolarHBondContact O-N 3.35Å; N379-V381 VanDerWaalsContact C-N 3.34Å; N379-V381 PolarHBondContact O-N 3.2Å; N379-A382 WeakPolarHBondContact O-CB 3.5Å; N379-A382 PolarHBondContact O-N 3.19Å; N379-V383 WeakPolarHBondContact O-CG2 3.41Å; N379-V383 PolarHBondContact O-N 3.08Å; N379-N404 HydrophobicContact CB-CB 4.1Å; N379-N404 PolarHBondContact OD1-OD1 3.39Å; N379-N407 PolarHBondContact ND2-OD1 3.45Å; N379-S408 WeakPolarHBondContact CB-OG 3.49Å; N379-S408 PolarHBondContact ND2-OG 3.24Å
380	H	98.9	Very high	98.9	Very high	37 Å²	37	43.7 Å²	43.7	17%	0.171	27%	0.273	C	S	.	.	H	α-helix	trans	-60.5	-43.3	177.9	179	50.9	0	0	0	112	S314 N318 V376 M377 G378 A382 V383 T384	S314-H380 WeakPolarHBondContact OG-CA 3.37Å; S314-H380 PolarHBondContact OG-ND1 2.93Å; N318-H380 HydrophobicContact CB-CB 4.09Å; V376-H380 PolarHBondContact O-N 2.73Å; M377-H380 PolarHBondContact O-N 3.18Å; G378-H380 VanDerWaalsContact C-N 3.25Å; G378-H380 PolarHBondContact O-N 3.08Å; H380-A382 VanDerWaalsContact C-N 3.32Å; H380-A382 PolarHBondContact O-N 3.2Å; H380-V383 PolarHBondContact O-N 3.19Å; H380-T384 PolarHBondContact CE1-OG1 3.11Å; H380-T384 PolarHBondContact O-N 2.84Å; H380-T384 PolarHBondContact O-OG1 3.29Å; H380-T384 VanDerWaalsContact O-OG1 3.07Å
381	V	98.9	Very high	98.9	Very high	90 Å²	90	47.8 Å²	47.8	55%	0.545	29%	0.291	S	S	.	.	H	α-helix	trans	-60.4	-43.3	175.2	177.7	0	0	0	0	111.1	M377 G378 N379 V383 T384 V385	M377-V381 PolarHBondContact O-N 3.26Å; G378-V381 PolarHBondContact O-N 3.09Å; N379-V381 VanDerWaalsContact C-N 3.34Å; N379-V381 PolarHBondContact O-N 3.2Å; V381-V383 VanDerWaalsContact C-N 3.35Å; V381-V383 PolarHBondContact O-N 2.82Å; V381-T384 PolarHBondContact O-N 3.31Å; V381-V385 WeakPolarHBondContact O-CG2 3.38Å; V381-V385 PolarHBondContact O-N 3.41Å
382	A	98.9	Very high	98.9	Very high	36 Å²	36	50 Å²	50	30%	0.298	30%	0.297	S	S	.	.	H	α-helix	trans	-61	-42.6	176.7	0	0	0	0	0	112.2	G378 N379 H380 V385 G386 M400	G378-A382 PolarHBondContact O-N 3.35Å; N379-A382 WeakPolarHBondContact O-CB 3.5Å; N379-A382 PolarHBondContact O-N 3.19Å; H380-A382 VanDerWaalsContact C-N 3.32Å; H380-A382 PolarHBondContact O-N 3.2Å; A382-V385 PolarHBondContact O-N 2.88Å; A382-G386 PolarHBondContact O-N 2.77Å; A382-M400 HydrophobicContact CB-CE 4.37Å; A382-M400 VanDerWaalsContact O-CE 3.28Å; A382-M400 WeakPolarHBondContact O-CE 3.36Å
383	V	98.9	Very high	98.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-44.4	175.5	175.3	0	0	0	0	111.1	V311 N379 H380 V381 V385 G386 G387 M401 N404 V405	V311-V383 HydrophobicContact CG2-CG1 4.12Å; N379-V383 WeakPolarHBondContact O-CG2 3.41Å; N379-V383 PolarHBondContact O-N 3.08Å; H380-V383 PolarHBondContact O-N 3.19Å; V381-V383 VanDerWaalsContact C-N 3.35Å; V381-V383 PolarHBondContact O-N 2.82Å; V383-V385 PolarHBondContact O-N 3.45Å; V383-G386 PolarHBondContact O-N 3.16Å; V383-G387 PolarHBondContact O-N 3.15Å; V383-M401 HydrophobicContact CG1-CE 3.99Å; V383-N404 HydrophobicContact CG2-CB 3.53Å; V383-V405 HydrophobicContact CG1-CG2 4.29Å; V383-V405 HydrophobicContact CG2-CG2 3.92Å
384	T	98.9	Very high	98.8	Very high	59 Å²	59	55.1 Å²	55.1	36%	0.362	32%	0.321	S	S	.	.	H	α-helix	trans	-59.4	-46.3	178.1	-64.9	0	0	0	0	111.7	H380 V381 G387 S388	H380-T384 PolarHBondContact CE1-OG1 3.11Å; H380-T384 PolarHBondContact O-N 2.84Å; H380-T384 PolarHBondContact O-OG1 3.29Å; H380-T384 VanDerWaalsContact O-OG1 3.07Å; V381-T384 PolarHBondContact O-N 3.31Å; T384-G387 PolarHBondContact O-N 3.25Å; T384-S388 PolarHBondContact O-N 2.9Å; T384-S388 PolarHBondContact O-OG 3.18Å
385	V	98.9	Very high	98.8	Very high	77 Å²	77	52.6 Å²	52.6	47%	0.467	30%	0.3	S	S	.	.	H	α-helix	trans	-64	-41.3	176.9	173.8	0	0	0	0	111.2	V381 A382 V383 S388 N389	V381-V385 WeakPolarHBondContact O-CG2 3.38Å; V381-V385 PolarHBondContact O-N 3.41Å; A382-V385 PolarHBondContact O-N 2.88Å; V383-V385 PolarHBondContact O-N 3.45Å; V385-S388 PolarHBondContact O-OG 2.84Å; V385-S388 VanDerWaalsContact O-OG 3.13Å; V385-N389 PolarHBondContact O-ND2 2.89Å
386	G	98.9	Very high	98.8	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-42.1	175.2	0	0	0	0	0	112.9	A382 V383 N389 N395	A382-G386 PolarHBondContact O-N 2.77Å; V383-G386 PolarHBondContact O-N 3.16Å; G386-N389 PolarHBondContact O-N 3.26Å; G386-N395 PolarHBondContact O-ND2 3.33Å
387	G	98.8	Very high	98.8	Very high	9 Å²	9	54.3 Å²	54.3	9%	0.093	31%	0.311	C	S	.	.	H	α-helix	trans	-64.5	-40.4	178.5	0	0	0	0	0	112.8	V383 T384 N389 N395	V383-G387 PolarHBondContact O-N 3.15Å; T384-G387 PolarHBondContact O-N 3.25Å; G387-N389 PolarHBondContact O-N 2.87Å; G387-N395 PolarHBondContact O-ND2 3.03Å
388	S	98.8	Very high	98.8	Very high	87 Å²	87	51.5 Å²	51.5	61%	0.608	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.4	-177.4	72.8	0	0	0	0	114.9	T384 V385	T384-S388 PolarHBondContact O-N 2.9Å; T384-S388 PolarHBondContact O-OG 3.18Å; V385-S388 PolarHBondContact O-OG 2.84Å; V385-S388 VanDerWaalsContact O-OG 3.13Å
389	N	98.8	Very high	98.8	Very high	61 Å²	61	49.8 Å²	49.8	33%	0.326	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	38.4	-172.2	-75.3	-79.8	0	0	0	112.9	V385 G386 G387 H391 F397	V385-N389 PolarHBondContact O-ND2 2.89Å; G386-N389 PolarHBondContact O-N 3.26Å; G387-N389 PolarHBondContact O-N 2.87Å; N389-H391 PolarHBondContact O-CE1 3.45Å; N389-H391 VanDerWaalsContact O-CE1 3.31Å; N389-H391 PolarHBondContact O-ND1 2.94Å; N389-F397 HydrophobicContact CB-CD2 4.12Å; N389-F397 HydrophobicContact CB-CE2 3.65Å; N389-F397 HydrophobicContact CB-CZ 4.1Å
390	G	98.5	Very high	98.8	Very high	32 Å²	32	50.5 Å²	50.5	33%	0.33	28%	0.282	S	S	.	.			trans	-69.7	145.3	166.2	0	0	0	0	0	111.6
391	H	98.7	Very high	98.8	Very high	105 Å²	105	48.8 Å²	48.8	49%	0.486	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-129.4	120.1	177.7	-57.9	101	0	0	0	110	N389 E393 L394	N389-H391 PolarHBondContact O-CE1 3.45Å; N389-H391 VanDerWaalsContact O-CE1 3.31Å; N389-H391 PolarHBondContact O-ND1 2.94Å; H391-E393 PolarHBondContact O-N 3.43Å; H391-L394 PolarHBondContact O-N 3.25Å; H391-L394 VanDerWaalsContact O-N 3.16Å
392	F	98.5	Very high	98.8	Very high	179 Å²	179	44.5 Å²	44.5	79%	0.785	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.2	-121.4	177.3	-46	-68.6	0	0	0	111.2	A305 L394	A305-F392 VanDerWaalsContact CB-O 3.23Å; A305-F392 WeakPolarHBondContact CB-O 3.16Å; F392-L394 VanDerWaalsContact C-N 3.35Å; F392-L394 PolarHBondContact O-N 3.27Å
393	E	98.8	Very high	98.8	Very high	100 Å²	100	45 Å²	45	47%	0.467	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-2.1	-173.7	-65	68.5	-138.1	0	0	114.7	V268 H391	V268-E393 HydrophobicContact CB-CB 4.05Å; V268-E393 HydrophobicContact CB-CG 4.05Å; V268-E393 HydrophobicContact CG1-CB 4.18Å; V268-E393 HydrophobicContact CG1-CG 4.37Å; H391-E393 PolarHBondContact O-N 3.43Å
394	L	98.8	Very high	98.8	Very high	28 Å²	28	46.1 Å²	46.1	15%	0.147	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-148.9	120.5	-175.6	-158.8	71	0	0	0	114.3	N177 L304 H391 F392 V396	N177-L394 HydrophobicContact CB-CD1 3.89Å; N177-L394 HydrophobicContact CB-CD2 4.37Å; L304-L394 HydrophobicContact CB-CD1 4.15Å; L304-L394 WeakPolarHBondContact O-CA 3.3Å; H391-L394 PolarHBondContact O-N 3.25Å; H391-L394 VanDerWaalsContact O-N 3.16Å; F392-L394 VanDerWaalsContact C-N 3.35Å; F392-L394 PolarHBondContact O-N 3.27Å; L394-V396 HydrophobicContact CB-CG1 4.49Å; L394-V396 HydrophobicContact CD2-CG1 3.89Å; L394-V396 HydrophobicContact CG-CG1 4.15Å; L394-V396 PolarHBondContact O-N 2.82Å
395	N	98.9	Very high	98.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.232	C	C	.	.			trans	-74.9	122.5	162.3	-176.9	-56.7	0	0	0	109.6	L304 A305 G386 G387 F397 K398	L304-N395 PolarHBondContact O-N 2.92Å; A305-N395 VanDerWaalsContact O-CB 3.3Å; A305-N395 WeakPolarHBondContact O-CB 3.46Å; A305-N395 PolarHBondContact O-N 3.44Å; G386-N395 PolarHBondContact O-ND2 3.33Å; G387-N395 PolarHBondContact O-ND2 3.03Å; N395-F397 WeakPolarHBondContact OD1-CB 3.11Å; N395-F397 PolarHBondContact OD1-N 3.19Å; N395-K398 WeakPolarHBondContact O-CE 2.92Å; N395-K398 WeakPolarHBondContact O-CG 3.2Å; N395-K398 PolarHBondContact O-NZ 3.47Å
396	V	98.8	Very high	98.8	Very high	61 Å²	61	39.8 Å²	39.8	37%	0.37	21%	0.21	S	C	.	.	S	Bend	trans	-108.5	36.2	-177.8	-66.6	0	0	0	0	112.5	G133 L394	G133-V396 CarbonylContact C-O 3.24Å; G133-V396 WeakPolarHBondContact CA-O 3.27Å; G133-V396 CarbonylContact O-C 3.53Å; G133-V396 VanDerWaalsContact O-C 3.22Å; G133-V396 WeakPolarHBondContact O-CA 3.48Å; L394-V396 HydrophobicContact CB-CG1 4.49Å; L394-V396 HydrophobicContact CD2-CG1 3.89Å; L394-V396 HydrophobicContact CG-CG1 4.15Å; L394-V396 PolarHBondContact O-N 2.82Å
397	F	98.9	Very high	98.8	Very high	73 Å²	73	42.4 Å²	42.4	32%	0.32	22%	0.224	S	C	.	.			trans	-114.5	12.4	170.4	-74.1	-99.1	0	0	0	111.6	N389 N395 M400 M401	N389-F397 HydrophobicContact CB-CD2 4.12Å; N389-F397 HydrophobicContact CB-CE2 3.65Å; N389-F397 HydrophobicContact CB-CZ 4.1Å; N395-F397 WeakPolarHBondContact OD1-CB 3.11Å; N395-F397 PolarHBondContact OD1-N 3.19Å; F397-M400 HydrophobicContact CB-CG 4.24Å; F397-M400 HydrophobicContact CB-SD 3.78Å; F397-M400 HydrophobicContact CD1-CG 4.22Å; F397-M400 HydrophobicContact CD1-SD 4.24Å; F397-M400 VanDerWaalsContact O-CG 3.27Å; F397-M400 WeakPolarHBondContact O-CG 3.36Å; F397-M400 PolarHBondContact O-N 3.41Å; F397-M401 HydrophobicContact CB-CG 4.4Å; F397-M401 HydrophobicContact CB-SD 4.49Å; F397-M401 WeakPolarHBondContact O-CG 3.43Å; F397-M401 PolarHBondContact O-N 3.49Å
398	K	98.9	Very high	98.8	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-52.7	-51.2	-168.3	-40.7	-167.8	-171.2	-67.2	0	113.4	G133 F180 P181 M184 L304 H307 N395 M400 M401 V402	G133-K398 WeakPolarHBondContact O-CB 3.09Å; G133-K398 WeakPolarHBondContact O-CG 3.12Å; G133-K398 PolarHBondContact O-N 3.42Å; G133-K398 VanDerWaalsContact O-N 3.08Å; F180-K398 HydrophobicContact CD1-CB 3.73Å; F180-K398 HydrophobicContact CD1-CD 4.35Å; F180-K398 HydrophobicContact CE1-CB 3.83Å; P181-K398 HydrophobicContact CB-CD 4.44Å; P181-K398 HydrophobicContact CG-CD 4.5Å; M184-K398 HydrophobicContact CE-CB 3.83Å; M184-K398 HydrophobicContact CE-CD 4.29Å; M184-K398 HydrophobicContact CE-CG 4.35Å; M184-K398 HydrophobicContact SD-CB 3.64Å; L304-K398 PolarHBondContact O-NZ 3.5Å; H307-K398 WeakPolarHBondContact NE2-CD 3.34Å; H307-K398 VanDerWaalsContact NE2-CG 3.34Å; H307-K398 WeakPolarHBondContact NE2-CG 3.39Å; H307-K398 PolarHBondContact NE2-NZ 3.45Å; N395-K398 WeakPolarHBondContact O-CE 2.92Å; N395-K398 WeakPolarHBondContact O-CG 3.2Å; N395-K398 PolarHBondContact O-NZ 3.47Å; K398-M400 PolarHBondContact O-N 2.84Å; K398-M401 PolarHBondContact O-N 3.3Å; K398-V402 PolarHBondContact O-N 3.47Å; K398-V402 VanDerWaalsContact O-N 3.17Å
399	P	98.9	Very high	98.8	Very high	4 Å²	4	37.9 Å²	37.9	3%	0.026	19%	0.191	C	C	.	.	H	α-helix	trans	-57.9	-42.5	-179.3	-29.4	38.1	0	0	0	114.7	M77 V129 Q131 G133 F180 V402 K403	M77-P399 HydrophobicContact CE-CB 4.11Å; V129-P399 HydrophobicContact CG1-CB 3.95Å; V129-P399 WeakPolarHBondContact O-CB 3.39Å; Q131-P399 HydrophobicContact CG-CG 4.31Å; G133-P399 WeakPolarHBondContact O-CD 3.27Å; F180-P399 HydrophobicContact CE1-CG 4.1Å; F180-P399 HydrophobicContact CZ-CB 4.17Å; F180-P399 HydrophobicContact CZ-CG 3.93Å; P399-V402 WeakPolarHBondContact O-CG1 3.38Å; P399-K403 VanDerWaalsContact O-CB 3.27Å; P399-K403 WeakPolarHBondContact O-CB 3.42Å; P399-K403 PolarHBondContact O-N 3.11Å; P399-K403 VanDerWaalsContact O-N 3.08Å
400	M	98.9	Very high	98.8	Very high	22 Å²	22	40.1 Å²	40.1	11%	0.108	20%	0.195	C	C	.	.	H	α-helix	trans	-71.3	-35.3	-179.1	64.6	55.4	40.1	0	0	111	V129 W130 A382 F397 K398 K403 N404	V129-M400 HydrophobicContact CG1-CB 4.42Å; W130-M400 HydrophobicContact CH2-CB 4.26Å; W130-M400 HydrophobicContact CZ3-CB 3.84Å; A382-M400 HydrophobicContact CB-CE 4.37Å; A382-M400 VanDerWaalsContact O-CE 3.28Å; A382-M400 WeakPolarHBondContact O-CE 3.36Å; F397-M400 HydrophobicContact CB-CG 4.24Å; F397-M400 HydrophobicContact CB-SD 3.78Å; F397-M400 HydrophobicContact CD1-CG 4.22Å; F397-M400 HydrophobicContact CD1-SD 4.24Å; F397-M400 VanDerWaalsContact O-CG 3.27Å; F397-M400 WeakPolarHBondContact O-CG 3.36Å; F397-M400 PolarHBondContact O-N 3.41Å; K398-M400 PolarHBondContact O-N 2.84Å; M400-K403 PolarHBondContact O-N 3.07Å; M400-N404 PolarHBondContact O-N 3.22Å; M400-N404 VanDerWaalsContact O-N 3.09Å; M400-N404 PolarHBondContact O-ND2 3.15Å
401	M	98.9	Very high	98.9	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.3	-52.5	-177.4	-67.5	-176.1	73	0	0	109.2	H307 L310 V311 V383 F397 K398 K403 N404 V405	H307-M401 HydrophobicContact CB-CE 3.53Å; H307-M401 HydrophobicContact CB-SD 3.78Å; L310-M401 HydrophobicContact CB-CE 4.32Å; L310-M401 HydrophobicContact CD1-CB 4.34Å; V311-M401 HydrophobicContact CG2-CE 3.74Å; V383-M401 HydrophobicContact CG1-CE 3.99Å; F397-M401 HydrophobicContact CB-CG 4.4Å; F397-M401 HydrophobicContact CB-SD 4.49Å; F397-M401 WeakPolarHBondContact O-CG 3.43Å; F397-M401 PolarHBondContact O-N 3.49Å; K398-M401 PolarHBondContact O-N 3.3Å; M401-K403 VanDerWaalsContact C-N 3.34Å; M401-K403 PolarHBondContact O-N 2.95Å; M401-N404 PolarHBondContact O-N 3.26Å; M401-V405 WeakPolarHBondContact O-CG2 3.17Å; M401-V405 PolarHBondContact O-N 3.03Å
402	V	98.9	Very high	98.9	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.1	-37.2	179	70.5	0	0	0	0	112.4	V81 F180 M184 V188 K398 P399 N404 V405 L406	V81-V402 HydrophobicContact CG2-CG1 4.04Å; V81-V402 HydrophobicContact CG2-CG2 3.89Å; F180-V402 HydrophobicContact CE1-CG1 4.1Å; F180-V402 HydrophobicContact CZ-CG1 4.2Å; M184-V402 HydrophobicContact CB-CB 4.03Å; M184-V402 HydrophobicContact CB-CG2 3.75Å; M184-V402 HydrophobicContact CG-CB 3.73Å; M184-V402 HydrophobicContact CG-CG1 3.9Å; M184-V402 HydrophobicContact CG-CG2 3.89Å; M184-V402 HydrophobicContact SD-CB 3.67Å; M184-V402 HydrophobicContact SD-CG1 3.9Å; M184-V402 HydrophobicContact SD-CG2 4.44Å; V188-V402 HydrophobicContact CG2-CG2 3.96Å; K398-V402 PolarHBondContact O-N 3.47Å; K398-V402 VanDerWaalsContact O-N 3.17Å; P399-V402 WeakPolarHBondContact O-CG1 3.38Å; V402-N404 VanDerWaalsContact C-N 3.34Å; V402-N404 PolarHBondContact O-N 3.22Å; V402-V405 PolarHBondContact O-N 3.33Å; V402-L406 HydrophobicContact CG2-CD1 3.74Å; V402-L406 HydrophobicContact CG2-CG 4.05Å; V402-L406 VanDerWaalsContact O-CB 3.3Å; V402-L406 WeakPolarHBondContact O-CB 3.48Å; V402-L406 VanDerWaalsContact O-CG 3.28Å; V402-L406 WeakPolarHBondContact O-CG 3.5Å; V402-L406 PolarHBondContact O-N 3.28Å
403	K	98.9	Very high	98.9	Very high	47 Å²	47	27.5 Å²	27.5	20%	0.204	13%	0.132	C	C	.	.	H	α-helix	trans	-56.7	-47.6	175.3	170.7	67	170.6	-154.7	0	111.5	P78 V129 P399 M400 M401 N407	P78-K403 HydrophobicContact CG-CB 4.3Å; P78-K403 HydrophobicContact CG-CD 3.57Å; V129-K403 HydrophobicContact CG1-CB 4.02Å; V129-K403 HydrophobicContact CG1-CG 4.32Å; V129-K403 HydrophobicContact CG2-CB 4.03Å; V129-K403 HydrophobicContact CG2-CD 3.87Å; V129-K403 HydrophobicContact CG2-CG 3.96Å; P399-K403 VanDerWaalsContact O-CB 3.27Å; P399-K403 WeakPolarHBondContact O-CB 3.42Å; P399-K403 PolarHBondContact O-N 3.11Å; P399-K403 VanDerWaalsContact O-N 3.08Å; M400-K403 PolarHBondContact O-N 3.07Å; M401-K403 VanDerWaalsContact C-N 3.34Å; M401-K403 PolarHBondContact O-N 2.95Å; K403-N407 WeakPolarHBondContact O-CB 3.23Å; K403-N407 PolarHBondContact O-N 3.38Å
404	N	98.9	Very high	98.9	Very high	23 Å²	23	26.2 Å²	26.2	12%	0.123	13%	0.128	C	C	.	.	H	α-helix	trans	-72.4	-39.9	-177.6	-78.9	-78.6	0	0	0	112.2	N379 V383 M400 M401 V402 N407 S408	N379-N404 HydrophobicContact CB-CB 4.1Å; N379-N404 PolarHBondContact OD1-OD1 3.39Å; V383-N404 HydrophobicContact CG2-CB 3.53Å; M400-N404 PolarHBondContact O-N 3.22Å; M400-N404 VanDerWaalsContact O-N 3.09Å; M400-N404 PolarHBondContact O-ND2 3.15Å; M401-N404 PolarHBondContact O-N 3.26Å; V402-N404 VanDerWaalsContact C-N 3.34Å; V402-N404 PolarHBondContact O-N 3.22Å; N404-N407 PolarHBondContact O-N 2.99Å; N404-S408 WeakPolarHBondContact O-CB 3.49Å; N404-S408 PolarHBondContact O-N 2.89Å; N404-S408 PolarHBondContact O-OG 3Å; N404-S408 VanDerWaalsContact O-OG 3.13Å
405	V	98.9	Very high	98.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.8	-48.6	175.5	174.3	0	0	0	0	111.1	V188 L310 L313 L317 V383 M401 V402 N407 S408 A409	V188-V405 HydrophobicContact CG1-CG1 3.83Å; V188-V405 HydrophobicContact CG2-CB 4.42Å; V188-V405 HydrophobicContact CG2-CG1 3.84Å; L310-V405 HydrophobicContact CB-CG2 4.29Å; L313-V405 HydrophobicContact CD2-CG1 3.92Å; L317-V405 HydrophobicContact CD1-CG1 4.46Å; V383-V405 HydrophobicContact CG1-CG2 4.29Å; V383-V405 HydrophobicContact CG2-CG2 3.92Å; M401-V405 WeakPolarHBondContact O-CG2 3.17Å; M401-V405 PolarHBondContact O-N 3.03Å; V402-V405 PolarHBondContact O-N 3.33Å; V405-N407 PolarHBondContact O-N 3.02Å; V405-S408 PolarHBondContact O-N 2.82Å; V405-A409 WeakPolarHBondContact O-CB 3.14Å; V405-A409 PolarHBondContact O-N 3.14Å
406	L	98.9	Very high	98.9	Very high	3 Å²	3	25.5 Å²	25.5	2%	0.016	13%	0.127	C	C	.	.	H	α-helix	trans	-63.4	-41.6	177.6	-71.9	172.5	0	0	0	112	P78 Q80 V81 A187 V188 E191 V402 S408 A409 R410	P78-L406 HydrophobicContact CB-CD1 3.79Å; P78-L406 HydrophobicContact CG-CD1 4.23Å; Q80-L406 HydrophobicContact CB-CD1 3.89Å; Q80-L406 HydrophobicContact CB-CD2 4.04Å; Q80-L406 HydrophobicContact CG-CD2 4.21Å; V81-L406 HydrophobicContact CG2-CD1 3.72Å; A187-L406 HydrophobicContact CB-CD1 4.35Å; A187-L406 HydrophobicContact CB-CD2 4.33Å; V188-L406 HydrophobicContact CG2-CD2 4.03Å; V188-L406 HydrophobicContact CG2-CG 4.2Å; E191-L406 HydrophobicContact CB-CD2 3.79Å; E191-L406 HydrophobicContact CG-CD2 4.1Å; V402-L406 HydrophobicContact CG2-CD1 3.74Å; V402-L406 HydrophobicContact CG2-CG 4.05Å; V402-L406 VanDerWaalsContact O-CB 3.3Å; V402-L406 WeakPolarHBondContact O-CB 3.48Å; V402-L406 VanDerWaalsContact O-CG 3.28Å; V402-L406 WeakPolarHBondContact O-CG 3.5Å; V402-L406 PolarHBondContact O-N 3.28Å; L406-S408 PolarHBondContact O-N 3.42Å; L406-A409 PolarHBondContact O-N 3.33Å; L406-R410 VanDerWaalsContact O-CB 3.23Å; L406-R410 WeakPolarHBondContact O-CB 3.4Å; L406-R410 PolarHBondContact O-N 3.28Å
407	N	98.9	Very high	98.9	Very high	56 Å²	56	25.1 Å²	25.1	30%	0.299	12%	0.124	S	C	.	.	H	α-helix	trans	-60.4	-46.5	176.5	-178.7	-110.3	0	0	0	111.2	N379 K403 N404 V405 R410 L411	N379-N407 PolarHBondContact ND2-OD1 3.45Å; K403-N407 WeakPolarHBondContact O-CB 3.23Å; K403-N407 PolarHBondContact O-N 3.38Å; N404-N407 PolarHBondContact O-N 2.99Å; V405-N407 PolarHBondContact O-N 3.02Å; N407-R410 PolarHBondContact O-N 3.45Å; N407-L411 WeakPolarHBondContact O-CB 3.32Å; N407-L411 WeakPolarHBondContact O-CG 3.3Å; N407-L411 PolarHBondContact O-N 2.84Å; N407-L411 WeakPolarHBondContact OD1-CD1 3.21Å
408	S	98.9	Very high	98.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-63	-46.9	177.3	-66.9	0	0	0	0	112.8	N379 N404 V405 L406 R410 L412	N379-S408 WeakPolarHBondContact CB-OG 3.49Å; N379-S408 PolarHBondContact ND2-OG 3.24Å; N404-S408 WeakPolarHBondContact O-CB 3.49Å; N404-S408 PolarHBondContact O-N 2.89Å; N404-S408 PolarHBondContact O-OG 3Å; N404-S408 VanDerWaalsContact O-OG 3.13Å; V405-S408 PolarHBondContact O-N 2.82Å; L406-S408 PolarHBondContact O-N 3.42Å; S408-R410 PolarHBondContact O-N 3.39Å; S408-L412 WeakPolarHBondContact O-CB 3.43Å; S408-L412 WeakPolarHBondContact O-CG 3.28Å; S408-L412 PolarHBondContact O-N 2.87Å
409	A	98.9	Very high	98.9	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-61.4	-44.6	179.3	0	0	0	0	0	111.7	E191 L196 L317 V405 L406 G413	E191-A409 HydrophobicContact CG-CB 4.17Å; L196-A409 HydrophobicContact CD2-CB 4.39Å; L317-A409 HydrophobicContact CD1-CB 4.32Å; V405-A409 WeakPolarHBondContact O-CB 3.14Å; V405-A409 PolarHBondContact O-N 3.14Å; L406-A409 PolarHBondContact O-N 3.33Å; A409-G413 PolarHBondContact O-N 3.28Å
410	R	98.9	Very high	98.9	Very high	108 Å²	108	23.7 Å²	23.7	41%	0.408	12%	0.123	S	C	.	.	H	α-helix	trans	-64.4	-50.3	178.2	-179.8	54.9	-177	-81.8	-7.7	112.3	E191 L406 N407 S408 L412 G413 D414	E191-R410 WeakPolarHBondContact OE1-CB 3.4Å; E191-R410 WeakPolarHBondContact OE1-CD 3.33Å; L406-R410 VanDerWaalsContact O-CB 3.23Å; L406-R410 WeakPolarHBondContact O-CB 3.4Å; L406-R410 PolarHBondContact O-N 3.28Å; N407-R410 PolarHBondContact O-N 3.45Å; S408-R410 PolarHBondContact O-N 3.39Å; R410-L412 VanDerWaalsContact C-N 3.34Å; R410-L412 PolarHBondContact O-N 2.75Å; R410-G413 PolarHBondContact O-N 2.97Å; R410-D414 IonicContact CZ-OD2 3.74Å; R410-D414 IonicContact NE-OD1 3.18Å; R410-D414 PolarHBondContact NE-OD1 2.8Å; R410-D414 IonicContact NE-OD2 3.52Å; R410-D414 PolarHBondContact NE-OD2 2.75Å; R410-D414 IonicContact NH2-OD2 3.95Å; R410-D414 PolarHBondContact NH2-OD2 3.43Å; R410-D414 WeakPolarHBondContact O-CB 3.29Å; R410-D414 PolarHBondContact O-N 3.48Å
411	L	98.9	Very high	98.9	Very high	50 Å²	50	26.9 Å²	26.9	26%	0.262	14%	0.14	S	C	.	.	H	α-helix	trans	-61.2	-43.1	-179.4	-71.9	175.6	0	0	0	111.6	V372 Q375 N407 A415	V372-L411 HydrophobicContact CG1-CB 3.71Å; V372-L411 HydrophobicContact CG2-CB 4.16Å; V372-L411 HydrophobicContact CG2-CD2 4.37Å; Q375-L411 HydrophobicContact CB-CD1 4.43Å; Q375-L411 HydrophobicContact CG-CD1 3.95Å; N407-L411 WeakPolarHBondContact O-CB 3.32Å; N407-L411 WeakPolarHBondContact O-CG 3.3Å; N407-L411 PolarHBondContact O-N 2.84Å; N407-L411 WeakPolarHBondContact OD1-CD1 3.21Å; L411-A415 WeakPolarHBondContact O-CB 3.36Å; L411-A415 PolarHBondContact O-N 3.02Å
412	L	98.9	Very high	98.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.5	-42.8	177.3	-75.4	170.4	0	0	0	112.2	L196 L317 V320 M324 V372 V376 S408 R410 S416	L196-L412 HydrophobicContact CD1-CB 3.55Å; L196-L412 HydrophobicContact CD1-CD1 4.4Å; L317-L412 HydrophobicContact CB-CD1 4.15Å; L317-L412 HydrophobicContact CD2-CD1 4.14Å; V320-L412 HydrophobicContact CB-CD1 4.27Å; V320-L412 HydrophobicContact CG1-CD1 4.22Å; V320-L412 HydrophobicContact CG1-CD2 4.28Å; M324-L412 HydrophobicContact CG-CD2 4.45Å; V372-L412 HydrophobicContact CG1-CD2 4.14Å; V372-L412 HydrophobicContact CG1-CG 4.45Å; V376-L412 HydrophobicContact CG1-CD1 4.21Å; V376-L412 HydrophobicContact CG2-CD1 4.06Å; V376-L412 HydrophobicContact CG2-CD2 4.2Å; V376-L412 HydrophobicContact CG2-CG 3.84Å; S408-L412 WeakPolarHBondContact O-CB 3.43Å; S408-L412 WeakPolarHBondContact O-CG 3.28Å; S408-L412 PolarHBondContact O-N 2.87Å; R410-L412 VanDerWaalsContact C-N 3.34Å; R410-L412 PolarHBondContact O-N 2.75Å; L412-S416 VanDerWaalsContact O-CB 3.26Å; L412-S416 WeakPolarHBondContact O-CB 3.48Å; L412-S416 PolarHBondContact O-N 2.86Å; L412-S416 PolarHBondContact O-OG 3.15Å
413	G	98.9	Very high	98.9	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-61.2	-54.5	176.3	0	0	0	0	0	112	A409 R410 A415 S416 V417	A409-G413 PolarHBondContact O-N 3.28Å; R410-G413 PolarHBondContact O-N 2.97Å; G413-A415 PolarHBondContact O-N 2.87Å; G413-S416 PolarHBondContact O-N 2.89Å; G413-V417 PolarHBondContact O-N 3.16Å; G413-V417 VanDerWaalsContact O-N 3.13Å
414	D	98.9	Very high	98.9	Very high	73 Å²	73	27.9 Å²	27.9	39%	0.39	15%	0.148	S	C	.	.	H	α-helix	trans	-61.8	-45.3	-179.7	-74.5	9	0	0	0	111.7	R410 S416 V417 S418	R410-D414 IonicContact CZ-OD2 3.74Å; R410-D414 IonicContact NE-OD1 3.18Å; R410-D414 PolarHBondContact NE-OD1 2.8Å; R410-D414 IonicContact NE-OD2 3.52Å; R410-D414 PolarHBondContact NE-OD2 2.75Å; R410-D414 IonicContact NH2-OD2 3.95Å; R410-D414 PolarHBondContact NH2-OD2 3.43Å; R410-D414 WeakPolarHBondContact O-CB 3.29Å; R410-D414 PolarHBondContact O-N 3.48Å; D414-S416 VanDerWaalsContact C-N 3.31Å; D414-S416 PolarHBondContact O-N 3.31Å; D414-V417 PolarHBondContact O-N 3.04Å; D414-S418 WeakPolarHBondContact O-CB 3.08Å; D414-S418 PolarHBondContact O-N 2.88Å
415	A	98.9	Very high	98.9	Very high	14 Å²	14	30.4 Å²	30.4	12%	0.116	16%	0.164	C	C	.	.	H	α-helix	trans	-64.6	-36.7	179	0	0	0	0	0	111.7	M369 V372 L411 G413 S418 F419	M369-A415 VanDerWaalsContact CE-C 3.45Å; M369-A415 HydrophobicContact CE-CB 3.79Å; M369-A415 WeakPolarHBondContact CE-O 3.29Å; M369-A415 HydrophobicContact SD-CB 3.97Å; V372-A415 HydrophobicContact CB-CB 4.38Å; V372-A415 HydrophobicContact CG1-CB 4.24Å; V372-A415 HydrophobicContact CG2-CB 4.14Å; L411-A415 WeakPolarHBondContact O-CB 3.36Å; L411-A415 PolarHBondContact O-N 3.02Å; G413-A415 PolarHBondContact O-N 2.87Å; A415-S418 PolarHBondContact O-N 2.96Å; A415-F419 WeakPolarHBondContact O-CB 3.47Å; A415-F419 PolarHBondContact O-N 3.24Å
416	S	98.9	Very high	98.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64.1	-43.3	176.7	-59.9	0	0	0	0	111.2	G199 L412 G413 D414 T420	G199-S416 VanDerWaalsContact C-CB 3.5Å; G199-S416 VanDerWaalsContact O-CB 3.25Å; G199-S416 WeakPolarHBondContact O-CB 3.42Å; L412-S416 VanDerWaalsContact O-CB 3.26Å; L412-S416 WeakPolarHBondContact O-CB 3.48Å; L412-S416 PolarHBondContact O-N 2.86Å; L412-S416 PolarHBondContact O-OG 3.15Å; G413-S416 PolarHBondContact O-N 2.89Å; D414-S416 VanDerWaalsContact C-N 3.31Å; D414-S416 PolarHBondContact O-N 3.31Å; S416-T420 VanDerWaalsContact O-CB 3.29Å; S416-T420 WeakPolarHBondContact O-CB 3.15Å; S416-T420 PolarHBondContact O-N 3.17Å; S416-T420 PolarHBondContact O-OG1 3.1Å
417	V	98.9	Very high	98.9	Very high	53 Å²	53	31.8 Å²	31.8	32%	0.321	18%	0.179	S	C	.	.	H	α-helix	trans	-64.8	-48.6	175.4	176.2	0	0	0	0	111.3	G413 D414 T420 N421	G413-V417 PolarHBondContact O-N 3.16Å; G413-V417 VanDerWaalsContact O-N 3.13Å; D414-V417 PolarHBondContact O-N 3.04Å; V417-T420 WeakPolarHBondContact O-CB 3.44Å; V417-T420 PolarHBondContact O-N 3.43Å; V417-N421 PolarHBondContact O-N 2.78Å
418	S	98.9	Very high	98.9	Very high	40 Å²	40	34.7 Å²	34.7	28%	0.28	19%	0.191	S	C	.	.	H	α-helix	trans	-63.3	-46.4	-179.5	-173.2	0	0	0	0	112	Q365 D414 A415 T420 N421 N422	Q365-S418 PolarHBondContact OE1-O 3.46Å; Q365-S418 PolarHBondContact OE1-OG 2.88Å; D414-S418 WeakPolarHBondContact O-CB 3.08Å; D414-S418 PolarHBondContact O-N 2.88Å; A415-S418 PolarHBondContact O-N 2.96Å; S418-T420 PolarHBondContact O-N 2.99Å; S418-N421 PolarHBondContact O-N 3.38Å; S418-N422 VanDerWaalsContact O-CB 3.28Å; S418-N422 WeakPolarHBondContact O-CB 3.3Å; S418-N422 PolarHBondContact O-N 3.2Å; S418-N422 PolarHBondContact O-ND2 3.26Å; S418-N422 PolarHBondContact OG-ND2 3.23Å
419	F	98.9	Very high	98.8	Very high	3 Å²	3	35.5 Å²	35.5	1%	0.013	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-36.7	177.3	-174.7	-113.9	0	0	0	111.5	L203 A328 I331 Q365 C366 M369 A415 C423 V424	L203-F419 HydrophobicContact CD1-CD1 3.77Å; L203-F419 HydrophobicContact CD1-CE1 4.27Å; L203-F419 HydrophobicContact CD2-CD1 4.5Å; A328-F419 HydrophobicContact CB-CE2 4.47Å; A328-F419 HydrophobicContact CB-CZ 4.31Å; I331-F419 HydrophobicContact CD1-CE1 4.07Å; I331-F419 HydrophobicContact CD1-CZ 3.76Å; I331-F419 HydrophobicContact CG2-CZ 4.49Å; Q365-F419 HydrophobicContact CB-CD2 3.83Å; Q365-F419 HydrophobicContact CB-CE2 4.46Å; C366-F419 HydrophobicContact CB-CE2 4.4Å; M369-F419 HydrophobicContact CB-CD2 4.41Å; M369-F419 HydrophobicContact CE-CB 3.82Å; M369-F419 HydrophobicContact CE-CD1 4.34Å; M369-F419 HydrophobicContact CE-CG 4.2Å; A415-F419 WeakPolarHBondContact O-CB 3.47Å; A415-F419 PolarHBondContact O-N 3.24Å; F419-C423 HydrophobicContact CD2-CB 4.15Å; F419-C423 HydrophobicContact CE2-CB 4.15Å; F419-C423 WeakPolarHBondContact O-CA 3.38Å; F419-C423 VanDerWaalsContact O-CB 3.25Å; F419-C423 WeakPolarHBondContact O-CB 3.31Å; F419-C423 PolarHBondContact O-N 3.34Å; F419-V424 HydrophobicContact CD1-CG2 3.65Å; F419-V424 HydrophobicContact CE1-CG2 3.44Å; F419-V424 VanDerWaalsContact CE1-CG2 3.44Å; F419-V424 HydrophobicContact CG-CG2 4.43Å; F419-V424 HydrophobicContact CZ-CG2 4.07Å; F419-V424 PolarHBondContact O-N 3.18Å
420	T	98.9	Very high	98.8	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.018	21%	0.208	C	C	.	.	H	α-helix	trans	-64.2	-60	175.1	-59.8	0	0	0	0	111.4	T202 L203 A206 S416 V417 S418 N422 V424 V425	T202-T420 HydrophobicContact CG2-CG2 3.85Å; L203-T420 WeakPolarHBondContact CA-OG1 3.49Å; L203-T420 WeakPolarHBondContact CB-OG1 3.25Å; L203-T420 WeakPolarHBondContact CD1-OG1 3.31Å; A206-T420 HydrophobicContact CB-CG2 3.36Å; S416-T420 VanDerWaalsContact O-CB 3.29Å; S416-T420 WeakPolarHBondContact O-CB 3.15Å; S416-T420 PolarHBondContact O-N 3.17Å; S416-T420 PolarHBondContact O-OG1 3.1Å; V417-T420 WeakPolarHBondContact O-CB 3.44Å; V417-T420 PolarHBondContact O-N 3.43Å; S418-T420 PolarHBondContact O-N 2.99Å; T420-N422 PolarHBondContact O-N 3.16Å; T420-V424 PolarHBondContact O-N 3.28Å; T420-V425 HydrophobicContact CG2-CG1 3.92Å; T420-V425 WeakPolarHBondContact O-CG1 3.3Å; T420-V425 WeakPolarHBondContact O-CG2 3.48Å; T420-V425 PolarHBondContact O-N 3.39Å; T420-V425 VanDerWaalsContact O-N 3.13Å
421	N	98.8	Very high	98.8	Very high	90 Å²	90	35.7 Å²	35.7	48%	0.481	21%	0.209	S	C	.	.	H	α-helix	trans	-69.7	-35.6	-169.5	-67.1	-13.9	0	0	0	112.8	V417 S418 V425	V417-N421 PolarHBondContact O-N 2.78Å; S418-N421 PolarHBondContact O-N 3.38Å; N421-V425 WeakPolarHBondContact O-CG2 3.5Å
422	N	98.8	Very high	98.8	Very high	63 Å²	63	41 Å²	41	34%	0.337	23%	0.233	S	C	.	.	H	α-helix	trans	-104.3	3.1	-172.7	-55.3	-45.2	0	0	0	112.6	N350 Q365 S418 T420	N350-N422 PolarHBondContact ND2-O 3.09Å; Q365-N422 HydrophobicContact CG-CB 3.79Å; S418-N422 VanDerWaalsContact O-CB 3.28Å; S418-N422 WeakPolarHBondContact O-CB 3.3Å; S418-N422 PolarHBondContact O-N 3.2Å; S418-N422 PolarHBondContact O-ND2 3.26Å; S418-N422 PolarHBondContact OG-ND2 3.23Å; T420-N422 PolarHBondContact O-N 3.16Å
423	C	98.8	Very high	98.8	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.034	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.6	-70.3	175.5	-176.6	0	0	0	0	111.3	P348 Q365 F419 V425 G426 I427	P348-C423 WeakPolarHBondContact CG-O 3.18Å; Q365-C423 HydrophobicContact CB-CB 3.84Å; Q365-C423 HydrophobicContact CG-CB 4.2Å; F419-C423 HydrophobicContact CD2-CB 4.15Å; F419-C423 HydrophobicContact CE2-CB 4.15Å; F419-C423 WeakPolarHBondContact O-CA 3.38Å; F419-C423 VanDerWaalsContact O-CB 3.25Å; F419-C423 WeakPolarHBondContact O-CB 3.31Å; F419-C423 PolarHBondContact O-N 3.34Å; C423-V425 PolarHBondContact O-N 2.88Å; C423-G426 PolarHBondContact O-N 3.19Å; C423-I427 WeakPolarHBondContact O-CG1 3.32Å; C423-I427 PolarHBondContact O-N 3.37Å
424	V	98.8	Very high	98.7	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-54.6	-49.1	-167	177.1	0	0	0	0	112.9	L203 A206 L207 K210 F419 T420 G426 I427	L203-V424 HydrophobicContact CD1-CG2 3.9Å; A206-V424 HydrophobicContact CB-CG1 3.89Å; L207-V424 HydrophobicContact CD2-CG1 3.85Å; L207-V424 HydrophobicContact CD2-CG2 4.31Å; L207-V424 HydrophobicContact CG-CG1 4.16Å; K210-V424 WeakPolarHBondContact CE-O 3.37Å; K210-V424 HydrophobicContact CG-CG1 4.24Å; F419-V424 HydrophobicContact CD1-CG2 3.65Å; F419-V424 HydrophobicContact CE1-CG2 3.44Å; F419-V424 VanDerWaalsContact CE1-CG2 3.44Å; F419-V424 HydrophobicContact CG-CG2 4.43Å; F419-V424 HydrophobicContact CZ-CG2 4.07Å; F419-V424 PolarHBondContact O-N 3.18Å; T420-V424 PolarHBondContact O-N 3.28Å; V424-G426 PolarHBondContact O-N 3.43Å; V424-I427 WeakPolarHBondContact O-CB 3.23Å; V424-I427 WeakPolarHBondContact O-CG1 3.07Å; V424-I427 PolarHBondContact O-N 2.96Å
425	V	98.7	Very high	98.7	Very high	75 Å²	75	44.7 Å²	44.7	46%	0.455	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-62.2	-29.9	-176.1	-61.9	0	0	0	0	112.9	A206 K210 T420 N421 C423	A206-V425 HydrophobicContact CB-CG1 3.98Å; K210-V425 WeakPolarHBondContact CE-O 3.42Å; K210-V425 PolarHBondContact NZ-O 2.94Å; K210-V425 VanDerWaalsContact NZ-O 3.14Å; T420-V425 HydrophobicContact CG2-CG1 3.92Å; T420-V425 WeakPolarHBondContact O-CG1 3.3Å; T420-V425 WeakPolarHBondContact O-CG2 3.48Å; T420-V425 PolarHBondContact O-N 3.39Å; T420-V425 VanDerWaalsContact O-N 3.13Å; N421-V425 WeakPolarHBondContact O-CG2 3.5Å; C423-V425 PolarHBondContact O-N 2.88Å
426	G	98.6	Very high	98.6	Very high	32 Å²	32	49.6 Å²	49.6	33%	0.33	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-97.1	2.6	-178.6	0	0	0	0	0	114.5	C423 V424 Q428	C423-G426 PolarHBondContact O-N 3.19Å; V424-G426 PolarHBondContact O-N 3.43Å; G426-Q428 PolarHBondContact O-N 2.94Å
427	I	98.8	Very high	98.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.279	C	S	.	.			trans	-58.7	132.2	175.6	-66.1	177.9	0	0	0	109.6	K210 F214 F237 I331 L345 L347 C423 V424	K210-I427 HydrophobicContact CD-CB 4.5Å; K210-I427 VanDerWaalsContact CE-O 3.32Å; K210-I427 WeakPolarHBondContact CE-O 3.23Å; K210-I427 PolarHBondContact NZ-O 3.45Å; F214-I427 HydrophobicContact CE2-CG2 3.92Å; F214-I427 HydrophobicContact CZ-CG2 3.93Å; F237-I427 HydrophobicContact CE1-CD1 4.3Å; F237-I427 HydrophobicContact CZ-CD1 4.19Å; F237-I427 HydrophobicContact CZ-CG2 4.49Å; I331-I427 HydrophobicContact CD1-CD1 4.14Å; I331-I427 HydrophobicContact CG1-CD1 4.46Å; I331-I427 HydrophobicContact CG2-CD1 3.96Å; L345-I427 HydrophobicContact CB-CG2 4.28Å; L345-I427 HydrophobicContact CD1-CG2 4Å; L345-I427 HydrophobicContact CD2-CG2 3.75Å; L345-I427 HydrophobicContact CG-CG2 4.22Å; L347-I427 HydrophobicContact CD2-CD1 4.31Å; L347-I427 HydrophobicContact CD2-CG1 3.93Å; C423-I427 WeakPolarHBondContact O-CG1 3.32Å; C423-I427 PolarHBondContact O-N 3.37Å; V424-I427 WeakPolarHBondContact O-CB 3.23Å; V424-I427 WeakPolarHBondContact O-CG1 3.07Å; V424-I427 PolarHBondContact O-N 2.96Å
428	Q	98.8	Very high	98.5	Very high	118 Å²	118	50 Å²	50	55%	0.551	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	148.3	169.1	-64.7	178.5	-9.9	0	0	110.1	L345 I346 G426	L345-Q428 CarbonylContact C-O 3.57Å; L345-Q428 WeakPolarHBondContact CA-O 3.42Å; I346-Q428 HydrophobicContact CB-CB 4.32Å; I346-Q428 PolarHBondContact N-O 3.01Å; I346-Q428 PolarHBondContact O-N 3.34Å; G426-Q428 PolarHBondContact O-N 2.94Å
429	A	98.8	Very high	98.3	Very high	17 Å²	17	53.6 Å²	53.6	14%	0.14	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	132.3	171.6	0	0	0	0	0	110.4	F214 I217 L233 T431 I434	F214-A429 HydrophobicContact CD1-CB 4.38Å; F214-A429 HydrophobicContact CE1-CB 4.2Å; I217-A429 HydrophobicContact CD1-CB 3.56Å; L233-A429 HydrophobicContact CD1-CB 3.77Å; A429-T431 HydrophobicContact CB-CG2 4.15Å; A429-T431 PolarHBondContact O-N 3.36Å; A429-I434 HydrophobicContact CB-CD1 4.17Å
430	N	98.6	Very high	98.2	Very high	43 Å²	43	58 Å²	58	23%	0.23	30%	0.303	C	S	.	.			trans	-80.7	74.7	170.3	-170.3	-18.5	0	0	0	109.6	G343 E344 I346 E432 R433 I434	G343-N430 WeakPolarHBondContact O-CB 3.4Å; E344-N430 PolarHBondContact O-N 3.47Å; I346-N430 HydrophobicContact CD1-CB 4.13Å; I346-N430 HydrophobicContact CG1-CB 4.05Å; N430-E432 VanDerWaalsContact C-N 3.26Å; N430-E432 PolarHBondContact O-N 3.5Å; N430-R433 HydrophobicContact CB-CB 4.18Å; N430-R433 VanDerWaalsContact CG-CB 3.45Å; N430-R433 PolarHBondContact O-N 2.82Å; N430-R433 VanDerWaalsContact O-N 3.12Å; N430-R433 WeakPolarHBondContact OD1-CB 3.25Å; N430-R433 PolarHBondContact OD1-N 3.32Å; N430-I434 WeakPolarHBondContact O-CG1 3.24Å; N430-I434 PolarHBondContact O-N 2.98Å
431	T	98.5	Very high	98.1	Very high	69 Å²	69	58.1 Å²	58.1	42%	0.423	30%	0.304	S	S	.	.	H	α-helix	trans	-60.6	-34	-173	52.8	0	0	0	0	112.9	I217 A429 I434 N435	I217-T431 HydrophobicContact CD1-CG2 4.01Å; I217-T431 HydrophobicContact CG1-CG2 4.48Å; I217-T431 HydrophobicContact CG2-CG2 4.29Å; A429-T431 HydrophobicContact CB-CG2 4.15Å; A429-T431 PolarHBondContact O-N 3.36Å; T431-I434 PolarHBondContact O-N 3.19Å; T431-N435 VanDerWaalsContact O-CB 3.25Å; T431-N435 WeakPolarHBondContact O-CB 3.43Å; T431-N435 PolarHBondContact O-N 3.04Å; T431-N435 PolarHBondContact O-ND2 3.23Å; T431-N435 VanDerWaalsContact O-ND2 3.15Å
432	E	98.4	Very high	98	Very high	161 Å²	161	55.7 Å²	55.7	75%	0.752	29%	0.291	S	S	*	.	H	α-helix	trans	-59.4	-50.7	174.1	-174.1	-174.5	166.1	0	0	111	N430 N435 K436	N430-E432 VanDerWaalsContact C-N 3.26Å; N430-E432 PolarHBondContact O-N 3.5Å; E432-N435 PolarHBondContact O-N 3.21Å; E432-K436 WeakPolarHBondContact O-CB 3.49Å; E432-K436 PolarHBondContact O-N 3.13Å
433	R	98.3	Very high	98	Very high	62 Å²	62	55.7 Å²	55.7	23%	0.234	29%	0.289	C	S	.	.	H	α-helix	trans	-67.4	-41.1	178.9	-178.7	164.6	170.9	88.7	3.5	112.3	G341 L342 G343 N430 K436 L437	G341-R433 PolarHBondContact O-NH2 2.93Å; L342-R433 PolarHBondContact O-NE 3.34Å; L342-R433 PolarHBondContact O-NH2 3.47Å; L342-R433 VanDerWaalsContact O-NH2 3.11Å; G343-R433 VanDerWaalsContact O-CD 3.29Å; G343-R433 WeakPolarHBondContact O-CD 3.49Å; N430-R433 HydrophobicContact CB-CB 4.18Å; N430-R433 VanDerWaalsContact CG-CB 3.45Å; N430-R433 PolarHBondContact O-N 2.82Å; N430-R433 VanDerWaalsContact O-N 3.12Å; N430-R433 WeakPolarHBondContact OD1-CB 3.25Å; N430-R433 PolarHBondContact OD1-N 3.32Å; R433-K436 PolarHBondContact O-N 2.96Å; R433-L437 HydrophobicContact CG-CD1 4.12Å; R433-L437 HydrophobicContact CG-CG 4.45Å; R433-L437 WeakPolarHBondContact O-CG 3.48Å; R433-L437 PolarHBondContact O-N 2.84Å
434	I	98.7	Very high	97.8	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.015	29%	0.29	C	S	.	.	H	α-helix	trans	-59.9	-49	176.8	-69.6	165.4	0	0	0	110.4	I217 I218 K219 L233 E344 A429 N430 T431 K436 L437 M438	I217-I434 HydrophobicContact CG2-CD1 3.98Å; I217-I434 HydrophobicContact CG2-CG2 4.35Å; I218-I434 WeakPolarHBondContact O-CG2 3.42Å; K219-I434 HydrophobicContact CB-CG2 4.01Å; L233-I434 HydrophobicContact CD1-CD1 3.67Å; E344-I434 HydrophobicContact CB-CD1 4.26Å; E344-I434 HydrophobicContact CB-CG1 4.1Å; E344-I434 HydrophobicContact CG-CG1 4.06Å; E344-I434 WeakPolarHBondContact O-CD1 3.47Å; A429-I434 HydrophobicContact CB-CD1 4.17Å; N430-I434 WeakPolarHBondContact O-CG1 3.24Å; N430-I434 PolarHBondContact O-N 2.98Å; T431-I434 PolarHBondContact O-N 3.19Å; I434-K436 VanDerWaalsContact C-N 3.31Å; I434-K436 PolarHBondContact O-N 3.48Å; I434-L437 PolarHBondContact O-N 3.19Å; I434-M438 HydrophobicContact CG2-CG 4.4Å; I434-M438 WeakPolarHBondContact O-CB 3.31Å; I434-M438 WeakPolarHBondContact O-CG 3.35Å; I434-M438 PolarHBondContact O-N 2.79Å
435	N	97.8	Very high	97.7	Very high	88 Å²	88	56.6 Å²	56.6	47%	0.471	29%	0.294	S	S	.	.	H	α-helix	trans	-62	-39.9	179.4	-72.3	-23	0	0	0	111.8	T431 E432 M438 N439	T431-N435 VanDerWaalsContact O-CB 3.25Å; T431-N435 WeakPolarHBondContact O-CB 3.43Å; T431-N435 PolarHBondContact O-N 3.04Å; T431-N435 PolarHBondContact O-ND2 3.23Å; T431-N435 VanDerWaalsContact O-ND2 3.15Å; E432-N435 PolarHBondContact O-N 3.21Å; N435-M438 PolarHBondContact O-N 2.82Å; N435-N439 PolarHBondContact O-N 3.39Å; N435-N439 VanDerWaalsContact O-N 3.12Å; N435-N439 PolarHBondContact O-ND2 2.66Å
436	K	98	Very high	97.5	Very high	117 Å²	117	56.3 Å²	56.3	51%	0.509	29%	0.293	S	S	.	.	H	α-helix	trans	-59.5	-51.6	173.8	-179.1	179.9	175.7	179.6	0	111.5	E432 R433 I434 M438 N439 E440	E432-K436 WeakPolarHBondContact O-CB 3.49Å; E432-K436 PolarHBondContact O-N 3.13Å; R433-K436 PolarHBondContact O-N 2.96Å; I434-K436 VanDerWaalsContact C-N 3.31Å; I434-K436 PolarHBondContact O-N 3.48Å; K436-M438 VanDerWaalsContact C-N 3.31Å; K436-M438 PolarHBondContact O-N 3.23Å; K436-N439 PolarHBondContact O-N 3.35Å; K436-E440 VanDerWaalsContact CE-CD 3.47Å; K436-E440 WeakPolarHBondContact CE-OE1 3.47Å; K436-E440 HydrophobicContact CG-CG 4.5Å; K436-E440 IonicContact NZ-OE1 3.98Å; K436-E440 WeakPolarHBondContact O-CG 3.22Å; K436-E440 PolarHBondContact O-N 2.58Å
437	L	97.4	Very high	97.3	Very high	52 Å²	52	55.6 Å²	55.6	27%	0.272	28%	0.284	S	S	.	.	H	α-helix	trans	-63.9	-35.9	-179.5	-68.4	174.5	0	0	0	112.3	R433 I434 E440 S441	R433-L437 HydrophobicContact CG-CD1 4.12Å; R433-L437 HydrophobicContact CG-CG 4.45Å; R433-L437 WeakPolarHBondContact O-CG 3.48Å; R433-L437 PolarHBondContact O-N 2.84Å; I434-L437 PolarHBondContact O-N 3.19Å; L437-E440 PolarHBondContact O-N 3.1Å; L437-S441 WeakPolarHBondContact O-CB 3.36Å; L437-S441 PolarHBondContact O-N 3.08Å
438	M	96.6	Very high	97.2	Very high	10 Å²	10	55.6 Å²	55.6	5%	0.049	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-47.1	172.9	-79.9	-66.2	-61.4	0	0	111.8	I218 I220 P230 I434 N435 K436 S441 L444 P492	I218-M438 HydrophobicContact CG2-CE 3.72Å; I218-M438 HydrophobicContact CG2-SD 4.29Å; I220-M438 HydrophobicContact CB-SD 4.47Å; I220-M438 HydrophobicContact CD1-CE 4.29Å; I220-M438 HydrophobicContact CD1-SD 3.46Å; I220-M438 WeakPolarHBondContact CD1-SD 3.45Å; I220-M438 HydrophobicContact CG1-SD 3.59Å; I220-M438 VanDerWaalsContact CG1-SD 3.59Å; I220-M438 PolarHBondContact N-SD 3.49Å; I220-M438 VanDerWaalsContact N-SD 3.41Å; P230-M438 HydrophobicContact CB-CE 4.22Å; P230-M438 HydrophobicContact CG-CE 4.09Å; I434-M438 HydrophobicContact CG2-CG 4.4Å; I434-M438 WeakPolarHBondContact O-CB 3.31Å; I434-M438 WeakPolarHBondContact O-CG 3.35Å; I434-M438 PolarHBondContact O-N 2.79Å; N435-M438 PolarHBondContact O-N 2.82Å; K436-M438 VanDerWaalsContact C-N 3.31Å; K436-M438 PolarHBondContact O-N 3.23Å; M438-S441 WeakPolarHBondContact O-CB 3.33Å; M438-S441 PolarHBondContact O-N 2.98Å; M438-L444 HydrophobicContact CE-CD1 4.26Å; M438-L444 HydrophobicContact CE-CD2 4.03Å; M438-L444 WeakPolarHBondContact O-CD1 3.36Å; M438-P492 HydrophobicContact CE-CB 3.7Å; M438-P492 HydrophobicContact CE-CG 3.83Å
439	N	94.6	Very high	97	Very high	114 Å²	114	52.6 Å²	52.6	61%	0.61	27%	0.271	S	S	*	.	H	α-helix	trans	-72.2	-28.3	-179.4	-69.1	-28	0	0	0	113.4	N435 K436	N435-N439 PolarHBondContact O-N 3.39Å; N435-N439 VanDerWaalsContact O-N 3.12Å; N435-N439 PolarHBondContact O-ND2 2.66Å; K436-N439 PolarHBondContact O-N 3.35Å
440	E	97.3	Very high	96.8	Very high	97 Å²	97	56.9 Å²	56.9	45%	0.453	30%	0.298	S	S	.	.	H	α-helix	trans	-84.1	-12.8	176.5	-70.1	175.9	175.1	0	0	112.9	K436 L437 T470	K436-E440 VanDerWaalsContact CE-CD 3.47Å; K436-E440 WeakPolarHBondContact CE-OE1 3.47Å; K436-E440 HydrophobicContact CG-CG 4.5Å; K436-E440 IonicContact NZ-OE1 3.98Å; K436-E440 WeakPolarHBondContact O-CG 3.22Å; K436-E440 PolarHBondContact O-N 2.58Å; L437-E440 PolarHBondContact O-N 3.1Å; E440-T470 HydrophobicContact CG-CG2 4.46Å
441	S	97.1	Very high	96.7	Very high	5 Å²	5	59.1 Å²	59.1	4%	0.035	31%	0.307	C	S	.	.			trans	-69.9	146.3	-177.4	-172.2	0	0	0	0	113.2	I220 L437 M438 M443 L471	I220-S441 VanDerWaalsContact CD1-CB 3.49Å; I220-S441 VanDerWaalsContact CD1-OG 3.3Å; I220-S441 WeakPolarHBondContact CD1-OG 3.38Å; L437-S441 WeakPolarHBondContact O-CB 3.36Å; L437-S441 PolarHBondContact O-N 3.08Å; M438-S441 WeakPolarHBondContact O-CB 3.33Å; M438-S441 PolarHBondContact O-N 2.98Å; S441-M443 PolarHBondContact OG-N 2.86Å; S441-L471 VanDerWaalsContact O-CD1 3.29Å; S441-L471 WeakPolarHBondContact O-CD1 3.39Å
442	L	97.6	Very high	96.7	Very high	39 Å²	39	57 Å²	57	20%	0.204	29%	0.292	C	S	.	.	S	Bend	trans	-86.3	-9.3	173.9	-56.7	-179.3	0	0	0	113.2	V445 A464 H465 L471	L442-V445 WeakPolarHBondContact O-CB 3.1Å; L442-V445 VanDerWaalsContact O-CG1 3.25Å; L442-V445 WeakPolarHBondContact O-CG1 3.38Å; L442-V445 PolarHBondContact O-N 2.95Å; L442-A464 HydrophobicContact CD2-CB 3.67Å; L442-H465 HydrophobicContact CD1-CB 3.75Å; L442-L471 HydrophobicContact CD2-CD2 3.86Å; L442-L471 HydrophobicContact CD2-CG 4.31Å
443	M	97.3	Very high	96.6	Very high	63 Å²	63	50.8 Å²	50.8	31%	0.31	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-78.4	-21.8	-169.8	-63.7	-60.7	93.3	0	0	114.1	D227 A228 S441 V445 T446	D227-M443 HydrophobicContact CB-CG 3.9Å; A228-M443 WeakPolarHBondContact O-CB 3.41Å; A228-M443 WeakPolarHBondContact O-CG 3.4Å; S441-M443 PolarHBondContact OG-N 2.86Å; M443-V445 PolarHBondContact O-N 3.42Å; M443-T446 PolarHBondContact O-OG1 2.99Å
444	L	96	Very high	96.6	Very high	9 Å²	9	55.5 Å²	55.5	5%	0.047	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-71.8	-10.5	178	-55.6	-176.9	0	0	0	113.2	P230 M438 T446 A447 L471 V490 P492 M495	P230-L444 HydrophobicContact CG-CD2 3.41Å; P230-L444 VanDerWaalsContact CG-CD2 3.41Å; M438-L444 HydrophobicContact CE-CD1 4.26Å; M438-L444 HydrophobicContact CE-CD2 4.03Å; M438-L444 WeakPolarHBondContact O-CD1 3.36Å; L444-T446 PolarHBondContact O-N 3.42Å; L444-T446 VanDerWaalsContact O-N 3.1Å; L444-A447 WeakPolarHBondContact O-CB 3.16Å; L444-A447 PolarHBondContact O-N 3.31Å; L444-A447 VanDerWaalsContact O-N 3.11Å; L444-L471 HydrophobicContact CB-CD1 4.17Å; L444-V490 HydrophobicContact CB-CG1 3.69Å; L444-V490 HydrophobicContact CD1-CG1 4.25Å; L444-P492 HydrophobicContact CD1-CG 4.12Å; L444-P492 HydrophobicContact CD2-CG 4.45Å; L444-M495 HydrophobicContact CD2-CE 4.3Å; L444-M495 HydrophobicContact CD2-SD 3.96Å
445	V	96.4	Very high	96.5	Very high	15 Å²	15	61.3 Å²	61.3	9%	0.091	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-59.4	-26.7	-176.7	76.6	0	0	0	0	113.1	L442 M443 A447 L448 A457 I460 A461 L471	L442-V445 WeakPolarHBondContact O-CB 3.1Å; L442-V445 VanDerWaalsContact O-CG1 3.25Å; L442-V445 WeakPolarHBondContact O-CG1 3.38Å; L442-V445 PolarHBondContact O-N 2.95Å; M443-V445 PolarHBondContact O-N 3.42Å; V445-A447 PolarHBondContact O-N 2.63Å; V445-L448 HydrophobicContact CG2-CD1 4.19Å; V445-L448 VanDerWaalsContact O-CB 3.28Å; V445-L448 WeakPolarHBondContact O-CB 3.4Å; V445-L448 PolarHBondContact O-N 3.13Å; V445-A457 HydrophobicContact CG2-CB 4.14Å; V445-A457 VanDerWaalsContact CG2-O 3.23Å; V445-A457 WeakPolarHBondContact CG2-O 3.44Å; V445-I460 HydrophobicContact CG2-CB 4.45Å; V445-I460 HydrophobicContact CG2-CG2 4.43Å; V445-A461 HydrophobicContact CB-CB 4.42Å; V445-A461 HydrophobicContact CG1-CB 4.1Å; V445-A461 HydrophobicContact CG2-CB 4.17Å; V445-L471 HydrophobicContact CB-CD1 3.78Å; V445-L471 HydrophobicContact CB-CD2 3.93Å; V445-L471 HydrophobicContact CG2-CD1 4.46Å; V445-L471 HydrophobicContact CG2-CD2 3.98Å
446	T	93	Very high	96.5	Very high	69 Å²	69	61.8 Å²	61.8	42%	0.423	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-64.6	-24.3	-179.5	54.8	0	0	0	0	112.8	M443 L444 L448 N449	M443-T446 PolarHBondContact O-OG1 2.99Å; L444-T446 PolarHBondContact O-N 3.42Å; L444-T446 VanDerWaalsContact O-N 3.1Å; T446-L448 PolarHBondContact O-N 3.31Å; T446-N449 WeakPolarHBondContact O-CB 3.28Å; T446-N449 PolarHBondContact O-N 3.42Å
447	A	95.3	Very high	96.5	Very high	17 Å²	17	56.2 Å²	56.2	14%	0.14	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-62.6	-21.6	172.6	0	0	0	0	0	112.6	L444 V445 P450 H451 V490 M495	L444-A447 WeakPolarHBondContact O-CB 3.16Å; L444-A447 PolarHBondContact O-N 3.31Å; L444-A447 VanDerWaalsContact O-N 3.11Å; V445-A447 PolarHBondContact O-N 2.63Å; A447-P450 WeakPolarHBondContact O-CD 3.49Å; A447-H451 PolarHBondContact O-CD2 2.93Å; A447-V490 HydrophobicContact CB-CB 4.5Å; A447-V490 HydrophobicContact CB-CG1 4.32Å; A447-V490 HydrophobicContact CB-CG2 4.26Å; A447-M495 HydrophobicContact CB-CE 4.21Å; A447-M495 HydrophobicContact CB-SD 3.98Å
448	L	96.3	Very high	96.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-80.9	-21.7	179.4	-60.1	178.5	0	0	0	113.3	V445 T446 H451 I452 A457 I460 L481 F486 W489 V490	V445-L448 HydrophobicContact CG2-CD1 4.19Å; V445-L448 VanDerWaalsContact O-CB 3.28Å; V445-L448 WeakPolarHBondContact O-CB 3.4Å; V445-L448 PolarHBondContact O-N 3.13Å; T446-L448 PolarHBondContact O-N 3.31Å; L448-H451 PolarHBondContact O-N 3.35Å; L448-I452 HydrophobicContact CB-CD1 3.83Å; L448-I452 HydrophobicContact CB-CG1 3.93Å; L448-I452 HydrophobicContact CD1-CD1 4.08Å; L448-I452 HydrophobicContact CG-CD1 4.49Å; L448-I452 WeakPolarHBondContact O-CG1 3.41Å; L448-I452 PolarHBondContact O-N 2.76Å; L448-A457 HydrophobicContact CB-CB 4.3Å; L448-I460 HydrophobicContact CD1-CD1 3.84Å; L448-L481 HydrophobicContact CD1-CD2 4.19Å; L448-L481 HydrophobicContact CD2-CD2 3.69Å; L448-F486 HydrophobicContact CD1-CE2 4.21Å; L448-F486 HydrophobicContact CD2-CD2 4.37Å; L448-W489 HydrophobicContact CD2-CB 4.41Å; L448-W489 HydrophobicContact CD2-CE3 4.14Å; L448-V490 HydrophobicContact CD2-CG2 3.4Å; L448-V490 VanDerWaalsContact CD2-CG2 3.4Å; L448-V490 HydrophobicContact CG-CG2 3.93Å
449	N	95.4	Very high	96.6	Very high	54 Å²	54	56.9 Å²	56.9	29%	0.289	31%	0.305	S	S	.	.	H	α-helix	trans	-49.5	-48	-176.1	-67.9	18.3	0	0	0	114.2	T446 H451 G453 A457	T446-N449 WeakPolarHBondContact O-CB 3.28Å; T446-N449 PolarHBondContact O-N 3.42Å; N449-H451 PolarHBondContact O-N 2.77Å; N449-G453 VanDerWaalsContact O-CA 3.22Å; N449-G453 WeakPolarHBondContact O-CA 3.36Å; N449-G453 PolarHBondContact O-N 3.48Å; N449-A457 WeakPolarHBondContact OD1-CB 3.25Å
450	P	94.9	Very high	96.7	Very high	107 Å²	107	51.4 Å²	51.4	70%	0.695	28%	0.276	S	S	*	.	H	α-helix	trans	-69.6	-13.4	179.1	27	-35.3	0	0	0	114.4	A447	A447-P450 WeakPolarHBondContact O-CD 3.49Å
451	H	96.9	Very high	96.7	Very high	91 Å²	91	47.7 Å²	47.7	42%	0.421	26%	0.262	S	S	.	.	H	α-helix	trans	-101.7	-39.1	-176.8	-58.3	-73.2	0	0	0	113.1	A447 L448 N449 W489	A447-H451 PolarHBondContact O-CD2 2.93Å; L448-H451 PolarHBondContact O-N 3.35Å; N449-H451 PolarHBondContact O-N 2.77Å; H451-W489 HydrophobicContact CB-CD2 3.8Å; H451-W489 HydrophobicContact CB-CE3 3.58Å; H451-W489 HydrophobicContact CB-CG 4.44Å; H451-W489 HydrophobicContact CB-CH2 4.17Å; H451-W489 HydrophobicContact CB-CZ2 4.37Å; H451-W489 HydrophobicContact CB-CZ3 3.78Å; H451-W489 AromaticContact CD2-CD2 3.94Å; H451-W489 AromaticContact CD2-CG 3.66Å; H451-W489 AromaticContact CE1-CD1 3.68Å; H451-W489 AromaticContact CE1-CG 3.85Å; H451-W489 AromaticContact CG-CD2 3.58Å; H451-W489 AromaticContact CG-CE2 3.99Å; H451-W489 AromaticContact CG-CE3 3.87Å; H451-W489 AromaticContact CG-CG 3.73Å; H451-W489 AromaticContact ND1-CD1 3.81Å; H451-W489 AromaticContact ND1-CD2 3.87Å; H451-W489 AromaticContact ND1-CE2 3.86Å; H451-W489 AromaticContact ND1-CG 3.85Å; H451-W489 AromaticContact ND1-NE1 3.83Å; H451-W489 AromaticContact NE2-CD1 3.97Å; H451-W489 AromaticContact NE2-CG 3.76Å
452	I	97.3	Very high	96.7	Very high	23 Å²	23	54.9 Å²	54.9	12%	0.118	29%	0.292	C	S	.	.	H	α-helix	trans	-124.6	-2.7	-173.6	66.4	173.8	0	0	0	113.9	L448 K456 I460 L481 W489	L448-I452 HydrophobicContact CB-CD1 3.83Å; L448-I452 HydrophobicContact CB-CG1 3.93Å; L448-I452 HydrophobicContact CD1-CD1 4.08Å; L448-I452 HydrophobicContact CG-CD1 4.49Å; L448-I452 WeakPolarHBondContact O-CG1 3.41Å; L448-I452 PolarHBondContact O-N 2.76Å; I452-K456 HydrophobicContact CB-CB 4.26Å; I452-K456 HydrophobicContact CB-CD 4.18Å; I452-K456 HydrophobicContact CD1-CB 3.89Å; I452-K456 HydrophobicContact CG1-CB 4.04Å; I452-K456 WeakPolarHBondContact O-CD 3.27Å; I452-I460 HydrophobicContact CD1-CD1 3.61Å; I452-L481 HydrophobicContact CD1-CD2 4.43Å; I452-W489 HydrophobicContact CG2-CH2 4.41Å; I452-W489 HydrophobicContact CG2-CZ3 3.77Å
453	G	97	Very high	96.8	Very high	32 Å²	32	54.5 Å²	54.5	33%	0.33	29%	0.292	S	S	.	.			trans	81.2	159.9	-176.5	0	0	0	0	0	113.8	N449 D455 A457	N449-G453 VanDerWaalsContact O-CA 3.22Å; N449-G453 WeakPolarHBondContact O-CA 3.36Å; N449-G453 PolarHBondContact O-N 3.48Å; G453-D455 PolarHBondContact O-N 3.09Å; G453-A457 PolarHBondContact O-N 3.05Å
454	Y	97.1	Very high	96.8	Very high	161 Å²	161	51.5 Å²	51.5	63%	0.631	28%	0.277	S	S	*	.	H	α-helix	trans	-59.8	-46.1	-174.8	179.5	-89.6	0	0	0	113.3	K456 A457 A458	Y454-K456 VanDerWaalsContact C-N 3.34Å; Y454-K456 PolarHBondContact O-N 3Å; Y454-A457 PolarHBondContact O-N 3.49Å; Y454-A458 HydrophobicContact CE1-CB 4.21Å; Y454-A458 WeakPolarHBondContact O-CB 3.34Å; Y454-A458 PolarHBondContact O-N 2.94Å
455	D	97.1	Very high	96.9	Very high	124 Å²	124	58 Å²	58	66%	0.663	31%	0.307	S	S	*	.	H	α-helix	trans	-64.5	-38.3	-172.9	-66.6	-33	0	0	0	112.7	G453 T459	G453-D455 PolarHBondContact O-N 3.09Å; D455-T459 WeakPolarHBondContact O-CB 3.44Å; D455-T459 PolarHBondContact O-N 2.9Å; D455-T459 PolarHBondContact O-OG1 2.59Å
456	K	97.9	Very high	96.9	Very high	98 Å²	98	66.1 Å²	66.1	43%	0.426	34%	0.341	S	S	.	.	H	α-helix	trans	-68.9	-44.2	175.9	-67.6	-171.4	-174.6	173.1	0	111.1	I452 Y454 A458 T459 I460 Y480	I452-K456 HydrophobicContact CB-CB 4.26Å; I452-K456 HydrophobicContact CB-CD 4.18Å; I452-K456 HydrophobicContact CD1-CB 3.89Å; I452-K456 HydrophobicContact CG1-CB 4.04Å; I452-K456 WeakPolarHBondContact O-CD 3.27Å; Y454-K456 VanDerWaalsContact C-N 3.34Å; Y454-K456 PolarHBondContact O-N 3Å; K456-A458 PolarHBondContact O-N 2.82Å; K456-T459 PolarHBondContact O-N 3.36Å; K456-I460 WeakPolarHBondContact O-CG1 3.49Å; K456-I460 PolarHBondContact O-N 3.46Å; K456-Y480 HydrophobicContact CB-CD2 3.9Å; K456-Y480 HydrophobicContact CB-CE2 3.97Å; K456-Y480 HydrophobicContact CD-CD1 4.31Å; K456-Y480 HydrophobicContact CD-CD2 4.41Å; K456-Y480 HydrophobicContact CD-CG 4.26Å; K456-Y480 HydrophobicContact CG-CD2 4.29Å; K456-Y480 HydrophobicContact CG-CE2 4.16Å
457	A	97.7	Very high	97.1	Very high	1 Å²	1	68 Å²	68	1%	0.008	34%	0.343	C	S	.	.	H	α-helix	trans	-59.3	-46.5	175.3	0	0	0	0	0	111.8	V445 L448 N449 G453 Y454 T459 I460 A461	V445-A457 HydrophobicContact CG2-CB 4.14Å; V445-A457 VanDerWaalsContact CG2-O 3.23Å; V445-A457 WeakPolarHBondContact CG2-O 3.44Å; L448-A457 HydrophobicContact CB-CB 4.3Å; N449-A457 WeakPolarHBondContact OD1-CB 3.25Å; G453-A457 PolarHBondContact O-N 3.05Å; Y454-A457 PolarHBondContact O-N 3.49Å; A457-T459 VanDerWaalsContact C-N 3.32Å; A457-T459 PolarHBondContact O-N 2.71Å; A457-I460 WeakPolarHBondContact O-CB 3.34Å; A457-I460 PolarHBondContact O-N 3.01Å; A457-A461 PolarHBondContact O-N 2.98Å
458	A	97.4	Very high	97.2	Very high	22 Å²	22	70.7 Å²	70.7	18%	0.182	37%	0.373	C	S	.	.	H	α-helix	trans	-62.6	-37.8	176.3	0	0	0	0	0	112.5	Y454 K456 A461 K462	Y454-A458 HydrophobicContact CE1-CB 4.21Å; Y454-A458 WeakPolarHBondContact O-CB 3.34Å; Y454-A458 PolarHBondContact O-N 2.94Å; K456-A458 PolarHBondContact O-N 2.82Å; A458-A461 PolarHBondContact O-N 3.49Å; A458-K462 WeakPolarHBondContact O-CB 3.33Å; A458-K462 VanDerWaalsContact O-CG 3.3Å; A458-K462 WeakPolarHBondContact O-CG 3.39Å; A458-K462 PolarHBondContact O-N 3.29Å
459	T	98.1	Very high	97.2	Very high	53 Å²	53	72.9 Å²	72.9	33%	0.325	39%	0.388	S	S	.	.	H	α-helix	trans	-65.1	-41	175.9	-60.2	0	0	0	0	111.8	D455 K456 A457 T463 L478 Y480	D455-T459 WeakPolarHBondContact O-CB 3.44Å; D455-T459 PolarHBondContact O-N 2.9Å; D455-T459 PolarHBondContact O-OG1 2.59Å; K456-T459 PolarHBondContact O-N 3.36Å; A457-T459 VanDerWaalsContact C-N 3.32Å; A457-T459 PolarHBondContact O-N 2.71Å; T459-T463 VanDerWaalsContact O-CB 3.25Å; T459-T463 WeakPolarHBondContact O-CB 3.4Å; T459-T463 PolarHBondContact O-N 3.09Å; T459-T463 PolarHBondContact O-OG1 3.2Å; T459-L478 HydrophobicContact CG2-CD1 4.26Å; T459-Y480 HydrophobicContact CG2-CE2 4.25Å
460	I	98.3	Very high	97.3	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-58.9	-53.6	173	-67.5	162	0	0	0	109.8	V445 L448 I452 K456 A457 K462 T463 A464 L471 V474 A475 L478 Y480	V445-I460 HydrophobicContact CG2-CB 4.45Å; V445-I460 HydrophobicContact CG2-CG2 4.43Å; L448-I460 HydrophobicContact CD1-CD1 3.84Å; I452-I460 HydrophobicContact CD1-CD1 3.61Å; K456-I460 WeakPolarHBondContact O-CG1 3.49Å; K456-I460 PolarHBondContact O-N 3.46Å; A457-I460 WeakPolarHBondContact O-CB 3.34Å; A457-I460 PolarHBondContact O-N 3.01Å; I460-K462 PolarHBondContact O-N 3.46Å; I460-T463 PolarHBondContact O-N 3.17Å; I460-A464 VanDerWaalsContact O-CB 3.31Å; I460-A464 WeakPolarHBondContact O-CB 3.29Å; I460-A464 PolarHBondContact O-N 3.33Å; I460-L471 HydrophobicContact CG2-CB 4.4Å; I460-L471 HydrophobicContact CG2-CD2 3.91Å; I460-V474 HydrophobicContact CG2-CB 4.38Å; I460-V474 HydrophobicContact CG2-CG1 4.14Å; I460-A475 HydrophobicContact CD1-CB 3.65Å; I460-A475 HydrophobicContact CG1-CB 4.1Å; I460-A475 HydrophobicContact CG2-CB 4.2Å; I460-L478 HydrophobicContact CG1-CD1 4.2Å; I460-Y480 HydrophobicContact CD1-CD2 3.91Å; I460-Y480 HydrophobicContact CG1-CD2 3.8Å; I460-Y480 HydrophobicContact CG1-CE2 4.33Å
461	A	97.4	Very high	97.4	Very high	19 Å²	19	67.5 Å²	67.5	16%	0.157	36%	0.355	C	S	.	.	H	α-helix	trans	-59.4	-46.3	-177.5	0	0	0	0	0	112.9	V445 A457 A458 T463 A464 H465 L471	V445-A461 HydrophobicContact CB-CB 4.42Å; V445-A461 HydrophobicContact CG1-CB 4.1Å; V445-A461 HydrophobicContact CG2-CB 4.17Å; A457-A461 PolarHBondContact O-N 2.98Å; A458-A461 PolarHBondContact O-N 3.49Å; A461-T463 VanDerWaalsContact C-N 3.32Å; A461-T463 PolarHBondContact O-N 2.85Å; A461-A464 PolarHBondContact O-N 3.43Å; A461-H465 WeakPolarHBondContact O-CB 3.31Å; A461-H465 PolarHBondContact O-N 3.27Å; A461-L471 HydrophobicContact CB-CD2 4.47Å
462	K	97.1	Very high	97.5	Very high	155 Å²	155	65.4 Å²	65.4	67%	0.674	35%	0.345	S	S	*	.	H	α-helix	trans	-61.4	-40.7	177.3	-73.9	174.1	-178.5	176.7	0	111.9	A458 I460 K466	A458-K462 WeakPolarHBondContact O-CB 3.33Å; A458-K462 VanDerWaalsContact O-CG 3.3Å; A458-K462 WeakPolarHBondContact O-CG 3.39Å; A458-K462 PolarHBondContact O-N 3.29Å; I460-K462 PolarHBondContact O-N 3.46Å; K462-K466 WeakPolarHBondContact O-CB 3.19Å; K462-K466 PolarHBondContact O-N 3Å
463	T	97.9	Very high	97.5	Very high	31 Å²	31	66.5 Å²	66.5	19%	0.19	36%	0.357	C	S	.	.	H	α-helix	trans	-72.7	-42.4	-179	-56.7	0	0	0	0	111.5	T459 I460 A461 H465 K466 K467 V474	T459-T463 VanDerWaalsContact O-CB 3.25Å; T459-T463 WeakPolarHBondContact O-CB 3.4Å; T459-T463 PolarHBondContact O-N 3.09Å; T459-T463 PolarHBondContact O-OG1 3.2Å; I460-T463 PolarHBondContact O-N 3.17Å; A461-T463 VanDerWaalsContact C-N 3.32Å; A461-T463 PolarHBondContact O-N 2.85Å; T463-H465 PolarHBondContact O-N 2.75Å; T463-K466 PolarHBondContact O-N 3.46Å; T463-K467 HydrophobicContact CG2-CD 4.05Å; T463-K467 HydrophobicContact CG2-CG 4.46Å; T463-K467 WeakPolarHBondContact O-CB 3.48Å; T463-K467 WeakPolarHBondContact O-CG 3.19Å; T463-K467 PolarHBondContact O-N 2.64Å; T463-V474 HydrophobicContact CG2-CG1 3.72Å
464	A	97.9	Very high	97.5	Very high	1 Å²	1	65 Å²	65	1%	0.008	34%	0.341	C	S	.	.	H	α-helix	trans	-57.7	-47.2	173.5	0	0	0	0	0	111.6	L442 I460 A461 K467 G468 S469 L471 V474	L442-A464 HydrophobicContact CD2-CB 3.67Å; I460-A464 VanDerWaalsContact O-CB 3.31Å; I460-A464 WeakPolarHBondContact O-CB 3.29Å; I460-A464 PolarHBondContact O-N 3.33Å; A461-A464 PolarHBondContact O-N 3.43Å; A464-K467 PolarHBondContact O-N 3.33Å; A464-G468 WeakPolarHBondContact O-CA 3.2Å; A464-G468 PolarHBondContact O-N 3.07Å; A464-S469 WeakPolarHBondContact CB-O 3.16Å; A464-S469 PolarHBondContact O-N 2.94Å; A464-S469 VanDerWaalsContact O-N 3.12Å; A464-L471 HydrophobicContact CB-CD2 4.22Å; A464-V474 HydrophobicContact CB-CB 4.31Å; A464-V474 HydrophobicContact CB-CG2 3.97Å
465	H	97.6	Very high	97.6	Very high	144 Å²	144	57.3 Å²	57.3	67%	0.667	31%	0.311	S	S	*	.	H	α-helix	trans	-59.5	-49.2	174.7	-175.4	62.7	0	0	0	112.4	L442 A461 T463 K467 G468	L442-H465 HydrophobicContact CD1-CB 3.75Å; A461-H465 WeakPolarHBondContact O-CB 3.31Å; A461-H465 PolarHBondContact O-N 3.27Å; T463-H465 PolarHBondContact O-N 2.75Å; H465-K467 VanDerWaalsContact C-N 3.28Å; H465-K467 PolarHBondContact O-N 2.7Å; H465-G468 PolarHBondContact O-N 2.77Å
466	K	97.5	Very high	97.6	Very high	187 Å²	187	53.9 Å²	53.9	81%	0.813	30%	0.295	S	S	*	.	H	α-helix	trans	-62	-34.2	-178.7	-174.7	177.8	178.8	-178.3	0	112.8	K462 T463	K462-K466 WeakPolarHBondContact O-CB 3.19Å; K462-K466 PolarHBondContact O-N 3Å; T463-K466 PolarHBondContact O-N 3.46Å
467	K	97.3	Very high	97.6	Very high	107 Å²	107	55 Å²	55	47%	0.465	30%	0.302	S	S	.	.	H	α-helix	trans	-92.4	-16.5	-177.9	-67.8	-175.3	-177.8	178.5	0	114	T463 A464 H465 E477	T463-K467 HydrophobicContact CG2-CD 4.05Å; T463-K467 HydrophobicContact CG2-CG 4.46Å; T463-K467 WeakPolarHBondContact O-CB 3.48Å; T463-K467 WeakPolarHBondContact O-CG 3.19Å; T463-K467 PolarHBondContact O-N 2.64Å; A464-K467 PolarHBondContact O-N 3.33Å; H465-K467 VanDerWaalsContact C-N 3.28Å; H465-K467 PolarHBondContact O-N 2.7Å; K467-E477 IonicContact NZ-OE1 2.65Å; K467-E477 PolarHBondContact NZ-OE1 3.28Å; K467-E477 IonicContact NZ-OE2 3.02Å; K467-E477 PolarHBondContact NZ-OE2 2.85Å
468	G	96.2	Very high	97.6	Very high	74 Å²	74	57.8 Å²	57.8	76%	0.763	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	39.1	-169.4	0	0	0	0	0	112.8	A464 H465	A464-G468 WeakPolarHBondContact O-CA 3.2Å; A464-G468 PolarHBondContact O-N 3.07Å; H465-G468 PolarHBondContact O-N 2.77Å
469	S	96.6	Very high	97.6	Very high	46 Å²	46	59.8 Å²	59.8	32%	0.322	34%	0.338	S	S	.	.			trans	-118.2	168.4	-179	-169.4	0	0	0	0	111.2	A464	A464-S469 WeakPolarHBondContact CB-O 3.16Å; A464-S469 PolarHBondContact O-N 2.94Å; A464-S469 VanDerWaalsContact O-N 3.12Å
470	T	97.9	Very high	97.6	Very high	45 Å²	45	61 Å²	61	28%	0.276	34%	0.337	S	S	.	.			trans	-77.1	157.9	179.3	68.3	0	0	0	0	111.9	E440 K472 A473 V474	E440-T470 HydrophobicContact CG-CG2 4.46Å; T470-K472 VanDerWaalsContact C-N 3.31Å; T470-K472 PolarHBondContact O-N 2.75Å; T470-A473 PolarHBondContact O-N 3.31Å; T470-A473 WeakPolarHBondContact OG1-CB 3.18Å; T470-A473 PolarHBondContact OG1-N 3.38Å; T470-V474 PolarHBondContact O-N 3.1Å; T470-V474 VanDerWaalsContact O-N 3.15Å
471	L	97.8	Very high	97.5	Very high	3 Å²	3	61.5 Å²	61.5	2%	0.016	34%	0.34	C	S	.	.	H	α-helix	trans	-57.6	-43.7	175	-66.4	175.9	0	0	0	111.9	S441 L442 L444 V445 I460 A461 A464 V474 A475 F486	S441-L471 VanDerWaalsContact O-CD1 3.29Å; S441-L471 WeakPolarHBondContact O-CD1 3.39Å; L442-L471 HydrophobicContact CD2-CD2 3.86Å; L442-L471 HydrophobicContact CD2-CG 4.31Å; L444-L471 HydrophobicContact CB-CD1 4.17Å; V445-L471 HydrophobicContact CB-CD1 3.78Å; V445-L471 HydrophobicContact CB-CD2 3.93Å; V445-L471 HydrophobicContact CG2-CD1 4.46Å; V445-L471 HydrophobicContact CG2-CD2 3.98Å; I460-L471 HydrophobicContact CG2-CB 4.4Å; I460-L471 HydrophobicContact CG2-CD2 3.91Å; A461-L471 HydrophobicContact CB-CD2 4.47Å; A464-L471 HydrophobicContact CB-CD2 4.22Å; L471-V474 PolarHBondContact O-N 3.26Å; L471-A475 WeakPolarHBondContact O-CB 3.31Å; L471-A475 PolarHBondContact O-N 2.89Å; L471-F486 HydrophobicContact CB-CE2 3.93Å; L471-F486 HydrophobicContact CB-CZ 3.86Å
472	K	97.9	Very high	97.6	Very high	48 Å²	48	63.6 Å²	63.6	21%	0.209	35%	0.351	C	S	.	.	H	α-helix	trans	-59.7	-52	179.5	-175.5	172.9	-179.7	172.3	0	111.3	T470 V474 A475 V476 E483 F486 D487	T470-K472 VanDerWaalsContact C-N 3.31Å; T470-K472 PolarHBondContact O-N 2.75Å; K472-V474 VanDerWaalsContact C-N 3.34Å; K472-V474 PolarHBondContact O-N 3.13Å; K472-A475 PolarHBondContact O-N 3.04Å; K472-V476 WeakPolarHBondContact O-CG2 3.33Å; K472-V476 PolarHBondContact O-N 3.19Å; K472-V476 VanDerWaalsContact O-N 3.11Å; K472-E483 VanDerWaalsContact CE-CB 3.48Å; K472-E483 IonicContact NZ-OE2 3.22Å; K472-F486 HydrophobicContact CB-CD1 3.78Å; K472-F486 HydrophobicContact CB-CD2 4.15Å; K472-F486 HydrophobicContact CB-CE1 3.82Å; K472-F486 HydrophobicContact CB-CE2 4.17Å; K472-F486 HydrophobicContact CB-CG 3.95Å; K472-F486 HydrophobicContact CB-CZ 4.01Å; K472-F486 HydrophobicContact CD-CB 4.46Å; K472-F486 HydrophobicContact CD-CD1 3.95Å; K472-F486 HydrophobicContact CD-CG 4.34Å; K472-F486 HydrophobicContact CG-CB 4.08Å; K472-F486 HydrophobicContact CG-CD1 3.84Å; K472-F486 HydrophobicContact CG-CD2 4.39Å; K472-F486 HydrophobicContact CG-CE1 4.39Å; K472-F486 HydrophobicContact CG-CG 3.84Å; K472-D487 WeakPolarHBondContact CE-OD1 3.26Å; K472-D487 IonicContact NZ-OD1 2.74Å; K472-D487 PolarHBondContact NZ-OD1 2.98Å; K472-D487 IonicContact NZ-OD2 3.42Å; K472-D487 PolarHBondContact NZ-OD2 2.91Å
473	A	97.4	Very high	97.6	Very high	45 Å²	45	61.2 Å²	61.2	37%	0.372	34%	0.342	S	S	.	.	H	α-helix	trans	-59.7	-44.3	-178.6	0	0	0	0	0	111.8	T470 E477	T470-A473 PolarHBondContact O-N 3.31Å; T470-A473 WeakPolarHBondContact OG1-CB 3.18Å; T470-A473 PolarHBondContact OG1-N 3.38Å; A473-E477 WeakPolarHBondContact O-CB 3.43Å; A473-E477 PolarHBondContact O-N 3.15Å
474	V	98.1	Very high	97.5	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-70.1	-38.1	179.3	170.6	0	0	0	0	112.6	I460 T463 A464 T470 L471 K472 V476 E477 L478	I460-V474 HydrophobicContact CG2-CB 4.38Å; I460-V474 HydrophobicContact CG2-CG1 4.14Å; T463-V474 HydrophobicContact CG2-CG1 3.72Å; A464-V474 HydrophobicContact CB-CB 4.31Å; A464-V474 HydrophobicContact CB-CG2 3.97Å; T470-V474 PolarHBondContact O-N 3.1Å; T470-V474 VanDerWaalsContact O-N 3.15Å; L471-V474 PolarHBondContact O-N 3.26Å; K472-V474 VanDerWaalsContact C-N 3.34Å; K472-V474 PolarHBondContact O-N 3.13Å; V474-V476 VanDerWaalsContact C-N 3.3Å; V474-V476 PolarHBondContact O-N 2.86Å; V474-E477 PolarHBondContact O-N 3.06Å; V474-L478 HydrophobicContact CG1-CD1 3.76Å; V474-L478 HydrophobicContact CG1-CG 4.22Å; V474-L478 WeakPolarHBondContact O-CB 3.18Å; V474-L478 VanDerWaalsContact O-CG 3.27Å; V474-L478 WeakPolarHBondContact O-CG 3.44Å; V474-L478 PolarHBondContact O-N 3.18Å
475	A	98	Very high	97.5	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-64	-37.3	178.9	0	0	0	0	0	112.3	I460 L471 K472 G479 Y480 L481 F486	I460-A475 HydrophobicContact CD1-CB 3.65Å; I460-A475 HydrophobicContact CG1-CB 4.1Å; I460-A475 HydrophobicContact CG2-CB 4.2Å; L471-A475 WeakPolarHBondContact O-CB 3.31Å; L471-A475 PolarHBondContact O-N 2.89Å; K472-A475 PolarHBondContact O-N 3.04Å; A475-G479 PolarHBondContact O-N 3.32Å; A475-Y480 PolarHBondContact O-N 3.26Å; A475-Y480 VanDerWaalsContact O-N 3.07Å; A475-L481 HydrophobicContact CB-CD1 3.6Å; A475-L481 HydrophobicContact CB-CD2 4.14Å; A475-L481 HydrophobicContact CB-CG 3.82Å; A475-F486 HydrophobicContact CB-CD2 4.41Å
476	V	97.8	Very high	97.6	Very high	53 Å²	53	63.5 Å²	63.5	32%	0.321	35%	0.351	S	S	.	.	H	α-helix	trans	-72.1	-45.4	173.9	175.6	0	0	0	0	111.3	K472 V474 L478 G479 L481 E483	K472-V476 WeakPolarHBondContact O-CG2 3.33Å; K472-V476 PolarHBondContact O-N 3.19Å; K472-V476 VanDerWaalsContact O-N 3.11Å; V474-V476 VanDerWaalsContact C-N 3.3Å; V474-V476 PolarHBondContact O-N 2.86Å; V476-L478 VanDerWaalsContact C-N 3.27Å; V476-L478 PolarHBondContact O-N 3.06Å; V476-G479 PolarHBondContact O-N 3.11Å; V476-L481 HydrophobicContact CG2-CD1 4.38Å; V476-E483 HydrophobicContact CG2-CG 3.77Å
477	E	97.7	Very high	97.5	Very high	122 Å²	122	58.9 Å²	58.9	57%	0.57	34%	0.335	S	S	*	.	H	α-helix	trans	-57.2	-40.5	177.3	-172.3	-166.3	170.1	0	0	112.1	K467 A473 V474 G479	K467-E477 IonicContact NZ-OE1 2.65Å; K467-E477 PolarHBondContact NZ-OE1 3.28Å; K467-E477 IonicContact NZ-OE2 3.02Å; K467-E477 PolarHBondContact NZ-OE2 2.85Å; A473-E477 WeakPolarHBondContact O-CB 3.43Å; A473-E477 PolarHBondContact O-N 3.15Å; V474-E477 PolarHBondContact O-N 3.06Å; E477-G479 PolarHBondContact O-N 2.98Å
478	L	97.2	Very high	97.5	Very high	59 Å²	59	59.7 Å²	59.7	31%	0.309	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-5	177.7	-67.1	175.5	0	0	0	113.5	T459 I460 V474 V476 Y480	T459-L478 HydrophobicContact CG2-CD1 4.26Å; I460-L478 HydrophobicContact CG1-CD1 4.2Å; V474-L478 HydrophobicContact CG1-CD1 3.76Å; V474-L478 HydrophobicContact CG1-CG 4.22Å; V474-L478 WeakPolarHBondContact O-CB 3.18Å; V474-L478 VanDerWaalsContact O-CG 3.27Å; V474-L478 WeakPolarHBondContact O-CG 3.44Å; V474-L478 PolarHBondContact O-N 3.18Å; V476-L478 VanDerWaalsContact C-N 3.27Å; V476-L478 PolarHBondContact O-N 3.06Å; L478-Y480 HydrophobicContact CB-CD1 4.24Å; L478-Y480 HydrophobicContact CB-CD2 4.06Å; L478-Y480 HydrophobicContact CB-CE1 4.29Å; L478-Y480 HydrophobicContact CB-CE2 4.12Å; L478-Y480 HydrophobicContact CB-CG 4.12Å; L478-Y480 HydrophobicContact CD1-CD2 4.22Å; L478-Y480 HydrophobicContact CD1-CE2 3.86Å; L478-Y480 WeakPolarHBondContact O-CD1 3.46Å; L478-Y480 PolarHBondContact O-N 3.3Å
479	G	97.6	Very high	97.5	Very high	63 Å²	63	58.6 Å²	58.6	65%	0.649	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	24.1	-178.1	0	0	0	0	0	113.8	A475 V476 E477	A475-G479 PolarHBondContact O-N 3.32Å; V476-G479 PolarHBondContact O-N 3.11Å; E477-G479 PolarHBondContact O-N 2.98Å
480	Y	97.9	Very high	97.5	Very high	78 Å²	78	57 Å²	57	31%	0.306	30%	0.302	S	S	.	.	S	Bend	trans	-83.2	-23.7	-179.4	-69.6	-10.7	0	0	0	113	K456 T459 I460 A475 L478	K456-Y480 HydrophobicContact CB-CD2 3.9Å; K456-Y480 HydrophobicContact CB-CE2 3.97Å; K456-Y480 HydrophobicContact CD-CD1 4.31Å; K456-Y480 HydrophobicContact CD-CD2 4.41Å; K456-Y480 HydrophobicContact CD-CG 4.26Å; K456-Y480 HydrophobicContact CG-CD2 4.29Å; K456-Y480 HydrophobicContact CG-CE2 4.16Å; T459-Y480 HydrophobicContact CG2-CE2 4.25Å; I460-Y480 HydrophobicContact CD1-CD2 3.91Å; I460-Y480 HydrophobicContact CG1-CD2 3.8Å; I460-Y480 HydrophobicContact CG1-CE2 4.33Å; A475-Y480 PolarHBondContact O-N 3.26Å; A475-Y480 VanDerWaalsContact O-N 3.07Å; L478-Y480 HydrophobicContact CB-CD1 4.24Å; L478-Y480 HydrophobicContact CB-CD2 4.06Å; L478-Y480 HydrophobicContact CB-CE1 4.29Å; L478-Y480 HydrophobicContact CB-CE2 4.12Å; L478-Y480 HydrophobicContact CB-CG 4.12Å; L478-Y480 HydrophobicContact CD1-CD2 4.22Å; L478-Y480 HydrophobicContact CD1-CE2 3.86Å; L478-Y480 WeakPolarHBondContact O-CD1 3.46Å; L478-Y480 PolarHBondContact O-N 3.3Å
481	L	97.4	Very high	97.4	Very high	11 Å²	11	58.5 Å²	58.5	6%	0.058	31%	0.305	C	S	.	.	S	Bend	trans	-163.4	165.9	177.1	52.3	80.1	0	0	0	110.5	L448 I452 A475 V476 Q485 F486 W489	L448-L481 HydrophobicContact CD1-CD2 4.19Å; L448-L481 HydrophobicContact CD2-CD2 3.69Å; I452-L481 HydrophobicContact CD1-CD2 4.43Å; A475-L481 HydrophobicContact CB-CD1 3.6Å; A475-L481 HydrophobicContact CB-CD2 4.14Å; A475-L481 HydrophobicContact CB-CG 3.82Å; V476-L481 HydrophobicContact CG2-CD1 4.38Å; L481-Q485 HydrophobicContact CB-CB 4.11Å; L481-F486 HydrophobicContact CD1-CB 3.75Å; L481-F486 HydrophobicContact CD1-CD2 4.03Å; L481-F486 HydrophobicContact CD1-CG 4.4Å; L481-F486 HydrophobicContact CD2-CD2 4.39Å; L481-W489 HydrophobicContact CB-CH2 4.34Å; L481-W489 HydrophobicContact CB-CZ3 3.77Å; L481-W489 HydrophobicContact CD2-CE3 3.91Å; L481-W489 HydrophobicContact CD2-CZ3 3.77Å; L481-W489 HydrophobicContact CG-CZ3 4.43Å
482	T	97.9	Very high	97.3	Very high	64 Å²	64	60 Å²	60	39%	0.393	31%	0.314	S	S	.	.			trans	-87.7	166.2	172.5	55.9	0	0	0	0	111.6	E484 Q485 F486	T482-E484 VanDerWaalsContact C-N 3.29Å; T482-E484 WeakPolarHBondContact CB-OE2 3.31Å; T482-E484 PolarHBondContact O-N 3.26Å; T482-Q485 PolarHBondContact O-N 2.82Å; T482-Q485 WeakPolarHBondContact OG1-CB 3.24Å; T482-Q485 WeakPolarHBondContact OG1-CG 3.25Å; T482-Q485 PolarHBondContact OG1-N 3.35Å; T482-Q485 PolarHBondContact OG1-OE1 3.06Å; T482-F486 PolarHBondContact O-N 2.86Å
483	E	97.2	Very high	97.1	Very high	104 Å²	104	61.7 Å²	61.7	49%	0.486	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-41.3	175.5	-74	-165.1	-165	0	0	112.1	K472 V476 Q485 F486 D487	K472-E483 VanDerWaalsContact CE-CB 3.48Å; K472-E483 IonicContact NZ-OE2 3.22Å; V476-E483 HydrophobicContact CG2-CG 3.77Å; E483-Q485 VanDerWaalsContact C-N 3.35Å; E483-Q485 PolarHBondContact O-N 2.79Å; E483-F486 WeakPolarHBondContact O-CB 3.29Å; E483-F486 PolarHBondContact O-N 3.31Å; E483-D487 PolarHBondContact O-N 2.84Å
484	E	97.5	Very high	97.1	Very high	137 Å²	137	64.1 Å²	64.1	64%	0.64	34%	0.336	S	S	*	.	H	α-helix	trans	-65.2	-39.5	-179.9	-62	73.9	-162.8	0	0	111.4	T482 D487 Q488	T482-E484 VanDerWaalsContact C-N 3.29Å; T482-E484 WeakPolarHBondContact CB-OE2 3.31Å; T482-E484 PolarHBondContact O-N 3.26Å; E484-D487 PolarHBondContact O-N 3.17Å; E484-Q488 WeakPolarHBondContact O-CB 3.07Å; E484-Q488 PolarHBondContact O-N 2.86Å
485	Q	97.8	Very high	96.9	Very high	66 Å²	66	66.1 Å²	66.1	31%	0.308	35%	0.346	S	S	.	.	H	α-helix	trans	-64.5	-40.8	173.9	-78	170.7	-40.2	0	0	111.7	L481 T482 E483 Q488 W489	L481-Q485 HydrophobicContact CB-CB 4.11Å; T482-Q485 PolarHBondContact O-N 2.82Å; T482-Q485 WeakPolarHBondContact OG1-CB 3.24Å; T482-Q485 WeakPolarHBondContact OG1-CG 3.25Å; T482-Q485 PolarHBondContact OG1-N 3.35Å; T482-Q485 PolarHBondContact OG1-OE1 3.06Å; E483-Q485 VanDerWaalsContact C-N 3.35Å; E483-Q485 PolarHBondContact O-N 2.79Å; Q485-Q488 PolarHBondContact O-N 2.8Å; Q485-W489 HydrophobicContact CB-CD2 4.17Å; Q485-W489 HydrophobicContact CB-CE3 4.16Å; Q485-W489 HydrophobicContact CB-CH2 3.83Å; Q485-W489 HydrophobicContact CB-CZ2 3.81Å; Q485-W489 HydrophobicContact CB-CZ3 4Å; Q485-W489 HydrophobicContact CG-CH2 3.88Å; Q485-W489 HydrophobicContact CG-CZ2 3.64Å; Q485-W489 WeakPolarHBondContact O-CB 3.37Å; Q485-W489 VanDerWaalsContact O-CD2 3.28Å; Q485-W489 PolarHBondContact O-N 2.83Å
486	F	97.9	Very high	96.8	Very high	21 Å²	21	68.6 Å²	68.6	9%	0.092	36%	0.358	C	S	.	.	H	α-helix	trans	-59.6	-49.2	176	-167.4	-85.9	0	0	0	110.8	L448 L471 K472 A475 L481 T482 E483 Q488 W489 V490	L448-F486 HydrophobicContact CD1-CE2 4.21Å; L448-F486 HydrophobicContact CD2-CD2 4.37Å; L471-F486 HydrophobicContact CB-CE2 3.93Å; L471-F486 HydrophobicContact CB-CZ 3.86Å; K472-F486 HydrophobicContact CB-CD1 3.78Å; K472-F486 HydrophobicContact CB-CD2 4.15Å; K472-F486 HydrophobicContact CB-CE1 3.82Å; K472-F486 HydrophobicContact CB-CE2 4.17Å; K472-F486 HydrophobicContact CB-CG 3.95Å; K472-F486 HydrophobicContact CB-CZ 4.01Å; K472-F486 HydrophobicContact CD-CB 4.46Å; K472-F486 HydrophobicContact CD-CD1 3.95Å; K472-F486 HydrophobicContact CD-CG 4.34Å; K472-F486 HydrophobicContact CG-CB 4.08Å; K472-F486 HydrophobicContact CG-CD1 3.84Å; K472-F486 HydrophobicContact CG-CD2 4.39Å; K472-F486 HydrophobicContact CG-CE1 4.39Å; K472-F486 HydrophobicContact CG-CG 3.84Å; A475-F486 HydrophobicContact CB-CD2 4.41Å; L481-F486 HydrophobicContact CD1-CB 3.75Å; L481-F486 HydrophobicContact CD1-CD2 4.03Å; L481-F486 HydrophobicContact CD1-CG 4.4Å; L481-F486 HydrophobicContact CD2-CD2 4.39Å; T482-F486 PolarHBondContact O-N 2.86Å; E483-F486 WeakPolarHBondContact O-CB 3.29Å; E483-F486 PolarHBondContact O-N 3.31Å; F486-Q488 VanDerWaalsContact C-N 3.26Å; F486-Q488 PolarHBondContact O-N 2.83Å; F486-W489 PolarHBondContact O-N 3.47Å; F486-V490 HydrophobicContact CD1-CB 4.12Å; F486-V490 HydrophobicContact CD1-CG2 4.16Å; F486-V490 HydrophobicContact CD2-CG2 4.01Å; F486-V490 HydrophobicContact CE1-CB 3.78Å; F486-V490 HydrophobicContact CE1-CG1 4.04Å; F486-V490 HydrophobicContact CE1-CG2 3.93Å; F486-V490 HydrophobicContact CE2-CG2 3.8Å; F486-V490 HydrophobicContact CG-CG2 4.2Å; F486-V490 HydrophobicContact CZ-CB 4.02Å; F486-V490 HydrophobicContact CZ-CG1 4.06Å; F486-V490 HydrophobicContact CZ-CG2 3.75Å; F486-V490 WeakPolarHBondContact O-CB 3.28Å; F486-V490 PolarHBondContact O-N 2.89Å
487	D	96.3	Very high	96.6	Very high	91 Å²	91	68.5 Å²	68.5	49%	0.487	37%	0.369	S	S	.	.	H	α-helix	trans	-65.7	-31.4	-178.5	-63.8	-19	0	0	0	111.9	K472 E483 E484	K472-D487 WeakPolarHBondContact CE-OD1 3.26Å; K472-D487 IonicContact NZ-OD1 2.74Å; K472-D487 PolarHBondContact NZ-OD1 2.98Å; K472-D487 IonicContact NZ-OD2 3.42Å; K472-D487 PolarHBondContact NZ-OD2 2.91Å; E483-D487 PolarHBondContact O-N 2.84Å; E484-D487 PolarHBondContact O-N 3.17Å
488	Q	96.6	Very high	96.3	Very high	124 Å²	124	69.4 Å²	69.4	58%	0.579	39%	0.385	S	S	*	.	H	α-helix	trans	-73.9	-37.1	175.7	-171.3	-179.9	9.2	0	0	113	E484 Q485 F486 K491	E484-Q488 WeakPolarHBondContact O-CB 3.07Å; E484-Q488 PolarHBondContact O-N 2.86Å; Q485-Q488 PolarHBondContact O-N 2.8Å; F486-Q488 VanDerWaalsContact C-N 3.26Å; F486-Q488 PolarHBondContact O-N 2.83Å; Q488-K491 WeakPolarHBondContact O-CE 3.44Å
489	W	97.5	Very high	95.7	Very high	51 Å²	51	77.7 Å²	77.7	19%	0.193	42%	0.419	C	S	.	.	H	α-helix	trans	-93	-35.4	-172	-59.5	-15.8	0	0	0	113.2	L448 H451 I452 L481 Q485 F486 K491	L448-W489 HydrophobicContact CD2-CB 4.41Å; L448-W489 HydrophobicContact CD2-CE3 4.14Å; H451-W489 HydrophobicContact CB-CD2 3.8Å; H451-W489 HydrophobicContact CB-CE3 3.58Å; H451-W489 HydrophobicContact CB-CG 4.44Å; H451-W489 HydrophobicContact CB-CH2 4.17Å; H451-W489 HydrophobicContact CB-CZ2 4.37Å; H451-W489 HydrophobicContact CB-CZ3 3.78Å; H451-W489 AromaticContact CD2-CD2 3.94Å; H451-W489 AromaticContact CD2-CG 3.66Å; H451-W489 AromaticContact CE1-CD1 3.68Å; H451-W489 AromaticContact CE1-CG 3.85Å; H451-W489 AromaticContact CG-CD2 3.58Å; H451-W489 AromaticContact CG-CE2 3.99Å; H451-W489 AromaticContact CG-CE3 3.87Å; H451-W489 AromaticContact CG-CG 3.73Å; H451-W489 AromaticContact ND1-CD1 3.81Å; H451-W489 AromaticContact ND1-CD2 3.87Å; H451-W489 AromaticContact ND1-CE2 3.86Å; H451-W489 AromaticContact ND1-CG 3.85Å; H451-W489 AromaticContact ND1-NE1 3.83Å; H451-W489 AromaticContact NE2-CD1 3.97Å; H451-W489 AromaticContact NE2-CG 3.76Å; I452-W489 HydrophobicContact CG2-CH2 4.41Å; I452-W489 HydrophobicContact CG2-CZ3 3.77Å; L481-W489 HydrophobicContact CB-CH2 4.34Å; L481-W489 HydrophobicContact CB-CZ3 3.77Å; L481-W489 HydrophobicContact CD2-CE3 3.91Å; L481-W489 HydrophobicContact CD2-CZ3 3.77Å; L481-W489 HydrophobicContact CG-CZ3 4.43Å; Q485-W489 HydrophobicContact CB-CD2 4.17Å; Q485-W489 HydrophobicContact CB-CE3 4.16Å; Q485-W489 HydrophobicContact CB-CH2 3.83Å; Q485-W489 HydrophobicContact CB-CZ2 3.81Å; Q485-W489 HydrophobicContact CB-CZ3 4Å; Q485-W489 HydrophobicContact CG-CH2 3.88Å; Q485-W489 HydrophobicContact CG-CZ2 3.64Å; Q485-W489 WeakPolarHBondContact O-CB 3.37Å; Q485-W489 VanDerWaalsContact O-CD2 3.28Å; Q485-W489 PolarHBondContact O-N 2.83Å; F486-W489 PolarHBondContact O-N 3.47Å; W489-K491 PolarHBondContact O-N 2.85Å
490	V	96.6	Very high	95.6	Very high	12 Å²	12	78.5 Å²	78.5	7%	0.073	41%	0.407	C	S	.	.			trans	-98.2	82.4	-176.6	-171.3	0	0	0	0	109.4	L444 A447 L448 F486 P492	L444-V490 HydrophobicContact CB-CG1 3.69Å; L444-V490 HydrophobicContact CD1-CG1 4.25Å; A447-V490 HydrophobicContact CB-CB 4.5Å; A447-V490 HydrophobicContact CB-CG1 4.32Å; A447-V490 HydrophobicContact CB-CG2 4.26Å; L448-V490 HydrophobicContact CD2-CG2 3.4Å; L448-V490 VanDerWaalsContact CD2-CG2 3.4Å; L448-V490 HydrophobicContact CG-CG2 3.93Å; F486-V490 HydrophobicContact CD1-CB 4.12Å; F486-V490 HydrophobicContact CD1-CG2 4.16Å; F486-V490 HydrophobicContact CD2-CG2 4.01Å; F486-V490 HydrophobicContact CE1-CB 3.78Å; F486-V490 HydrophobicContact CE1-CG1 4.04Å; F486-V490 HydrophobicContact CE1-CG2 3.93Å; F486-V490 HydrophobicContact CE2-CG2 3.8Å; F486-V490 HydrophobicContact CG-CG2 4.2Å; F486-V490 HydrophobicContact CZ-CB 4.02Å; F486-V490 HydrophobicContact CZ-CG1 4.06Å; F486-V490 HydrophobicContact CZ-CG2 3.75Å; F486-V490 WeakPolarHBondContact O-CB 3.28Å; F486-V490 PolarHBondContact O-N 2.89Å; V490-P492 WeakPolarHBondContact O-CD 3.05Å
491	K	96.1	Very high	95.4	Very high	77 Å²	77	78.5 Å²	78.5	34%	0.335	41%	0.412	S	S	.	.			trans	-110.4	102.6	179.1	-68.3	173.7	176.3	173.2	0	110.6	Q488 W489 S493 E494	Q488-K491 WeakPolarHBondContact O-CE 3.44Å; W489-K491 PolarHBondContact O-N 2.85Å; K491-S493 PolarHBondContact O-N 2.91Å; K491-S493 VanDerWaalsContact O-N 3.09Å; K491-E494 HydrophobicContact CB-CB 4.3Å; K491-E494 HydrophobicContact CB-CG 4.04Å; K491-E494 HydrophobicContact CD-CG 4.28Å; K491-E494 WeakPolarHBondContact CD-OE1 2.98Å; K491-E494 IonicContact NZ-OE1 2.71Å; K491-E494 PolarHBondContact NZ-OE1 2.92Å; K491-E494 PolarHBondContact O-N 2.82Å
492	P	94.9	Very high	95.3	Very high	34 Å²	34	82.2 Å²	82.2	22%	0.221	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-54.5	-31.8	179.9	-28.5	35.8	0	0	0	114.1	I218 M438 L444 V490 E494 M495	I218-P492 HydrophobicContact CD1-CB 3.98Å; I218-P492 HydrophobicContact CG2-CB 4.02Å; M438-P492 HydrophobicContact CE-CB 3.7Å; M438-P492 HydrophobicContact CE-CG 3.83Å; L444-P492 HydrophobicContact CD1-CG 4.12Å; L444-P492 HydrophobicContact CD2-CG 4.45Å; V490-P492 WeakPolarHBondContact O-CD 3.05Å; P492-E494 PolarHBondContact O-N 2.94Å; P492-M495 PolarHBondContact O-N 3.25Å; P492-M495 VanDerWaalsContact O-N 3.09Å
493	S	94.8	Very high	95.2	Very high	83 Å²	83	83.3 Å²	83.3	58%	0.58	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-62.9	-23.1	176.2	52.5	0	0	0	0	114	K491	K491-S493 PolarHBondContact O-N 2.91Å; K491-S493 VanDerWaalsContact O-N 3.09Å
494	E	95.4	Very high	95	Very high	96 Å²	96	82 Å²	82	45%	0.449	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-94.4	6.8	177.2	-60.6	-175.1	-163.7	0	0	112.8	K491 P492	K491-E494 HydrophobicContact CB-CB 4.3Å; K491-E494 HydrophobicContact CB-CG 4.04Å; K491-E494 HydrophobicContact CD-CG 4.28Å; K491-E494 WeakPolarHBondContact CD-OE1 2.98Å; K491-E494 IonicContact NZ-OE1 2.71Å; K491-E494 PolarHBondContact NZ-OE1 2.92Å; K491-E494 PolarHBondContact O-N 2.82Å; P492-E494 PolarHBondContact O-N 2.94Å
495	M	95.6	Very high	94.9	Very high	42 Å²	42	78.3 Å²	78.3	21%	0.207	42%	0.417	C	S	.	.	S	Bend	trans	-112.2	20.1	-176.5	-58.2	179.5	70.6	0	0	113.2	L444 A447 P492	L444-M495 HydrophobicContact CD2-CE 4.3Å; L444-M495 HydrophobicContact CD2-SD 3.96Å; A447-M495 HydrophobicContact CB-CE 4.21Å; A447-M495 HydrophobicContact CB-SD 3.98Å; P492-M495 PolarHBondContact O-N 3.25Å; P492-M495 VanDerWaalsContact O-N 3.09Å
496	L	95.9	Very high	94.7	Very high	52 Å²	52	79.2 Å²	79.2	27%	0.272	43%	0.425	S	S	.	.	S	Bend	trans	-110.4	9.7	-170.4	-56.5	179.7	0	0	0	114.8	I218 P230	I218-L496 HydrophobicContact CD1-CD1 3.89Å; I218-L496 HydrophobicContact CG1-CD1 4.02Å; I218-L496 HydrophobicContact CG2-CD2 4.2Å; P230-L496 HydrophobicContact CB-CD2 4.13Å
497	G	93	Very high	94.4	Very high	52 Å²	52	83.7 Å²	83.7	54%	0.536	45%	0.451	S	S	.	.	S	Bend	trans	-171	172.2	-176.9	0	0	0	0	0	114.5
498	P	91.7	Very high	94.3	Very high	140 Å²	140	83.1 Å²	83.1	91%	0.909	45%	0.448	S	S	*	.			trans	-65.8	155.9	176.1	29.4	-34.7	0	0	0	111.7
499	K	83.4	Confident	94.1	Very high	234 Å²	234	79.4 Å²	79.4	100%	1.017	44%	0.436	S	S	*	.			trans	-118.7	0	175.9	-68	-169.6	178.3	-172.9	0	111

Retrieved 499 of 499 residues in 149.5 ms (Link to these results)

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