A0A087XFU5_POEFO Loading...

T-box transcription factor 6

AlphaFold DB , UniProt , Accession A0A087XFU5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 626 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.6	Very low	32	Very low	239 Å²	239	152.2 Å²	152.2	100%	1.177	82%	0.815	S	S	*	*				0	140.7	0	-67.7	160.6	73.4	0	0	107.2
2	L	33.3	Very low	31.8	Very low	153 Å²	153	153.3 Å²	153.3	80%	0.801	81%	0.812	S	S	*	*			trans	10.3	115.3	166.4	-59.1	173.4	0	0	0	117.4
3	N	31.2	Very low	31.9	Very low	145 Å²	145	158.5 Å²	158.5	78%	0.775	81%	0.814	S	S	*	*				69.5	140.2	84.2	-72	20.8	0	0	0	113.3
4	V	31.5	Very low	31.5	Very low	114 Å²	114	160.9 Å²	160.9	69%	0.691	82%	0.823	S	S	*	*			cis	-158.1	-177.7	-4.6	113.8	0	0	0	0	109.8
5	E	32.5	Very low	31.2	Very low	163 Å²	163	154.1 Å²	154.1	76%	0.762	81%	0.809	S	S	*	*			trans	-46.8	175.7	173.2	-46.3	160.7	115.8	0	0	115.8
6	M	32.1	Very low	31	Very low	153 Å²	153	154.4 Å²	154.4	75%	0.754	81%	0.811	S	S	*	*			cis	-149.6	160.3	21	-63.5	-174.5	-69.2	0	0	112.9
7	Y	25.8	Very low	30.9	Very low	231 Å²	231	151.1 Å²	151.1	91%	0.906	80%	0.803	S	S	*	*				-168.7	113.1	129.6	-114.6	-67.3	0	0	0	112.3
8	P	43.7	Very low	30.8	Very low	107 Å²	107	154.3 Å²	154.3	70%	0.695	81%	0.809	S	S	*	*			trans	-100.3	147.4	151.9	34.9	-28	0	0	0	110.3
9	G	28.7	Very low	30.8	Very low	72 Å²	72	157 Å²	157	74%	0.742	81%	0.809	S	S	*	*			trans	-99	-179.7	169.1	0	0	0	0	0	111.8
10	L	30	Very low	30.8	Very low	176 Å²	176	160.3 Å²	160.3	92%	0.921	81%	0.81	S	S	*	*			trans	-161.3	154.6	155.1	-113.1	169.5	0	0	0	111.7
11	T	30	Very low	30.8	Very low	121 Å²	121	158.3 Å²	158.3	74%	0.742	80%	0.802	S	S	*	*			trans	-94	158.4	168.2	48.5	0	0	0	0	110.3
12	Q	28.6	Very low	30.6	Very low	166 Å²	166	158.9 Å²	158.9	78%	0.776	79%	0.791	S	S	*	*			trans	146.9	144.1	131.8	-169.2	165.5	92.5	0	0	113.4
13	R	33.2	Very low	30.4	Very low	221 Å²	221	160.7 Å²	160.7	83%	0.834	80%	0.795	S	S	*	*			trans	13.6	139.5	163.2	-66.4	172.3	169.7	172.6	-5.4	120.6
14	M	26.1	Very low	30.6	Very low	192 Å²	192	158.3 Å²	158.3	95%	0.946	80%	0.796	S	S	*	*				-145.4	162.7	126.1	-146.4	62.6	177	0	0	110.3
15	G	27.2	Very low	30.9	Very low	59 Å²	59	159.1 Å²	159.1	61%	0.608	80%	0.803	S	S	*	*			trans	-157.7	174.3	175.8	0	0	0	0	0	112.2
16	D	28	Very low	31	Very low	158 Å²	158	155.7 Å²	155.7	85%	0.845	80%	0.803	S	S	*	*			trans	68.8	127.9	167.3	-60.9	-20.5	0	0	0	121.1
17	C	29.1	Very low	31	Very low	99 Å²	99	160.5 Å²	160.5	67%	0.669	81%	0.813	S	S	*	*			trans	59.9	128.7	149.3	-55.1	0	0	0	0	119.4
18	F	29.4	Very low	31.4	Very low	208 Å²	208	157.4 Å²	157.4	91%	0.912	81%	0.811	S	S	*	*				-165.8	177.5	58.8	-102	-71.6	0	0	0	114
19	Y	31	Very low	31.5	Very low	206 Å²	206	157 Å²	157	81%	0.808	81%	0.808	S	S	*	*			trans	-117.9	133.8	-175.6	-161	-79.2	0	0	0	110.5
20	R	31.1	Very low	31.7	Very low	223 Å²	223	162.1 Å²	162.1	84%	0.842	82%	0.818	S	S	*	*			trans	-168.1	134.4	167	-117.3	-67.9	168.4	-174.3	-6.8	115
21	D	30	Very low	32	Very low	119 Å²	119	161.5 Å²	161.5	64%	0.636	81%	0.814	S	S	*	*			trans	-71.2	153.6	168.4	-45.7	-89.2	0	0	0	114.2
22	R	30.5	Very low	32.6	Very low	250 Å²	250	160.5 Å²	160.5	94%	0.943	81%	0.81	S	S	*	*				-158.9	147.8	128.1	-158.3	159.1	-178.7	153.4	-0.1	113.4
23	E	29.2	Very low	33.4	Very low	191 Å²	191	158.3 Å²	158.3	89%	0.893	81%	0.81	S	S	*	*			trans	-84.7	176.1	179.3	-68.2	171.1	98.5	0	0	114.9
24	A	34.6	Very low	33.4	Very low	96 Å²	96	154 Å²	154	79%	0.793	81%	0.809	S	S	*	*			trans	-83.2	173	-172.4	0	0	0	0	0	115.6
25	P	38.9	Very low	33.7	Very low	130 Å²	130	151.5 Å²	151.5	84%	0.844	81%	0.808	S	S	*	*			trans	-109.1	157.1	152.5	37.4	-28.9	0	0	0	112.1
26	A	32.8	Very low	34	Very low	91 Å²	91	156 Å²	156	75%	0.752	82%	0.818	S	S	*	*			trans	-130.7	151.8	176.8	0	0	0	0	0	111.8
27	R	32.3	Very low	34.2	Very low	254 Å²	254	153.2 Å²	153.2	96%	0.958	82%	0.817	S	S	*	*			trans	-174.4	157.2	134.7	-100	156.2	-171.1	-159.5	0.4	113.6
28	L	34.4	Very low	34.5	Very low	166 Å²	166	152.8 Å²	152.8	87%	0.869	82%	0.821	S	S	*	*			trans	-109.7	-168.9	-173.5	-77.1	167	0	0	0	109.9
29	P	47.2	Very low	35.7	Very low	99 Å²	99	148.5 Å²	148.5	64%	0.643	81%	0.814	S	S	*	*			cis	-132.2	179	-34.2	27.6	-8	0	0	0	113.1
30	L	31.4	Very low	35.9	Very low	179 Å²	179	150.6 Å²	150.6	94%	0.937	82%	0.82	S	S	*	*			trans	-143.4	156.5	138.7	-82.5	-173.1	0	0	0	110.5
31	L	36.6	Very low	36.5	Very low	163 Å²	163	148.1 Å²	148.1	85%	0.853	82%	0.823	S	S	*	*			trans	-118.6	161.7	-172.8	-82.9	166.9	0	0	0	112.7
32	P	43.3	Very low	36.9	Very low	100 Å²	100	150.8 Å²	150.8	65%	0.649	84%	0.836	S	S	*	*			trans	-95.3	165	-178.4	38.4	-36	0	0	0	114.3
33	P	45.7	Very low	37.4	Very low	120 Å²	120	143 Å²	143	78%	0.779	83%	0.833	S	S	*	*			trans	-72.2	128.2	157.6	31.9	-32	0	0	0	109.5
34	V	31.8	Very low	37.7	Very low	132 Å²	132	138.1 Å²	138.1	80%	0.8	83%	0.826	S	S	*	*				71.5	102.6	65.6	178.2	0	0	0	0	113.1
35	C	32.4	Very low	38.2	Very low	138 Å²	138	137.5 Å²	137.5	93%	0.932	83%	0.829	S	S	*	*			trans	-141.6	138.5	141.1	-91.4	0	0	0	0	106.6
36	D	34.1	Very low	37.9	Very low	153 Å²	153	140.2 Å²	140.2	82%	0.818	83%	0.83	S	S	*	*			trans	-127.9	130.6	-173.8	-176.2	14.8	0	0	0	110.4
37	A	33.2	Very low	38.2	Very low	101 Å²	101	140.6 Å²	140.6	84%	0.835	83%	0.827	S	S	*	*			trans	-169.5	114	173.1	0	0	0	0	0	111
38	A	35.7	Very low	38.5	Very low	90 Å²	90	134 Å²	134	74%	0.744	82%	0.82	S	S	*	*			trans	-134.1	-179.2	169.3	0	0	0	0	0	108.9
39	P	54.2	Low	38.8	Very low	117 Å²	117	130.8 Å²	130.8	76%	0.76	81%	0.812	S	S	*	*			cis	-126.6	165.7	-15.9	39.1	-26.5	0	0	0	112.7
40	R	34.4	Very low	38.3	Very low	250 Å²	250	134.9 Å²	134.9	94%	0.943	82%	0.819	S	S	*	*			trans	-147.7	137.3	143.3	-76.4	-152.5	171.4	-167.5	-4.6	112.2
41	L	42.8	Very low	38.8	Very low	172 Å²	172	132.3 Å²	132.3	90%	0.901	81%	0.814	S	S	*	*			trans	-76	130.4	170.1	-73.2	129.9	0	0	0	110.7
42	L	39	Very low	39.1	Very low	174 Å²	174	132.2 Å²	132.2	91%	0.911	81%	0.809	S	S	*	*			trans	-148.3	121.4	135.6	-83.1	-171.6	0	0	0	108.1
43	G	42.2	Very low	39.5	Very low	86 Å²	86	137 Å²	137	89%	0.887	82%	0.819	S	S	*	*			trans	-84.5	118.6	173.3	0	0	0	0	0	110.6
44	A	35.8	Very low	40.6	Very low	90 Å²	90	136.9 Å²	136.9	74%	0.744	81%	0.812	S	S	*	*			trans	-122.3	128.2	163.5	0	0	0	0	0	107.8	E46	A44-E46 PolarHBondContact O-N 3.11Å; A44-E46 VanDerWaalsContact O-N 3.11Å
45	G	44.2	Very low	43.2	Very low	82 Å²	82	136.4 Å²	136.4	85%	0.845	80%	0.801	S	S	*	*			trans	-77.1	97.4	-175.4	0	0	0	0	0	112	S47	G45-S47 PolarHBondContact O-N 3.41Å
46	E	31.7	Very low	46.2	Very low	187 Å²	187	130.7 Å²	130.7	87%	0.874	76%	0.762	S	S	*	*			trans	-70	96.1	166.3	-69.8	-163.4	138.4	0	0	110	A44 S48	A44-E46 PolarHBondContact O-N 3.11Å; A44-E46 VanDerWaalsContact O-N 3.11Å; E46-S48 PolarHBondContact O-N 3.02Å
47	S	39.8	Very low	49.1	Very low	99 Å²	99	129.7 Å²	129.7	69%	0.692	75%	0.747	S	S	*	*			trans	-62.3	115.8	162.8	47.3	0	0	0	0	108.3	G45 S49	G45-S47 PolarHBondContact O-N 3.41Å; S47-S49 PolarHBondContact O-N 2.81Å; S47-S49 PolarHBondContact O-OG 3.4Å
48	S	38.5	Very low	52.2	Low	115 Å²	115	125.4 Å²	125.4	80%	0.804	71%	0.71	S	S	*	*			trans	-78.2	54	-172.6	54.1	0	0	0	0	113.1	E46 K50	E46-S48 PolarHBondContact O-N 3.02Å; S48-K50 PolarHBondContact O-N 2.78Å
49	S	39.9	Very low	55.1	Low	100 Å²	100	125.7 Å²	125.7	70%	0.699	70%	0.699	S	S	*	*			trans	-66.4	81.5	167.3	49.1	0	0	0	0	110	S47 P51	S47-S49 PolarHBondContact O-N 2.81Å; S47-S49 PolarHBondContact O-OG 3.4Å; S49-P51 VanDerWaalsContact O-N 3.17Å
50	K	37.2	Very low	57.2	Low	184 Å²	184	121 Å²	121	80%	0.8	67%	0.667	S	S	*	*			trans	-43.8	126	157.3	-65.6	177.4	-178.3	175.4	0	106.9	S48 Q52	S48-K50 PolarHBondContact O-N 2.78Å; K50-Q52 PolarHBondContact O-N 3.19Å
51	P	41.8	Very low	60.2	Low	126 Å²	126	110.1 Å²	110.1	82%	0.818	63%	0.627	S	S	*	*			trans	-56.9	117.1	179.3	22.6	-32.4	0	0	0	107.6	S49 K53	S49-P51 VanDerWaalsContact O-N 3.17Å; P51-K53 PolarHBondContact O-N 2.96Å
52	Q	44.1	Very low	62.7	Low	161 Å²	161	106.4 Å²	106.4	75%	0.752	61%	0.608	S	S	*	*			trans	-61.7	108.5	177.3	-88.4	-175.1	-63.4	0	0	107	K50 D54	K50-Q52 PolarHBondContact O-N 3.19Å; Q52-D54 PolarHBondContact O-N 3.01Å
53	K	51.4	Low	65.4	Low	199 Å²	199	99 Å²	99	87%	0.865	57%	0.571	S	S	*	*			trans	-72.4	90.7	169	-173.4	-179.6	-176.4	-177.6	0	105.5	P51 E55	P51-K53 PolarHBondContact O-N 2.96Å; K53-E55 PolarHBondContact O-N 2.93Å
54	D	67.5	Low	68.1	Low	119 Å²	119	99.8 Å²	99.8	64%	0.636	56%	0.56	S	S	*	*			trans	-47	112.7	-169.9	-76.5	-39.7	0	0	0	111.3	Q52	Q52-D54 PolarHBondContact O-N 3.01Å
55	E	88.3	Confident	71	Confident	121 Å²	121	97.4 Å²	97.4	57%	0.565	54%	0.535	S	S	*	.			trans	-80.5	124.7	-179.6	-178.9	179.9	-135	0	0	108	K53 R57	K53-E55 PolarHBondContact O-N 2.93Å; E55-R57 HydrophobicContact CG-CG 4.27Å; E55-R57 WeakPolarHBondContact O-CG 3.33Å; E55-R57 PolarHBondContact O-N 2.9Å; E55-R57 IonicContact OE2-CZ 3.62Å; E55-R57 IonicContact OE2-NE 3.71Å; E55-R57 PolarHBondContact OE2-NE 2.92Å; E55-R57 IonicContact OE2-NH2 2.65Å; E55-R57 PolarHBondContact OE2-NH2 3.46Å
56	V	94.1	Very high	73.6	Confident	18 Å²	18	93.6 Å²	93.6	11%	0.109	50%	0.495	C	S	.	.			trans	-66	111.7	179	-172.6	0	0	0	0	109	L93 S94 L96 H201 F203	V56-L93 HydrophobicContact CG1-CD1 3.73Å; V56-S94 WeakPolarHBondContact CA-O 3.28Å; V56-L96 HydrophobicContact CB-CD2 4.38Å; V56-L96 HydrophobicContact CG1-CD2 3.49Å; V56-L96 VanDerWaalsContact CG1-CD2 3.49Å; V56-L96 HydrophobicContact CG1-CG 4.26Å; V56-L96 HydrophobicContact CG2-CD2 3.91Å; V56-H201 HydrophobicContact CG1-CB 4.44Å; V56-F203 HydrophobicContact CB-CZ 4.4Å; V56-F203 HydrophobicContact CG1-CE2 4.39Å; V56-F203 HydrophobicContact CG1-CZ 3.91Å; V56-F203 WeakPolarHBondContact O-CE1 3.13Å; V56-F203 WeakPolarHBondContact O-CZ 3.5Å
57	R	95.8	Very high	76.8	Confident	132 Å²	132	90 Å²	90	50%	0.498	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	138.5	-174.6	-73.8	167.7	-177.3	178.5	1.7	110.8	E55 L93 S94	E55-R57 HydrophobicContact CG-CG 4.27Å; E55-R57 WeakPolarHBondContact O-CG 3.33Å; E55-R57 PolarHBondContact O-N 2.9Å; E55-R57 IonicContact OE2-CZ 3.62Å; E55-R57 IonicContact OE2-NE 3.71Å; E55-R57 PolarHBondContact OE2-NE 2.92Å; E55-R57 IonicContact OE2-NH2 2.65Å; E55-R57 PolarHBondContact OE2-NH2 3.46Å; R57-L93 WeakPolarHBondContact O-CA 3.34Å; R57-L93 WeakPolarHBondContact O-CD1 3.35Å; R57-S94 PolarHBondContact N-O 3.44Å; R57-S94 PolarHBondContact O-N 2.73Å; R57-S94 PolarHBondContact O-OG 2.78Å
58	M	97.2	Very high	79.6	Confident	12 Å²	12	89.9 Å²	89.9	6%	0.059	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.5	-178	-170.3	177.2	-77.6	0	0	110.2	L91 K92 L93 V185 V187 F203 F205	M58-L91 HydrophobicContact CG-CB 4.15Å; M58-L91 HydrophobicContact CG-CD1 4.44Å; M58-L91 HydrophobicContact CG-CD2 4.43Å; M58-L91 HydrophobicContact SD-CB 4.38Å; M58-L91 HydrophobicContact SD-CD1 3.64Å; M58-L91 HydrophobicContact SD-CD2 4.41Å; M58-L91 HydrophobicContact SD-CG 4.35Å; M58-K92 CarbonylContact C-O 3.51Å; M58-K92 VanDerWaalsContact CA-O 3.26Å; M58-K92 WeakPolarHBondContact CA-O 3.43Å; M58-K92 WeakPolarHBondContact CG-O 3.24Å; M58-L93 HydrophobicContact CB-CD1 4.21Å; M58-L93 HydrophobicContact CE-CD1 3.84Å; M58-L93 HydrophobicContact CE-CD2 3.97Å; M58-L93 HydrophobicContact CE-CG 4.38Å; M58-V185 HydrophobicContact CE-CG1 3.89Å; M58-V185 HydrophobicContact SD-CB 4.02Å; M58-V185 HydrophobicContact SD-CG1 3.77Å; M58-V187 HydrophobicContact CE-CG2 3.52Å; M58-F203 HydrophobicContact CB-CB 4.27Å; M58-F203 HydrophobicContact CB-CD1 3.63Å; M58-F203 HydrophobicContact CB-CD2 3.88Å; M58-F203 HydrophobicContact CB-CE1 3.87Å; M58-F203 HydrophobicContact CB-CE2 4.11Å; M58-F203 HydrophobicContact CB-CG 3.64Å; M58-F203 HydrophobicContact CB-CZ 4.1Å; M58-F203 HydrophobicContact CE-CD2 3.55Å; M58-F203 HydrophobicContact CE-CE2 3.86Å; M58-F203 HydrophobicContact CE-CG 4.32Å; M58-F203 HydrophobicContact CG-CD2 4.41Å; M58-F203 HydrophobicContact CG-CG 4.32Å; M58-F203 HydrophobicContact SD-CB 3.83Å; M58-F203 HydrophobicContact SD-CD2 3.63Å; M58-F203 HydrophobicContact SD-CE2 4.42Å; M58-F203 HydrophobicContact SD-CG 3.82Å; M58-F205 HydrophobicContact CB-CZ 4.32Å; M58-F205 HydrophobicContact CG-CE2 4.43Å; M58-F205 HydrophobicContact CG-CZ 4.06Å; M58-F205 WeakPolarHBondContact O-CE1 3.23Å; M58-F205 WeakPolarHBondContact O-CZ 3.42Å; M58-F205 HydrophobicContact SD-CE2 4.34Å
59	D	97.6	Very high	82.4	Confident	96 Å²	96	84.4 Å²	84.4	51%	0.513	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134.6	-177.6	-57.9	-51.2	0	0	0	110.9	E61 L91 K92	D59-E61 PolarHBondContact O-N 3.35Å; D59-L91 CarbonylContact O-C 3.56Å; D59-L91 VanDerWaalsContact O-CA 3.27Å; D59-L91 WeakPolarHBondContact O-CA 3.47Å; D59-K92 HydrophobicContact CB-CB 4.39Å; D59-K92 PolarHBondContact N-O 3.25Å; D59-K92 PolarHBondContact O-N 3.37Å
60	L	98.1	Very high	85.2	Confident	18 Å²	18	82 Å²	82	9%	0.094	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	111.1	174.6	179.7	64.9	0	0	0	111	S63 W66 L89 L91 F205 E207 T208	L60-S63 PolarHBondContact O-N 3.05Å; L60-W66 HydrophobicContact CD2-CB 4.13Å; L60-W66 HydrophobicContact CD2-CG 3.99Å; L60-L89 HydrophobicContact CD1-CD1 3.79Å; L60-L91 HydrophobicContact CD1-CD2 3.93Å; L60-F205 HydrophobicContact CB-CD1 3.73Å; L60-F205 HydrophobicContact CB-CD2 4.46Å; L60-F205 HydrophobicContact CB-CE1 3.84Å; L60-F205 HydrophobicContact CB-CG 4.06Å; L60-F205 HydrophobicContact CB-CZ 4.26Å; L60-F205 HydrophobicContact CD2-CB 4.07Å; L60-F205 HydrophobicContact CD2-CD1 4.45Å; L60-F205 HydrophobicContact CD2-CG 4.25Å; L60-E207 HydrophobicContact CD2-CG 3.62Å; L60-T208 HydrophobicContact CD1-CG2 4.1Å; L60-T208 HydrophobicContact CD2-CG2 3.67Å
61	E	97.2	Very high	88.1	Confident	22 Å²	22	78 Å²	78	10%	0.103	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	144.5	172.7	-65.4	-166.7	163.8	0	0	111.2	D59 S63 R90 K92 T154	D59-E61 PolarHBondContact O-N 3.35Å; E61-S63 PolarHBondContact O-N 3.01Å; E61-R90 HydrophobicContact CB-CB 3.86Å; E61-R90 HydrophobicContact CG-CB 4.44Å; E61-R90 PolarHBondContact N-O 3.32Å; E61-R90 IonicContact OE2-CZ 2.7Å; E61-R90 IonicContact OE2-NE 2.88Å; E61-R90 PolarHBondContact OE2-NE 3.01Å; E61-R90 IonicContact OE2-NH2 3.2Å; E61-R90 PolarHBondContact OE2-NH2 2.7Å; E61-K92 HydrophobicContact CG-CG 3.96Å; E61-K92 WeakPolarHBondContact OE1-CE 3.26Å; E61-K92 WeakPolarHBondContact OE1-CG 3.39Å; E61-T154 VanDerWaalsContact CD-CG2 3.43Å; E61-T154 WeakPolarHBondContact OE1-CG2 3.3Å; E61-T154 PolarHBondContact OE1-OG1 3.28Å; E61-T154 WeakPolarHBondContact OE2-CG2 3.26Å; E61-T154 PolarHBondContact OE2-OG1 2.79Å
62	N	94.6	Very high	90.7	Very high	94 Å²	94	74 Å²	74	50%	0.503	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	30.3	-175.7	-57.9	-13.5	0	0	0	113.5	P64 L65 W66	N62-P64 VanDerWaalsContact O-N 3.13Å; N62-L65 HydrophobicContact CB-CB 4.43Å; N62-L65 WeakPolarHBondContact O-CB 3.16Å; N62-L65 PolarHBondContact O-N 2.85Å; N62-W66 PolarHBondContact O-N 3.4Å
63	S	97.1	Very high	93.2	Very high	19 Å²	19	67.5 Å²	67.5	13%	0.133	36%	0.355	C	S	.	.	H	α-helix	trans	-44.6	-37.6	170.5	170	0	0	0	0	114.1	L60 E61 L65 W66 K67 E207	L60-S63 PolarHBondContact O-N 3.05Å; E61-S63 PolarHBondContact O-N 3.01Å; S63-L65 VanDerWaalsContact C-N 3.34Å; S63-L65 PolarHBondContact O-N 3.26Å; S63-W66 PolarHBondContact O-N 2.71Å; S63-K67 WeakPolarHBondContact O-CB 3.36Å; S63-K67 WeakPolarHBondContact O-CG 3.44Å; S63-K67 PolarHBondContact O-N 3.45Å; S63-K67 WeakPolarHBondContact OG-CE 3.26Å; S63-K67 PolarHBondContact OG-NZ 2.89Å; S63-E207 PolarHBondContact OG-OE1 2.88Å
64	P	98	Very high	95.5	Very high	101 Å²	101	58.3 Å²	58.3	66%	0.656	32%	0.315	S	S	*	.	H	α-helix	trans	-57.8	-38.6	172.9	-27.9	36.8	0	0	0	114.7	N62 K67 Q68	N62-P64 VanDerWaalsContact O-N 3.13Å; P64-K67 PolarHBondContact O-N 3.37Å; P64-Q68 PolarHBondContact O-N 3.3Å
65	L	97.9	Very high	97	Very high	41 Å²	41	52.6 Å²	52.6	22%	0.215	28%	0.284	C	S	.	.	H	α-helix	trans	-71.2	-40	176.2	-177.9	64.4	0	0	0	111.1	N62 S63 K67 Q68 F69 P87	N62-L65 HydrophobicContact CB-CB 4.43Å; N62-L65 WeakPolarHBondContact O-CB 3.16Å; N62-L65 PolarHBondContact O-N 2.85Å; S63-L65 VanDerWaalsContact C-N 3.34Å; S63-L65 PolarHBondContact O-N 3.26Å; L65-K67 VanDerWaalsContact C-N 3.35Å; L65-Q68 WeakPolarHBondContact O-CB 3.37Å; L65-Q68 PolarHBondContact O-N 3.19Å; L65-F69 HydrophobicContact CD1-CD2 4.23Å; L65-F69 HydrophobicContact CD1-CE2 3.89Å; L65-F69 HydrophobicContact CG-CD2 4.23Å; L65-F69 HydrophobicContact CG-CE2 4.12Å; L65-F69 WeakPolarHBondContact O-CD2 3.39Å; L65-F69 PolarHBondContact O-N 3.37Å; L65-F69 VanDerWaalsContact O-N 3.08Å; L65-P87 HydrophobicContact CD2-CB 4.17Å; L65-P87 HydrophobicContact CD2-CG 4.05Å; L65-P87 HydrophobicContact CG-CG 4Å
66	W	98.4	Very high	97.5	Very high	1 Å²	1	47 Å²	47	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-43.9	172.7	-80.4	104.5	0	0	0	111.8	L60 N62 S63 Q68 F69 S70 M76 P87 L89 E207 T208	L60-W66 HydrophobicContact CD2-CB 4.13Å; L60-W66 HydrophobicContact CD2-CG 3.99Å; N62-W66 PolarHBondContact O-N 3.4Å; S63-W66 PolarHBondContact O-N 2.71Å; W66-Q68 VanDerWaalsContact C-N 3.33Å; W66-Q68 PolarHBondContact O-N 2.84Å; W66-F69 PolarHBondContact O-N 3.24Å; W66-S70 VanDerWaalsContact O-CB 3.3Å; W66-S70 WeakPolarHBondContact O-CB 3.47Å; W66-S70 PolarHBondContact O-N 2.88Å; W66-M76 HydrophobicContact CH2-CE 3.69Å; W66-M76 HydrophobicContact CZ3-CE 3.78Å; W66-P87 HydrophobicContact CD2-CB 4.12Å; W66-P87 HydrophobicContact CD2-CG 4.18Å; W66-P87 HydrophobicContact CE3-CG 4.41Å; W66-P87 WeakPolarHBondContact CH2-O 3.35Å; W66-P87 HydrophobicContact CZ2-CB 3.97Å; W66-P87 VanDerWaalsContact CZ2-O 3.22Å; W66-P87 WeakPolarHBondContact CZ2-O 3.37Å; W66-L89 HydrophobicContact CZ2-CB 4.36Å; W66-L89 HydrophobicContact CZ2-CD1 4.43Å; W66-E207 HydrophobicContact CB-CB 4.36Å; W66-E207 HydrophobicContact CB-CG 3.71Å; W66-T208 HydrophobicContact CD2-CG2 3.85Å; W66-T208 HydrophobicContact CE3-CG2 3.91Å; W66-T208 HydrophobicContact CG-CG2 4.31Å; W66-T208 HydrophobicContact CH2-CG2 4.38Å; W66-T208 HydrophobicContact CZ2-CG2 4.34Å; W66-T208 HydrophobicContact CZ3-CG2 4.17Å
67	K	98.4	Very high	97.7	Very high	112 Å²	112	47.3 Å²	47.3	49%	0.487	26%	0.259	S	S	.	.	H	α-helix	trans	-61.9	-36.6	174.4	-76.2	164.9	173.8	147.3	0	112.7	S63 P64 L65 S70 S71 E207	S63-K67 WeakPolarHBondContact O-CB 3.36Å; S63-K67 WeakPolarHBondContact O-CG 3.44Å; S63-K67 PolarHBondContact O-N 3.45Å; S63-K67 WeakPolarHBondContact OG-CE 3.26Å; S63-K67 PolarHBondContact OG-NZ 2.89Å; P64-K67 PolarHBondContact O-N 3.37Å; L65-K67 VanDerWaalsContact C-N 3.35Å; K67-S70 PolarHBondContact O-N 2.91Å; K67-S71 PolarHBondContact O-N 2.88Å; K67-S71 PolarHBondContact O-OG 2.9Å; K67-E207 WeakPolarHBondContact CE-OE1 3.42Å; K67-E207 HydrophobicContact CG-CB 3.82Å; K67-E207 HydrophobicContact CG-CG 4.08Å; K67-E207 IonicContact NZ-OE1 2.85Å; K67-E207 PolarHBondContact NZ-OE1 2.83Å; K67-E207 VanDerWaalsContact NZ-OE1 3.16Å
68	Q	98.3	Very high	97.8	Very high	96 Å²	96	41.1 Å²	41.1	45%	0.449	24%	0.236	S	C	.	.	H	α-helix	trans	-66.8	-33.7	174.1	-171.6	179.9	14.6	0	0	113.3	P64 L65 W66 S71 L224	P64-Q68 PolarHBondContact O-N 3.3Å; L65-Q68 WeakPolarHBondContact O-CB 3.37Å; L65-Q68 PolarHBondContact O-N 3.19Å; W66-Q68 VanDerWaalsContact C-N 3.33Å; W66-Q68 PolarHBondContact O-N 2.84Å; Q68-S71 PolarHBondContact O-OG 2.86Å; Q68-L224 HydrophobicContact CG-CD1 4.42Å; Q68-L224 HydrophobicContact CG-CD2 4.04Å
69	F	98.4	Very high	97.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-75.4	-40.8	170	-82.4	-75.4	0	0	0	111.8	L65 W66 S71 V72 G73 T74 F86 P87 I221 L224 K225	L65-F69 HydrophobicContact CD1-CD2 4.23Å; L65-F69 HydrophobicContact CD1-CE2 3.89Å; L65-F69 HydrophobicContact CG-CD2 4.23Å; L65-F69 HydrophobicContact CG-CE2 4.12Å; L65-F69 WeakPolarHBondContact O-CD2 3.39Å; L65-F69 PolarHBondContact O-N 3.37Å; L65-F69 VanDerWaalsContact O-N 3.08Å; W66-F69 PolarHBondContact O-N 3.24Å; F69-S71 PolarHBondContact O-N 3.47Å; F69-V72 PolarHBondContact O-N 2.95Å; F69-G73 CarbonylContact O-C 3.51Å; F69-G73 PolarHBondContact O-N 3.13Å; F69-T74 VanDerWaalsContact C-OG1 3.32Å; F69-T74 HydrophobicContact CB-CG2 4.12Å; F69-T74 PolarHBondContact O-N 2.98Å; F69-T74 PolarHBondContact O-OG1 3.2Å; F69-F86 HydrophobicContact CE2-CD1 4.44Å; F69-F86 AromaticContact CE2-CE1 3.92Å; F69-F86 HydrophobicContact CE2-CE1 3.92Å; F69-F86 HydrophobicContact CZ-CD1 4.29Å; F69-F86 AromaticContact CZ-CE1 3.95Å; F69-F86 HydrophobicContact CZ-CE1 3.95Å; F69-P87 HydrophobicContact CD2-CG 3.39Å; F69-P87 HydrophobicContact CE2-CG 3.58Å; F69-P87 HydrophobicContact CG-CG 4.35Å; F69-I221 HydrophobicContact CD1-CD1 4Å; F69-I221 HydrophobicContact CD1-CG2 4.38Å; F69-I221 HydrophobicContact CE1-CG2 4.28Å; F69-L224 HydrophobicContact CD1-CB 4.22Å; F69-L224 HydrophobicContact CD1-CD1 4.29Å; F69-L224 HydrophobicContact CE1-CB 3.46Å; F69-L224 VanDerWaalsContact CE1-CB 3.46Å; F69-L224 HydrophobicContact CE1-CD1 4.34Å; F69-L224 HydrophobicContact CZ-CB 3.67Å; F69-K225 HydrophobicContact CE1-CD 3.66Å; F69-K225 HydrophobicContact CE1-CG 3.91Å; F69-K225 HydrophobicContact CZ-CD 3.89Å; F69-K225 HydrophobicContact CZ-CG 4.27Å
70	S	98.1	Very high	97.9	Very high	49 Å²	49	45.7 Å²	45.7	34%	0.343	26%	0.255	S	S	.	.	H	α-helix	trans	-61.6	-41	-178.4	-173.9	0	0	0	0	112.5	W66 K67 V72 G73 T74	W66-S70 VanDerWaalsContact O-CB 3.3Å; W66-S70 WeakPolarHBondContact O-CB 3.47Å; W66-S70 PolarHBondContact O-N 2.88Å; K67-S70 PolarHBondContact O-N 2.91Å; S70-V72 PolarHBondContact O-N 2.95Å; S70-G73 PolarHBondContact O-N 3Å; S70-G73 VanDerWaalsContact O-N 3.13Å; S70-T74 WeakPolarHBondContact CA-OG1 3.41Å; S70-T74 PolarHBondContact N-OG1 3.5Å
71	S	97.8	Very high	97.8	Very high	100 Å²	100	53.5 Å²	53.5	70%	0.699	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-19.7	178.1	62.8	0	0	0	0	114.5	K67 Q68 F69	K67-S71 PolarHBondContact O-N 2.88Å; K67-S71 PolarHBondContact O-OG 2.9Å; Q68-S71 PolarHBondContact O-OG 2.86Å; F69-S71 PolarHBondContact O-N 3.47Å
72	V	97.1	Very high	97.9	Very high	44 Å²	44	52.9 Å²	52.9	27%	0.267	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-12.5	175.9	-176.9	0	0	0	0	111.7	F69 S70 N218 K220 I221 L224	F69-V72 PolarHBondContact O-N 2.95Å; S70-V72 PolarHBondContact O-N 2.95Å; V72-N218 WeakPolarHBondContact CG1-ND2 3.07Å; V72-N218 PolarHBondContact O-ND2 2.56Å; V72-K220 HydrophobicContact CG1-CB 3.67Å; V72-I221 HydrophobicContact CB-CD1 3.75Å; V72-I221 HydrophobicContact CG1-CD1 3.57Å; V72-I221 HydrophobicContact CG1-CG1 3.9Å; V72-L224 HydrophobicContact CB-CD1 4.36Å; V72-L224 HydrophobicContact CG2-CD1 3.97Å
73	G	97.2	Very high	98	Very high	24 Å²	24	54.9 Å²	54.9	25%	0.247	29%	0.288	C	S	.	.			trans	89.6	88.6	-173.8	0	0	0	0	0	111.7	F69 S70 E75 I221	F69-G73 CarbonylContact O-C 3.51Å; F69-G73 PolarHBondContact O-N 3.13Å; S70-G73 PolarHBondContact O-N 3Å; S70-G73 VanDerWaalsContact O-N 3.13Å; G73-E75 PolarHBondContact O-N 3.39Å; G73-I221 VanDerWaalsContact O-CD1 3.26Å; G73-I221 WeakPolarHBondContact O-CD1 3.34Å
74	T	98.6	Very high	98.1	Very high	5 Å²	5	59.8 Å²	59.8	3%	0.031	30%	0.304	C	S	.	.			trans	-54.7	124.1	-176.2	-47.6	0	0	0	0	112.5	F69 S70 M76 Q209 F210 I211	F69-T74 VanDerWaalsContact C-OG1 3.32Å; F69-T74 HydrophobicContact CB-CG2 4.12Å; F69-T74 PolarHBondContact O-N 2.98Å; F69-T74 PolarHBondContact O-OG1 3.2Å; S70-T74 WeakPolarHBondContact CA-OG1 3.41Å; S70-T74 PolarHBondContact N-OG1 3.5Å; T74-M76 HydrophobicContact CG2-CE 4.06Å; T74-Q209 WeakPolarHBondContact CB-O 3.46Å; T74-Q209 PolarHBondContact OG1-O 3.03Å; T74-F210 HydrophobicContact CG2-CB 3.73Å; T74-F210 CarbonylContact O-C 3.57Å; T74-F210 WeakPolarHBondContact O-CA 3.41Å; T74-F210 VanDerWaalsContact O-CB 3.32Å; T74-F210 WeakPolarHBondContact O-CB 3.19Å; T74-I211 PolarHBondContact O-N 2.9Å
75	E	98.7	Very high	98.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	141.1	171.2	-59.6	176.7	-164.7	0	0	111.5	G73 W123 I211 V213 Y216 Q217 N218 I221 K225	G73-E75 PolarHBondContact O-N 3.39Å; E75-W123 HydrophobicContact CG-CZ2 4.02Å; E75-I211 CarbonylContact C-O 3.59Å; E75-I211 VanDerWaalsContact CA-O 3.31Å; E75-I211 WeakPolarHBondContact CA-O 3.5Å; E75-V213 HydrophobicContact CB-CG1 4.41Å; E75-V213 HydrophobicContact CB-CG2 4.01Å; E75-V213 HydrophobicContact CG-CG1 4.39Å; E75-Y216 HydrophobicContact CB-CD1 4.02Å; E75-Y216 HydrophobicContact CB-CE1 4.38Å; E75-Y216 WeakPolarHBondContact OE2-CA 3.42Å; E75-Q217 PolarHBondContact OE2-N 3.44Å; E75-N218 WeakPolarHBondContact OE1-CB 3.13Å; E75-N218 PolarHBondContact OE1-N 2.8Å; E75-I221 HydrophobicContact CB-CG2 4.09Å; E75-I221 HydrophobicContact CG-CG1 4.3Å; E75-I221 HydrophobicContact CG-CG2 4.42Å; E75-K225 WeakPolarHBondContact O-CE 3.43Å; E75-K225 PolarHBondContact O-NZ 2.86Å
76	M	98.7	Very high	98.1	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.015	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122.3	174.5	-69.4	-65.5	-176	0	0	111.3	W66 T74 M85 F86 L162 F210 I211 T212 V213	W66-M76 HydrophobicContact CH2-CE 3.69Å; W66-M76 HydrophobicContact CZ3-CE 3.78Å; T74-M76 HydrophobicContact CG2-CE 4.06Å; M76-M85 HydrophobicContact CE-CB 4.12Å; M76-M85 HydrophobicContact CE-CG 4.47Å; M76-M85 HydrophobicContact SD-CB 4.1Å; M76-M85 HydrophobicContact SD-CG 4.33Å; M76-F86 WeakPolarHBondContact CE-O 3.37Å; M76-F86 VanDerWaalsContact SD-O 3.4Å; M76-L162 HydrophobicContact CB-CD1 4.03Å; M76-L162 HydrophobicContact CG-CD1 4.46Å; M76-F210 HydrophobicContact CB-CD2 3.71Å; M76-F210 HydrophobicContact CB-CE2 3.93Å; M76-F210 HydrophobicContact CB-CG 4.07Å; M76-F210 HydrophobicContact CB-CZ 4.44Å; M76-F210 HydrophobicContact CE-CD1 4.05Å; M76-F210 HydrophobicContact CG-CB 3.8Å; M76-F210 HydrophobicContact CG-CD1 3.58Å; M76-F210 HydrophobicContact CG-CD2 3.55Å; M76-F210 HydrophobicContact CG-CE1 3.93Å; M76-F210 HydrophobicContact CG-CE2 3.93Å; M76-F210 HydrophobicContact CG-CG 3.37Å; M76-F210 HydrophobicContact CG-CZ 4.11Å; M76-I211 PolarHBondContact N-O 3.2Å; M76-T212 WeakPolarHBondContact O-CA 3.34Å; M76-V213 PolarHBondContact O-N 3.48Å
77	I	98.6	Very high	98.1	Very high	24 Å²	24	55.7 Å²	55.7	12%	0.123	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	129	175.9	-63.7	-78.9	0	0	0	109.9	T79 R83 V213 Y216	I77-T79 HydrophobicContact CG2-CG2 3.86Å; I77-R83 HydrophobicContact CB-CG 4.15Å; I77-R83 HydrophobicContact CG2-CG 3.97Å; I77-R83 VanDerWaalsContact O-CB 3.3Å; I77-R83 WeakPolarHBondContact O-CB 3.21Å; I77-R83 WeakPolarHBondContact O-CG 3.02Å; I77-V213 CarbonylContact C-O 3.57Å; I77-V213 VanDerWaalsContact CA-O 3.26Å; I77-V213 WeakPolarHBondContact CA-O 3.26Å; I77-V213 HydrophobicContact CD1-CG2 3.99Å; I77-Y216 HydrophobicContact CD1-CD1 4.02Å; I77-Y216 HydrophobicContact CD1-CD2 4.24Å; I77-Y216 HydrophobicContact CD1-CE1 4Å; I77-Y216 HydrophobicContact CD1-CE2 4.23Å; I77-Y216 HydrophobicContact CD1-CG 4.13Å; I77-Y216 HydrophobicContact CG1-CD1 4.1Å; I77-Y216 HydrophobicContact CG1-CD2 4.49Å; I77-Y216 HydrophobicContact CG1-CE1 3.55Å; I77-Y216 HydrophobicContact CG1-CE2 4Å; I77-Y216 VanDerWaalsContact CG1-CZ 3.48Å
78	I	98.5	Very high	98	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.01	27%	0.265	C	S	.	.			trans	-114.4	141.2	170.9	65.9	176.1	0	0	0	110.5	L162 N164 L175 T212 V213	I78-L162 HydrophobicContact CG2-CB 3.7Å; I78-L162 HydrophobicContact CG2-CD1 4.46Å; I78-N164 HydrophobicContact CD1-CB 3.72Å; I78-N164 HydrophobicContact CG1-CB 4.04Å; I78-L175 WeakPolarHBondContact CD1-O 3.41Å; I78-T212 HydrophobicContact CG2-CG2 3.84Å; I78-V213 PolarHBondContact N-O 2.96Å
79	T	98.4	Very high	98	Very high	48 Å²	48	47.2 Å²	47.2	29%	0.294	24%	0.244	S	C	.	.			trans	-145.1	156.8	-179	73	0	0	0	0	112.5	I77 K81 G82 R83 T163	I77-T79 HydrophobicContact CG2-CG2 3.86Å; T79-K81 PolarHBondContact O-N 3.27Å; T79-K81 VanDerWaalsContact O-N 3.08Å; T79-G82 WeakPolarHBondContact O-CA 3.28Å; T79-G82 PolarHBondContact O-N 3.46Å; T79-R83 HydrophobicContact CG2-CB 4.29Å; T79-T163 WeakPolarHBondContact O-CA 3.26Å; T79-T163 WeakPolarHBondContact O-CB 3.32Å; T79-T163 PolarHBondContact O-OG1 3.42Å
80	K	97.4	Very high	98	Very high	157 Å²	157	52 Å²	52	68%	0.683	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-27.8	-177.9	-174.2	173.1	-178.2	175.5	0	114.8	N164 N165	K80-N164 PolarHBondContact N-OD1 2.67Å; K80-N165 HydrophobicContact CG-CB 4.24Å
81	K	97.3	Very high	98	Very high	181 Å²	181	49.6 Å²	49.6	79%	0.787	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	2	177.1	-67.8	-173.9	176.9	-179.8	0	113.9	T79 K161 H172	T79-K81 PolarHBondContact O-N 3.27Å; T79-K81 VanDerWaalsContact O-N 3.08Å; K81-K161 PolarHBondContact O-NZ 2.78Å; K81-H172 PolarHBondContact O-CE1 3.13Å
82	G	97.9	Very high	98	Very high	10 Å²	10	50.2 Å²	50.2	10%	0.103	24%	0.236	C	C	.	.			trans	75.8	127	-174.9	0	0	0	0	0	113.4	T79 K161 L162	T79-G82 WeakPolarHBondContact O-CA 3.28Å; T79-G82 PolarHBondContact O-N 3.46Å; G82-K161 WeakPolarHBondContact O-CE 3.05Å; G82-L162 WeakPolarHBondContact CA-O 3.1Å
83	R	98.4	Very high	98	Very high	135 Å²	135	48.5 Å²	48.5	51%	0.509	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	136.9	-179.9	-171.1	73.6	171	-171.7	-4.7	110.6	I77 T79 K161 L162	I77-R83 HydrophobicContact CB-CG 4.15Å; I77-R83 HydrophobicContact CG2-CG 3.97Å; I77-R83 VanDerWaalsContact O-CB 3.3Å; I77-R83 WeakPolarHBondContact O-CB 3.21Å; I77-R83 WeakPolarHBondContact O-CG 3.02Å; T79-R83 HydrophobicContact CG2-CB 4.29Å; R83-K161 CarbonylContact O-C 3.59Å; R83-K161 VanDerWaalsContact O-CA 3.26Å; R83-K161 WeakPolarHBondContact O-CA 3.4Å; R83-L162 PolarHBondContact N-O 3.44Å; R83-L162 PolarHBondContact O-N 2.67Å
84	R	98.1	Very high	98	Very high	122 Å²	122	49.6 Å²	49.6	46%	0.46	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	143.5	174.8	-71.5	176.3	168.5	174.3	-7.6	111	H158 Y159 K161	R84-H158 WeakPolarHBondContact CD-O 3.05Å; R84-H158 WeakPolarHBondContact CG-O 3.43Å; R84-H158 PolarHBondContact NE-O 3.44Å; R84-Y159 VanDerWaalsContact NH2-CD1 3.35Å; R84-K161 HydrophobicContact CG-CG 4.2Å
85	M	98.3	Very high	97.8	Very high	18 Å²	18	50.2 Å²	50.2	9%	0.089	24%	0.237	C	C	.	.			trans	-63.2	148	171.7	-66.3	-174.9	-69.4	0	0	111.7	M76 L89 L106 A160 L162 F210	M76-M85 HydrophobicContact CE-CB 4.12Å; M76-M85 HydrophobicContact CE-CG 4.47Å; M76-M85 HydrophobicContact SD-CB 4.1Å; M76-M85 HydrophobicContact SD-CG 4.33Å; M85-L89 HydrophobicContact CE-CB 4.18Å; M85-L106 HydrophobicContact CE-CD2 3.71Å; M85-A160 HydrophobicContact CE-CB 4.42Å; M85-L162 HydrophobicContact CG-CD1 3.78Å; M85-L162 HydrophobicContact CG-CD2 4.44Å; M85-L162 HydrophobicContact CG-CG 4.03Å; M85-L162 HydrophobicContact SD-CD1 4.38Å; M85-F210 HydrophobicContact SD-CE1 4.04Å; M85-F210 HydrophobicContact SD-CZ 4.49Å
86	F	98.2	Very high	97.6	Very high	35 Å²	35	50.5 Å²	50.5	15%	0.154	24%	0.238	C	C	.	.	S	Bend	trans	-144.6	126.4	165.9	-175	-82	0	0	0	110	F69 M76 K225 S228 N229	F69-F86 HydrophobicContact CE2-CD1 4.44Å; F69-F86 AromaticContact CE2-CE1 3.92Å; F69-F86 HydrophobicContact CE2-CE1 3.92Å; F69-F86 HydrophobicContact CZ-CD1 4.29Å; F69-F86 AromaticContact CZ-CE1 3.95Å; F69-F86 HydrophobicContact CZ-CE1 3.95Å; M76-F86 WeakPolarHBondContact CE-O 3.37Å; M76-F86 VanDerWaalsContact SD-O 3.4Å; F86-K225 HydrophobicContact CD1-CD 3.87Å; F86-K225 PolarHBondContact O-NZ 2.87Å; F86-S228 WeakPolarHBondContact CE1-OG 3.24Å; F86-N229 HydrophobicContact CD1-CB 4.15Å; F86-N229 HydrophobicContact CD2-CB 3.91Å; F86-N229 HydrophobicContact CE1-CB 3.93Å; F86-N229 HydrophobicContact CE2-CB 3.65Å; F86-N229 HydrophobicContact CG-CB 4.16Å; F86-N229 VanDerWaalsContact CZ-CA 3.48Å; F86-N229 HydrophobicContact CZ-CB 3.68Å
87	P	98.2	Very high	97.4	Very high	4 Å²	4	54.2 Å²	54.2	3%	0.026	26%	0.258	C	S	.	.	S	Bend	cis	-58.7	157.5	1.7	-23.2	34.2	0	0	0	113.6	L65 W66 F69	L65-P87 HydrophobicContact CD2-CB 4.17Å; L65-P87 HydrophobicContact CD2-CG 4.05Å; L65-P87 HydrophobicContact CG-CG 4Å; W66-P87 HydrophobicContact CD2-CB 4.12Å; W66-P87 HydrophobicContact CD2-CG 4.18Å; W66-P87 HydrophobicContact CE3-CG 4.41Å; W66-P87 WeakPolarHBondContact CH2-O 3.35Å; W66-P87 HydrophobicContact CZ2-CB 3.97Å; W66-P87 VanDerWaalsContact CZ2-O 3.22Å; W66-P87 WeakPolarHBondContact CZ2-O 3.37Å; F69-P87 HydrophobicContact CD2-CG 3.39Å; F69-P87 HydrophobicContact CE2-CG 3.58Å; F69-P87 HydrophobicContact CG-CG 4.35Å
88	G	96.8	Very high	97.2	Very high	27 Å²	27	56.6 Å²	56.6	28%	0.278	28%	0.275	S	S	.	.			trans	-74.9	130.5	176.7	0	0	0	0	0	110.1	R90	G88-R90 PolarHBondContact O-N 2.99Å
89	L	98.1	Very high	97	Very high	3 Å²	3	61.5 Å²	61.5	2%	0.016	31%	0.309	C	S	.	.			trans	-71	99.8	174.1	-174.8	67.5	0	0	0	109.3	L60 W66 M85 L91 L106 F157 V185 T208	L60-L89 HydrophobicContact CD1-CD1 3.79Å; W66-L89 HydrophobicContact CZ2-CB 4.36Å; W66-L89 HydrophobicContact CZ2-CD1 4.43Å; M85-L89 HydrophobicContact CE-CB 4.18Å; L89-L91 HydrophobicContact CD1-CD2 4.06Å; L89-L91 HydrophobicContact CG-CD1 4.43Å; L89-L91 HydrophobicContact CG-CD2 4.45Å; L89-L91 HydrophobicContact CG-CG 4.46Å; L89-L106 HydrophobicContact CD2-CD1 3.67Å; L89-L106 HydrophobicContact CD2-CD2 4.3Å; L89-F157 HydrophobicContact CB-CB 4.26Å; L89-F157 HydrophobicContact CD2-CB 4.39Å; L89-F157 HydrophobicContact CD2-CD2 4.2Å; L89-F157 HydrophobicContact CD2-CG 4.44Å; L89-F157 HydrophobicContact CG-CD2 4.43Å; L89-F157 PolarHBondContact O-N 3.22Å; L89-V185 HydrophobicContact CD2-CG2 3.86Å; L89-T208 HydrophobicContact CD1-CG2 4.14Å
90	R	97.9	Very high	96.7	Very high	100 Å²	100	62.4 Å²	62.4	38%	0.377	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	136.1	179	-78.8	171.6	54.6	158	-0.4	109.4	E61 G88 T154 I155	E61-R90 HydrophobicContact CB-CB 3.86Å; E61-R90 HydrophobicContact CG-CB 4.44Å; E61-R90 PolarHBondContact N-O 3.32Å; E61-R90 IonicContact OE2-CZ 2.7Å; E61-R90 IonicContact OE2-NE 2.88Å; E61-R90 PolarHBondContact OE2-NE 3.01Å; E61-R90 IonicContact OE2-NH2 3.2Å; E61-R90 PolarHBondContact OE2-NH2 2.7Å; G88-R90 PolarHBondContact O-N 2.99Å; R90-T154 HydrophobicContact CB-CG2 4.03Å; R90-T154 HydrophobicContact CG-CG2 4.14Å; R90-I155 CarbonylContact C-O 3.56Å; R90-I155 VanDerWaalsContact CA-O 3.31Å; R90-I155 WeakPolarHBondContact CA-O 3.41Å
91	L	98.2	Very high	96.6	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	148.3	-168.7	-53.6	166	0	0	0	110.4	M58 D59 L60 L89 I155 F157 V185 F205	M58-L91 HydrophobicContact CG-CB 4.15Å; M58-L91 HydrophobicContact CG-CD1 4.44Å; M58-L91 HydrophobicContact CG-CD2 4.43Å; M58-L91 HydrophobicContact SD-CB 4.38Å; M58-L91 HydrophobicContact SD-CD1 3.64Å; M58-L91 HydrophobicContact SD-CD2 4.41Å; M58-L91 HydrophobicContact SD-CG 4.35Å; D59-L91 CarbonylContact O-C 3.56Å; D59-L91 VanDerWaalsContact O-CA 3.27Å; D59-L91 WeakPolarHBondContact O-CA 3.47Å; L60-L91 HydrophobicContact CD1-CD2 3.93Å; L89-L91 HydrophobicContact CD1-CD2 4.06Å; L89-L91 HydrophobicContact CG-CD1 4.43Å; L89-L91 HydrophobicContact CG-CD2 4.45Å; L89-L91 HydrophobicContact CG-CG 4.46Å; L91-I155 HydrophobicContact CB-CB 4.35Å; L91-I155 PolarHBondContact N-O 3.34Å; L91-I155 PolarHBondContact O-N 2.67Å; L91-F157 HydrophobicContact CD1-CD2 3.98Å; L91-F157 HydrophobicContact CD1-CE2 3.7Å; L91-V185 HydrophobicContact CD1-CB 4.22Å; L91-V185 HydrophobicContact CD1-CG1 3.84Å; L91-V185 HydrophobicContact CD1-CG2 3.78Å; L91-F205 HydrophobicContact CD2-CD2 4.23Å; L91-F205 HydrophobicContact CD2-CE2 3.54Å; L91-F205 HydrophobicContact CD2-CZ 4.06Å
92	K	97.9	Very high	96.5	Very high	113 Å²	113	52.3 Å²	52.3	49%	0.491	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	150.9	159.7	-62.8	-175.1	-179.6	-177.4	0	108.9	M58 D59 E61	M58-K92 CarbonylContact C-O 3.51Å; M58-K92 VanDerWaalsContact CA-O 3.26Å; M58-K92 WeakPolarHBondContact CA-O 3.43Å; M58-K92 WeakPolarHBondContact CG-O 3.24Å; D59-K92 HydrophobicContact CB-CB 4.39Å; D59-K92 PolarHBondContact N-O 3.25Å; D59-K92 PolarHBondContact O-N 3.37Å; E61-K92 HydrophobicContact CG-CG 3.96Å; E61-K92 WeakPolarHBondContact OE1-CE 3.26Å; E61-K92 WeakPolarHBondContact OE1-CG 3.39Å
93	L	97.2	Very high	96.4	Very high	8 Å²	8	52.5 Å²	52.5	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	140	-179.4	-176	50.3	0	0	0	108.7	V56 R57 M58 L96 L104 W150 Q151 I155 V187	V56-L93 HydrophobicContact CG1-CD1 3.73Å; R57-L93 WeakPolarHBondContact O-CA 3.34Å; R57-L93 WeakPolarHBondContact O-CD1 3.35Å; M58-L93 HydrophobicContact CB-CD1 4.21Å; M58-L93 HydrophobicContact CE-CD1 3.84Å; M58-L93 HydrophobicContact CE-CD2 3.97Å; M58-L93 HydrophobicContact CE-CG 4.38Å; L93-L96 HydrophobicContact CD2-CD1 3.64Å; L93-L96 HydrophobicContact CD2-CG 4.3Å; L93-L96 HydrophobicContact CG-CD1 3.93Å; L93-L96 HydrophobicContact CG-CG 4.14Å; L93-L104 HydrophobicContact CD2-CD1 4.35Å; L93-L104 HydrophobicContact CD2-CD2 4.03Å; L93-W150 HydrophobicContact CD2-CB 4.37Å; L93-Q151 WeakPolarHBondContact O-CG 3.4Å; L93-I155 HydrophobicContact CB-CD1 3.55Å; L93-I155 HydrophobicContact CD2-CD1 3.89Å; L93-I155 HydrophobicContact CG-CD1 4.41Å; L93-V187 HydrophobicContact CD1-CG2 4.42Å; L93-V187 HydrophobicContact CD2-CG1 4.46Å; L93-V187 HydrophobicContact CD2-CG2 3.8Å
94	S	96.8	Very high	96.3	Very high	47 Å²	47	46.1 Å²	46.1	33%	0.329	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	164.6	-178.2	60.4	0	0	0	0	110.5	V56 R57 L96 Q151	V56-S94 WeakPolarHBondContact CA-O 3.28Å; R57-S94 PolarHBondContact N-O 3.44Å; R57-S94 PolarHBondContact O-N 2.73Å; R57-S94 PolarHBondContact O-OG 2.78Å; S94-L96 VanDerWaalsContact C-N 3.33Å; S94-L96 PolarHBondContact O-N 3.42Å; S94-Q151 VanDerWaalsContact C-OE1 3.31Å
95	G	94.8	Very high	96.2	Very high	18 Å²	18	40.4 Å²	40.4	19%	0.186	22%	0.218	C	C	.	.	S	Bend	trans	76.2	10.8	-179.6	0	0	0	0	0	115.6
96	L	94.5	Very high	96.2	Very high	6 Å²	6	39.6 Å²	39.6	3%	0.031	21%	0.214	C	C	.	.			trans	-80.3	141.2	171.6	-62.9	-177.9	0	0	0	110.9	V56 L93 S94 P98 Y102 W150 Q151 V187	V56-L96 HydrophobicContact CB-CD2 4.38Å; V56-L96 HydrophobicContact CG1-CD2 3.49Å; V56-L96 VanDerWaalsContact CG1-CD2 3.49Å; V56-L96 HydrophobicContact CG1-CG 4.26Å; V56-L96 HydrophobicContact CG2-CD2 3.91Å; L93-L96 HydrophobicContact CD2-CD1 3.64Å; L93-L96 HydrophobicContact CD2-CG 4.3Å; L93-L96 HydrophobicContact CG-CD1 3.93Å; L93-L96 HydrophobicContact CG-CG 4.14Å; S94-L96 VanDerWaalsContact C-N 3.33Å; S94-L96 PolarHBondContact O-N 3.42Å; L96-P98 VanDerWaalsContact O-CD 3.24Å; L96-P98 WeakPolarHBondContact O-CD 3.2Å; L96-P98 VanDerWaalsContact O-N 3.14Å; L96-Y102 HydrophobicContact CB-CE2 3.92Å; L96-Y102 HydrophobicContact CD1-CD2 3.88Å; L96-Y102 HydrophobicContact CD1-CE2 4.04Å; L96-Y102 HydrophobicContact CD1-CG 4.17Å; L96-Y102 HydrophobicContact CD2-CD1 4.13Å; L96-Y102 HydrophobicContact CD2-CE1 3.78Å; L96-Y102 HydrophobicContact CD2-CE2 4.27Å; L96-Y102 HydrophobicContact CG-CE2 4.32Å; L96-W150 HydrophobicContact CD1-CB 4.02Å; L96-Q151 HydrophobicContact CB-CG 4.29Å; L96-Q151 PolarHBondContact O-NE2 3.5Å; L96-V187 HydrophobicContact CD1-CG1 4.43Å; L96-V187 HydrophobicContact CD2-CG1 3.94Å
97	N	93.6	Very high	96.1	Very high	81 Å²	81	38.9 Å²	38.9	43%	0.433	21%	0.212	S	C	.	.			trans	-58.2	118.1	167.3	-179.2	-53.4	0	0	0	108.8	S99 L100 Y102	N97-S99 PolarHBondContact O-N 3.09Å; N97-S99 VanDerWaalsContact O-N 3.13Å; N97-S99 PolarHBondContact OD1-N 3.03Å; N97-L100 HydrophobicContact CB-CB 4.31Å; N97-L100 HydrophobicContact CB-CD1 3.93Å; N97-L100 HydrophobicContact CB-CG 3.99Å; N97-L100 PolarHBondContact O-N 3.13Å; N97-L100 PolarHBondContact OD1-N 2.85Å; N97-Y102 PolarHBondContact N-OH 2.8Å
98	P	95.8	Very high	96.1	Very high	73 Å²	73	39.3 Å²	39.3	47%	0.474	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.1	-171.2	-27.2	36.4	0	0	0	114.6	L96 G147 A148	L96-P98 VanDerWaalsContact O-CD 3.24Å; L96-P98 WeakPolarHBondContact O-CD 3.2Å; L96-P98 VanDerWaalsContact O-N 3.14Å; P98-G147 PolarHBondContact O-N 2.87Å; P98-A148 HydrophobicContact CB-CB 4.12Å; P98-A148 PolarHBondContact O-N 2.92Å
99	S	93.9	Very high	96.1	Very high	105 Å²	105	39.9 Å²	39.9	73%	0.734	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-24.6	-173.5	-55	0	0	0	0	113.9	N97	N97-S99 PolarHBondContact O-N 3.09Å; N97-S99 VanDerWaalsContact O-N 3.13Å; N97-S99 PolarHBondContact OD1-N 3.03Å
100	L	92.4	Very high	96	Very high	67 Å²	67	41.9 Å²	41.9	35%	0.351	23%	0.225	S	C	.	.	S	Bend	trans	-75.1	158.1	177.2	-64.1	-177.5	0	0	0	111.3	N97 Y102 T146 G147 E189	N97-L100 HydrophobicContact CB-CB 4.31Å; N97-L100 HydrophobicContact CB-CD1 3.93Å; N97-L100 HydrophobicContact CB-CG 3.99Å; N97-L100 PolarHBondContact O-N 3.13Å; N97-L100 PolarHBondContact OD1-N 2.85Å; L100-Y102 HydrophobicContact CB-CE2 3.84Å; L100-Y102 WeakPolarHBondContact O-CE2 3.24Å; L100-T146 CarbonylContact O-C 3.46Å; L100-T146 VanDerWaalsContact O-CA 3.26Å; L100-T146 WeakPolarHBondContact O-CA 3.39Å; L100-G147 PolarHBondContact O-N 2.91Å; L100-E189 HydrophobicContact CD1-CG 4.23Å
101	R	93.9	Very high	95.9	Very high	111 Å²	111	39 Å²	39	42%	0.419	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	146.6	174.6	-64.5	-178.6	79.4	158.3	3.5	110.9	P144 A145 T146 A190	R101-P144 PolarHBondContact NE-O 2.82Å; R101-P144 VanDerWaalsContact NE-O 3.13Å; R101-P144 PolarHBondContact NH2-O 3.22Å; R101-A145 CarbonylContact C-O 3.52Å; R101-A145 VanDerWaalsContact CA-O 3.29Å; R101-A145 WeakPolarHBondContact CA-O 3.44Å; R101-T146 HydrophobicContact CG-CG2 4.19Å; R101-A190 HydrophobicContact CB-CB 4.42Å; R101-A190 PolarHBondContact O-N 3.31Å
102	Y	94.9	Very high	95.8	Very high	15 Å²	15	41.4 Å²	41.4	6%	0.059	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142.1	-178.8	-55.2	-93	0	0	0	111.1	L96 N97 L100 P144 A145 W150 V187 I188 E189	L96-Y102 HydrophobicContact CB-CE2 3.92Å; L96-Y102 HydrophobicContact CD1-CD2 3.88Å; L96-Y102 HydrophobicContact CD1-CE2 4.04Å; L96-Y102 HydrophobicContact CD1-CG 4.17Å; L96-Y102 HydrophobicContact CD2-CD1 4.13Å; L96-Y102 HydrophobicContact CD2-CE1 3.78Å; L96-Y102 HydrophobicContact CD2-CE2 4.27Å; L96-Y102 HydrophobicContact CG-CE2 4.32Å; N97-Y102 PolarHBondContact N-OH 2.8Å; L100-Y102 HydrophobicContact CB-CE2 3.84Å; L100-Y102 WeakPolarHBondContact O-CE2 3.24Å; Y102-P144 WeakPolarHBondContact O-CA 3.16Å; Y102-A145 PolarHBondContact N-O 2.84Å; Y102-A145 PolarHBondContact O-N 2.99Å; Y102-A145 VanDerWaalsContact O-N 3.16Å; Y102-W150 PolarHBondContact O-NE1 2.95Å; Y102-V187 HydrophobicContact CD1-CG1 3.84Å; Y102-V187 HydrophobicContact CG-CG1 4.22Å; Y102-I188 CarbonylContact C-O 3.55Å; Y102-I188 VanDerWaalsContact CA-O 3.24Å; Y102-I188 WeakPolarHBondContact CA-O 3.49Å; Y102-E189 HydrophobicContact CD1-CB 4.1Å; Y102-E189 HydrophobicContact CE1-CB 3.97Å; Y102-E189 HydrophobicContact CE1-CG 4.28Å
103	I	95.4	Very high	95.7	Very high	15 Å²	15	41.8 Å²	41.8	8%	0.077	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131	166.4	-64.5	168.4	0	0	0	107.3	I139 P144 I188 A190 W196	I103-I139 HydrophobicContact CG2-CG2 4.06Å; I103-P144 HydrophobicContact CG1-CB 3.85Å; I103-I188 PolarHBondContact N-O 3.39Å; I103-I188 PolarHBondContact O-N 3.28Å; I103-A190 HydrophobicContact CD1-CB 4.31Å; I103-A190 HydrophobicContact CG1-CB 4.22Å; I103-W196 HydrophobicContact CD1-CD2 4.36Å; I103-W196 HydrophobicContact CD1-CZ2 4.05Å
104	L	96.9	Very high	95.7	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.4	171.5	-94.5	66.3	0	0	0	109.7	L93 H140 S143 W150 I155 F157 H186 V187	L93-L104 HydrophobicContact CD2-CD1 4.35Å; L93-L104 HydrophobicContact CD2-CD2 4.03Å; L104-H140 HydrophobicContact CB-CB 4.11Å; L104-H140 WeakPolarHBondContact O-CB 3.46Å; L104-H140 PolarHBondContact O-N 3.16Å; L104-S143 PolarHBondContact N-OG 2.85Å; L104-S143 VanDerWaalsContact N-OG 3.1Å; L104-S143 PolarHBondContact O-OG 3.32Å; L104-W150 HydrophobicContact CB-CH2 3.92Å; L104-W150 HydrophobicContact CB-CZ2 4.02Å; L104-W150 HydrophobicContact CB-CZ3 4.39Å; L104-W150 HydrophobicContact CD1-CD2 3.97Å; L104-W150 HydrophobicContact CD1-CG 4.24Å; L104-W150 HydrophobicContact CD1-CZ2 4Å; L104-W150 HydrophobicContact CD2-CD2 4.1Å; L104-W150 HydrophobicContact CD2-CE3 3.87Å; L104-W150 HydrophobicContact CD2-CH2 4.31Å; L104-W150 HydrophobicContact CD2-CZ3 3.98Å; L104-W150 HydrophobicContact CG-CH2 4.48Å; L104-W150 HydrophobicContact CG-CZ2 4.4Å; L104-I155 HydrophobicContact CD2-CD1 3.61Å; L104-I155 HydrophobicContact CD2-CG1 4.11Å; L104-I155 HydrophobicContact CD2-CG2 3.98Å; L104-F157 HydrophobicContact CB-CZ 4.42Å; L104-H186 WeakPolarHBondContact CA-O 3.49Å; L104-V187 HydrophobicContact CD1-CB 4.22Å; L104-V187 HydrophobicContact CD1-CG1 3.83Å; L104-V187 HydrophobicContact CD1-CG2 3.95Å; L104-V187 HydrophobicContact CG-CG2 4.02Å
105	L	95.8	Very high	95.7	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.016	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	156.9	176.1	64.9	81.7	0	0	0	112.2	V137 F138 I139 V185 H186 I188 W196	L105-V137 HydrophobicContact CD1-CB 4.09Å; L105-V137 HydrophobicContact CD1-CG1 3.96Å; L105-V137 HydrophobicContact CD2-CG2 4.38Å; L105-F138 CarbonylContact C-O 3.59Å; L105-F138 VanDerWaalsContact CA-O 3.27Å; L105-F138 WeakPolarHBondContact CA-O 3.29Å; L105-I139 HydrophobicContact CB-CG1 4.17Å; L105-V185 WeakPolarHBondContact O-CA 3.33Å; L105-H186 HydrophobicContact CD1-CB 3.71Å; L105-H186 HydrophobicContact CG-CB 4.06Å; L105-H186 PolarHBondContact N-O 3.04Å; L105-H186 PolarHBondContact O-N 3.13Å; L105-I188 HydrophobicContact CD2-CD1 3.95Å; L105-W196 HydrophobicContact CD2-CH2 4.44Å; L105-W196 HydrophobicContact CD2-CZ3 4.23Å
106	L	98.1	Very high	95.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.5	177.7	166.3	69	0	0	0	108.4	M85 L89 V137 F138 F157 A160 I173 P183 R184 V185	M85-L106 HydrophobicContact CE-CD2 3.71Å; L89-L106 HydrophobicContact CD2-CD1 3.67Å; L89-L106 HydrophobicContact CD2-CD2 4.3Å; L106-V137 CarbonylContact O-C 3.5Å; L106-V137 WeakPolarHBondContact O-CA 3.45Å; L106-F138 HydrophobicContact CB-CB 4.45Å; L106-F138 PolarHBondContact N-O 3.11Å; L106-F138 PolarHBondContact O-N 3.04Å; L106-F157 HydrophobicContact CB-CD1 3.62Å; L106-F157 HydrophobicContact CB-CE1 3.63Å; L106-F157 HydrophobicContact CB-CG 4.31Å; L106-F157 HydrophobicContact CB-CZ 4.33Å; L106-F157 HydrophobicContact CD2-CB 4.11Å; L106-F157 HydrophobicContact CD2-CD1 4.08Å; L106-F157 HydrophobicContact CD2-CG 4.24Å; L106-F157 HydrophobicContact CG-CD1 4.47Å; L106-A160 HydrophobicContact CD2-CB 3.87Å; L106-I173 HydrophobicContact CD2-CD1 4.38Å; L106-I173 HydrophobicContact CG-CD1 4.42Å; L106-P183 HydrophobicContact CD1-CB 4.1Å; L106-R184 WeakPolarHBondContact CA-O 3.22Å; L106-V185 HydrophobicContact CD1-CG2 4.15Å
107	D	96.8	Very high	96	Very high	20 Å²	20	50.1 Å²	50.1	11%	0.107	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	170.9	161.9	87.3	12.7	0	0	0	110.7	V137 R184 H186	D107-V137 HydrophobicContact CB-CG1 4.09Å; D107-R184 PolarHBondContact N-O 3.45Å; D107-R184 PolarHBondContact O-N 3.4Å; D107-R184 VanDerWaalsContact O-N 3.11Å; D107-R184 WeakPolarHBondContact OD1-CB 3.37Å; D107-R184 VanDerWaalsContact OD1-CD 3.26Å; D107-R184 WeakPolarHBondContact OD1-CD 3.36Å; D107-R184 WeakPolarHBondContact OD1-CG 3.49Å; D107-R184 IonicContact OD1-NH1 2.71Å; D107-R184 IonicContact OD2-CZ 3.23Å; D107-R184 IonicContact OD2-NH1 3.21Å; D107-R184 PolarHBondContact OD2-NH1 3.16Å; D107-H186 IonicContact OD2-NE2 3.65Å
108	V	97.8	Very high	96.2	Very high	14 Å²	14	48.2 Å²	48.2	9%	0.085	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	97.4	174.8	179.6	0	0	0	0	108.1	I173 L175 Y181 F210	V108-I173 HydrophobicContact CB-CG2 4.2Å; V108-I173 HydrophobicContact CG2-CD1 3.98Å; V108-I173 HydrophobicContact CG2-CG2 4.34Å; V108-L175 HydrophobicContact CB-CD2 4.15Å; V108-L175 HydrophobicContact CG1-CD1 3.99Å; V108-L175 HydrophobicContact CG1-CD2 3.82Å; V108-Y181 HydrophobicContact CG1-CD1 3.92Å; V108-Y181 HydrophobicContact CG1-CG 3.98Å; V108-F210 HydrophobicContact CG1-CZ 3.93Å
109	V	96.6	Very high	96.2	Very high	39 Å²	39	49.2 Å²	49.2	24%	0.236	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	149.9	-177.6	-60.1	0	0	0	0	111.9	A111 Y181 Q182 R184	V109-A111 PolarHBondContact O-N 3.06Å; V109-Y181 CarbonylContact O-C 3.52Å; V109-Y181 VanDerWaalsContact O-CA 3.31Å; V109-Y181 WeakPolarHBondContact O-CA 3.49Å; V109-Y181 WeakPolarHBondContact O-CD1 3.37Å; V109-Q182 HydrophobicContact CG2-CB 4.22Å; V109-Q182 PolarHBondContact N-O 2.86Å; V109-Q182 VanDerWaalsContact N-O 3.07Å; V109-Q182 PolarHBondContact O-N 3.05Å; V109-R184 HydrophobicContact CG2-CG 4.24Å
110	P	96.6	Very high	96.1	Very high	44 Å²	44	48.7 Å²	48.7	29%	0.286	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	131.5	168.4	-21.4	32.5	0	0	0	110.7	Y181	P110-Y181 HydrophobicContact CB-CE1 4.35Å; P110-Y181 HydrophobicContact CG-CD1 4.44Å; P110-Y181 HydrophobicContact CG-CE1 3.98Å
111	A	96.5	Very high	96.1	Very high	41 Å²	41	48.3 Å²	48.3	34%	0.339	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-26.3	179.2	0	0	0	0	0	112.5	V109 R180 Q182 Q209	V109-A111 PolarHBondContact O-N 3.06Å; A111-R180 HydrophobicContact CB-CB 4.03Å; A111-R180 PolarHBondContact N-O 3.25Å; A111-Q182 HydrophobicContact CB-CB 4.43Å; A111-Q209 HydrophobicContact CB-CG 4.37Å
112	D	95.6	Very high	96.2	Very high	50 Å²	50	44.5 Å²	44.5	27%	0.267	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	-175.3	175.9	61	69.5	0	0	0	110.3	S114 Y116 R180	D112-S114 WeakPolarHBondContact OD1-CA 3.41Å; D112-S114 VanDerWaalsContact OD1-CB 3.25Å; D112-S114 WeakPolarHBondContact OD1-CB 3.48Å; D112-S114 PolarHBondContact OD1-N 3.26Å; D112-S114 PolarHBondContact OD1-OG 2.83Å; D112-Y116 PolarHBondContact OD2-OH 2.62Å; D112-R180 WeakPolarHBondContact OD2-CB 3.26Å; D112-R180 WeakPolarHBondContact OD2-CD 3.4Å
113	N	95.6	Very high	96.3	Very high	120 Å²	120	45.7 Å²	45.7	64%	0.642	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.9	33.2	-178.9	-162.3	65.1	0	0	0	112.6	G128 A129	N113-G128 CarbonylContact O-C 3.55Å; N113-G128 WeakPolarHBondContact O-CA 3.39Å; N113-A129 PolarHBondContact O-N 3.42Å
114	S	96.9	Very high	96.4	Very high	33 Å²	33	48.7 Å²	48.7	23%	0.231	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	145.5	-177.7	-49.7	0	0	0	0	113.2	D112 G127 H179	D112-S114 WeakPolarHBondContact OD1-CA 3.41Å; D112-S114 VanDerWaalsContact OD1-CB 3.25Å; D112-S114 WeakPolarHBondContact OD1-CB 3.48Å; D112-S114 PolarHBondContact OD1-N 3.26Å; D112-S114 PolarHBondContact OD1-OG 2.83Å; S114-G127 WeakPolarHBondContact CA-O 3.17Å; S114-H179 PolarHBondContact O-CD2 2.93Å
115	R	97.5	Very high	96.4	Very high	102 Å²	102	51.5 Å²	51.5	39%	0.385	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	135.9	165.7	-169.9	179.6	-160.9	-109.9	7.8	109.6	V126 G127 G128 E130	R115-V126 WeakPolarHBondContact O-CG2 3.41Å; R115-V126 PolarHBondContact O-N 3.44Å; R115-G127 PolarHBondContact N-O 2.91Å; R115-G128 WeakPolarHBondContact CB-O 3.46Å; R115-E130 IonicContact CZ-OE1 3.71Å; R115-E130 VanDerWaalsContact CZ-OE1 3.23Å; R115-E130 IonicContact NE-OE1 3.23Å; R115-E130 PolarHBondContact NE-OE1 3.36Å; R115-E130 IonicContact NH2-OE1 3.68Å; R115-E130 PolarHBondContact NH2-OE1 2.79Å
116	Y	98.1	Very high	96.4	Very high	18 Å²	18	54.7 Å²	54.7	7%	0.071	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	162	-170	-73.9	-88.6	0	0	0	113.9	D112 Q124 A125 L178 R180	D112-Y116 PolarHBondContact OD2-OH 2.62Å; Y116-Q124 CarbonylContact C-O 3.56Å; Y116-Q124 VanDerWaalsContact CA-O 3.29Å; Y116-Q124 WeakPolarHBondContact CA-O 3.3Å; Y116-Q124 WeakPolarHBondContact CD1-O 3.34Å; Y116-A125 HydrophobicContact CD1-CB 4.31Å; Y116-A125 HydrophobicContact CE1-CB 3.9Å; Y116-L178 WeakPolarHBondContact CB-O 3.13Å; Y116-L178 PolarHBondContact N-O 3.16Å; Y116-L178 WeakPolarHBondContact O-CB 3.27Å; Y116-R180 HydrophobicContact CD2-CG 4.1Å; Y116-R180 HydrophobicContact CE2-CB 4.31Å; Y116-R180 HydrophobicContact CE2-CG 3.67Å; Y116-R180 PolarHBondContact OH-NH1 3.39Å
117	R	97.4	Very high	96.3	Very high	102 Å²	102	56.6 Å²	56.6	39%	0.385	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	156.2	159.5	72	179.4	175.3	-162	0.3	110	Q119 W123 Q124 V126	R117-Q119 HydrophobicContact CG-CG 4.18Å; R117-W123 VanDerWaalsContact C-CE3 3.45Å; R117-Q124 HydrophobicContact CG-CB 4.32Å; R117-Q124 PolarHBondContact N-O 2.79Å; R117-Q124 PolarHBondContact O-N 2.92Å; R117-V126 HydrophobicContact CB-CG1 4.45Å; R117-V126 HydrophobicContact CB-CG2 4.39Å; R117-V126 HydrophobicContact CG-CG1 3.66Å; R117-V126 HydrophobicContact CG-CG2 4.47Å
118	F	97.5	Very high	96.2	Very high	41 Å²	41	58.2 Å²	58.2	18%	0.18	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119	169.7	-168.8	-108.3	0	0	0	109.5	G121 G122 W123 Q217 N218	F118-G121 VanDerWaalsContact CE2-C 3.44Å; F118-G121 WeakPolarHBondContact CE2-O 3.11Å; F118-G121 WeakPolarHBondContact CZ-O 3.25Å; F118-G122 WeakPolarHBondContact CA-O 3.26Å; F118-G122 WeakPolarHBondContact CD2-O 3.44Å; F118-W123 HydrophobicContact CB-CD2 4.17Å; F118-W123 HydrophobicContact CB-CE3 4.03Å; F118-W123 HydrophobicContact CB-CH2 4.19Å; F118-W123 HydrophobicContact CB-CZ2 4.26Å; F118-W123 HydrophobicContact CB-CZ3 4.06Å; F118-W123 AromaticContact CD2-CD1 3.77Å; F118-W123 AromaticContact CD2-CD2 3.84Å; F118-W123 HydrophobicContact CD2-CD2 3.84Å; F118-W123 AromaticContact CD2-CE2 3.78Å; F118-W123 AromaticContact CD2-CG 3.88Å; F118-W123 HydrophobicContact CD2-CG 3.88Å; F118-W123 HydrophobicContact CD2-CZ2 4.44Å; F118-W123 AromaticContact CD2-NE1 3.67Å; F118-W123 HydrophobicContact CG-CD2 4.49Å; F118-Q217 HydrophobicContact CB-CB 3.61Å; F118-Q217 HydrophobicContact CB-CG 4.15Å; F118-Q217 HydrophobicContact CD1-CB 3.83Å; F118-Q217 WeakPolarHBondContact CD1-O 3.31Å; F118-Q217 VanDerWaalsContact CE1-O 3.32Å; F118-Q217 WeakPolarHBondContact CE1-O 3.19Å; F118-Q217 HydrophobicContact CG-CB 3.76Å; F118-N218 HydrophobicContact CE1-CB 4.17Å; F118-N218 HydrophobicContact CE2-CB 3.93Å; F118-N218 HydrophobicContact CZ-CB 3.61Å
119	Q	95.4	Very high	95.9	Very high	94 Å²	94	59 Å²	59	44%	0.439	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	144.3	178.4	-76.2	-167.8	-15.8	0	0	110.5	R117 G121 G122	R117-Q119 HydrophobicContact CG-CG 4.18Å; Q119-G121 PolarHBondContact O-N 2.93Å; Q119-G122 PolarHBondContact N-O 2.98Å; Q119-G122 PolarHBondContact O-N 3.42Å; Q119-G122 VanDerWaalsContact O-N 3.1Å
120	G	92.4	Very high	95.7	Very high	93 Å²	93	60.6 Å²	60.6	96%	0.959	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	26.8	-179	0	0	0	0	0	114	G122	G120-G122 VanDerWaalsContact C-N 3.28Å; G120-G122 PolarHBondContact O-N 3.12Å
121	G	92.9	Very high	95.3	Very high	60 Å²	60	62.6 Å²	62.6	62%	0.619	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	6.3	-175.3	0	0	0	0	0	115.3	F118 Q119	F118-G121 VanDerWaalsContact CE2-C 3.44Å; F118-G121 WeakPolarHBondContact CE2-O 3.11Å; F118-G121 WeakPolarHBondContact CZ-O 3.25Å; Q119-G121 PolarHBondContact O-N 2.93Å
122	G	95	Very high	94.7	Very high	30 Å²	30	70.4 Å²	70.4	31%	0.309	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	158.5	-178.6	0	0	0	0	0	114.2	F118 Q119 G120	F118-G122 WeakPolarHBondContact CA-O 3.26Å; F118-G122 WeakPolarHBondContact CD2-O 3.44Å; Q119-G122 PolarHBondContact N-O 2.98Å; Q119-G122 PolarHBondContact O-N 3.42Å; Q119-G122 VanDerWaalsContact O-N 3.1Å; G120-G122 VanDerWaalsContact C-N 3.28Å; G120-G122 PolarHBondContact O-N 3.12Å
123	W	97.2	Very high	94.2	Very high	41 Å²	41	69.7 Å²	69.7	16%	0.155	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	120	175.9	-78.9	107	0	0	0	111.3	E75 R117 F118 L178 I211 V213 Q217	E75-W123 HydrophobicContact CG-CZ2 4.02Å; R117-W123 VanDerWaalsContact C-CE3 3.45Å; F118-W123 HydrophobicContact CB-CD2 4.17Å; F118-W123 HydrophobicContact CB-CE3 4.03Å; F118-W123 HydrophobicContact CB-CH2 4.19Å; F118-W123 HydrophobicContact CB-CZ2 4.26Å; F118-W123 HydrophobicContact CB-CZ3 4.06Å; F118-W123 AromaticContact CD2-CD1 3.77Å; F118-W123 AromaticContact CD2-CD2 3.84Å; F118-W123 HydrophobicContact CD2-CD2 3.84Å; F118-W123 AromaticContact CD2-CE2 3.78Å; F118-W123 AromaticContact CD2-CG 3.88Å; F118-W123 HydrophobicContact CD2-CG 3.88Å; F118-W123 HydrophobicContact CD2-CZ2 4.44Å; F118-W123 AromaticContact CD2-NE1 3.67Å; F118-W123 HydrophobicContact CG-CD2 4.49Å; W123-L178 HydrophobicContact CH2-CD2 4.12Å; W123-L178 HydrophobicContact CZ3-CD2 4.2Å; W123-I211 HydrophobicContact CB-CD1 4.16Å; W123-I211 HydrophobicContact CD2-CD1 3.38Å; W123-I211 HydrophobicContact CE3-CD1 3.85Å; W123-I211 HydrophobicContact CG-CD1 3.54Å; W123-I211 HydrophobicContact CH2-CD1 4.5Å; W123-I211 HydrophobicContact CH2-CG2 3.63Å; W123-I211 HydrophobicContact CZ2-CB 4.34Å; W123-I211 HydrophobicContact CZ2-CD1 4.15Å; W123-I211 HydrophobicContact CZ2-CG2 3.89Å; W123-I211 HydrophobicContact CZ3-CD1 4.38Å; W123-I211 HydrophobicContact CZ3-CG2 3.99Å; W123-V213 HydrophobicContact CH2-CG1 3.83Å; W123-V213 HydrophobicContact CZ2-CG1 4.08Å; W123-Q217 HydrophobicContact CH2-CB 4.17Å; W123-Q217 HydrophobicContact CH2-CG 3.69Å; W123-Q217 HydrophobicContact CZ2-CB 3.94Å; W123-Q217 HydrophobicContact CZ2-CG 3.92Å
124	Q	96.9	Very high	93.7	Very high	78 Å²	78	68.6 Å²	68.6	36%	0.364	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	137	-178.9	-59.8	173.9	13.1	0	0	110.4	Y116 R117	Y116-Q124 CarbonylContact C-O 3.56Å; Y116-Q124 VanDerWaalsContact CA-O 3.29Å; Y116-Q124 WeakPolarHBondContact CA-O 3.3Å; Y116-Q124 WeakPolarHBondContact CD1-O 3.34Å; R117-Q124 HydrophobicContact CG-CB 4.32Å; R117-Q124 PolarHBondContact N-O 2.79Å; R117-Q124 PolarHBondContact O-N 2.92Å
125	A	97.4	Very high	93.1	Very high	58 Å²	58	71.3 Å²	71.3	48%	0.479	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	140.5	168.9	0	0	0	0	0	110	Y116	Y116-A125 HydrophobicContact CD1-CB 4.31Å; Y116-A125 HydrophobicContact CE1-CB 3.9Å
126	V	96.8	Very high	92.9	Very high	70 Å²	70	69.5 Å²	69.5	42%	0.424	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	-0.3	-174	-70	0	0	0	0	115.1	R115 R117	R115-V126 WeakPolarHBondContact O-CG2 3.41Å; R115-V126 PolarHBondContact O-N 3.44Å; R117-V126 HydrophobicContact CB-CG1 4.45Å; R117-V126 HydrophobicContact CB-CG2 4.39Å; R117-V126 HydrophobicContact CG-CG1 3.66Å; R117-V126 HydrophobicContact CG-CG2 4.47Å
127	G	94.9	Very high	92.8	Very high	41 Å²	41	70 Å²	70	42%	0.423	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.7	173.2	175.7	0	0	0	0	0	111.2	S114 R115	S114-G127 WeakPolarHBondContact CA-O 3.17Å; R115-G127 PolarHBondContact N-O 2.91Å
128	G	94.7	Very high	92.8	Very high	53 Å²	53	66.9 Å²	66.9	55%	0.546	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	158.3	168.1	0	0	0	0	0	111.7	N113 R115	N113-G128 CarbonylContact O-C 3.55Å; N113-G128 WeakPolarHBondContact O-CA 3.39Å; R115-G128 WeakPolarHBondContact CB-O 3.46Å
129	A	92.6	Very high	92.7	Very high	30 Å²	30	68.6 Å²	68.6	25%	0.248	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-64.8	151.7	177.6	0	0	0	0	0	113	N113 H179	N113-A129 PolarHBondContact O-N 3.42Å; A129-H179 VanDerWaalsContact CA-NE2 3.31Å; A129-H179 WeakPolarHBondContact CA-NE2 3.31Å
130	E	90.9	Very high	92.8	Very high	74 Å²	74	64.7 Å²	64.7	35%	0.346	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-66.3	148.2	170.1	-70.9	170.8	-146.4	0	0	110.7	R115 H176 H179	R115-E130 IonicContact CZ-OE1 3.71Å; R115-E130 VanDerWaalsContact CZ-OE1 3.23Å; R115-E130 IonicContact NE-OE1 3.23Å; R115-E130 PolarHBondContact NE-OE1 3.36Å; R115-E130 IonicContact NH2-OE1 3.68Å; R115-E130 PolarHBondContact NH2-OE1 2.79Å; E130-H176 HydrophobicContact CB-CB 4.5Å; E130-H176 VanDerWaalsContact CB-CD2 3.42Å; E130-H176 WeakPolarHBondContact CB-CD2 3.47Å; E130-H176 IonicContact OE2-CG 3.55Å; E130-H176 IonicContact OE2-ND1 2.73Å; E130-H179 PolarHBondContact N-NE2 2.76Å; E130-H179 IonicContact OE1-CE1 3.58Å
131	A	89.4	Confident	93	Very high	86 Å²	86	64 Å²	64	71%	0.711	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-55.3	138.8	-171.3	0	0	0	0	0	112.7	L133 H176	A131-L133 PolarHBondContact O-N 3.47Å; A131-H176 PolarHBondContact O-NE2 3Å
132	R	84	Confident	93.2	Very high	204 Å²	204	63.7 Å²	63.7	77%	0.77	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-57.9	134.6	-173.9	-82.5	-168.7	176.4	163.8	0.2	112.3
133	L	85.3	Confident	93.2	Very high	35 Å²	35	63.5 Å²	63.5	18%	0.183	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-77.9	160.6	174	-65.9	164.8	0	0	0	110.2	A131 D135 T166 I174	A131-L133 PolarHBondContact O-N 3.47Å; L133-D135 PolarHBondContact O-N 3.27Å; L133-T166 HydrophobicContact CD2-CG2 3.76Å; L133-I174 HydrophobicContact CD1-CB 4.12Å; L133-I174 HydrophobicContact CD1-CG2 3.66Å; L133-I174 WeakPolarHBondContact CD1-O 3.5Å; L133-I174 HydrophobicContact CD2-CG2 4.23Å; L133-I174 HydrophobicContact CG-CG2 4.49Å
134	P	84.8	Confident	93.1	Very high	98 Å²	98	63.6 Å²	63.6	64%	0.636	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-59.1	127.4	168	-20.4	32.6	0	0	0	110.2	R136	P134-R136 PolarHBondContact O-N 3.43Å
135	D	84.5	Confident	93.1	Very high	90 Å²	90	60.2 Å²	60.2	48%	0.481	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-57.9	136.1	-179.9	-71.1	-42.5	0	0	0	111.3	L133 T380	L133-D135 PolarHBondContact O-N 3.27Å; D135-T380 HydrophobicContact CB-CG2 4.5Å; D135-T380 VanDerWaalsContact O-CG2 3.25Å; D135-T380 WeakPolarHBondContact O-CG2 3.43Å
136	R	93.6	Very high	93	Very high	63 Å²	63	60 Å²	60	24%	0.238	35%	0.354	C	S	.	.			trans	-134.6	126.4	177.8	-73.2	-171	176.4	-160.2	-2.9	111.2	P134 D168 H172	P134-R136 PolarHBondContact O-N 3.43Å; R136-D168 VanDerWaalsContact CZ-O 3.26Å; R136-D168 PolarHBondContact NH1-O 2.83Å; R136-D168 IonicContact NH1-OD2 3.44Å; R136-D168 PolarHBondContact NH1-OD2 3.36Å; R136-D168 PolarHBondContact NH2-O 2.84Å; R136-H172 WeakPolarHBondContact CD-O 3.27Å; R136-H172 PolarHBondContact NH1-O 3.31Å
137	V	95.1	Very high	93	Very high	28 Å²	28	56.6 Å²	56.6	17%	0.17	33%	0.334	C	S	.	.			trans	-104.8	137.1	176.4	-61.6	0	0	0	0	110.2	L105 L106 D107 I139	L105-V137 HydrophobicContact CD1-CB 4.09Å; L105-V137 HydrophobicContact CD1-CG1 3.96Å; L105-V137 HydrophobicContact CD2-CG2 4.38Å; L106-V137 CarbonylContact O-C 3.5Å; L106-V137 WeakPolarHBondContact O-CA 3.45Å; D107-V137 HydrophobicContact CB-CG1 4.09Å; V137-I139 HydrophobicContact CG2-CG1 4.42Å
138	F	97.4	Very high	93.1	Very high	37 Å²	37	57 Å²	57	16%	0.162	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	114.2	166.8	175.3	-86.2	0	0	0	108.8	L105 L106 F157 A160 I173	L105-F138 CarbonylContact C-O 3.59Å; L105-F138 VanDerWaalsContact CA-O 3.27Å; L105-F138 WeakPolarHBondContact CA-O 3.29Å; L106-F138 HydrophobicContact CB-CB 4.45Å; L106-F138 PolarHBondContact N-O 3.11Å; L106-F138 PolarHBondContact O-N 3.04Å; F138-F157 AromaticContact CD1-CD1 3.67Å; F138-F157 HydrophobicContact CD1-CD1 3.67Å; F138-F157 HydrophobicContact CD1-CE1 4.15Å; F138-F157 AromaticContact CE1-CD1 3.9Å; F138-F157 HydrophobicContact CE1-CD1 3.9Å; F138-F157 HydrophobicContact CE1-CE1 4.46Å; F138-A160 HydrophobicContact CB-CB 4.17Å; F138-A160 HydrophobicContact CD1-CB 3.9Å; F138-A160 HydrophobicContact CD2-CB 3.93Å; F138-A160 HydrophobicContact CE1-CB 4.3Å; F138-A160 HydrophobicContact CE2-CB 4.33Å; F138-A160 HydrophobicContact CG-CB 3.7Å; F138-I173 HydrophobicContact CB-CD1 4.03Å; F138-I173 HydrophobicContact CB-CG1 4.35Å
139	I	96.7	Very high	93.2	Very high	77 Å²	77	56.9 Å²	56.9	40%	0.395	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	131	174	-58.6	175.9	0	0	0	108.8	I103 L105 V137 W196	I103-I139 HydrophobicContact CG2-CG2 4.06Å; L105-I139 HydrophobicContact CB-CG1 4.17Å; V137-I139 HydrophobicContact CG2-CG1 4.42Å; I139-W196 HydrophobicContact CD1-CH2 4.45Å
140	H	97.5	Very high	93.4	Very high	12 Å²	12	55.5 Å²	55.5	6%	0.056	31%	0.306	C	S	.	.			trans	-65.5	131.6	178.1	-170	-75	0	0	0	110.2	L104 D142 S143 W150 S156 F157	L104-H140 HydrophobicContact CB-CB 4.11Å; L104-H140 WeakPolarHBondContact O-CB 3.46Å; L104-H140 PolarHBondContact O-N 3.16Å; H140-D142 VanDerWaalsContact C-N 3.29Å; H140-D142 IonicContact CE1-OD1 3.74Å; H140-D142 PolarHBondContact CE1-OD1 3.07Å; H140-D142 PolarHBondContact ND1-N 2.88Å; H140-D142 IonicContact ND1-OD1 3.94Å; H140-D142 PolarHBondContact ND1-OD1 3.11Å; H140-D142 PolarHBondContact O-N 3.39Å; H140-D142 VanDerWaalsContact O-N 3.16Å; H140-S143 WeakPolarHBondContact O-CB 3.39Å; H140-S143 PolarHBondContact O-N 2.97Å; H140-S143 PolarHBondContact O-OG 3.1Å; H140-W150 HydrophobicContact CB-CH2 3.99Å; H140-W150 AromaticContact CE1-CZ3 3.88Å; H140-W150 AromaticContact CG-CH2 3.84Å; H140-W150 AromaticContact CG-CZ3 3.95Å; H140-W150 AromaticContact ND1-CH2 3.48Å; H140-W150 WeakPolarHBondContact ND1-CH2 3.48Å; H140-W150 AromaticContact ND1-CZ3 3.52Å; H140-S156 PolarHBondContact NE2-N 3.47Å; H140-F157 HydrophobicContact CB-CE1 3.96Å; H140-F157 HydrophobicContact CB-CZ 4.28Å
141	P	96.4	Very high	93.7	Very high	80 Å²	80	54.9 Å²	54.9	52%	0.519	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.3	-168	21.6	-34.4	0	0	0	114.9	S143 Y159	P141-S143 PolarHBondContact O-N 2.85Å; P141-Y159 HydrophobicContact CG-CD2 4.17Å
142	D	96.1	Very high	94.1	Very high	53 Å²	53	55 Å²	55	28%	0.283	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-10.8	173.1	-59.2	44.4	0	0	0	114	H140 P144 A145 H149 W150 R153	H140-D142 VanDerWaalsContact C-N 3.29Å; H140-D142 IonicContact CE1-OD1 3.74Å; H140-D142 PolarHBondContact CE1-OD1 3.07Å; H140-D142 PolarHBondContact ND1-N 2.88Å; H140-D142 IonicContact ND1-OD1 3.94Å; H140-D142 PolarHBondContact ND1-OD1 3.11Å; H140-D142 PolarHBondContact O-N 3.39Å; H140-D142 VanDerWaalsContact O-N 3.16Å; D142-P144 CarbonylContact O-C 3.52Å; D142-A145 WeakPolarHBondContact O-CB 3.37Å; D142-A145 PolarHBondContact O-N 2.84Å; D142-H149 IonicContact OD2-CD2 3.5Å; D142-H149 IonicContact OD2-CE1 3.16Å; D142-H149 PolarHBondContact OD2-CE1 3.38Å; D142-H149 IonicContact OD2-NE2 3.89Å; D142-H149 PolarHBondContact OD2-NE2 3.21Å; D142-W150 HydrophobicContact CB-CH2 3.69Å; D142-W150 HydrophobicContact CB-CZ2 4.37Å; D142-W150 HydrophobicContact CB-CZ3 3.98Å; D142-R153 IonicContact OD2-CZ 2.67Å; D142-R153 IonicContact OD2-NH1 2.75Å; D142-R153 PolarHBondContact OD2-NH1 2.75Å
143	S	95.4	Very high	94.6	Very high	25 Å²	25	50.9 Å²	50.9	18%	0.175	28%	0.284	C	S	.	.			trans	-73.5	140.8	-175.8	-56.9	0	0	0	0	113.1	L104 H140 P141	L104-S143 PolarHBondContact N-OG 2.85Å; L104-S143 VanDerWaalsContact N-OG 3.1Å; L104-S143 PolarHBondContact O-OG 3.32Å; H140-S143 WeakPolarHBondContact O-CB 3.39Å; H140-S143 PolarHBondContact O-N 2.97Å; H140-S143 PolarHBondContact O-OG 3.1Å; P141-S143 PolarHBondContact O-N 2.85Å
144	P	94.9	Very high	95.2	Very high	44 Å²	44	51.7 Å²	51.7	29%	0.286	29%	0.29	S	S	.	.	S	Bend	cis	-85.8	118.6	-6	30.6	-30.9	0	0	0	112.5	R101 Y102 I103 D142 A190	R101-P144 PolarHBondContact NE-O 2.82Å; R101-P144 VanDerWaalsContact NE-O 3.13Å; R101-P144 PolarHBondContact NH2-O 3.22Å; Y102-P144 WeakPolarHBondContact O-CA 3.16Å; I103-P144 HydrophobicContact CG1-CB 3.85Å; D142-P144 CarbonylContact O-C 3.52Å; P144-A190 HydrophobicContact CB-CB 4.37Å
145	A	95.9	Very high	95.8	Very high	7 Å²	7	47.1 Å²	47.1	6%	0.058	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	167.9	175.2	0	0	0	0	0	112.6	R101 Y102 D142 H149 W150	R101-A145 CarbonylContact C-O 3.52Å; R101-A145 VanDerWaalsContact CA-O 3.29Å; R101-A145 WeakPolarHBondContact CA-O 3.44Å; Y102-A145 PolarHBondContact N-O 2.84Å; Y102-A145 PolarHBondContact O-N 2.99Å; Y102-A145 VanDerWaalsContact O-N 3.16Å; D142-A145 WeakPolarHBondContact O-CB 3.37Å; D142-A145 PolarHBondContact O-N 2.84Å; A145-H149 HydrophobicContact CB-CB 3.87Å; A145-W150 HydrophobicContact CB-CD2 4.27Å; A145-W150 HydrophobicContact CB-CZ2 3.98Å; A145-W150 PolarHBondContact O-NE1 3.22Å
146	T	96	Very high	96.4	Very high	52 Å²	52	44.3 Å²	44.3	32%	0.319	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	157.9	178.8	55.8	0	0	0	0	112.6	L100 R101 A148 H149 W150	L100-T146 CarbonylContact O-C 3.46Å; L100-T146 VanDerWaalsContact O-CA 3.26Å; L100-T146 WeakPolarHBondContact O-CA 3.39Å; R101-T146 HydrophobicContact CG-CG2 4.19Å; T146-A148 PolarHBondContact O-N 2.73Å; T146-H149 WeakPolarHBondContact O-CB 3.36Å; T146-H149 PolarHBondContact O-N 3.01Å; T146-H149 WeakPolarHBondContact OG1-CB 3.26Å; T146-H149 PolarHBondContact OG1-N 3.32Å; T146-W150 PolarHBondContact O-N 3.14Å
147	G	96	Very high	96.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-56.4	-34	171.5	0	0	0	0	0	112.5	P98 L100 Q151	P98-G147 PolarHBondContact O-N 2.87Å; L100-G147 PolarHBondContact O-N 2.91Å; G147-Q151 WeakPolarHBondContact O-CB 3.49Å; G147-Q151 WeakPolarHBondContact O-CG 3.46Å; G147-Q151 PolarHBondContact O-N 2.65Å; G147-Q151 VanDerWaalsContact O-N 3.11Å; G147-Q151 PolarHBondContact O-NE2 3.48Å
148	A	97.3	Very high	96.6	Very high	49 Å²	49	43.7 Å²	43.7	41%	0.405	25%	0.245	S	C	.	.	H	α-helix	trans	-63.7	-43.6	172.7	0	0	0	0	0	113	P98 T146 S152	P98-A148 HydrophobicContact CB-CB 4.12Å; P98-A148 PolarHBondContact O-N 2.92Å; T146-A148 PolarHBondContact O-N 2.73Å; A148-S152 VanDerWaalsContact O-CB 3.31Å; A148-S152 WeakPolarHBondContact O-CB 3.31Å; A148-S152 PolarHBondContact O-N 3.16Å; A148-S152 VanDerWaalsContact O-N 3.12Å; A148-S152 PolarHBondContact O-OG 3.21Å
149	H	97.6	Very high	96.6	Very high	50 Å²	50	48.1 Å²	48.1	23%	0.231	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-45.3	176.1	179.7	135.6	0	0	0	111.6	D142 A145 T146 S152 R153	D142-H149 IonicContact OD2-CD2 3.5Å; D142-H149 IonicContact OD2-CE1 3.16Å; D142-H149 PolarHBondContact OD2-CE1 3.38Å; D142-H149 IonicContact OD2-NE2 3.89Å; D142-H149 PolarHBondContact OD2-NE2 3.21Å; A145-H149 HydrophobicContact CB-CB 3.87Å; T146-H149 WeakPolarHBondContact O-CB 3.36Å; T146-H149 PolarHBondContact O-N 3.01Å; T146-H149 WeakPolarHBondContact OG1-CB 3.26Å; T146-H149 PolarHBondContact OG1-N 3.32Å; H149-S152 PolarHBondContact O-OG 3.06Å; H149-R153 PolarHBondContact CE1-NH2 3.44Å; H149-R153 VanDerWaalsContact NE2-CZ 3.26Å; H149-R153 PolarHBondContact NE2-NH1 2.88Å; H149-R153 VanDerWaalsContact NE2-NH1 3.16Å; H149-R153 PolarHBondContact NE2-NH2 2.97Å
150	W	97.5	Very high	96.7	Very high	1 Å²	1	44.5 Å²	44.5	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-69.8	-32.2	-177.9	-68.1	125	0	0	0	113.9	L93 L96 Y102 L104 H140 D142 A145 T146 I155	L93-W150 HydrophobicContact CD2-CB 4.37Å; L96-W150 HydrophobicContact CD1-CB 4.02Å; Y102-W150 PolarHBondContact O-NE1 2.95Å; L104-W150 HydrophobicContact CB-CH2 3.92Å; L104-W150 HydrophobicContact CB-CZ2 4.02Å; L104-W150 HydrophobicContact CB-CZ3 4.39Å; L104-W150 HydrophobicContact CD1-CD2 3.97Å; L104-W150 HydrophobicContact CD1-CG 4.24Å; L104-W150 HydrophobicContact CD1-CZ2 4Å; L104-W150 HydrophobicContact CD2-CD2 4.1Å; L104-W150 HydrophobicContact CD2-CE3 3.87Å; L104-W150 HydrophobicContact CD2-CH2 4.31Å; L104-W150 HydrophobicContact CD2-CZ3 3.98Å; L104-W150 HydrophobicContact CG-CH2 4.48Å; L104-W150 HydrophobicContact CG-CZ2 4.4Å; H140-W150 HydrophobicContact CB-CH2 3.99Å; H140-W150 AromaticContact CE1-CZ3 3.88Å; H140-W150 AromaticContact CG-CH2 3.84Å; H140-W150 AromaticContact CG-CZ3 3.95Å; H140-W150 AromaticContact ND1-CH2 3.48Å; H140-W150 WeakPolarHBondContact ND1-CH2 3.48Å; H140-W150 AromaticContact ND1-CZ3 3.52Å; D142-W150 HydrophobicContact CB-CH2 3.69Å; D142-W150 HydrophobicContact CB-CZ2 4.37Å; D142-W150 HydrophobicContact CB-CZ3 3.98Å; A145-W150 HydrophobicContact CB-CD2 4.27Å; A145-W150 HydrophobicContact CB-CZ2 3.98Å; A145-W150 PolarHBondContact O-NE1 3.22Å; T146-W150 PolarHBondContact O-N 3.14Å; W150-I155 HydrophobicContact CE3-CD1 4.31Å; W150-I155 HydrophobicContact CE3-CG1 3.87Å; W150-I155 HydrophobicContact CZ3-CG1 4.29Å
151	Q	97.3	Very high	96.7	Very high	61 Å²	61	47 Å²	47	29%	0.285	25%	0.254	S	S	.	.	H	α-helix	trans	-86.6	-18.7	-179.4	-64.2	175.3	110.1	0	0	113.3	L93 S94 L96 G147 R153	L93-Q151 WeakPolarHBondContact O-CG 3.4Å; S94-Q151 VanDerWaalsContact C-OE1 3.31Å; L96-Q151 HydrophobicContact CB-CG 4.29Å; L96-Q151 PolarHBondContact O-NE2 3.5Å; G147-Q151 WeakPolarHBondContact O-CB 3.49Å; G147-Q151 WeakPolarHBondContact O-CG 3.46Å; G147-Q151 PolarHBondContact O-N 2.65Å; G147-Q151 VanDerWaalsContact O-N 3.11Å; G147-Q151 PolarHBondContact O-NE2 3.48Å; Q151-R153 VanDerWaalsContact C-N 3.32Å; Q151-R153 PolarHBondContact O-N 2.91Å
152	S	96.9	Very high	96.8	Very high	90 Å²	90	43.2 Å²	43.2	63%	0.629	23%	0.23	S	C	*	.	S	Bend	trans	-78.9	-6.1	-178.8	55.7	0	0	0	0	115.2	A148 H149	A148-S152 VanDerWaalsContact O-CB 3.31Å; A148-S152 WeakPolarHBondContact O-CB 3.31Å; A148-S152 PolarHBondContact O-N 3.16Å; A148-S152 VanDerWaalsContact O-N 3.12Å; A148-S152 PolarHBondContact O-OG 3.21Å; H149-S152 PolarHBondContact O-OG 3.06Å
153	R	94.3	Very high	96.9	Very high	117 Å²	117	40.7 Å²	40.7	44%	0.442	22%	0.216	S	C	.	.	S	Bend	trans	-150	160.1	-173.7	71.1	-176.9	76	173.2	-0.1	112.7	D142 H149 Q151 I155	D142-R153 IonicContact OD2-CZ 2.67Å; D142-R153 IonicContact OD2-NH1 2.75Å; D142-R153 PolarHBondContact OD2-NH1 2.75Å; H149-R153 PolarHBondContact CE1-NH2 3.44Å; H149-R153 VanDerWaalsContact NE2-CZ 3.26Å; H149-R153 PolarHBondContact NE2-NH1 2.88Å; H149-R153 VanDerWaalsContact NE2-NH1 3.16Å; H149-R153 PolarHBondContact NE2-NH2 2.97Å; Q151-R153 VanDerWaalsContact C-N 3.32Å; Q151-R153 PolarHBondContact O-N 2.91Å; R153-I155 PolarHBondContact O-N 2.96Å
154	T	97.3	Very high	97	Very high	52 Å²	52	42.9 Å²	42.9	32%	0.319	23%	0.226	S	C	.	.			trans	-59.7	126.9	160.4	-57.9	0	0	0	0	110.5	E61 R90	E61-T154 VanDerWaalsContact CD-CG2 3.43Å; E61-T154 WeakPolarHBondContact OE1-CG2 3.3Å; E61-T154 PolarHBondContact OE1-OG1 3.28Å; E61-T154 WeakPolarHBondContact OE2-CG2 3.26Å; E61-T154 PolarHBondContact OE2-OG1 2.79Å; R90-T154 HydrophobicContact CB-CG2 4.03Å; R90-T154 HydrophobicContact CG-CG2 4.14Å
155	I	98.1	Very high	97	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	138.9	168.3	-64.7	147.7	0	0	0	108.4	R90 L91 L93 L104 W150 R153 F157	R90-I155 CarbonylContact C-O 3.56Å; R90-I155 VanDerWaalsContact CA-O 3.31Å; R90-I155 WeakPolarHBondContact CA-O 3.41Å; L91-I155 HydrophobicContact CB-CB 4.35Å; L91-I155 PolarHBondContact N-O 3.34Å; L91-I155 PolarHBondContact O-N 2.67Å; L93-I155 HydrophobicContact CB-CD1 3.55Å; L93-I155 HydrophobicContact CD2-CD1 3.89Å; L93-I155 HydrophobicContact CG-CD1 4.41Å; L104-I155 HydrophobicContact CD2-CD1 3.61Å; L104-I155 HydrophobicContact CD2-CG1 4.11Å; L104-I155 HydrophobicContact CD2-CG2 3.98Å; W150-I155 HydrophobicContact CE3-CD1 4.31Å; W150-I155 HydrophobicContact CE3-CG1 3.87Å; W150-I155 HydrophobicContact CZ3-CG1 4.29Å; R153-I155 PolarHBondContact O-N 2.96Å; I155-F157 HydrophobicContact CG2-CD2 4.16Å; I155-F157 HydrophobicContact CG2-CE2 3.67Å; I155-F157 HydrophobicContact CG2-CZ 4.33Å
156	S	97.6	Very high	96.9	Very high	31 Å²	31	46.2 Å²	46.2	22%	0.217	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	102.3	-171.6	-177.8	0	0	0	0	113.2	H140 H158	H140-S156 PolarHBondContact NE2-N 3.47Å; S156-H158 PolarHBondContact O-N 2.83Å; S156-H158 PolarHBondContact O-ND1 3.21Å; S156-H158 PolarHBondContact OG-ND1 3.35Å; S156-H158 VanDerWaalsContact OG-ND1 3.13Å
157	F	97.9	Very high	96.8	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.009	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-74.5	20.8	178.6	-72	-84.9	0	0	0	114	L89 L91 L104 L106 F138 H140 I155 Y159 A160 V185	L89-F157 HydrophobicContact CB-CB 4.26Å; L89-F157 HydrophobicContact CD2-CB 4.39Å; L89-F157 HydrophobicContact CD2-CD2 4.2Å; L89-F157 HydrophobicContact CD2-CG 4.44Å; L89-F157 HydrophobicContact CG-CD2 4.43Å; L89-F157 PolarHBondContact O-N 3.22Å; L91-F157 HydrophobicContact CD1-CD2 3.98Å; L91-F157 HydrophobicContact CD1-CE2 3.7Å; L104-F157 HydrophobicContact CB-CZ 4.42Å; L106-F157 HydrophobicContact CB-CD1 3.62Å; L106-F157 HydrophobicContact CB-CE1 3.63Å; L106-F157 HydrophobicContact CB-CG 4.31Å; L106-F157 HydrophobicContact CB-CZ 4.33Å; L106-F157 HydrophobicContact CD2-CB 4.11Å; L106-F157 HydrophobicContact CD2-CD1 4.08Å; L106-F157 HydrophobicContact CD2-CG 4.24Å; L106-F157 HydrophobicContact CG-CD1 4.47Å; F138-F157 AromaticContact CD1-CD1 3.67Å; F138-F157 HydrophobicContact CD1-CD1 3.67Å; F138-F157 HydrophobicContact CD1-CE1 4.15Å; F138-F157 AromaticContact CE1-CD1 3.9Å; F138-F157 HydrophobicContact CE1-CD1 3.9Å; F138-F157 HydrophobicContact CE1-CE1 4.46Å; H140-F157 HydrophobicContact CB-CE1 3.96Å; H140-F157 HydrophobicContact CB-CZ 4.28Å; I155-F157 HydrophobicContact CG2-CD2 4.16Å; I155-F157 HydrophobicContact CG2-CE2 3.67Å; I155-F157 HydrophobicContact CG2-CZ 4.33Å; F157-Y159 PolarHBondContact O-N 2.95Å; F157-Y159 VanDerWaalsContact O-N 3.09Å; F157-A160 WeakPolarHBondContact O-CB 2.99Å; F157-A160 PolarHBondContact O-N 2.83Å; F157-V185 HydrophobicContact CE2-CG1 3.84Å; F157-V185 HydrophobicContact CE2-CG2 4.38Å; F157-V185 HydrophobicContact CZ-CG1 3.93Å
158	H	95.5	Very high	96.8	Very high	77 Å²	77	50.8 Å²	50.8	36%	0.356	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-62	-14.9	-178.4	75.1	-65.5	0	0	0	115.6	R84 S156	R84-H158 WeakPolarHBondContact CD-O 3.05Å; R84-H158 WeakPolarHBondContact CG-O 3.43Å; R84-H158 PolarHBondContact NE-O 3.44Å; S156-H158 PolarHBondContact O-N 2.83Å; S156-H158 PolarHBondContact O-ND1 3.21Å; S156-H158 PolarHBondContact OG-ND1 3.35Å; S156-H158 VanDerWaalsContact OG-ND1 3.13Å
159	Y	96.5	Very high	96.6	Very high	130 Å²	130	54.4 Å²	54.4	51%	0.51	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-81.2	-19.6	170.6	-74.1	-67	0	0	0	113.3	R84 P141 F157	R84-Y159 VanDerWaalsContact NH2-CD1 3.35Å; P141-Y159 HydrophobicContact CG-CD2 4.17Å; F157-Y159 PolarHBondContact O-N 2.95Å; F157-Y159 VanDerWaalsContact O-N 3.09Å
160	A	97.8	Very high	96.4	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.302	C	S	.	.			trans	-61.9	141.3	176.6	0	0	0	0	0	110.9	M85 L106 F138 F157	M85-A160 HydrophobicContact CE-CB 4.42Å; L106-A160 HydrophobicContact CD2-CB 3.87Å; F138-A160 HydrophobicContact CB-CB 4.17Å; F138-A160 HydrophobicContact CD1-CB 3.9Å; F138-A160 HydrophobicContact CD2-CB 3.93Å; F138-A160 HydrophobicContact CE1-CB 4.3Å; F138-A160 HydrophobicContact CE2-CB 4.33Å; F138-A160 HydrophobicContact CG-CB 3.7Å; F157-A160 WeakPolarHBondContact O-CB 2.99Å; F157-A160 PolarHBondContact O-N 2.83Å
161	K	98.2	Very high	96.2	Very high	65 Å²	65	60.8 Å²	60.8	28%	0.283	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	142	-178.1	-79.8	171	160.6	-164.1	0	110.5	K81 G82 R83 R84 H172 I173	K81-K161 PolarHBondContact O-NZ 2.78Å; G82-K161 WeakPolarHBondContact O-CE 3.05Å; R83-K161 CarbonylContact O-C 3.59Å; R83-K161 VanDerWaalsContact O-CA 3.26Å; R83-K161 WeakPolarHBondContact O-CA 3.4Å; R84-K161 HydrophobicContact CG-CG 4.2Å; K161-H172 HydrophobicContact CB-CB 4.42Å; K161-H172 WeakPolarHBondContact CD-CD2 3.47Å; K161-H172 WeakPolarHBondContact CD-NE2 3.42Å; K161-H172 PolarHBondContact NZ-NE2 3Å; K161-H172 VanDerWaalsContact NZ-NE2 3.15Å; K161-I173 PolarHBondContact O-N 3.32Å
162	L	98.4	Very high	96.2	Very high	1 Å²	1	59 Å²	59	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.1	176.1	-48.7	-176.6	0	0	0	109.5	M76 I78 G82 R83 M85 I173 L175 F210	M76-L162 HydrophobicContact CB-CD1 4.03Å; M76-L162 HydrophobicContact CG-CD1 4.46Å; I78-L162 HydrophobicContact CG2-CB 3.7Å; I78-L162 HydrophobicContact CG2-CD1 4.46Å; G82-L162 WeakPolarHBondContact CA-O 3.1Å; R83-L162 PolarHBondContact N-O 3.44Å; R83-L162 PolarHBondContact O-N 2.67Å; M85-L162 HydrophobicContact CG-CD1 3.78Å; M85-L162 HydrophobicContact CG-CD2 4.44Å; M85-L162 HydrophobicContact CG-CG 4.03Å; M85-L162 HydrophobicContact SD-CD1 4.38Å; L162-I173 CarbonylContact C-O 3.54Å; L162-I173 WeakPolarHBondContact CA-O 3.25Å; L162-I173 HydrophobicContact CD2-CB 4.07Å; L162-I173 HydrophobicContact CD2-CD1 4.42Å; L162-I173 HydrophobicContact CD2-CG2 4.36Å; L162-L175 HydrophobicContact CB-CD1 4.25Å; L162-L175 HydrophobicContact CD1-CD1 3.93Å; L162-L175 HydrophobicContact CD2-CD1 3.92Å; L162-L175 HydrophobicContact CG-CD1 4.24Å; L162-F210 HydrophobicContact CD1-CE1 4.5Å; L162-F210 HydrophobicContact CD1-CE2 3.95Å; L162-F210 HydrophobicContact CD1-CZ 3.64Å
163	T	98.3	Very high	96.2	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	151.2	-178.3	-172.6	0	0	0	0	111.4	T79 N165 D168 H172 I173 I174 L175	T79-T163 WeakPolarHBondContact O-CA 3.26Å; T79-T163 WeakPolarHBondContact O-CB 3.32Å; T79-T163 PolarHBondContact O-OG1 3.42Å; T163-N165 WeakPolarHBondContact OG1-CB 3.24Å; T163-N165 PolarHBondContact OG1-N 3.13Å; T163-N165 VanDerWaalsContact OG1-N 3.09Å; T163-D168 HydrophobicContact CG2-CB 3.92Å; T163-H172 HydrophobicContact CG2-CB 3.73Å; T163-I173 PolarHBondContact N-O 2.87Å; T163-I174 HydrophobicContact CG2-CB 4.2Å; T163-I174 HydrophobicContact CG2-CG1 3.77Å; T163-I174 HydrophobicContact CG2-CG2 4.42Å; T163-I174 WeakPolarHBondContact O-CA 3.46Å; T163-L175 PolarHBondContact O-N 2.78Å
164	N	96.9	Very high	96.4	Very high	71 Å²	71	49.9 Å²	49.9	38%	0.38	27%	0.269	S	S	.	.			trans	-95.7	2.7	167	68.9	-37.9	0	0	0	112.7	I78 K80 T166	I78-N164 HydrophobicContact CD1-CB 3.72Å; I78-N164 HydrophobicContact CG1-CB 4.04Å; K80-N164 PolarHBondContact N-OD1 2.67Å; N164-T166 PolarHBondContact O-N 2.71Å
165	N	96.3	Very high	96.4	Very high	41 Å²	41	47.7 Å²	47.7	22%	0.219	26%	0.255	C	S	.	.			trans	-81.7	103.9	178.9	-178.2	20.4	0	0	0	110.5	K80 T163 L167 D168 I174	K80-N165 HydrophobicContact CG-CB 4.24Å; T163-N165 WeakPolarHBondContact OG1-CB 3.24Å; T163-N165 PolarHBondContact OG1-N 3.13Å; T163-N165 VanDerWaalsContact OG1-N 3.09Å; N165-L167 PolarHBondContact O-N 3.2Å; N165-L167 PolarHBondContact OD1-N 2.79Å; N165-L167 VanDerWaalsContact OD1-N 3.16Å; N165-D168 HydrophobicContact CB-CB 4.22Å; N165-D168 WeakPolarHBondContact ND2-CA 3.47Å; N165-D168 PolarHBondContact ND2-N 3.3Å; N165-D168 VanDerWaalsContact O-CB 3.32Å; N165-D168 WeakPolarHBondContact O-CB 3.46Å; N165-D168 PolarHBondContact O-N 2.66Å; N165-D168 VanDerWaalsContact O-N 3.17Å; N165-I174 WeakPolarHBondContact O-CD1 3.38Å; N165-I174 WeakPolarHBondContact O-CG1 3.48Å
166	T	94.1	Very high	96.4	Very high	79 Å²	79	49 Å²	49	49%	0.485	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-21.9	176.3	55.6	0	0	0	0	113.6	L133 N164 I174	L133-T166 HydrophobicContact CD2-CG2 3.76Å; N164-T166 PolarHBondContact O-N 2.71Å; T166-I174 HydrophobicContact CG2-CG2 4.49Å; T166-I174 WeakPolarHBondContact O-CD1 3.31Å
167	L	93.1	Very high	96.4	Very high	142 Å²	142	48.7 Å²	48.7	74%	0.743	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	33.5	178.4	-54.2	179.5	0	0	0	112	N165 T169	N165-L167 PolarHBondContact O-N 3.2Å; N165-L167 PolarHBondContact OD1-N 2.79Å; N165-L167 VanDerWaalsContact OD1-N 3.16Å; L167-T169 PolarHBondContact O-N 3.15Å
168	D	95	Very high	96.4	Very high	6 Å²	6	50.3 Å²	50.3	3%	0.032	27%	0.268	C	S	.	.			trans	-69.3	116.2	179.5	-179	92.9	0	0	0	112.4	R136 T163 N165 Q170 G171 H172 I174	R136-D168 VanDerWaalsContact CZ-O 3.26Å; R136-D168 PolarHBondContact NH1-O 2.83Å; R136-D168 IonicContact NH1-OD2 3.44Å; R136-D168 PolarHBondContact NH1-OD2 3.36Å; R136-D168 PolarHBondContact NH2-O 2.84Å; T163-D168 HydrophobicContact CG2-CB 3.92Å; N165-D168 HydrophobicContact CB-CB 4.22Å; N165-D168 WeakPolarHBondContact ND2-CA 3.47Å; N165-D168 PolarHBondContact ND2-N 3.3Å; N165-D168 VanDerWaalsContact O-CB 3.32Å; N165-D168 WeakPolarHBondContact O-CB 3.46Å; N165-D168 PolarHBondContact O-N 2.66Å; N165-D168 VanDerWaalsContact O-N 3.17Å; D168-Q170 WeakPolarHBondContact OD2-CA 3.31Å; D168-Q170 PolarHBondContact OD2-N 2.95Å; D168-G171 PolarHBondContact OD2-N 3.31Å; D168-G171 VanDerWaalsContact OD2-N 3.15Å; D168-H172 IonicContact OD1-CE1 3.33Å; D168-H172 IonicContact OD1-CG 2.66Å; D168-H172 IonicContact OD1-ND1 3.13Å; D168-H172 PolarHBondContact OD1-ND1 3.45Å; D168-H172 IonicContact OD2-CG 3.18Å; D168-H172 PolarHBondContact OD2-N 2.92Å; D168-H172 IonicContact OD2-ND1 2.67Å; D168-I174 HydrophobicContact CB-CD1 4.38Å; D168-I174 HydrophobicContact CB-CG1 4.24Å
169	T	94.3	Very high	96.5	Very high	126 Å²	126	47 Å²	47	77%	0.773	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	1.9	178.7	59	0	0	0	0	114	L167	L167-T169 PolarHBondContact O-N 3.15Å
170	Q	94.1	Very high	96.6	Very high	138 Å²	138	44.2 Å²	44.2	65%	0.645	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	0.2	-171.7	-59.5	-64.4	-85.5	0	0	113	D168 H172	D168-Q170 WeakPolarHBondContact OD2-CA 3.31Å; D168-Q170 PolarHBondContact OD2-N 2.95Å; Q170-H172 VanDerWaalsContact C-N 3.27Å; Q170-H172 WeakPolarHBondContact CB-CE1 3.45Å; Q170-H172 PolarHBondContact O-N 3.16Å
171	G	92.8	Very high	96.6	Very high	46 Å²	46	44.7 Å²	44.7	47%	0.474	24%	0.243	S	C	.	.			trans	71.8	18.8	-175.5	0	0	0	0	0	113.6	D168	D168-G171 PolarHBondContact OD2-N 3.31Å; D168-G171 VanDerWaalsContact OD2-N 3.15Å
172	H	97.1	Very high	96.6	Very high	25 Å²	25	42.6 Å²	42.6	12%	0.116	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-67.1	152.2	171.8	-56.2	136.3	0	0	0	110.4	K81 R136 K161 T163 D168 Q170 I174	K81-H172 PolarHBondContact O-CE1 3.13Å; R136-H172 WeakPolarHBondContact CD-O 3.27Å; R136-H172 PolarHBondContact NH1-O 3.31Å; K161-H172 HydrophobicContact CB-CB 4.42Å; K161-H172 WeakPolarHBondContact CD-CD2 3.47Å; K161-H172 WeakPolarHBondContact CD-NE2 3.42Å; K161-H172 PolarHBondContact NZ-NE2 3Å; K161-H172 VanDerWaalsContact NZ-NE2 3.15Å; T163-H172 HydrophobicContact CG2-CB 3.73Å; D168-H172 IonicContact OD1-CE1 3.33Å; D168-H172 IonicContact OD1-CG 2.66Å; D168-H172 IonicContact OD1-ND1 3.13Å; D168-H172 PolarHBondContact OD1-ND1 3.45Å; D168-H172 IonicContact OD2-CG 3.18Å; D168-H172 PolarHBondContact OD2-N 2.92Å; D168-H172 IonicContact OD2-ND1 2.67Å; Q170-H172 VanDerWaalsContact C-N 3.27Å; Q170-H172 WeakPolarHBondContact CB-CE1 3.45Å; Q170-H172 PolarHBondContact O-N 3.16Å; H172-I174 PolarHBondContact O-N 2.99Å
173	I	97.6	Very high	96.6	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	117	175	-55.6	179.7	0	0	0	107.5	L106 V108 F138 K161 L162 T163 L175	L106-I173 HydrophobicContact CD2-CD1 4.38Å; L106-I173 HydrophobicContact CG-CD1 4.42Å; V108-I173 HydrophobicContact CB-CG2 4.2Å; V108-I173 HydrophobicContact CG2-CD1 3.98Å; V108-I173 HydrophobicContact CG2-CG2 4.34Å; F138-I173 HydrophobicContact CB-CD1 4.03Å; F138-I173 HydrophobicContact CB-CG1 4.35Å; K161-I173 PolarHBondContact O-N 3.32Å; L162-I173 CarbonylContact C-O 3.54Å; L162-I173 WeakPolarHBondContact CA-O 3.25Å; L162-I173 HydrophobicContact CD2-CB 4.07Å; L162-I173 HydrophobicContact CD2-CD1 4.42Å; L162-I173 HydrophobicContact CD2-CG2 4.36Å; T163-I173 PolarHBondContact N-O 2.87Å; I173-L175 HydrophobicContact CG2-CD2 3.94Å; I173-L175 HydrophobicContact CG2-CG 4.22Å
174	I	97.6	Very high	96.6	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.056	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	128.8	179.4	-49.3	165.6	0	0	0	108	L133 T163 N165 T166 D168 H172	L133-I174 HydrophobicContact CD1-CB 4.12Å; L133-I174 HydrophobicContact CD1-CG2 3.66Å; L133-I174 WeakPolarHBondContact CD1-O 3.5Å; L133-I174 HydrophobicContact CD2-CG2 4.23Å; L133-I174 HydrophobicContact CG-CG2 4.49Å; T163-I174 HydrophobicContact CG2-CB 4.2Å; T163-I174 HydrophobicContact CG2-CG1 3.77Å; T163-I174 HydrophobicContact CG2-CG2 4.42Å; T163-I174 WeakPolarHBondContact O-CA 3.46Å; N165-I174 WeakPolarHBondContact O-CD1 3.38Å; N165-I174 WeakPolarHBondContact O-CG1 3.48Å; T166-I174 HydrophobicContact CG2-CG2 4.49Å; T166-I174 WeakPolarHBondContact O-CD1 3.31Å; D168-I174 HydrophobicContact CB-CD1 4.38Å; D168-I174 HydrophobicContact CB-CG1 4.24Å; H172-I174 PolarHBondContact O-N 2.99Å
175	L	97.6	Very high	96.7	Very high	5 Å²	5	43.1 Å²	43.1	3%	0.026	23%	0.231	C	C	.	.			trans	-132.6	149.9	175.4	-54.7	175.8	0	0	0	109.6	I78 V108 L162 T163 I173 Y181 F210 T212	I78-L175 WeakPolarHBondContact CD1-O 3.41Å; V108-L175 HydrophobicContact CB-CD2 4.15Å; V108-L175 HydrophobicContact CG1-CD1 3.99Å; V108-L175 HydrophobicContact CG1-CD2 3.82Å; L162-L175 HydrophobicContact CB-CD1 4.25Å; L162-L175 HydrophobicContact CD1-CD1 3.93Å; L162-L175 HydrophobicContact CD2-CD1 3.92Å; L162-L175 HydrophobicContact CG-CD1 4.24Å; T163-L175 PolarHBondContact O-N 2.78Å; I173-L175 HydrophobicContact CG2-CD2 3.94Å; I173-L175 HydrophobicContact CG2-CG 4.22Å; L175-Y181 HydrophobicContact CB-CE2 3.93Å; L175-Y181 HydrophobicContact CD1-CD2 4.32Å; L175-Y181 HydrophobicContact CD1-CE2 4.43Å; L175-Y181 HydrophobicContact CD1-CG 4.46Å; L175-Y181 HydrophobicContact CD2-CD1 3.79Å; L175-Y181 HydrophobicContact CD2-CE1 3.56Å; L175-Y181 HydrophobicContact CD2-CE2 4.29Å; L175-Y181 HydrophobicContact CD2-CG 4.28Å; L175-Y181 HydrophobicContact CG-CE2 4.45Å; L175-F210 HydrophobicContact CD1-CE2 4.04Å; L175-F210 HydrophobicContact CD1-CZ 4.25Å; L175-T212 HydrophobicContact CB-CG2 3.86Å; L175-T212 HydrophobicContact CD1-CG2 3.56Å; L175-T212 HydrophobicContact CG-CG2 4.38Å
176	H	97.6	Very high	96.7	Very high	28 Å²	28	41.2 Å²	41.2	13%	0.13	22%	0.221	C	C	.	.			trans	-73.9	156.1	168.4	-66.2	-42.9	0	0	0	110	E130 A131 H179 Y181 T212	E130-H176 HydrophobicContact CB-CB 4.5Å; E130-H176 VanDerWaalsContact CB-CD2 3.42Å; E130-H176 WeakPolarHBondContact CB-CD2 3.47Å; E130-H176 IonicContact OE2-CG 3.55Å; E130-H176 IonicContact OE2-ND1 2.73Å; A131-H176 PolarHBondContact O-NE2 3Å; H176-H179 WeakPolarHBondContact CB-ND1 3.32Å; H176-Y181 PolarHBondContact N-OH 3.2Å; H176-T212 VanDerWaalsContact O-CB 3.23Å; H176-T212 WeakPolarHBondContact O-CB 3.45Å; H176-T212 PolarHBondContact O-OG1 3.38Å
177	S	97.6	Very high	96.8	Very high	25 Å²	25	37.5 Å²	37.5	18%	0.175	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	153.7	172.7	-163.5	0	0	0	0	110.5	H179	S177-H179 VanDerWaalsContact C-N 3.33Å; S177-H179 PolarHBondContact O-CE1 2.87Å; S177-H179 PolarHBondContact O-N 3.32Å; S177-H179 PolarHBondContact O-ND1 2.87Å
178	L	98.1	Very high	96.8	Very high	37 Å²	37	31 Å²	31	19%	0.194	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	31.8	176.6	-48	177.4	0	0	0	114.9	Y116 W123 T212 V213	Y116-L178 WeakPolarHBondContact CB-O 3.13Å; Y116-L178 PolarHBondContact N-O 3.16Å; Y116-L178 WeakPolarHBondContact O-CB 3.27Å; W123-L178 HydrophobicContact CH2-CD2 4.12Å; W123-L178 HydrophobicContact CZ3-CD2 4.2Å; L178-T212 WeakPolarHBondContact CA-O 3.47Å; L178-T212 PolarHBondContact N-O 3.39Å; L178-T212 PolarHBondContact N-OG1 3.44Å; L178-V213 HydrophobicContact CD2-CG1 4.34Å
179	H	98.1	Very high	96.7	Very high	8 Å²	8	32 Å²	32	4%	0.037	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	153.4	176.2	-68.5	79	0	0	0	110.6	S114 A129 E130 H176 S177 Y181 I211 T212	S114-H179 PolarHBondContact O-CD2 2.93Å; A129-H179 VanDerWaalsContact CA-NE2 3.31Å; A129-H179 WeakPolarHBondContact CA-NE2 3.31Å; E130-H179 PolarHBondContact N-NE2 2.76Å; E130-H179 IonicContact OE1-CE1 3.58Å; H176-H179 WeakPolarHBondContact CB-ND1 3.32Å; S177-H179 VanDerWaalsContact C-N 3.33Å; S177-H179 PolarHBondContact O-CE1 2.87Å; S177-H179 PolarHBondContact O-N 3.32Å; S177-H179 PolarHBondContact O-ND1 2.87Å; H179-Y181 HydrophobicContact CB-CD2 4.33Å; H179-Y181 HydrophobicContact CB-CE2 3.61Å; H179-Y181 WeakPolarHBondContact O-CD2 3.36Å; H179-I211 WeakPolarHBondContact O-CA 3.39Å; H179-T212 PolarHBondContact N-OG1 3.08Å; H179-T212 PolarHBondContact O-N 2.81Å; H179-T212 PolarHBondContact O-OG1 3.45Å
180	R	98.1	Very high	96.4	Very high	71 Å²	71	26.8 Å²	26.8	27%	0.268	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	137	177.3	-75.2	177	177.6	-176.8	-0.4	111.4	A111 D112 Y116 F210 I211	A111-R180 HydrophobicContact CB-CB 4.03Å; A111-R180 PolarHBondContact N-O 3.25Å; D112-R180 WeakPolarHBondContact OD2-CB 3.26Å; D112-R180 WeakPolarHBondContact OD2-CD 3.4Å; Y116-R180 HydrophobicContact CD2-CG 4.1Å; Y116-R180 HydrophobicContact CE2-CB 4.31Å; Y116-R180 HydrophobicContact CE2-CG 3.67Å; Y116-R180 PolarHBondContact OH-NH1 3.39Å; R180-F210 WeakPolarHBondContact CA-O 3.21Å; R180-I211 HydrophobicContact CG-CD1 4.11Å; R180-I211 HydrophobicContact CG-CG1 3.48Å; R180-I211 VanDerWaalsContact CG-CG1 3.48Å
181	Y	98.4	Very high	95.5	Very high	10 Å²	10	28 Å²	28	4%	0.039	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	145.1	-175.5	-71.4	-81.2	0	0	0	112.5	V108 V109 P110 L175 H176 H179 Q209 F210 T212	V108-Y181 HydrophobicContact CG1-CD1 3.92Å; V108-Y181 HydrophobicContact CG1-CG 3.98Å; V109-Y181 CarbonylContact O-C 3.52Å; V109-Y181 VanDerWaalsContact O-CA 3.31Å; V109-Y181 WeakPolarHBondContact O-CA 3.49Å; V109-Y181 WeakPolarHBondContact O-CD1 3.37Å; P110-Y181 HydrophobicContact CB-CE1 4.35Å; P110-Y181 HydrophobicContact CG-CD1 4.44Å; P110-Y181 HydrophobicContact CG-CE1 3.98Å; L175-Y181 HydrophobicContact CB-CE2 3.93Å; L175-Y181 HydrophobicContact CD1-CD2 4.32Å; L175-Y181 HydrophobicContact CD1-CE2 4.43Å; L175-Y181 HydrophobicContact CD1-CG 4.46Å; L175-Y181 HydrophobicContact CD2-CD1 3.79Å; L175-Y181 HydrophobicContact CD2-CE1 3.56Å; L175-Y181 HydrophobicContact CD2-CE2 4.29Å; L175-Y181 HydrophobicContact CD2-CG 4.28Å; L175-Y181 HydrophobicContact CG-CE2 4.45Å; H176-Y181 PolarHBondContact N-OH 3.2Å; H179-Y181 HydrophobicContact CB-CD2 4.33Å; H179-Y181 HydrophobicContact CB-CE2 3.61Å; H179-Y181 WeakPolarHBondContact O-CD2 3.36Å; Y181-Q209 WeakPolarHBondContact O-CA 3.38Å; Y181-Q209 WeakPolarHBondContact O-CG 3.29Å; Y181-F210 HydrophobicContact CD2-CE2 4.47Å; Y181-F210 PolarHBondContact N-O 3.33Å; Y181-F210 PolarHBondContact O-N 3.05Å; Y181-T212 HydrophobicContact CD2-CG2 3.62Å; Y181-T212 HydrophobicContact CE2-CG2 3.7Å
182	Q	98.3	Very high	94.2	Very high	21 Å²	21	29.1 Å²	29.1	10%	0.098	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	115.2	175.8	177.6	60.2	64.2	0	0	109.7	V109 A111 V204 F205 T208	V109-Q182 HydrophobicContact CG2-CB 4.22Å; V109-Q182 PolarHBondContact N-O 2.86Å; V109-Q182 VanDerWaalsContact N-O 3.07Å; V109-Q182 PolarHBondContact O-N 3.05Å; A111-Q182 HydrophobicContact CB-CB 4.43Å; Q182-V204 VanDerWaalsContact CD-CG1 3.5Å; Q182-V204 HydrophobicContact CG-CG1 3.53Å; Q182-F205 PolarHBondContact NE2-O 2.84Å; Q182-T208 PolarHBondContact NE2-OG1 3.18Å
183	P	98.4	Very high	92.2	Very high	4 Å²	4	33.7 Å²	33.7	3%	0.026	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	138.9	167	-24.7	36.6	0	0	0	111.9	L106 T208 F210	L106-P183 HydrophobicContact CD1-CB 4.1Å; P183-T208 VanDerWaalsContact CD-O 3.26Å; P183-T208 WeakPolarHBondContact CD-O 3.47Å; P183-T208 WeakPolarHBondContact CG-O 3.4Å; P183-F210 HydrophobicContact CG-CD1 4.16Å; P183-F210 HydrophobicContact CG-CE1 3.67Å
184	R	98.1	Very high	90.2	Very high	76 Å²	76	37.8 Å²	37.8	29%	0.287	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	139.7	171.3	-45.6	161.1	59	-140	15.4	109.5	L106 D107 V109 H186 F203 V204	L106-R184 WeakPolarHBondContact CA-O 3.22Å; D107-R184 PolarHBondContact N-O 3.45Å; D107-R184 PolarHBondContact O-N 3.4Å; D107-R184 VanDerWaalsContact O-N 3.11Å; D107-R184 WeakPolarHBondContact OD1-CB 3.37Å; D107-R184 VanDerWaalsContact OD1-CD 3.26Å; D107-R184 WeakPolarHBondContact OD1-CD 3.36Å; D107-R184 WeakPolarHBondContact OD1-CG 3.49Å; D107-R184 IonicContact OD1-NH1 2.71Å; D107-R184 IonicContact OD2-CZ 3.23Å; D107-R184 IonicContact OD2-NH1 3.21Å; D107-R184 PolarHBondContact OD2-NH1 3.16Å; V109-R184 HydrophobicContact CG2-CG 4.24Å; R184-H186 PolarHBondContact NH1-NE2 3.18Å; R184-F203 WeakPolarHBondContact CA-O 3.09Å; R184-V204 HydrophobicContact CB-CG2 4.29Å; R184-V204 HydrophobicContact CG-CG2 4.01Å
185	V	98.3	Very high	88.3	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	126	-177.2	-177.9	0	0	0	0	109.3	M58 L89 L91 L105 L106 F157 F203	M58-V185 HydrophobicContact CE-CG1 3.89Å; M58-V185 HydrophobicContact SD-CB 4.02Å; M58-V185 HydrophobicContact SD-CG1 3.77Å; L89-V185 HydrophobicContact CD2-CG2 3.86Å; L91-V185 HydrophobicContact CD1-CB 4.22Å; L91-V185 HydrophobicContact CD1-CG1 3.84Å; L91-V185 HydrophobicContact CD1-CG2 3.78Å; L105-V185 WeakPolarHBondContact O-CA 3.33Å; L106-V185 HydrophobicContact CD1-CG2 4.15Å; F157-V185 HydrophobicContact CE2-CG1 3.84Å; F157-V185 HydrophobicContact CE2-CG2 4.38Å; F157-V185 HydrophobicContact CZ-CG1 3.93Å; V185-F203 PolarHBondContact N-O 2.65Å; V185-F203 PolarHBondContact O-N 2.9Å
186	H	96.8	Very high	86.7	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.009	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	134.1	-175.5	-60.5	-83.7	0	0	0	110.8	L104 L105 D107 R184 H201 S202	L104-H186 WeakPolarHBondContact CA-O 3.49Å; L105-H186 HydrophobicContact CD1-CB 3.71Å; L105-H186 HydrophobicContact CG-CB 4.06Å; L105-H186 PolarHBondContact N-O 3.04Å; L105-H186 PolarHBondContact O-N 3.13Å; D107-H186 IonicContact OD2-NE2 3.65Å; R184-H186 PolarHBondContact NH1-NE2 3.18Å; H186-H201 WeakPolarHBondContact CA-O 3.47Å; H186-S202 PolarHBondContact CE1-OG 3.22Å; H186-S202 WeakPolarHBondContact ND1-CB 3.48Å; H186-S202 PolarHBondContact ND1-OG 2.99Å
187	V	96.1	Very high	84.7	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	117.5	172.5	-178.8	0	0	0	0	107.1	M58 L93 L96 Y102 L104 Q200 H201 F203	M58-V187 HydrophobicContact CE-CG2 3.52Å; L93-V187 HydrophobicContact CD1-CG2 4.42Å; L93-V187 HydrophobicContact CD2-CG1 4.46Å; L93-V187 HydrophobicContact CD2-CG2 3.8Å; L96-V187 HydrophobicContact CD1-CG1 4.43Å; L96-V187 HydrophobicContact CD2-CG1 3.94Å; Y102-V187 HydrophobicContact CD1-CG1 3.84Å; Y102-V187 HydrophobicContact CG-CG1 4.22Å; L104-V187 HydrophobicContact CD1-CB 4.22Å; L104-V187 HydrophobicContact CD1-CG1 3.83Å; L104-V187 HydrophobicContact CD1-CG2 3.95Å; L104-V187 HydrophobicContact CG-CG2 4.02Å; V187-Q200 WeakPolarHBondContact O-CA 3.44Å; V187-H201 HydrophobicContact CB-CB 4.42Å; V187-H201 PolarHBondContact N-O 3.25Å; V187-H201 PolarHBondContact O-N 3.42Å; V187-F203 HydrophobicContact CG2-CD2 4.33Å; V187-F203 HydrophobicContact CG2-CE2 3.89Å
188	I	93.9	Very high	83.4	Confident	6 Å²	6	48.6 Å²	48.6	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	119.8	-175.5	-56.3	174.4	0	0	0	108.9	Y102 I103 L105 A190 W196 Q200	Y102-I188 CarbonylContact C-O 3.55Å; Y102-I188 VanDerWaalsContact CA-O 3.24Å; Y102-I188 WeakPolarHBondContact CA-O 3.49Å; I103-I188 PolarHBondContact N-O 3.39Å; I103-I188 PolarHBondContact O-N 3.28Å; L105-I188 HydrophobicContact CD2-CD1 3.95Å; I188-A190 PolarHBondContact O-N 3.46Å; I188-W196 HydrophobicContact CD1-CE3 4.1Å; I188-W196 HydrophobicContact CD1-CZ3 4.22Å; I188-W196 HydrophobicContact CG2-CB 4.45Å; I188-Q200 HydrophobicContact CG1-CG 4.14Å
189	E	92.5	Very high	82.6	Confident	28 Å²	28	48.2 Å²	48.2	13%	0.131	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	119	172.2	-176.5	-155.5	143.7	0	0	110.3	L100 Y102 R191 G198 G199	L100-E189 HydrophobicContact CD1-CG 4.23Å; Y102-E189 HydrophobicContact CD1-CB 4.1Å; Y102-E189 HydrophobicContact CE1-CB 3.97Å; Y102-E189 HydrophobicContact CE1-CG 4.28Å; E189-R191 HydrophobicContact CG-CG 4.43Å; E189-R191 WeakPolarHBondContact OE1-CG 3.45Å; E189-R191 IonicContact OE1-CZ 3.5Å; E189-R191 IonicContact OE1-NE 2.73Å; E189-R191 PolarHBondContact OE1-NE 3.01Å; E189-R191 IonicContact OE1-NH2 3.35Å; E189-R191 PolarHBondContact OE1-NH2 3Å; E189-R191 IonicContact OE2-CZ 3.96Å; E189-R191 IonicContact OE2-NE 3.81Å; E189-R191 IonicContact OE2-NH2 3.25Å; E189-R191 PolarHBondContact OE2-NH2 3.13Å; E189-G198 PolarHBondContact O-N 3.44Å; E189-G198 VanDerWaalsContact OE2-CA 3.28Å; E189-G198 WeakPolarHBondContact OE2-CA 3.44Å; E189-G199 WeakPolarHBondContact CB-O 3.42Å; E189-G199 PolarHBondContact N-O 3.08Å; E189-G199 PolarHBondContact OE2-N 3.18Å
190	A	88.4	Confident	82.2	Confident	15 Å²	15	51.8 Å²	51.8	12%	0.124	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	95.6	179.4	0	0	0	0	0	109.8	R101 I103 P144 I188 D192	R101-A190 HydrophobicContact CB-CB 4.42Å; R101-A190 PolarHBondContact O-N 3.31Å; I103-A190 HydrophobicContact CD1-CB 4.31Å; I103-A190 HydrophobicContact CG1-CB 4.22Å; P144-A190 HydrophobicContact CB-CB 4.37Å; I188-A190 PolarHBondContact O-N 3.46Å; A190-D192 VanDerWaalsContact C-N 3.26Å; A190-D192 PolarHBondContact O-N 2.93Å
191	R	74.6	Confident	82	Confident	164 Å²	164	51.7 Å²	51.7	62%	0.619	25%	0.254	S	S	*	.	S	Bend	trans	-72.6	-19.9	179.9	-70.8	-176.1	171.8	165	5.5	113.8	E189 G197 G198	E189-R191 HydrophobicContact CG-CG 4.43Å; E189-R191 WeakPolarHBondContact OE1-CG 3.45Å; E189-R191 IonicContact OE1-CZ 3.5Å; E189-R191 IonicContact OE1-NE 2.73Å; E189-R191 PolarHBondContact OE1-NE 3.01Å; E189-R191 IonicContact OE1-NH2 3.35Å; E189-R191 PolarHBondContact OE1-NH2 3Å; E189-R191 IonicContact OE2-CZ 3.96Å; E189-R191 IonicContact OE2-NE 3.81Å; E189-R191 IonicContact OE2-NH2 3.25Å; E189-R191 PolarHBondContact OE2-NH2 3.13Å; R191-G197 PolarHBondContact NH1-O 3.27Å; R191-G198 VanDerWaalsContact CZ-CA 3.45Å
192	D	66.1	Low	81.8	Confident	70 Å²	70	53.9 Å²	53.9	37%	0.374	27%	0.271	S	S	.	.	S	Bend	trans	-154.2	162	179.8	-154.4	-28.3	0	0	0	108.6	A190 L194 R195	A190-D192 VanDerWaalsContact C-N 3.26Å; A190-D192 PolarHBondContact O-N 2.93Å; D192-L194 PolarHBondContact O-N 2.93Å; D192-L194 VanDerWaalsContact O-N 3.09Å; D192-R195 HydrophobicContact CB-CB 3.7Å; D192-R195 HydrophobicContact CB-CG 4.02Å; D192-R195 PolarHBondContact O-N 3.49Å; D192-R195 IonicContact OD2-CZ 2.7Å; D192-R195 IonicContact OD2-NE 2.79Å; D192-R195 PolarHBondContact OD2-NE 2.95Å; D192-R195 IonicContact OD2-NH2 3.18Å; D192-R195 PolarHBondContact OD2-NH2 3.19Å
193	M	54.2	Low	81.8	Confident	121 Å²	121	54.5 Å²	54.5	60%	0.596	27%	0.274	S	S	*	.	S	Bend	trans	-61.3	-21.9	179.8	-72.4	-172.5	173.9	0	0	113.4	W356	M193-W356 HydrophobicContact SD-CH2 4.5Å; M193-W356 HydrophobicContact SD-CZ2 3.82Å
194	L	55.9	Low	81.8	Confident	90 Å²	90	57.8 Å²	57.8	47%	0.471	29%	0.293	S	S	.	.	S	Bend	trans	-119.3	-3.5	176.5	-109.2	85.6	0	0	0	115.3	D192 F360	D192-L194 PolarHBondContact O-N 2.93Å; D192-L194 VanDerWaalsContact O-N 3.09Å; L194-F360 HydrophobicContact CD1-CD2 4.42Å; L194-F360 HydrophobicContact CD1-CE1 4.09Å; L194-F360 HydrophobicContact CD1-CE2 3.75Å; L194-F360 HydrophobicContact CD1-CZ 3.58Å; L194-F360 HydrophobicContact CD2-CD1 4.45Å; L194-F360 HydrophobicContact CD2-CE1 3.43Å; L194-F360 VanDerWaalsContact CD2-CE1 3.43Å; L194-F360 HydrophobicContact CD2-CE2 4.45Å; L194-F360 HydrophobicContact CD2-CZ 3.45Å; L194-F360 VanDerWaalsContact CD2-CZ 3.45Å; L194-F360 HydrophobicContact CG-CE1 4.4Å; L194-F360 HydrophobicContact CG-CZ 4.06Å
195	R	57.5	Low	81.8	Confident	169 Å²	169	55.5 Å²	55.5	64%	0.638	29%	0.285	S	S	*	.			trans	-113	103.8	-171.6	-61.3	-171.9	-78.4	165.8	-3.1	112	D192	D192-R195 HydrophobicContact CB-CB 3.7Å; D192-R195 HydrophobicContact CB-CG 4.02Å; D192-R195 PolarHBondContact O-N 3.49Å; D192-R195 IonicContact OD2-CZ 2.7Å; D192-R195 IonicContact OD2-NE 2.79Å; D192-R195 PolarHBondContact OD2-NE 2.95Å; D192-R195 IonicContact OD2-NH2 3.18Å; D192-R195 PolarHBondContact OD2-NH2 3.19Å
196	W	63.6	Low	81.8	Confident	66 Å²	66	59.9 Å²	59.9	25%	0.25	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	136.5	172.7	-55.8	19.2	0	0	0	107.8	I103 L105 I139 I188 V381	I103-W196 HydrophobicContact CD1-CD2 4.36Å; I103-W196 HydrophobicContact CD1-CZ2 4.05Å; L105-W196 HydrophobicContact CD2-CH2 4.44Å; L105-W196 HydrophobicContact CD2-CZ3 4.23Å; I139-W196 HydrophobicContact CD1-CH2 4.45Å; I188-W196 HydrophobicContact CD1-CE3 4.1Å; I188-W196 HydrophobicContact CD1-CZ3 4.22Å; I188-W196 HydrophobicContact CG2-CB 4.45Å; W196-V381 HydrophobicContact CH2-CB 4.22Å; W196-V381 HydrophobicContact CH2-CG1 3.61Å; W196-V381 HydrophobicContact CH2-CG2 3.55Å; W196-V381 HydrophobicContact CZ2-CG1 3.75Å; W196-V381 HydrophobicContact CZ3-CB 4.31Å; W196-V381 HydrophobicContact CZ3-CG1 4.03Å; W196-V381 HydrophobicContact CZ3-CG2 3.57Å
197	G	55.9	Low	81.9	Confident	44 Å²	44	61 Å²	61	45%	0.454	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	137.1	27.2	-174.2	0	0	0	0	0	115	R191	R191-G197 PolarHBondContact NH1-O 3.27Å
198	G	70.3	Confident	82	Confident	17 Å²	17	61 Å²	61	18%	0.175	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-157.2	152.7	0	0	0	0	0	111.6	E189 R191 Q200	E189-G198 PolarHBondContact O-N 3.44Å; E189-G198 VanDerWaalsContact OE2-CA 3.28Å; E189-G198 WeakPolarHBondContact OE2-CA 3.44Å; R191-G198 VanDerWaalsContact CZ-CA 3.45Å; G198-Q200 PolarHBondContact O-N 2.82Å
199	G	81	Confident	82.2	Confident	29 Å²	29	64.3 Å²	64.3	30%	0.299	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	134.1	174.4	0	0	0	0	0	112.3	E189	E189-G199 WeakPolarHBondContact CB-O 3.42Å; E189-G199 PolarHBondContact N-O 3.08Å; E189-G199 PolarHBondContact OE2-N 3.18Å
200	Q	89.5	Confident	82.5	Confident	82 Å²	82	63.1 Å²	63.1	38%	0.383	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	130.3	171.9	175.5	173.1	-41.3	0	0	109.7	V187 I188 G198	V187-Q200 WeakPolarHBondContact O-CA 3.44Å; I188-Q200 HydrophobicContact CG1-CG 4.14Å; G198-Q200 PolarHBondContact O-N 2.82Å
201	H	93.6	Very high	83	Confident	69 Å²	69	62.8 Å²	62.8	32%	0.319	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140.1	173.3	-56.6	-93.9	0	0	0	108.7	V56 H186 V187 F203	V56-H201 HydrophobicContact CG1-CB 4.44Å; H186-H201 WeakPolarHBondContact CA-O 3.47Å; V187-H201 HydrophobicContact CB-CB 4.42Å; V187-H201 PolarHBondContact N-O 3.25Å; V187-H201 PolarHBondContact O-N 3.42Å; H201-F203 HydrophobicContact CB-CE2 3.55Å; H201-F203 HydrophobicContact CB-CZ 3.67Å
202	S	95.9	Very high	84.1	Confident	57 Å²	57	55 Å²	55	40%	0.399	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	118.7	-173.8	-52	0	0	0	0	109.1	H186	H186-S202 PolarHBondContact CE1-OG 3.22Å; H186-S202 WeakPolarHBondContact ND1-CB 3.48Å; H186-S202 PolarHBondContact ND1-OG 2.99Å
203	F	98	Very high	85.7	Confident	34 Å²	34	51.6 Å²	51.6	15%	0.149	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	137.2	-172.4	-58.1	-81.3	0	0	0	110.6	V56 M58 R184 V185 V187 H201 F205	V56-F203 HydrophobicContact CB-CZ 4.4Å; V56-F203 HydrophobicContact CG1-CE2 4.39Å; V56-F203 HydrophobicContact CG1-CZ 3.91Å; V56-F203 WeakPolarHBondContact O-CE1 3.13Å; V56-F203 WeakPolarHBondContact O-CZ 3.5Å; M58-F203 HydrophobicContact CB-CB 4.27Å; M58-F203 HydrophobicContact CB-CD1 3.63Å; M58-F203 HydrophobicContact CB-CD2 3.88Å; M58-F203 HydrophobicContact CB-CE1 3.87Å; M58-F203 HydrophobicContact CB-CE2 4.11Å; M58-F203 HydrophobicContact CB-CG 3.64Å; M58-F203 HydrophobicContact CB-CZ 4.1Å; M58-F203 HydrophobicContact CE-CD2 3.55Å; M58-F203 HydrophobicContact CE-CE2 3.86Å; M58-F203 HydrophobicContact CE-CG 4.32Å; M58-F203 HydrophobicContact CG-CD2 4.41Å; M58-F203 HydrophobicContact CG-CG 4.32Å; M58-F203 HydrophobicContact SD-CB 3.83Å; M58-F203 HydrophobicContact SD-CD2 3.63Å; M58-F203 HydrophobicContact SD-CE2 4.42Å; M58-F203 HydrophobicContact SD-CG 3.82Å; R184-F203 WeakPolarHBondContact CA-O 3.09Å; V185-F203 PolarHBondContact N-O 2.65Å; V185-F203 PolarHBondContact O-N 2.9Å; V187-F203 HydrophobicContact CG2-CD2 4.33Å; V187-F203 HydrophobicContact CG2-CE2 3.89Å; H201-F203 HydrophobicContact CB-CE2 3.55Å; H201-F203 HydrophobicContact CB-CZ 3.67Å; F203-F205 HydrophobicContact CB-CE2 4.28Å; F203-F205 HydrophobicContact CB-CZ 4.46Å
204	V	98.2	Very high	87.8	Confident	72 Å²	72	49.9 Å²	49.9	44%	0.436	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	126.9	-176.2	-170.2	0	0	0	0	108.1	Q182 R184	Q182-V204 VanDerWaalsContact CD-CG1 3.5Å; Q182-V204 HydrophobicContact CG-CG1 3.53Å; R184-V204 HydrophobicContact CB-CG2 4.29Å; R184-V204 HydrophobicContact CG-CG2 4.01Å
205	F	98.3	Very high	89.8	Confident	28 Å²	28	48.1 Å²	48.1	12%	0.123	27%	0.273	C	S	.	.			trans	-113.9	108.1	179.9	-60.3	-77.5	0	0	0	108.9	M58 L60 L91 Q182 F203 E207 T208	M58-F205 HydrophobicContact CB-CZ 4.32Å; M58-F205 HydrophobicContact CG-CE2 4.43Å; M58-F205 HydrophobicContact CG-CZ 4.06Å; M58-F205 WeakPolarHBondContact O-CE1 3.23Å; M58-F205 WeakPolarHBondContact O-CZ 3.42Å; M58-F205 HydrophobicContact SD-CE2 4.34Å; L60-F205 HydrophobicContact CB-CD1 3.73Å; L60-F205 HydrophobicContact CB-CD2 4.46Å; L60-F205 HydrophobicContact CB-CE1 3.84Å; L60-F205 HydrophobicContact CB-CG 4.06Å; L60-F205 HydrophobicContact CB-CZ 4.26Å; L60-F205 HydrophobicContact CD2-CB 4.07Å; L60-F205 HydrophobicContact CD2-CD1 4.45Å; L60-F205 HydrophobicContact CD2-CG 4.25Å; L91-F205 HydrophobicContact CD2-CD2 4.23Å; L91-F205 HydrophobicContact CD2-CE2 3.54Å; L91-F205 HydrophobicContact CD2-CZ 4.06Å; Q182-F205 PolarHBondContact NE2-O 2.84Å; F203-F205 HydrophobicContact CB-CE2 4.28Å; F203-F205 HydrophobicContact CB-CZ 4.46Å; F205-E207 PolarHBondContact O-N 3.45Å; F205-T208 HydrophobicContact CB-CG2 3.74Å; F205-T208 WeakPolarHBondContact O-CB 3.37Å; F205-T208 PolarHBondContact O-N 3.48Å; F205-T208 PolarHBondContact O-OG1 2.7Å
206	P	98.1	Very high	91.8	Very high	94 Å²	94	43.3 Å²	43.3	61%	0.61	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-58.5	-32.6	-175	-27.7	36.4	0	0	0	113.9	T208 Q209	P206-T208 PolarHBondContact O-N 2.88Å; P206-T208 VanDerWaalsContact O-N 3.14Å; P206-Q209 WeakPolarHBondContact O-CB 3.34Å; P206-Q209 PolarHBondContact O-N 2.74Å
207	E	98	Very high	93.4	Very high	25 Å²	25	43.8 Å²	43.8	12%	0.117	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-69.5	-7	176.4	69.2	-98.3	-117.3	0	0	114.3	L60 S63 W66 K67 F205	L60-E207 HydrophobicContact CD2-CG 3.62Å; S63-E207 PolarHBondContact OG-OE1 2.88Å; W66-E207 HydrophobicContact CB-CB 4.36Å; W66-E207 HydrophobicContact CB-CG 3.71Å; K67-E207 WeakPolarHBondContact CE-OE1 3.42Å; K67-E207 HydrophobicContact CG-CB 3.82Å; K67-E207 HydrophobicContact CG-CG 4.08Å; K67-E207 IonicContact NZ-OE1 2.85Å; K67-E207 PolarHBondContact NZ-OE1 2.83Å; K67-E207 VanDerWaalsContact NZ-OE1 3.16Å; F205-E207 PolarHBondContact O-N 3.45Å
208	T	98.6	Very high	95.4	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-93.1	-1.7	175.4	68.3	0	0	0	0	113.9	L60 W66 L89 Q182 P183 F205 P206 F210	L60-T208 HydrophobicContact CD1-CG2 4.1Å; L60-T208 HydrophobicContact CD2-CG2 3.67Å; W66-T208 HydrophobicContact CD2-CG2 3.85Å; W66-T208 HydrophobicContact CE3-CG2 3.91Å; W66-T208 HydrophobicContact CG-CG2 4.31Å; W66-T208 HydrophobicContact CH2-CG2 4.38Å; W66-T208 HydrophobicContact CZ2-CG2 4.34Å; W66-T208 HydrophobicContact CZ3-CG2 4.17Å; L89-T208 HydrophobicContact CD1-CG2 4.14Å; Q182-T208 PolarHBondContact NE2-OG1 3.18Å; P183-T208 VanDerWaalsContact CD-O 3.26Å; P183-T208 WeakPolarHBondContact CD-O 3.47Å; P183-T208 WeakPolarHBondContact CG-O 3.4Å; F205-T208 HydrophobicContact CB-CG2 3.74Å; F205-T208 WeakPolarHBondContact O-CB 3.37Å; F205-T208 PolarHBondContact O-N 3.48Å; F205-T208 PolarHBondContact O-OG1 2.7Å; P206-T208 PolarHBondContact O-N 2.88Å; P206-T208 VanDerWaalsContact O-N 3.14Å; T208-F210 WeakPolarHBondContact O-CD1 3.41Å
209	Q	98.6	Very high	96.7	Very high	75 Å²	75	47.3 Å²	47.3	35%	0.35	26%	0.264	S	S	.	.			trans	-58.4	140.4	171.4	-170.8	-179.2	105.5	0	0	110.8	T74 A111 Y181 P206	T74-Q209 WeakPolarHBondContact CB-O 3.46Å; T74-Q209 PolarHBondContact OG1-O 3.03Å; A111-Q209 HydrophobicContact CB-CG 4.37Å; Y181-Q209 WeakPolarHBondContact O-CA 3.38Å; Y181-Q209 WeakPolarHBondContact O-CG 3.29Å; P206-Q209 WeakPolarHBondContact O-CB 3.34Å; P206-Q209 PolarHBondContact O-N 2.74Å
210	F	98.8	Very high	97.4	Very high	3 Å²	3	52.3 Å²	52.3	1%	0.013	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	161.7	178	59.6	-107.9	0	0	0	113.7	T74 M76 M85 V108 L162 L175 R180 Y181 P183 T208 T212	T74-F210 HydrophobicContact CG2-CB 3.73Å; T74-F210 CarbonylContact O-C 3.57Å; T74-F210 WeakPolarHBondContact O-CA 3.41Å; T74-F210 VanDerWaalsContact O-CB 3.32Å; T74-F210 WeakPolarHBondContact O-CB 3.19Å; M76-F210 HydrophobicContact CB-CD2 3.71Å; M76-F210 HydrophobicContact CB-CE2 3.93Å; M76-F210 HydrophobicContact CB-CG 4.07Å; M76-F210 HydrophobicContact CB-CZ 4.44Å; M76-F210 HydrophobicContact CE-CD1 4.05Å; M76-F210 HydrophobicContact CG-CB 3.8Å; M76-F210 HydrophobicContact CG-CD1 3.58Å; M76-F210 HydrophobicContact CG-CD2 3.55Å; M76-F210 HydrophobicContact CG-CE1 3.93Å; M76-F210 HydrophobicContact CG-CE2 3.93Å; M76-F210 HydrophobicContact CG-CG 3.37Å; M76-F210 HydrophobicContact CG-CZ 4.11Å; M85-F210 HydrophobicContact SD-CE1 4.04Å; M85-F210 HydrophobicContact SD-CZ 4.49Å; V108-F210 HydrophobicContact CG1-CZ 3.93Å; L162-F210 HydrophobicContact CD1-CE1 4.5Å; L162-F210 HydrophobicContact CD1-CE2 3.95Å; L162-F210 HydrophobicContact CD1-CZ 3.64Å; L175-F210 HydrophobicContact CD1-CE2 4.04Å; L175-F210 HydrophobicContact CD1-CZ 4.25Å; R180-F210 WeakPolarHBondContact CA-O 3.21Å; Y181-F210 HydrophobicContact CD2-CE2 4.47Å; Y181-F210 PolarHBondContact N-O 3.33Å; Y181-F210 PolarHBondContact O-N 3.05Å; P183-F210 HydrophobicContact CG-CD1 4.16Å; P183-F210 HydrophobicContact CG-CE1 3.67Å; T208-F210 WeakPolarHBondContact O-CD1 3.41Å; F210-T212 HydrophobicContact CD2-CG2 4.31Å; F210-T212 HydrophobicContact CE2-CG2 3.88Å
211	I	98.6	Very high	97.8	Very high	8 Å²	8	48.4 Å²	48.4	4%	0.041	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	134.6	164.2	-65.9	169.9	0	0	0	109.1	T74 E75 M76 W123 H179 R180 V213	T74-I211 PolarHBondContact O-N 2.9Å; E75-I211 CarbonylContact C-O 3.59Å; E75-I211 VanDerWaalsContact CA-O 3.31Å; E75-I211 WeakPolarHBondContact CA-O 3.5Å; M76-I211 PolarHBondContact N-O 3.2Å; W123-I211 HydrophobicContact CB-CD1 4.16Å; W123-I211 HydrophobicContact CD2-CD1 3.38Å; W123-I211 HydrophobicContact CE3-CD1 3.85Å; W123-I211 HydrophobicContact CG-CD1 3.54Å; W123-I211 HydrophobicContact CH2-CD1 4.5Å; W123-I211 HydrophobicContact CH2-CG2 3.63Å; W123-I211 HydrophobicContact CZ2-CB 4.34Å; W123-I211 HydrophobicContact CZ2-CD1 4.15Å; W123-I211 HydrophobicContact CZ2-CG2 3.89Å; W123-I211 HydrophobicContact CZ3-CD1 4.38Å; W123-I211 HydrophobicContact CZ3-CG2 3.99Å; H179-I211 WeakPolarHBondContact O-CA 3.39Å; R180-I211 HydrophobicContact CG-CD1 4.11Å; R180-I211 HydrophobicContact CG-CG1 3.48Å; R180-I211 VanDerWaalsContact CG-CG1 3.48Å; I211-V213 HydrophobicContact CG2-CG1 4.23Å
212	T	98.5	Very high	98	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	140.5	170.6	43.6	0	0	0	0	111.7	M76 I78 L175 H176 L178 H179 Y181 F210	M76-T212 WeakPolarHBondContact O-CA 3.34Å; I78-T212 HydrophobicContact CG2-CG2 3.84Å; L175-T212 HydrophobicContact CB-CG2 3.86Å; L175-T212 HydrophobicContact CD1-CG2 3.56Å; L175-T212 HydrophobicContact CG-CG2 4.38Å; H176-T212 VanDerWaalsContact O-CB 3.23Å; H176-T212 WeakPolarHBondContact O-CB 3.45Å; H176-T212 PolarHBondContact O-OG1 3.38Å; L178-T212 WeakPolarHBondContact CA-O 3.47Å; L178-T212 PolarHBondContact N-O 3.39Å; L178-T212 PolarHBondContact N-OG1 3.44Å; H179-T212 PolarHBondContact N-OG1 3.08Å; H179-T212 PolarHBondContact O-N 2.81Å; H179-T212 PolarHBondContact O-OG1 3.45Å; Y181-T212 HydrophobicContact CD2-CG2 3.62Å; Y181-T212 HydrophobicContact CE2-CG2 3.7Å; F210-T212 HydrophobicContact CD2-CG2 4.31Å; F210-T212 HydrophobicContact CE2-CG2 3.88Å
213	V	98.7	Very high	98.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	154.7	177.5	-62.9	0	0	0	0	110.9	E75 M76 I77 I78 W123 L178 I211 A215 Y216 Q217	E75-V213 HydrophobicContact CB-CG1 4.41Å; E75-V213 HydrophobicContact CB-CG2 4.01Å; E75-V213 HydrophobicContact CG-CG1 4.39Å; M76-V213 PolarHBondContact O-N 3.48Å; I77-V213 CarbonylContact C-O 3.57Å; I77-V213 VanDerWaalsContact CA-O 3.26Å; I77-V213 WeakPolarHBondContact CA-O 3.26Å; I77-V213 HydrophobicContact CD1-CG2 3.99Å; I78-V213 PolarHBondContact N-O 2.96Å; W123-V213 HydrophobicContact CH2-CG1 3.83Å; W123-V213 HydrophobicContact CZ2-CG1 4.08Å; L178-V213 HydrophobicContact CD2-CG1 4.34Å; I211-V213 HydrophobicContact CG2-CG1 4.23Å; V213-A215 WeakPolarHBondContact CB-O 3.32Å; V213-Y216 HydrophobicContact CG2-CD1 4.27Å; V213-Q217 HydrophobicContact CG1-CG 4.01Å
214	T	98.4	Very high	98	Very high	85 Å²	85	49 Å²	49	52%	0.521	26%	0.26	S	S	.	.	S	Bend	trans	-85.7	-33.6	170.2	43	0	0	0	0	112
215	A	98.1	Very high	98	Very high	53 Å²	53	45.9 Å²	45.9	44%	0.438	24%	0.241	S	C	.	.	S	Bend	trans	-138.2	149	169.8	0	0	0	0	0	108.9	V213 Q217	V213-A215 WeakPolarHBondContact CB-O 3.32Å; A215-Q217 PolarHBondContact O-NE2 2.89Å
216	Y	98.5	Very high	97.9	Very high	68 Å²	68	46.4 Å²	46.4	27%	0.267	24%	0.244	S	C	.	.			trans	-60.2	144.2	-178.8	-64.3	-58.4	0	0	0	111.7	E75 I77 V213 I221 T222 K225	E75-Y216 HydrophobicContact CB-CD1 4.02Å; E75-Y216 HydrophobicContact CB-CE1 4.38Å; E75-Y216 WeakPolarHBondContact OE2-CA 3.42Å; I77-Y216 HydrophobicContact CD1-CD1 4.02Å; I77-Y216 HydrophobicContact CD1-CD2 4.24Å; I77-Y216 HydrophobicContact CD1-CE1 4Å; I77-Y216 HydrophobicContact CD1-CE2 4.23Å; I77-Y216 HydrophobicContact CD1-CG 4.13Å; I77-Y216 HydrophobicContact CG1-CD1 4.1Å; I77-Y216 HydrophobicContact CG1-CD2 4.49Å; I77-Y216 HydrophobicContact CG1-CE1 3.55Å; I77-Y216 HydrophobicContact CG1-CE2 4Å; I77-Y216 VanDerWaalsContact CG1-CZ 3.48Å; V213-Y216 HydrophobicContact CG2-CD1 4.27Å; Y216-I221 HydrophobicContact CD1-CG2 4.16Å; Y216-I221 HydrophobicContact CE1-CG2 4.28Å; Y216-T222 VanDerWaalsContact CB-OG1 3.28Å; Y216-T222 WeakPolarHBondContact CB-OG1 3.43Å; Y216-T222 HydrophobicContact CD2-CG2 4.38Å; Y216-K225 HydrophobicContact CE1-CD 4.25Å; Y216-K225 HydrophobicContact CE1-CG 4.11Å; Y216-K225 HydrophobicContact CE2-CB 4.49Å; Y216-K225 HydrophobicContact CE2-CG 4.16Å; Y216-K225 WeakPolarHBondContact OH-CD 3.39Å; Y216-K225 WeakPolarHBondContact OH-CG 3.31Å
217	Q	98.3	Very high	97.8	Very high	76 Å²	76	46.6 Å²	46.6	36%	0.355	24%	0.24	S	C	.	.			trans	-107.5	-43.3	-177.8	-56	-63.9	-75.6	0	0	111.4	E75 F118 W123 V213 A215	E75-Q217 PolarHBondContact OE2-N 3.44Å; F118-Q217 HydrophobicContact CB-CB 3.61Å; F118-Q217 HydrophobicContact CB-CG 4.15Å; F118-Q217 HydrophobicContact CD1-CB 3.83Å; F118-Q217 WeakPolarHBondContact CD1-O 3.31Å; F118-Q217 VanDerWaalsContact CE1-O 3.32Å; F118-Q217 WeakPolarHBondContact CE1-O 3.19Å; F118-Q217 HydrophobicContact CG-CB 3.76Å; W123-Q217 HydrophobicContact CH2-CB 4.17Å; W123-Q217 HydrophobicContact CH2-CG 3.69Å; W123-Q217 HydrophobicContact CZ2-CB 3.94Å; W123-Q217 HydrophobicContact CZ2-CG 3.92Å; V213-Q217 HydrophobicContact CG1-CG 4.01Å; A215-Q217 PolarHBondContact O-NE2 2.89Å
218	N	97.6	Very high	97.7	Very high	20 Å²	20	47.1 Å²	47.1	11%	0.107	25%	0.246	C	C	.	.			trans	-91.8	113	176.7	-173.4	-7.6	0	0	0	111.1	V72 E75 F118 K220 I221 T222	V72-N218 WeakPolarHBondContact CG1-ND2 3.07Å; V72-N218 PolarHBondContact O-ND2 2.56Å; E75-N218 WeakPolarHBondContact OE1-CB 3.13Å; E75-N218 PolarHBondContact OE1-N 2.8Å; F118-N218 HydrophobicContact CE1-CB 4.17Å; F118-N218 HydrophobicContact CE2-CB 3.93Å; F118-N218 HydrophobicContact CZ-CB 3.61Å; N218-K220 PolarHBondContact O-N 3.46Å; N218-K220 VanDerWaalsContact O-N 3.15Å; N218-K220 WeakPolarHBondContact OD1-CB 3.41Å; N218-K220 PolarHBondContact OD1-N 2.91Å; N218-K220 VanDerWaalsContact OD1-N 3.14Å; N218-I221 HydrophobicContact CB-CB 4.42Å; N218-I221 HydrophobicContact CB-CG1 3.97Å; N218-I221 WeakPolarHBondContact O-CA 3.39Å; N218-I221 WeakPolarHBondContact O-CB 3.26Å; N218-I221 PolarHBondContact O-N 2.76Å; N218-T222 PolarHBondContact O-N 3.41Å
219	N	96.5	Very high	97.6	Very high	114 Å²	114	48.4 Å²	48.4	61%	0.61	25%	0.253	S	S	*	.	H	α-helix	trans	-55.4	-33.2	178.7	-71.5	-9.2	0	0	0	113.2	I221 T222 E223	N219-I221 PolarHBondContact O-N 3.31Å; N219-T222 WeakPolarHBondContact O-CA 3.38Å; N219-T222 VanDerWaalsContact O-CB 3.31Å; N219-T222 WeakPolarHBondContact O-CB 3.38Å; N219-T222 PolarHBondContact O-N 2.9Å; N219-E223 WeakPolarHBondContact O-CG 3.37Å; N219-E223 PolarHBondContact O-N 3.03Å
220	K	97.4	Very high	97.4	Very high	135 Å²	135	49.4 Å²	49.4	59%	0.587	27%	0.266	S	S	*	.	H	α-helix	trans	-61.7	-33.5	175	-60.7	179.2	179.5	179.1	0	112	V72 N218 L224	V72-K220 HydrophobicContact CG1-CB 3.67Å; N218-K220 PolarHBondContact O-N 3.46Å; N218-K220 VanDerWaalsContact O-N 3.15Å; N218-K220 WeakPolarHBondContact OD1-CB 3.41Å; N218-K220 PolarHBondContact OD1-N 2.91Å; N218-K220 VanDerWaalsContact OD1-N 3.14Å; K220-L224 WeakPolarHBondContact O-CB 3.4Å; K220-L224 VanDerWaalsContact O-CG 3.24Å; K220-L224 WeakPolarHBondContact O-CG 3.21Å; K220-L224 PolarHBondContact O-N 3Å; K220-L224 VanDerWaalsContact O-N 3.09Å
221	I	98	Very high	97.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-68.5	-47.7	171	-61.3	-68.2	0	0	0	109.4	F69 V72 G73 E75 Y216 N218 N219 E223 L224 K225	F69-I221 HydrophobicContact CD1-CD1 4Å; F69-I221 HydrophobicContact CD1-CG2 4.38Å; F69-I221 HydrophobicContact CE1-CG2 4.28Å; V72-I221 HydrophobicContact CB-CD1 3.75Å; V72-I221 HydrophobicContact CG1-CD1 3.57Å; V72-I221 HydrophobicContact CG1-CG1 3.9Å; G73-I221 VanDerWaalsContact O-CD1 3.26Å; G73-I221 WeakPolarHBondContact O-CD1 3.34Å; E75-I221 HydrophobicContact CB-CG2 4.09Å; E75-I221 HydrophobicContact CG-CG1 4.3Å; E75-I221 HydrophobicContact CG-CG2 4.42Å; Y216-I221 HydrophobicContact CD1-CG2 4.16Å; Y216-I221 HydrophobicContact CE1-CG2 4.28Å; N218-I221 HydrophobicContact CB-CB 4.42Å; N218-I221 HydrophobicContact CB-CG1 3.97Å; N218-I221 WeakPolarHBondContact O-CA 3.39Å; N218-I221 WeakPolarHBondContact O-CB 3.26Å; N218-I221 PolarHBondContact O-N 2.76Å; N219-I221 PolarHBondContact O-N 3.31Å; I221-E223 VanDerWaalsContact C-N 3.33Å; I221-E223 PolarHBondContact O-N 3.45Å; I221-L224 PolarHBondContact O-N 3.15Å; I221-L224 VanDerWaalsContact O-N 3.15Å; I221-K225 HydrophobicContact CG2-CD 4.41Å; I221-K225 VanDerWaalsContact CG2-CE 3.44Å; I221-K225 HydrophobicContact CG2-CG 3.99Å; I221-K225 WeakPolarHBondContact O-CG 3.21Å; I221-K225 PolarHBondContact O-N 2.94Å
222	T	97.3	Very high	96.8	Very high	38 Å²	38	58.4 Å²	58.4	23%	0.233	31%	0.308	C	S	.	.	H	α-helix	trans	-52.6	-48.5	177	-55.4	0	0	0	0	112.2	Y216 N218 N219 K225 I226	Y216-T222 VanDerWaalsContact CB-OG1 3.28Å; Y216-T222 WeakPolarHBondContact CB-OG1 3.43Å; Y216-T222 HydrophobicContact CD2-CG2 4.38Å; N218-T222 PolarHBondContact O-N 3.41Å; N219-T222 WeakPolarHBondContact O-CA 3.38Å; N219-T222 VanDerWaalsContact O-CB 3.31Å; N219-T222 WeakPolarHBondContact O-CB 3.38Å; N219-T222 PolarHBondContact O-N 2.9Å; T222-K225 WeakPolarHBondContact O-CB 3.44Å; T222-K225 PolarHBondContact O-N 3.37Å; T222-I226 HydrophobicContact CG2-CD1 3.99Å; T222-I226 WeakPolarHBondContact O-CG1 3.39Å; T222-I226 PolarHBondContact O-N 2.86Å
223	E	96.9	Very high	96.4	Very high	106 Å²	106	64.8 Å²	64.8	50%	0.495	34%	0.336	S	S	.	.	H	α-helix	trans	-58.1	-50.3	174.7	-69.8	159.2	-147.3	0	0	112	N219 I221 K225 I226 N227	N219-E223 WeakPolarHBondContact O-CG 3.37Å; N219-E223 PolarHBondContact O-N 3.03Å; I221-E223 VanDerWaalsContact C-N 3.33Å; I221-E223 PolarHBondContact O-N 3.45Å; E223-K225 VanDerWaalsContact C-N 3.29Å; E223-K225 PolarHBondContact O-N 2.93Å; E223-I226 PolarHBondContact O-N 2.78Å; E223-I226 VanDerWaalsContact O-N 3.17Å; E223-N227 WeakPolarHBondContact O-CB 3.43Å; E223-N227 PolarHBondContact O-N 3.43Å; E223-N227 PolarHBondContact O-ND2 2.93Å
224	L	97.4	Very high	96	Very high	29 Å²	29	67.7 Å²	67.7	15%	0.152	37%	0.366	C	S	.	.	H	α-helix	trans	-59.1	-39.5	176.5	-74.5	173.9	0	0	0	112	Q68 F69 V72 K220 I221 S228	Q68-L224 HydrophobicContact CG-CD1 4.42Å; Q68-L224 HydrophobicContact CG-CD2 4.04Å; F69-L224 HydrophobicContact CD1-CB 4.22Å; F69-L224 HydrophobicContact CD1-CD1 4.29Å; F69-L224 HydrophobicContact CE1-CB 3.46Å; F69-L224 VanDerWaalsContact CE1-CB 3.46Å; F69-L224 HydrophobicContact CE1-CD1 4.34Å; F69-L224 HydrophobicContact CZ-CB 3.67Å; V72-L224 HydrophobicContact CB-CD1 4.36Å; V72-L224 HydrophobicContact CG2-CD1 3.97Å; K220-L224 WeakPolarHBondContact O-CB 3.4Å; K220-L224 VanDerWaalsContact O-CG 3.24Å; K220-L224 WeakPolarHBondContact O-CG 3.21Å; K220-L224 PolarHBondContact O-N 3Å; K220-L224 VanDerWaalsContact O-N 3.09Å; I221-L224 PolarHBondContact O-N 3.15Å; I221-L224 VanDerWaalsContact O-N 3.15Å; L224-S228 WeakPolarHBondContact O-CB 3.25Å; L224-S228 PolarHBondContact O-N 2.88Å; L224-S228 PolarHBondContact O-OG 3.1Å
225	K	97.8	Very high	95.5	Very high	6 Å²	6	70.8 Å²	70.8	3%	0.026	37%	0.372	C	S	.	.	H	α-helix	trans	-64.6	-44.7	175.9	-59.7	-78.7	-179.8	167.7	0	110.5	F69 E75 F86 Y216 I221 T222 E223 N229	F69-K225 HydrophobicContact CE1-CD 3.66Å; F69-K225 HydrophobicContact CE1-CG 3.91Å; F69-K225 HydrophobicContact CZ-CD 3.89Å; F69-K225 HydrophobicContact CZ-CG 4.27Å; E75-K225 WeakPolarHBondContact O-CE 3.43Å; E75-K225 PolarHBondContact O-NZ 2.86Å; F86-K225 HydrophobicContact CD1-CD 3.87Å; F86-K225 PolarHBondContact O-NZ 2.87Å; Y216-K225 HydrophobicContact CE1-CD 4.25Å; Y216-K225 HydrophobicContact CE1-CG 4.11Å; Y216-K225 HydrophobicContact CE2-CB 4.49Å; Y216-K225 HydrophobicContact CE2-CG 4.16Å; Y216-K225 WeakPolarHBondContact OH-CD 3.39Å; Y216-K225 WeakPolarHBondContact OH-CG 3.31Å; I221-K225 HydrophobicContact CG2-CD 4.41Å; I221-K225 VanDerWaalsContact CG2-CE 3.44Å; I221-K225 HydrophobicContact CG2-CG 3.99Å; I221-K225 WeakPolarHBondContact O-CG 3.21Å; I221-K225 PolarHBondContact O-N 2.94Å; T222-K225 WeakPolarHBondContact O-CB 3.44Å; T222-K225 PolarHBondContact O-N 3.37Å; E223-K225 VanDerWaalsContact C-N 3.29Å; E223-K225 PolarHBondContact O-N 2.93Å; K225-N229 WeakPolarHBondContact O-CB 3.4Å; K225-N229 PolarHBondContact O-N 3.41Å
226	I	96.4	Very high	95.3	Very high	38 Å²	38	70.9 Å²	70.9	20%	0.195	36%	0.361	C	S	.	.	H	α-helix	trans	-61.2	-48.2	177.6	-72.1	167.7	0	0	0	110.9	T222 E223 F235 R236	T222-I226 HydrophobicContact CG2-CD1 3.99Å; T222-I226 WeakPolarHBondContact O-CG1 3.39Å; T222-I226 PolarHBondContact O-N 2.86Å; E223-I226 PolarHBondContact O-N 2.78Å; E223-I226 VanDerWaalsContact O-N 3.17Å; I226-F235 HydrophobicContact CD1-CB 4.01Å; I226-F235 HydrophobicContact CG1-CB 4Å; I226-F235 HydrophobicContact CG2-CB 4.04Å; I226-F235 WeakPolarHBondContact CG2-O 3.32Å; I226-R236 HydrophobicContact CG2-CG 3.64Å; I226-R236 VanDerWaalsContact O-CZ 3.25Å; I226-R236 PolarHBondContact O-NE 3.32Å; I226-R236 PolarHBondContact O-NH2 3.3Å
227	N	96.2	Very high	94.1	Very high	98 Å²	98	75.2 Å²	75.2	52%	0.524	38%	0.384	S	S	.	.	H	α-helix	trans	-75.5	-27.9	-173.2	-69.7	-24	0	0	0	114	E223 R236	E223-N227 WeakPolarHBondContact O-CB 3.43Å; E223-N227 PolarHBondContact O-N 3.43Å; E223-N227 PolarHBondContact O-ND2 2.93Å; N227-R236 PolarHBondContact O-NH1 2.85Å; N227-R236 VanDerWaalsContact O-NH1 3.13Å; N227-R236 PolarHBondContact O-NH2 2.66Å
228	S	95.6	Very high	92.5	Very high	36 Å²	36	77.3 Å²	77.3	25%	0.252	40%	0.397	S	S	.	.	H	α-helix	trans	-103.9	-24.2	179.7	64	0	0	0	0	115.1	F86 L224 P230	F86-S228 WeakPolarHBondContact CE1-OG 3.24Å; L224-S228 WeakPolarHBondContact O-CB 3.25Å; L224-S228 PolarHBondContact O-N 2.88Å; L224-S228 PolarHBondContact O-OG 3.1Å; S228-P230 WeakPolarHBondContact O-CD 3.49Å
229	N	95.8	Very high	90.6	Very high	29 Å²	29	77 Å²	77	16%	0.155	40%	0.399	C	S	.	.			trans	-84.8	121.6	-179.9	-171.5	-11.7	0	0	0	111.7	F86 K225 F231 A232 R236	F86-N229 HydrophobicContact CD1-CB 4.15Å; F86-N229 HydrophobicContact CD2-CB 3.91Å; F86-N229 HydrophobicContact CE1-CB 3.93Å; F86-N229 HydrophobicContact CE2-CB 3.65Å; F86-N229 HydrophobicContact CG-CB 4.16Å; F86-N229 VanDerWaalsContact CZ-CA 3.48Å; F86-N229 HydrophobicContact CZ-CB 3.68Å; K225-N229 WeakPolarHBondContact O-CB 3.4Å; K225-N229 PolarHBondContact O-N 3.41Å; N229-F231 VanDerWaalsContact C-N 3.26Å; N229-F231 PolarHBondContact O-N 2.84Å; N229-F231 WeakPolarHBondContact OD1-CD2 3.4Å; N229-F231 PolarHBondContact OD1-N 3.27Å; N229-A232 HydrophobicContact CB-CB 4.04Å; N229-A232 PolarHBondContact O-N 2.91Å; N229-R236 PolarHBondContact O-NH2 2.68Å
230	P	94.1	Very high	88.6	Confident	95 Å²	95	77.3 Å²	77.3	62%	0.617	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-58.3	-35.6	176	-25.3	35.6	0	0	0	113.4	S228 A232 K233	S228-P230 WeakPolarHBondContact O-CD 3.49Å; P230-A232 PolarHBondContact O-N 3.09Å; P230-K233 WeakPolarHBondContact O-CB 3.47Å; P230-K233 PolarHBondContact O-N 2.64Å
231	F	92.7	Very high	86.6	Confident	186 Å²	186	74.3 Å²	74.3	82%	0.816	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-72.8	-9.9	179.2	-60.7	-75.4	0	0	0	113.5	N229	N229-F231 VanDerWaalsContact C-N 3.26Å; N229-F231 PolarHBondContact O-N 2.84Å; N229-F231 WeakPolarHBondContact OD1-CD2 3.4Å; N229-F231 PolarHBondContact OD1-N 3.27Å
232	A	93	Very high	84.7	Confident	14 Å²	14	77.3 Å²	77.3	12%	0.116	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-102.3	6.3	175.2	0	0	0	0	0	113.2	N229 P230 G234 F235	N229-A232 HydrophobicContact CB-CB 4.04Å; N229-A232 PolarHBondContact O-N 2.91Å; P230-A232 PolarHBondContact O-N 3.09Å; A232-G234 PolarHBondContact O-N 2.96Å; A232-F235 PolarHBondContact O-N 2.78Å
233	K	90	Very high	82.9	Confident	134 Å²	134	81.7 Å²	81.7	58%	0.583	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-53.5	-31.8	-176.5	-175.9	176.8	178.3	-179.6	0	114	P230 F235 R236	P230-K233 WeakPolarHBondContact O-CB 3.47Å; P230-K233 PolarHBondContact O-N 2.64Å; K233-F235 PolarHBondContact O-N 3.43Å; K233-R236 PolarHBondContact O-N 3.28Å
234	G	90.1	Very high	81.3	Confident	61 Å²	61	85 Å²	85	63%	0.629	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-66.4	-14.2	178.1	0	0	0	0	0	115.5	A232	A232-G234 PolarHBondContact O-N 2.96Å
235	F	88.7	Confident	79.5	Confident	151 Å²	151	89.8 Å²	89.8	66%	0.662	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-99.5	7.9	177.9	-62.9	-82.7	0	0	0	113.5	I226 A232 K233	I226-F235 HydrophobicContact CD1-CB 4.01Å; I226-F235 HydrophobicContact CG1-CB 4Å; I226-F235 HydrophobicContact CG2-CB 4.04Å; I226-F235 WeakPolarHBondContact CG2-O 3.32Å; A232-F235 PolarHBondContact O-N 2.78Å; K233-F235 PolarHBondContact O-N 3.43Å
236	R	92.1	Very high	78	Confident	55 Å²	55	97.8 Å²	97.8	21%	0.208	49%	0.49	C	S	.	.	S	Bend	trans	-84.8	157.2	172	-60.2	175.2	-165.6	-161.3	2.1	109.4	I226 N227 N229 K233 D238 G239 M240	I226-R236 HydrophobicContact CG2-CG 3.64Å; I226-R236 VanDerWaalsContact O-CZ 3.25Å; I226-R236 PolarHBondContact O-NE 3.32Å; I226-R236 PolarHBondContact O-NH2 3.3Å; N227-R236 PolarHBondContact O-NH1 2.85Å; N227-R236 VanDerWaalsContact O-NH1 3.13Å; N227-R236 PolarHBondContact O-NH2 2.66Å; N229-R236 PolarHBondContact O-NH2 2.68Å; K233-R236 PolarHBondContact O-N 3.28Å; R236-D238 HydrophobicContact CB-CB 4.36Å; R236-D238 PolarHBondContact O-N 3.32Å; R236-G239 VanDerWaalsContact O-CA 3.31Å; R236-G239 WeakPolarHBondContact O-CA 3.39Å; R236-G239 PolarHBondContact O-N 2.87Å; R236-M240 PolarHBondContact O-N 3.43Å; R236-M240 VanDerWaalsContact O-N 3.16Å
237	E	73.8	Confident	76.8	Confident	158 Å²	158	99 Å²	99	74%	0.738	50%	0.497	S	S	*	.	H	α-helix	trans	-55.9	-38.4	170.8	-57.7	-47.7	126.7	0	0	111.6	G239 M240	E237-G239 PolarHBondContact O-N 2.61Å; E237-M240 PolarHBondContact O-N 3.3Å; E237-M240 VanDerWaalsContact O-N 3.08Å
238	D	65	Low	75.6	Confident	120 Å²	120	96.2 Å²	96.2	64%	0.642	49%	0.487	S	S	*	.	H	α-helix	trans	-59.6	-8.5	170.4	-59.7	-38	0	0	0	114.9	R236 N241	R236-D238 HydrophobicContact CB-CB 4.36Å; R236-D238 PolarHBondContact O-N 3.32Å; D238-N241 WeakPolarHBondContact CA-ND2 3.48Å; D238-N241 PolarHBondContact O-ND2 3.17Å; D238-N241 VanDerWaalsContact O-ND2 3.11Å; D238-N241 PolarHBondContact O-OD1 3.18Å
239	G	57.5	Low	74.4	Confident	14 Å²	14	103.5 Å²	103.5	14%	0.144	51%	0.509	C	S	.	.	H	α-helix	trans	-110.5	-23.5	176	0	0	0	0	0	113.7	R236 E237 N241 S242	R236-G239 VanDerWaalsContact O-CA 3.31Å; R236-G239 WeakPolarHBondContact O-CA 3.39Å; R236-G239 PolarHBondContact O-N 2.87Å; E237-G239 PolarHBondContact O-N 2.61Å; G239-N241 VanDerWaalsContact C-N 3.29Å; G239-N241 PolarHBondContact O-N 2.73Å; G239-S242 WeakPolarHBondContact O-CA 3.26Å; G239-S242 WeakPolarHBondContact O-CB 3.39Å; G239-S242 PolarHBondContact O-N 2.9Å
240	M	55.9	Low	73.1	Confident	121 Å²	121	107.6 Å²	107.6	60%	0.596	53%	0.527	S	S	*	.	H	α-helix	trans	-69.8	-30.8	176.6	-170.6	53.5	172.9	0	0	111.7	R236 E237 S242 K243	R236-M240 PolarHBondContact O-N 3.43Å; R236-M240 VanDerWaalsContact O-N 3.16Å; E237-M240 PolarHBondContact O-N 3.3Å; E237-M240 VanDerWaalsContact O-N 3.08Å; M240-S242 PolarHBondContact O-N 3.16Å; M240-K243 PolarHBondContact O-N 3.09Å
241	N	53.7	Low	72.1	Confident	72 Å²	72	110.1 Å²	110.1	39%	0.385	53%	0.529	S	S	.	.	H	α-helix	trans	-56.7	-24.8	165.4	66.6	30.9	0	0	0	112.8	D238 G239 K243 K244 Q245	D238-N241 WeakPolarHBondContact CA-ND2 3.48Å; D238-N241 PolarHBondContact O-ND2 3.17Å; D238-N241 VanDerWaalsContact O-ND2 3.11Å; D238-N241 PolarHBondContact O-OD1 3.18Å; G239-N241 VanDerWaalsContact C-N 3.29Å; G239-N241 PolarHBondContact O-N 2.73Å; N241-K243 VanDerWaalsContact C-N 3.34Å; N241-K243 PolarHBondContact O-N 2.88Å; N241-K244 PolarHBondContact O-N 2.98Å; N241-Q245 WeakPolarHBondContact O-CB 3.26Å; N241-Q245 WeakPolarHBondContact O-CG 3.31Å; N241-Q245 PolarHBondContact O-N 2.95Å
242	S	57.8	Low	70.9	Confident	62 Å²	62	110.5 Å²	110.5	43%	0.434	53%	0.525	S	S	.	.	H	α-helix	trans	-73.1	-28.2	-178.1	-156.8	0	0	0	0	111.7	G239 M240 R246	G239-S242 WeakPolarHBondContact O-CA 3.26Å; G239-S242 WeakPolarHBondContact O-CB 3.39Å; G239-S242 PolarHBondContact O-N 2.9Å; M240-S242 PolarHBondContact O-N 3.16Å; S242-R246 WeakPolarHBondContact O-CB 3.45Å; S242-R246 PolarHBondContact O-N 3.37Å
243	K	61.2	Low	69.6	Low	131 Å²	131	117.2 Å²	117.2	57%	0.57	55%	0.551	S	S	*	*	H	α-helix	trans	-65.7	-54	169.2	-168.9	173.7	179.9	-179	0	110	M240 N241 Q245 R246 D247	M240-K243 PolarHBondContact O-N 3.09Å; N241-K243 VanDerWaalsContact C-N 3.34Å; N241-K243 PolarHBondContact O-N 2.88Å; K243-Q245 VanDerWaalsContact C-N 3.27Å; K243-Q245 PolarHBondContact O-N 2.89Å; K243-R246 WeakPolarHBondContact O-CB 3.41Å; K243-R246 PolarHBondContact O-N 2.92Å; K243-D247 WeakPolarHBondContact O-CB 3.1Å; K243-D247 PolarHBondContact O-N 3.15Å
244	K	61.7	Low	68.3	Low	174 Å²	174	117.1 Å²	117.1	76%	0.757	55%	0.554	S	S	*	*	H	α-helix	trans	-55.6	-38.2	174.3	-75.9	-175.1	175.9	178.3	0	113	N241 A248	N241-K244 PolarHBondContact O-N 2.98Å; K244-A248 WeakPolarHBondContact O-CB 3.36Å; K244-A248 PolarHBondContact O-N 2.82Å
245	Q	60.8	Low	66.9	Low	131 Å²	131	118.6 Å²	118.6	61%	0.612	55%	0.551	S	S	*	*	H	α-helix	trans	-71	-37.8	174.5	-76.5	-172.1	-2.2	0	0	113.4	N241 K243 A248 R249	N241-Q245 WeakPolarHBondContact O-CB 3.26Å; N241-Q245 WeakPolarHBondContact O-CG 3.31Å; N241-Q245 PolarHBondContact O-N 2.95Å; K243-Q245 VanDerWaalsContact C-N 3.27Å; K243-Q245 PolarHBondContact O-N 2.89Å; Q245-A248 PolarHBondContact O-N 3.49Å; Q245-R249 WeakPolarHBondContact O-CB 3.42Å; Q245-R249 PolarHBondContact O-N 3.08Å
246	R	65.2	Low	65.5	Low	174 Å²	174	115.4 Å²	115.4	66%	0.657	54%	0.544	S	S	*	.	H	α-helix	trans	-65	-47.6	175.8	-170.9	-177.4	-155.2	130.6	-1	110.2	S242 K243 A248 R249 Q250	S242-R246 WeakPolarHBondContact O-CB 3.45Å; S242-R246 PolarHBondContact O-N 3.37Å; K243-R246 WeakPolarHBondContact O-CB 3.41Å; K243-R246 PolarHBondContact O-N 2.92Å; R246-A248 PolarHBondContact O-N 3.08Å; R246-R249 CarbonylContact O-C 3.58Å; R246-R249 PolarHBondContact O-N 2.86Å; R246-Q250 WeakPolarHBondContact O-CB 3.43Å; R246-Q250 WeakPolarHBondContact O-CG 3.37Å; R246-Q250 PolarHBondContact O-N 3.1Å
247	D	71.4	Confident	63.9	Low	63 Å²	63	117.8 Å²	117.8	34%	0.337	56%	0.56	S	S	.	*	H	α-helix	trans	-62.5	-43	176.7	-55.5	-13.6	0	0	0	110.2	K243 Q250 K251	K243-D247 WeakPolarHBondContact O-CB 3.1Å; K243-D247 PolarHBondContact O-N 3.15Å; D247-Q250 PolarHBondContact O-N 3.36Å; D247-K251 WeakPolarHBondContact O-CB 3.38Å; D247-K251 VanDerWaalsContact O-CG 3.32Å; D247-K251 WeakPolarHBondContact O-CG 3.2Å; D247-K251 PolarHBondContact O-N 2.96Å
248	A	71.6	Confident	63.1	Low	39 Å²	39	113.3 Å²	113.3	32%	0.322	54%	0.544	S	S	.	.	H	α-helix	trans	-66.4	-36	174.3	0	0	0	0	0	113.1	K244 Q245 R246 K251 R252	K244-A248 WeakPolarHBondContact O-CB 3.36Å; K244-A248 PolarHBondContact O-N 2.82Å; Q245-A248 PolarHBondContact O-N 3.49Å; R246-A248 PolarHBondContact O-N 3.08Å; A248-K251 PolarHBondContact O-N 3.23Å; A248-R252 WeakPolarHBondContact O-CG 3.3Å; A248-R252 PolarHBondContact O-N 3.4Å
249	R	70.3	Confident	62.5	Low	189 Å²	189	113.4 Å²	113.4	71%	0.713	54%	0.54	S	S	*	.	H	α-helix	trans	-72.7	-33	176.1	-170	177	-174.3	-169.2	2.2	111.7	Q245 R246 K253	Q245-R249 WeakPolarHBondContact O-CB 3.42Å; Q245-R249 PolarHBondContact O-N 3.08Å; R246-R249 CarbonylContact O-C 3.58Å; R246-R249 PolarHBondContact O-N 2.86Å; R249-K253 WeakPolarHBondContact O-CB 3.32Å; R249-K253 PolarHBondContact O-N 3.33Å
250	Q	68.6	Low	62.5	Low	115 Å²	115	116.4 Å²	116.4	54%	0.537	56%	0.556	S	S	.	*	H	α-helix	trans	-68.4	-45.9	169.7	-76.5	172.7	-56	0	0	110.8	R246 D247 R252 K253 M254	R246-Q250 WeakPolarHBondContact O-CB 3.43Å; R246-Q250 WeakPolarHBondContact O-CG 3.37Å; R246-Q250 PolarHBondContact O-N 3.1Å; D247-Q250 PolarHBondContact O-N 3.36Å; Q250-R252 PolarHBondContact O-N 2.95Å; Q250-K253 CarbonylContact O-C 3.58Å; Q250-K253 WeakPolarHBondContact O-CB 3.21Å; Q250-K253 PolarHBondContact O-N 2.91Å; Q250-K253 VanDerWaalsContact O-N 3.15Å; Q250-M254 WeakPolarHBondContact O-CB 3.44Å; Q250-M254 PolarHBondContact O-N 2.81Å
251	K	72.5	Confident	62.5	Low	149 Å²	149	115.7 Å²	115.7	65%	0.648	55%	0.554	S	S	*	*	H	α-helix	trans	-57.8	-46.1	173.6	-75.1	179.7	179.3	-168.4	0	112.2	D247 A248 K253 M254 V255	D247-K251 WeakPolarHBondContact O-CB 3.38Å; D247-K251 VanDerWaalsContact O-CG 3.32Å; D247-K251 WeakPolarHBondContact O-CG 3.2Å; D247-K251 PolarHBondContact O-N 2.96Å; A248-K251 PolarHBondContact O-N 3.23Å; K251-K253 PolarHBondContact O-N 2.88Å; K251-M254 PolarHBondContact O-N 3.15Å; K251-M254 VanDerWaalsContact O-N 3.15Å; K251-V255 WeakPolarHBondContact O-CG2 3.38Å; K251-V255 PolarHBondContact O-N 3.15Å
252	R	69	Low	62.3	Low	194 Å²	194	117.9 Å²	117.9	73%	0.732	57%	0.566	S	S	*	*	H	α-helix	trans	-61	-41.2	173.7	-72.4	177.2	-167.7	178.5	3.7	112.7	A248 Q250 M254 V256	A248-R252 WeakPolarHBondContact O-CG 3.3Å; A248-R252 PolarHBondContact O-N 3.4Å; Q250-R252 PolarHBondContact O-N 2.95Å; R252-M254 VanDerWaalsContact C-N 3.31Å; R252-M254 PolarHBondContact O-N 3.09Å; R252-V256 WeakPolarHBondContact O-CG2 3.42Å; R252-V256 PolarHBondContact O-N 2.88Å; R252-V256 VanDerWaalsContact O-N 3.11Å
253	K	64.8	Low	62.1	Low	154 Å²	154	121.3 Å²	121.3	67%	0.67	58%	0.578	S	S	*	*	H	α-helix	trans	-62.5	-38	173.1	-87.5	-165.1	166	-155.5	0	112.5	R249 Q250 K251 L257	R249-K253 WeakPolarHBondContact O-CB 3.32Å; R249-K253 PolarHBondContact O-N 3.33Å; Q250-K253 CarbonylContact O-C 3.58Å; Q250-K253 WeakPolarHBondContact O-CB 3.21Å; Q250-K253 PolarHBondContact O-N 2.91Å; Q250-K253 VanDerWaalsContact O-N 3.15Å; K251-K253 PolarHBondContact O-N 2.88Å; K253-L257 WeakPolarHBondContact O-CB 3.31Å; K253-L257 PolarHBondContact O-N 3.14Å; K253-L257 VanDerWaalsContact O-N 3.17Å
254	M	61.7	Low	61.7	Low	132 Å²	132	120.2 Å²	120.2	65%	0.65	58%	0.582	S	S	*	*	H	α-helix	trans	-71.2	-45	-179.6	-157.2	180	96.9	0	0	111.2	Q250 K251 R252 V256 L257 T258	Q250-M254 WeakPolarHBondContact O-CB 3.44Å; Q250-M254 PolarHBondContact O-N 2.81Å; K251-M254 PolarHBondContact O-N 3.15Å; K251-M254 VanDerWaalsContact O-N 3.15Å; R252-M254 VanDerWaalsContact C-N 3.31Å; R252-M254 PolarHBondContact O-N 3.09Å; M254-V256 PolarHBondContact O-N 3.34Å; M254-L257 WeakPolarHBondContact O-CA 3.43Å; M254-L257 WeakPolarHBondContact O-CB 3.44Å; M254-L257 PolarHBondContact O-N 2.93Å; M254-T258 PolarHBondContact O-N 2.94Å; M254-T258 PolarHBondContact O-OG1 2.87Å
255	V	60.7	Low	60.9	Low	92 Å²	92	118.8 Å²	118.8	56%	0.558	58%	0.582	S	S	*	*	H	α-helix	trans	-57.2	-48.2	175	169.3	0	0	0	0	111.3	K251 L257 T258 E259	K251-V255 WeakPolarHBondContact O-CG2 3.38Å; K251-V255 PolarHBondContact O-N 3.15Å; V255-L257 PolarHBondContact O-N 3.17Å; V255-T258 PolarHBondContact O-N 3.01Å; V255-E259 WeakPolarHBondContact O-CB 3.28Å; V255-E259 PolarHBondContact O-N 2.99Å
256	V	59.8	Low	60.1	Low	85 Å²	85	118.1 Å²	118.1	52%	0.515	59%	0.591	S	S	.	*	H	α-helix	trans	-61.7	-31.1	175.8	170.4	0	0	0	0	112	R252 M254 T260	R252-V256 WeakPolarHBondContact O-CG2 3.42Å; R252-V256 PolarHBondContact O-N 2.88Å; R252-V256 VanDerWaalsContact O-N 3.11Å; M254-V256 PolarHBondContact O-N 3.34Å; V256-T260 WeakPolarHBondContact O-CG2 3.5Å; V256-T260 PolarHBondContact O-N 3.01Å; V256-T260 VanDerWaalsContact O-N 3.13Å; V256-T260 PolarHBondContact O-OG1 3.3Å
257	L	58.2	Low	59	Low	104 Å²	104	117.5 Å²	117.5	55%	0.545	60%	0.601	S	S	.	*	H	α-helix	trans	-73.8	-40.3	177.4	-131.9	159.6	0	0	0	111.9	K253 M254 V255 T260 L261	K253-L257 WeakPolarHBondContact O-CB 3.31Å; K253-L257 PolarHBondContact O-N 3.14Å; K253-L257 VanDerWaalsContact O-N 3.17Å; M254-L257 WeakPolarHBondContact O-CA 3.43Å; M254-L257 WeakPolarHBondContact O-CB 3.44Å; M254-L257 PolarHBondContact O-N 2.93Å; V255-L257 PolarHBondContact O-N 3.17Å; L257-T260 WeakPolarHBondContact CA-OG1 3.24Å; L257-T260 PolarHBondContact O-N 3.25Å; L257-T260 PolarHBondContact O-OG1 2.83Å; L257-L261 HydrophobicContact CD2-CD1 3.95Å; L257-L261 HydrophobicContact CD2-CG 4.48Å; L257-L261 WeakPolarHBondContact O-CG 2.99Å; L257-L261 PolarHBondContact O-N 3.34Å; L257-L261 VanDerWaalsContact O-N 3.13Å
258	T	57	Low	58.2	Low	65 Å²	65	119.4 Å²	119.4	40%	0.399	62%	0.617	S	S	.	*	H	α-helix	trans	-61.9	-47.4	171.8	-55	0	0	0	0	111	M254 V255 T260 L261 D262	M254-T258 PolarHBondContact O-N 2.94Å; M254-T258 PolarHBondContact O-OG1 2.87Å; V255-T258 PolarHBondContact O-N 3.01Å; T258-T260 PolarHBondContact O-N 3.2Å; T258-L261 WeakPolarHBondContact O-CA 3.14Å; T258-L261 WeakPolarHBondContact O-CB 3.34Å; T258-L261 PolarHBondContact O-N 3.35Å; T258-D262 PolarHBondContact O-N 2.86Å
259	E	54	Low	56.5	Low	121 Å²	121	123.4 Å²	123.4	57%	0.565	64%	0.641	S	S	*	*	H	α-helix	trans	-59.3	-32.1	177.3	-166.7	169.7	-137.9	0	0	112.3	V255 I263	V255-E259 WeakPolarHBondContact O-CB 3.28Å; V255-E259 PolarHBondContact O-N 2.99Å; E259-I263 VanDerWaalsContact O-CD1 3.31Å; E259-I263 WeakPolarHBondContact O-CD1 3.36Å; E259-I263 WeakPolarHBondContact O-CG1 3.44Å
260	T	56.4	Low	54.6	Low	78 Å²	78	123.5 Å²	123.5	48%	0.479	65%	0.65	S	S	.	*	H	α-helix	trans	-81.1	-13.9	171	53.6	0	0	0	0	115.5	V256 L257 T258 V264	V256-T260 WeakPolarHBondContact O-CG2 3.5Å; V256-T260 PolarHBondContact O-N 3.01Å; V256-T260 VanDerWaalsContact O-N 3.13Å; V256-T260 PolarHBondContact O-OG1 3.3Å; L257-T260 WeakPolarHBondContact CA-OG1 3.24Å; L257-T260 PolarHBondContact O-N 3.25Å; L257-T260 PolarHBondContact O-OG1 2.83Å; T258-T260 PolarHBondContact O-N 3.2Å; T260-V264 WeakPolarHBondContact O-CG2 3.49Å
261	L	56.4	Low	52.9	Low	105 Å²	105	122.5 Å²	122.5	55%	0.55	66%	0.661	S	S	.	*	H	α-helix	trans	-90.4	-40.7	177	-80.7	162.4	0	0	0	111.4	L257 T258 I263 V264 N265	L257-L261 HydrophobicContact CD2-CD1 3.95Å; L257-L261 HydrophobicContact CD2-CG 4.48Å; L257-L261 WeakPolarHBondContact O-CG 2.99Å; L257-L261 PolarHBondContact O-N 3.34Å; L257-L261 VanDerWaalsContact O-N 3.13Å; T258-L261 WeakPolarHBondContact O-CA 3.14Å; T258-L261 WeakPolarHBondContact O-CB 3.34Å; T258-L261 PolarHBondContact O-N 3.35Å; L261-I263 PolarHBondContact O-N 2.85Å; L261-V264 PolarHBondContact O-N 2.94Å; L261-N265 PolarHBondContact O-N 3.13Å
262	D	49.3	Very low	51.1	Low	118 Å²	118	120.3 Å²	120.3	63%	0.631	67%	0.671	S	S	*	*	H	α-helix	trans	-64.1	-23.6	178.6	-63.9	-28.7	0	0	0	112.5	T258 V264	T258-D262 PolarHBondContact O-N 2.86Å; D262-V264 VanDerWaalsContact C-N 3.34Å
263	I	54.1	Low	49.3	Very low	134 Å²	134	119.9 Å²	119.9	69%	0.687	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-19.9	174.4	-69.5	172.2	0	0	0	112.8	E259 L261	E259-I263 VanDerWaalsContact O-CD1 3.31Å; E259-I263 WeakPolarHBondContact O-CD1 3.36Å; E259-I263 WeakPolarHBondContact O-CG1 3.44Å; L261-I263 PolarHBondContact O-N 2.85Å
264	V	51.4	Low	47.7	Very low	109 Å²	109	117.9 Å²	117.9	66%	0.661	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	-14.6	-169.7	-177.9	0	0	0	0	112.8	T260 L261 D262 C266	T260-V264 WeakPolarHBondContact O-CG2 3.49Å; L261-V264 PolarHBondContact O-N 2.94Å; D262-V264 VanDerWaalsContact C-N 3.34Å; V264-C266 PolarHBondContact O-N 3.04Å; V264-C266 VanDerWaalsContact O-N 3.09Å
265	N	45.7	Very low	46.1	Very low	143 Å²	143	116 Å²	116	77%	0.765	69%	0.688	S	S	*	*			trans	-87.4	42.3	-177.9	-155.4	97.1	0	0	0	114	L261	L261-N265 PolarHBondContact O-N 3.13Å
266	C	44.1	Very low	44.7	Very low	118 Å²	118	116 Å²	116	80%	0.797	70%	0.697	S	S	*	*			trans	-124.1	79.2	170.2	-74.9	0	0	0	0	109.3	V264	V264-C266 PolarHBondContact O-N 3.04Å; V264-C266 VanDerWaalsContact O-N 3.09Å
267	D	43.1	Very low	43.3	Very low	160 Å²	160	116.8 Å²	116.8	86%	0.856	71%	0.707	S	S	*	*			trans	-77.7	158.9	178.5	-127.9	11.6	0	0	0	111.4
268	P	53.5	Low	42	Very low	104 Å²	104	116.8 Å²	116.8	68%	0.675	72%	0.715	S	S	*	*			trans	-99.9	-171.8	-156.5	40.1	-40.1	0	0	0	116.3
269	C	35.6	Very low	41	Very low	123 Å²	123	118 Å²	118	83%	0.831	73%	0.727	S	S	*	*			trans	86.8	146	176.5	-57.1	0	0	0	0	115.3
270	E	31.1	Very low	40.1	Very low	191 Å²	191	118.9 Å²	118.9	89%	0.893	74%	0.735	S	S	*	*			cis	-139.6	170.3	9.6	-153.2	175.2	-148.3	0	0	113.5
271	A	33.3	Very low	39.3	Very low	93 Å²	93	122 Å²	122	77%	0.769	75%	0.748	S	S	*	*			trans	-22.7	138	-179.8	0	0	0	0	0	121.7
272	A	33.4	Very low	38.3	Very low	104 Å²	104	125.6 Å²	125.6	86%	0.86	76%	0.762	S	S	*	*				-164.2	171	129.6	0	0	0	0	0	111.9
273	E	32.5	Very low	37.5	Very low	184 Å²	184	125.3 Å²	125.3	86%	0.86	77%	0.765	S	S	*	*			trans	-85.2	164.3	-164.9	-53.3	-178.6	123.3	0	0	116.8
274	S	29.5	Very low	36.7	Very low	113 Å²	113	127 Å²	127	79%	0.79	77%	0.774	S	S	*	*			trans	89.3	130.6	141.3	79.7	0	0	0	0	122.2
275	A	29.7	Very low	35.7	Very low	93 Å²	93	126.6 Å²	126.6	77%	0.769	78%	0.783	S	S	*	*			trans	50.6	108	136.7	0	0	0	0	0	122.9
276	A	30.2	Very low	35.2	Very low	90 Å²	90	128 Å²	128	74%	0.744	79%	0.789	S	S	*	*				79.8	141	123.2	0	0	0	0	0	123.1
277	S	31.7	Very low	34.6	Very low	103 Å²	103	126.6 Å²	126.6	72%	0.72	79%	0.786	S	S	*	*			trans	68.7	119.9	145.7	50.9	0	0	0	0	123
278	S	31.1	Very low	34.1	Very low	103 Å²	103	124.6 Å²	124.6	72%	0.72	79%	0.785	S	S	*	*				79.7	126.9	125.7	66.9	0	0	0	0	123.8
279	S	35.4	Very low	33.2	Very low	92 Å²	92	127.4 Å²	127.4	64%	0.643	79%	0.793	S	S	*	*				74.8	121	128.8	61.6	0	0	0	0	123
280	D	34.3	Very low	33.7	Very low	138 Å²	138	126.6 Å²	126.6	74%	0.738	79%	0.786	S	S	*	*				79	109.8	126.2	-57.6	-13.6	0	0	0	123.6
281	L	40.8	Very low	33.6	Very low	145 Å²	145	126.5 Å²	126.5	76%	0.759	79%	0.786	S	S	*	*				34.9	121.4	118.6	-59.9	173.4	0	0	0	120.3
282	Q	34.9	Very low	33.7	Very low	180 Å²	180	129 Å²	129	84%	0.841	79%	0.786	S	S	*	*				178.5	112.9	125.8	-94.9	147.8	90.9	0	0	109.1
283	T	32.1	Very low	34.4	Very low	111 Å²	111	130 Å²	130	68%	0.681	78%	0.784	S	S	*	*				58.3	112	82.6	58.6	0	0	0	0	117.8
284	L	37	Very low	34.4	Very low	170 Å²	170	127.9 Å²	127.9	89%	0.89	78%	0.778	S	S	*	*			trans	59.5	148.1	140.7	-52.3	170.4	0	0	0	117.7
285	A	31.4	Very low	34.5	Very low	101 Å²	101	128.7 Å²	128.7	84%	0.835	78%	0.783	S	S	*	*			cis	-161.9	-166.4	34.5	0	0	0	0	0	114
286	L	34.4	Very low	34.6	Very low	171 Å²	171	130 Å²	130	90%	0.895	79%	0.787	S	S	*	*			trans	-78.5	163.4	-166.4	-78	151.9	0	0	0	118.5
287	A	32.3	Very low	34.7	Very low	90 Å²	90	131.7 Å²	131.7	74%	0.744	79%	0.792	S	S	*	*			trans	72.7	144.2	153.6	0	0	0	0	0	117.7
288	S	32.4	Very low	34.6	Very low	117 Å²	117	129.6 Å²	129.6	82%	0.818	79%	0.787	S	S	*	*			cis	-156.8	170.1	36.7	-56.6	0	0	0	0	114.4
289	L	33.9	Very low	34.6	Very low	163 Å²	163	134.9 Å²	134.9	85%	0.853	80%	0.797	S	S	*	*			trans	-72	166.8	159.9	-88.1	165.8	0	0	0	110.8
290	P	46.6	Very low	34.7	Very low	107 Å²	107	138.2 Å²	138.2	70%	0.695	80%	0.796	S	S	*	*			cis	-152.9	-164.7	39.4	43.6	-21	0	0	0	118.8
291	Q	29.1	Very low	35.4	Very low	189 Å²	189	137 Å²	137	88%	0.883	80%	0.795	S	S	*	*			trans	98.2	140.7	154.2	-79.5	177.8	-8.5	0	0	121.8
292	L	36.1	Very low	35	Very low	146 Å²	146	135.6 Å²	135.6	76%	0.764	79%	0.785	S	S	*	*			trans	-92.5	171.1	173	-75	159.4	0	0	0	110.3
293	P	47.3	Very low	34.8	Very low	125 Å²	125	134.5 Å²	134.5	81%	0.812	78%	0.779	S	S	*	*				-136.5	165.6	100.6	38.9	-29.9	0	0	0	114.9
294	D	32.2	Very low	34.7	Very low	138 Å²	138	132.5 Å²	132.5	74%	0.738	77%	0.774	S	S	*	*			trans	-79.9	163.8	-177.1	-49.4	-89.5	0	0	0	115.1
295	S	32	Very low	34.3	Very low	130 Å²	130	129.9 Å²	129.9	91%	0.909	77%	0.77	S	S	*	*			trans	-160.1	140	141.8	-82.1	0	0	0	0	110.6
296	S	31.5	Very low	34.3	Very low	121 Å²	121	135.7 Å²	135.7	85%	0.846	77%	0.772	S	S	*	*			trans	-118.8	139.2	-167.6	74.9	0	0	0	0	114.7
297	C	31.6	Very low	34.6	Very low	125 Å²	125	133.1 Å²	133.1	85%	0.845	77%	0.766	S	S	*	*			trans	-177.4	135.8	143.6	-170.3	0	0	0	0	109
298	G	30.5	Very low	34.5	Very low	59 Å²	59	135.3 Å²	135.3	61%	0.608	77%	0.769	S	S	*	*			cis	131.5	76.7	-10.7	0	0	0	0	0	115.3
299	F	30.7	Very low	35.3	Very low	214 Å²	214	135.2 Å²	135.2	94%	0.939	77%	0.766	S	S	*	*			trans	-159.1	145.5	158.4	-108.2	-74.1	0	0	0	112.8
300	R	36.7	Very low	35.3	Very low	163 Å²	163	135 Å²	135	62%	0.615	76%	0.761	S	S	*	*			trans	-143.7	-176.6	171.5	-136.2	-155.5	165.7	-169.6	1.3	107	E302	R300-E302 VanDerWaalsContact CZ-C 3.47Å; R300-E302 IonicContact CZ-OE1 2.67Å; R300-E302 VanDerWaalsContact CZ-OE1 3.23Å; R300-E302 IonicContact CZ-OE2 3.4Å; R300-E302 PolarHBondContact NE-O 2.78Å; R300-E302 IonicContact NE-OE2 3.72Å; R300-E302 IonicContact NH1-OE1 2.74Å; R300-E302 PolarHBondContact NH1-OE1 3.15Å; R300-E302 IonicContact NH1-OE2 2.95Å; R300-E302 PolarHBondContact NH1-OE2 3.18Å; R300-E302 PolarHBondContact NH2-O 2.82Å; R300-E302 IonicContact NH2-OE1 3.35Å; R300-E302 PolarHBondContact NH2-OE1 3.43Å
301	P	50.5	Low	35.1	Very low	112 Å²	112	135.5 Å²	135.5	73%	0.727	76%	0.764	S	S	*	*			cis	-117.8	-173.6	25.9	48.2	-36.6	0	0	0	112.4
302	E	32.5	Very low	35.8	Very low	115 Å²	115	130.3 Å²	130.3	54%	0.537	75%	0.753	S	S	.	*			cis	-137.1	-133.7	-6.8	-142.2	-0.7	-92.2	0	0	110.7	R300	R300-E302 VanDerWaalsContact CZ-C 3.47Å; R300-E302 IonicContact CZ-OE1 2.67Å; R300-E302 VanDerWaalsContact CZ-OE1 3.23Å; R300-E302 IonicContact CZ-OE2 3.4Å; R300-E302 PolarHBondContact NE-O 2.78Å; R300-E302 IonicContact NE-OE2 3.72Å; R300-E302 IonicContact NH1-OE1 2.74Å; R300-E302 PolarHBondContact NH1-OE1 3.15Å; R300-E302 IonicContact NH1-OE2 2.95Å; R300-E302 PolarHBondContact NH1-OE2 3.18Å; R300-E302 PolarHBondContact NH2-O 2.82Å; R300-E302 IonicContact NH2-OE1 3.35Å; R300-E302 PolarHBondContact NH2-OE1 3.43Å
303	E	30.6	Very low	36.2	Very low	157 Å²	157	131.9 Å²	131.9	73%	0.734	76%	0.762	S	S	*	*			cis	-155.5	-156.3	6.2	-147	-145.9	104.3	0	0	113.3
304	A	30.1	Very low	36.2	Very low	69 Å²	69	130.8 Å²	130.8	57%	0.57	75%	0.749	S	S	*	*			trans	-45.7	164.6	178.1	0	0	0	0	0	118.5
305	S	27.1	Very low	36.8	Very low	116 Å²	116	130.9 Å²	130.9	81%	0.811	75%	0.749	S	S	*	*			cis	-168.6	166.9	-12.3	-96.4	0	0	0	0	111.1
306	Y	32.4	Very low	37.4	Very low	223 Å²	223	128.6 Å²	128.6	88%	0.875	74%	0.737	S	S	*	*			trans	-103	150.2	172.8	-72.4	-83.8	0	0	0	112.6
307	P	40.6	Very low	38.2	Very low	117 Å²	117	130.1 Å²	130.1	76%	0.76	73%	0.731	S	S	*	*				-133.3	166.6	92.7	11.4	12.7	0	0	0	112.9
308	V	30.9	Very low	38.8	Very low	135 Å²	135	127.3 Å²	127.3	82%	0.818	71%	0.71	S	S	*	*			cis	85.3	134.4	41.6	-178.8	0	0	0	0	113.4
309	P	49	Very low	39.5	Very low	115 Å²	115	130.7 Å²	130.7	75%	0.747	71%	0.709	S	S	*	*			trans	-127.7	-173	-140.1	45.8	-33.3	0	0	0	118.9
310	E	33.1	Very low	40.3	Very low	159 Å²	159	127 Å²	127	74%	0.743	70%	0.696	S	S	*	*			trans	74.5	157.1	168	-77.8	-71.1	104.4	0	0	118
311	P	42.3	Very low	40.5	Very low	118 Å²	118	124.1 Å²	124.1	77%	0.766	70%	0.696	S	S	*	*			cis	-120.7	159.1	7.1	41	-28.3	0	0	0	117.3
312	A	43.8	Very low	39.9	Very low	79 Å²	79	122.4 Å²	122.4	65%	0.653	69%	0.687	S	S	*	*			trans	-99.9	99.5	-176.3	0	0	0	0	0	115.2
313	L	44.4	Very low	40.2	Very low	180 Å²	180	123.4 Å²	123.4	94%	0.942	69%	0.692	S	S	*	*			trans	-146.4	62.8	170	-84.5	-178.2	0	0	0	114.7
314	D	47.4	Very low	40.8	Very low	101 Å²	101	124.4 Å²	124.4	54%	0.54	70%	0.699	S	S	.	*			trans	-169.8	115.1	138	-178.9	26.7	0	0	0	110.1
315	L	45	Very low	41.3	Very low	141 Å²	141	124.9 Å²	124.9	74%	0.738	70%	0.698	S	S	*	*	S	Bend	trans	-156.3	-25.3	173.3	-165.6	59.7	0	0	0	112.2	F319	L315-F319 PolarHBondContact O-N 3.38Å
316	A	44.8	Very low	41.5	Very low	81 Å²	81	126.5 Å²	126.5	67%	0.669	70%	0.698	S	S	*	*	H	α-helix	trans	-72.6	-33.3	177.6	0	0	0	0	0	113.2
317	Q	48.7	Very low	41.5	Very low	153 Å²	153	123.6 Å²	123.6	72%	0.715	70%	0.696	S	S	*	*	H	α-helix	trans	-76.8	-46.2	177.7	-69.3	-175.3	-103.1	0	0	111	F319 M320 T321	Q317-F319 VanDerWaalsContact C-N 3.33Å; Q317-F319 PolarHBondContact O-N 2.93Å; Q317-M320 PolarHBondContact O-N 3.42Å; Q317-T321 PolarHBondContact O-N 2.88Å; Q317-T321 PolarHBondContact O-OG1 3.28Å
318	T	44	Very low	40.9	Very low	67 Å²	67	123 Å²	123	41%	0.411	69%	0.694	S	S	.	*	H	α-helix	trans	-58.8	-38.7	-179.5	3	0	0	0	0	113.1	T321 S322	T318-T321 WeakPolarHBondContact CA-OG1 3.46Å; T318-T321 PolarHBondContact O-N 3.05Å; T318-T321 PolarHBondContact O-OG1 3.24Å; T318-S322 WeakPolarHBondContact O-CB 3.43Å; T318-S322 PolarHBondContact O-N 2.98Å; T318-S322 VanDerWaalsContact O-N 3.08Å
319	F	44.1	Very low	40.9	Very low	130 Å²	130	122.4 Å²	122.4	57%	0.57	69%	0.691	S	S	*	*	H	α-helix	trans	-66.9	-38.2	178.3	-174.1	-102.9	0	0	0	113.1	L315 Q317 S322 Q323	L315-F319 PolarHBondContact O-N 3.38Å; Q317-F319 VanDerWaalsContact C-N 3.33Å; Q317-F319 PolarHBondContact O-N 2.93Å; F319-S322 PolarHBondContact O-N 3.06Å; F319-Q323 HydrophobicContact CE1-CG 4.45Å; F319-Q323 HydrophobicContact CZ-CG 4.35Å
320	M	47.4	Very low	39.9	Very low	136 Å²	136	122.4 Å²	122.4	67%	0.67	69%	0.689	S	S	*	*	H	α-helix	trans	-70.5	-30.3	178.8	-75.1	-72.1	-73.6	0	0	112.6	Q317	Q317-M320 PolarHBondContact O-N 3.42Å
321	T	42.1	Very low	39.8	Very low	102 Å²	102	121.4 Å²	121.4	63%	0.626	69%	0.687	S	S	*	*	H	α-helix	trans	-78.8	-30	174.1	45.6	0	0	0	0	113.5	Q317 T318 Q323	Q317-T321 PolarHBondContact O-N 2.88Å; Q317-T321 PolarHBondContact O-OG1 3.28Å; T318-T321 WeakPolarHBondContact CA-OG1 3.46Å; T318-T321 PolarHBondContact O-N 3.05Å; T318-T321 PolarHBondContact O-OG1 3.24Å; T321-Q323 PolarHBondContact O-N 3.26Å
322	S	36.8	Very low	39.1	Very low	77 Å²	77	122.9 Å²	122.9	54%	0.538	68%	0.684	S	S	.	*	H	α-helix	trans	-69.1	-31.6	-177.6	-173.6	0	0	0	0	113.2	T318 F319 M324 S325	T318-S322 WeakPolarHBondContact O-CB 3.43Å; T318-S322 PolarHBondContact O-N 2.98Å; T318-S322 VanDerWaalsContact O-N 3.08Å; F319-S322 PolarHBondContact O-N 3.06Å; S322-M324 PolarHBondContact O-N 3.3Å; S322-S325 PolarHBondContact O-OG 3.35Å
323	Q	39.5	Very low	38.3	Very low	136 Å²	136	126.3 Å²	126.3	64%	0.636	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	31.6	-176.9	-67.9	-78.4	24.7	0	0	114.9	F319 T321	F319-Q323 HydrophobicContact CE1-CG 4.45Å; F319-Q323 HydrophobicContact CZ-CG 4.35Å; T321-Q323 PolarHBondContact O-N 3.26Å
324	M	42.3	Very low	37.4	Very low	177 Å²	177	123.9 Å²	123.9	87%	0.872	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132	1.2	176.9	-72	-164.5	63.3	0	0	114.8	S322	S322-M324 PolarHBondContact O-N 3.3Å
325	S	42.2	Very low	36.6	Very low	80 Å²	80	126.6 Å²	126.6	56%	0.559	69%	0.689	S	S	*	*	S	Bend	trans	-111.6	136.6	168.5	39.7	0	0	0	0	110.5	S322	S322-S325 PolarHBondContact O-OG 3.35Å
326	D	30.7	Very low	36.2	Very low	150 Å²	150	128.4 Å²	128.4	80%	0.802	69%	0.694	S	S	*	*			trans	59.9	106.4	167.8	-50.5	-37.6	0	0	0	118.6
327	I	32.2	Very low	35.9	Very low	162 Å²	162	131.2 Å²	131.2	83%	0.831	70%	0.698	S	S	*	*				-171.7	137.2	98.3	-89.7	162.5	0	0	0	109.3
328	S	28.3	Very low	35.4	Very low	104 Å²	104	130.2 Å²	130.2	73%	0.727	69%	0.693	S	S	*	*			trans	-122.6	148.7	170.3	56.4	0	0	0	0	109.8
329	V	31.4	Very low	35.4	Very low	123 Å²	123	129.8 Å²	129.8	75%	0.745	70%	0.696	S	S	*	*			trans	70.8	130.8	-174.7	-154	0	0	0	0	109.8
330	T	27.5	Very low	35.2	Very low	115 Å²	115	127.4 Å²	127.4	71%	0.706	69%	0.692	S	S	*	*			cis	-153.7	152.7	46.2	-46.6	0	0	0	0	111.7
331	L	30.3	Very low	34.8	Very low	137 Å²	137	128 Å²	128	72%	0.717	69%	0.693	S	S	*	*			trans	24.3	130.3	164	-86.1	77	0	0	0	120.9
332	Q	28.8	Very low	34.9	Very low	149 Å²	149	127.1 Å²	127.1	70%	0.696	68%	0.684	S	S	*	*				64	124.6	77.9	-164	175	-24.4	0	0	111.2
333	E	26.3	Very low	35.3	Very low	151 Å²	151	128.8 Å²	128.8	71%	0.706	69%	0.685	S	S	*	*			cis	-157.6	-176.7	47.2	-158.3	151.6	-107.9	0	0	114.7
334	T	26.7	Very low	35.5	Very low	130 Å²	130	127.3 Å²	127.3	80%	0.798	68%	0.68	S	S	*	*			trans	72.5	96.8	171.2	62.2	0	0	0	0	119.2
335	Q	29.8	Very low	35.5	Very low	157 Å²	157	123.4 Å²	123.4	73%	0.734	66%	0.66	S	S	*	*				-167.4	64.7	123.5	-166.2	176.3	-20.9	0	0	111	E338	Q335-E338 PolarHBondContact NE2-OE2 3.28Å
336	E	35.7	Very low	35.6	Very low	179 Å²	179	127.8 Å²	127.8	84%	0.836	66%	0.664	S	S	*	*			trans	-87	114.8	168.4	-66.1	-158	132.8	0	0	110.8
337	N	39.8	Very low	35.9	Very low	141 Å²	141	126.6 Å²	126.6	75%	0.754	65%	0.652	S	S	*	*	S	Bend	trans	-178.5	-31.5	144.7	-100.8	-58.7	0	0	0	112.4	A339	N337-A339 PolarHBondContact O-N 3.25Å
338	E	37.5	Very low	36.5	Very low	131 Å²	131	123.1 Å²	123.1	61%	0.612	64%	0.638	S	S	*	*	H	α-helix	trans	-69.3	-18.8	175.4	-79	-171.7	101.1	0	0	113.8	Q335 N342	Q335-E338 PolarHBondContact NE2-OE2 3.28Å; E338-N342 PolarHBondContact O-ND2 3.26Å
339	A	43.2	Very low	37.5	Very low	58 Å²	58	123.8 Å²	123.8	48%	0.479	63%	0.628	S	S	.	*	H	α-helix	trans	-65.4	-43	-178	0	0	0	0	0	112.6	N337 N342 M343	N337-A339 PolarHBondContact O-N 3.25Å; A339-N342 PolarHBondContact O-N 3.08Å; A339-M343 WeakPolarHBondContact O-CB 3.37Å; A339-M343 PolarHBondContact O-N 2.99Å
340	V	40.3	Very low	38	Very low	80 Å²	80	122.6 Å²	122.6	49%	0.485	62%	0.618	S	S	.	*	H	α-helix	trans	-67.6	-47.4	-169.6	-176.7	0	0	0	0	111.8	N342 M343 I344	V340-N342 VanDerWaalsContact C-N 3.34Å; V340-N342 PolarHBondContact O-N 3.16Å; V340-M343 PolarHBondContact O-N 2.78Å; V340-M343 VanDerWaalsContact O-N 3.15Å; V340-I344 HydrophobicContact CG1-CD1 3.91Å; V340-I344 HydrophobicContact CG1-CG1 4.49Å; V340-I344 WeakPolarHBondContact O-CG1 3.23Å; V340-I344 PolarHBondContact O-N 2.95Å
341	H	39.6	Very low	38.4	Very low	150 Å²	150	123.4 Å²	123.4	69%	0.694	61%	0.611	S	S	*	*	H	α-helix	trans	-65.4	-37.3	179.9	-162.6	-52.7	0	0	0	112	E345	H341-E345 PolarHBondContact O-N 3.11Å
342	N	43.3	Very low	39.1	Very low	82 Å²	82	122.8 Å²	122.8	44%	0.439	61%	0.608	S	S	.	*	H	α-helix	trans	-70.7	-32.9	173.7	-80	-77.9	0	0	0	112.5	E338 A339 V340 R346	E338-N342 PolarHBondContact O-ND2 3.26Å; A339-N342 PolarHBondContact O-N 3.08Å; V340-N342 VanDerWaalsContact C-N 3.34Å; V340-N342 PolarHBondContact O-N 3.16Å; N342-R346 WeakPolarHBondContact O-CB 3.41Å; N342-R346 WeakPolarHBondContact O-CD 3.36Å; N342-R346 WeakPolarHBondContact O-CG 3.41Å; N342-R346 PolarHBondContact O-N 3.31Å; N342-R346 VanDerWaalsContact O-N 3.08Å
343	M	45.5	Very low	39.8	Very low	112 Å²	112	121.3 Å²	121.3	55%	0.552	60%	0.6	S	S	*	*	H	α-helix	trans	-72.2	-41.5	179.2	179.1	159.4	54.3	0	0	111.9	A339 V340 R346 F347	A339-M343 WeakPolarHBondContact O-CB 3.37Å; A339-M343 PolarHBondContact O-N 2.99Å; V340-M343 PolarHBondContact O-N 2.78Å; V340-M343 VanDerWaalsContact O-N 3.15Å; M343-R346 PolarHBondContact O-N 2.9Å; M343-F347 VanDerWaalsContact O-CB 3.23Å; M343-F347 WeakPolarHBondContact O-CB 3.13Å; M343-F347 PolarHBondContact O-N 3.5Å
344	I	43.4	Very low	40.4	Very low	105 Å²	105	119.1 Å²	119.1	54%	0.538	59%	0.592	S	S	.	*	H	α-helix	trans	-63	-47.8	176.4	-67.5	167.4	0	0	0	110.6	V340 R346 F347 V348	V340-I344 HydrophobicContact CG1-CD1 3.91Å; V340-I344 HydrophobicContact CG1-CG1 4.49Å; V340-I344 WeakPolarHBondContact O-CG1 3.23Å; V340-I344 PolarHBondContact O-N 2.95Å; I344-R346 VanDerWaalsContact C-N 3.34Å; I344-R346 PolarHBondContact O-N 3.08Å; I344-F347 PolarHBondContact O-N 3.45Å; I344-V348 WeakPolarHBondContact O-CG2 3.31Å; I344-V348 PolarHBondContact O-N 3.27Å
345	E	44.3	Very low	40.8	Very low	96 Å²	96	120.8 Å²	120.8	45%	0.449	59%	0.585	S	S	.	*	H	α-helix	trans	-54.8	-46.7	174	-109.5	-92	118	0	0	112.1	H341 K349	H341-E345 PolarHBondContact O-N 3.11Å; E345-K349 WeakPolarHBondContact O-CB 3.48Å; E345-K349 VanDerWaalsContact O-CG 3.32Å; E345-K349 WeakPolarHBondContact O-CG 3.48Å; E345-K349 PolarHBondContact O-N 2.9Å; E345-K349 VanDerWaalsContact O-N 3.1Å; E345-K349 WeakPolarHBondContact OE1-CE 3.41Å; E345-K349 IonicContact OE1-NZ 3.93Å; E345-K349 PolarHBondContact OE1-NZ 3.33Å; E345-K349 IonicContact OE2-NZ 2.78Å; E345-K349 PolarHBondContact OE2-NZ 3.33Å
346	R	43.9	Very low	41.2	Very low	172 Å²	172	119 Å²	119	65%	0.649	57%	0.572	S	S	*	*	H	α-helix	trans	-67.7	-37.2	176.4	-74.6	171.7	-177.4	-178.1	3.3	113.1	N342 M343 I344 K349 N350	N342-R346 WeakPolarHBondContact O-CB 3.41Å; N342-R346 WeakPolarHBondContact O-CD 3.36Å; N342-R346 WeakPolarHBondContact O-CG 3.41Å; N342-R346 PolarHBondContact O-N 3.31Å; N342-R346 VanDerWaalsContact O-N 3.08Å; M343-R346 PolarHBondContact O-N 2.9Å; I344-R346 VanDerWaalsContact C-N 3.34Å; I344-R346 PolarHBondContact O-N 3.08Å; R346-K349 PolarHBondContact O-N 3.43Å; R346-N350 VanDerWaalsContact O-CB 3.26Å; R346-N350 WeakPolarHBondContact O-CB 3.16Å; R346-N350 PolarHBondContact O-N 3.2Å
347	F	36.6	Very low	41.3	Very low	125 Å²	125	115.2 Å²	115.2	55%	0.548	55%	0.552	S	S	.	*	H	α-helix	trans	-72	-39.9	-177.5	-164.8	-103.9	0	0	0	111.5	M343 I344 K351	M343-F347 VanDerWaalsContact O-CB 3.23Å; M343-F347 WeakPolarHBondContact O-CB 3.13Å; M343-F347 PolarHBondContact O-N 3.5Å; I344-F347 PolarHBondContact O-N 3.45Å; F347-K351 HydrophobicContact CD1-CD 4.31Å; F347-K351 HydrophobicContact CE1-CD 3.9Å; F347-K351 VanDerWaalsContact CE1-CE 3.5Å; F347-K351 HydrophobicContact CE1-CG 4.44Å; F347-K351 HydrophobicContact CZ-CD 4.42Å; F347-K351 VanDerWaalsContact O-CB 3.31Å; F347-K351 WeakPolarHBondContact O-CB 2.98Å; F347-K351 PolarHBondContact O-N 3.46Å
348	V	45.1	Very low	41	Very low	89 Å²	89	117 Å²	117	54%	0.539	55%	0.553	S	S	.	*	H	α-helix	trans	-63.8	-48.2	171.7	174.6	0	0	0	0	110.4	I344 K351 L352	I344-V348 WeakPolarHBondContact O-CG2 3.31Å; I344-V348 PolarHBondContact O-N 3.27Å; V348-K351 PolarHBondContact O-N 3.22Å; V348-L352 WeakPolarHBondContact O-CB 3.4Å; V348-L352 PolarHBondContact O-N 3.18Å
349	K	48.5	Very low	40.9	Very low	117 Å²	117	114.8 Å²	114.8	51%	0.509	55%	0.549	S	S	.	.	H	α-helix	trans	-64.8	-42.6	-179.9	-72.8	172.7	-179.2	171.9	0	112.7	E345 R346 L352 F353	E345-K349 WeakPolarHBondContact O-CB 3.48Å; E345-K349 VanDerWaalsContact O-CG 3.32Å; E345-K349 WeakPolarHBondContact O-CG 3.48Å; E345-K349 PolarHBondContact O-N 2.9Å; E345-K349 VanDerWaalsContact O-N 3.1Å; E345-K349 WeakPolarHBondContact OE1-CE 3.41Å; E345-K349 IonicContact OE1-NZ 3.93Å; E345-K349 PolarHBondContact OE1-NZ 3.33Å; E345-K349 IonicContact OE2-NZ 2.78Å; E345-K349 PolarHBondContact OE2-NZ 3.33Å; R346-K349 PolarHBondContact O-N 3.43Å; K349-L352 PolarHBondContact O-N 3.49Å; K349-F353 WeakPolarHBondContact O-CB 3.49Å; K349-F353 PolarHBondContact O-N 2.82Å
350	N	41.2	Very low	40.7	Very low	99 Å²	99	116.9 Å²	116.9	53%	0.529	55%	0.547	S	S	.	.	H	α-helix	trans	-68.6	-38.6	174.8	-81	-9.2	0	0	0	112.8	R346 L352 F353 L354	R346-N350 VanDerWaalsContact O-CB 3.26Å; R346-N350 WeakPolarHBondContact O-CB 3.16Å; R346-N350 PolarHBondContact O-N 3.2Å; N350-L352 VanDerWaalsContact C-N 3.35Å; N350-F353 PolarHBondContact O-N 2.9Å; N350-L354 WeakPolarHBondContact O-CB 3.44Å; N350-L354 VanDerWaalsContact O-CD1 3.25Å; N350-L354 WeakPolarHBondContact O-CD1 3.45Å; N350-L354 PolarHBondContact O-N 3.44Å
351	K	37.1	Very low	40.4	Very low	132 Å²	132	120.1 Å²	120.1	57%	0.574	56%	0.555	S	S	*	*	H	α-helix	trans	-62.9	-41.8	173.4	-88.3	-165.6	171	-175.4	0	111.6	F347 V348 Y355	F347-K351 HydrophobicContact CD1-CD 4.31Å; F347-K351 HydrophobicContact CE1-CD 3.9Å; F347-K351 VanDerWaalsContact CE1-CE 3.5Å; F347-K351 HydrophobicContact CE1-CG 4.44Å; F347-K351 HydrophobicContact CZ-CD 4.42Å; F347-K351 VanDerWaalsContact O-CB 3.31Å; F347-K351 WeakPolarHBondContact O-CB 2.98Å; F347-K351 PolarHBondContact O-N 3.46Å; V348-K351 PolarHBondContact O-N 3.22Å; K351-Y355 WeakPolarHBondContact O-CB 3.48Å; K351-Y355 PolarHBondContact O-N 2.85Å
352	L	45	Very low	40.1	Very low	124 Å²	124	122 Å²	122	65%	0.649	56%	0.561	S	S	*	*	H	α-helix	trans	-64.5	-42.7	177	-147.6	74.7	0	0	0	111.2	V348 K349 N350 Y355 W356	V348-L352 WeakPolarHBondContact O-CB 3.4Å; V348-L352 PolarHBondContact O-N 3.18Å; K349-L352 PolarHBondContact O-N 3.49Å; N350-L352 VanDerWaalsContact C-N 3.35Å; L352-Y355 PolarHBondContact O-N 3.22Å; L352-W356 VanDerWaalsContact O-CB 3.31Å; L352-W356 WeakPolarHBondContact O-CB 3.15Å; L352-W356 PolarHBondContact O-N 3.02Å
353	F	42.4	Very low	39.5	Very low	118 Å²	118	128.9 Å²	128.9	52%	0.518	58%	0.581	S	S	.	*	H	α-helix	trans	-61.3	-50.2	175.8	-172	-104.9	0	0	0	112.4	K349 N350 Y355 W356 F357	K349-F353 WeakPolarHBondContact O-CB 3.49Å; K349-F353 PolarHBondContact O-N 2.82Å; N350-F353 PolarHBondContact O-N 2.9Å; F353-Y355 PolarHBondContact O-N 2.82Å; F353-W356 PolarHBondContact O-N 3.34Å; F353-F357 HydrophobicContact CE1-CD2 4.27Å; F353-F357 HydrophobicContact CE1-CE2 4.43Å; F353-F357 HydrophobicContact CZ-CD2 4.25Å; F353-F357 HydrophobicContact CZ-CE2 4.16Å; F353-F357 PolarHBondContact O-N 2.81Å
354	L	40	Very low	38.9	Very low	104 Å²	104	131.2 Å²	131.2	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-67.1	-33.9	177.5	-90.7	77.5	0	0	0	113	N350 F357 K358	N350-L354 WeakPolarHBondContact O-CB 3.44Å; N350-L354 VanDerWaalsContact O-CD1 3.25Å; N350-L354 WeakPolarHBondContact O-CD1 3.45Å; N350-L354 PolarHBondContact O-N 3.44Å; L354-F357 PolarHBondContact O-N 2.9Å; L354-K358 WeakPolarHBondContact O-CB 3.32Å; L354-K358 PolarHBondContact O-N 2.82Å
355	Y	34.8	Very low	38.2	Very low	165 Å²	165	132 Å²	132	65%	0.647	61%	0.605	S	S	*	*	H	α-helix	trans	-69.1	-39.4	176.8	-175.2	-98.8	0	0	0	111.5	K351 L352 F353 K358 T359	K351-Y355 WeakPolarHBondContact O-CB 3.48Å; K351-Y355 PolarHBondContact O-N 2.85Å; L352-Y355 PolarHBondContact O-N 3.22Å; F353-Y355 PolarHBondContact O-N 2.82Å; Y355-K358 PolarHBondContact O-N 3.4Å; Y355-T359 PolarHBondContact O-N 2.79Å; Y355-T359 PolarHBondContact O-OG1 3.02Å
356	W	38.8	Very low	37.5	Very low	121 Å²	121	133.5 Å²	133.5	46%	0.458	62%	0.621	S	S	.	*	H	α-helix	trans	-64.5	-43.9	172	-165.9	81.3	0	0	0	111.3	M193 L352 F353 K358 T359 F360	M193-W356 HydrophobicContact SD-CH2 4.5Å; M193-W356 HydrophobicContact SD-CZ2 3.82Å; L352-W356 VanDerWaalsContact O-CB 3.31Å; L352-W356 WeakPolarHBondContact O-CB 3.15Å; L352-W356 PolarHBondContact O-N 3.02Å; F353-W356 PolarHBondContact O-N 3.34Å; W356-K358 PolarHBondContact O-N 3.48Å; W356-T359 WeakPolarHBondContact CA-OG1 3.43Å; W356-T359 PolarHBondContact O-N 3.18Å; W356-T359 PolarHBondContact O-OG1 2.9Å; W356-T359 VanDerWaalsContact O-OG1 3.08Å; W356-F360 PolarHBondContact O-N 3.45Å; W356-F360 VanDerWaalsContact O-N 3.13Å
357	F	37.1	Very low	36.8	Very low	99 Å²	99	131.5 Å²	131.5	43%	0.434	63%	0.628	S	S	.	*	H	α-helix	trans	-59.8	-46.1	173.6	-124.4	-93.4	0	0	0	112.4	F353 L354 T359 F360	F353-F357 HydrophobicContact CE1-CD2 4.27Å; F353-F357 HydrophobicContact CE1-CE2 4.43Å; F353-F357 HydrophobicContact CZ-CD2 4.25Å; F353-F357 HydrophobicContact CZ-CE2 4.16Å; F353-F357 PolarHBondContact O-N 2.81Å; L354-F357 PolarHBondContact O-N 2.9Å; F357-T359 PolarHBondContact O-N 3.49Å; F357-F360 WeakPolarHBondContact O-CB 3.18Å; F357-F360 PolarHBondContact O-N 3.49Å; F357-F360 VanDerWaalsContact O-N 3.16Å
358	K	33.1	Very low	36.5	Very low	177 Å²	177	133.2 Å²	133.2	77%	0.77	64%	0.642	S	S	*	*	H	α-helix	trans	-66.8	-31.3	178.3	-82	-166.4	172.5	-170.3	0	113.6	L354 Y355 W356 F360	L354-K358 WeakPolarHBondContact O-CB 3.32Å; L354-K358 PolarHBondContact O-N 2.82Å; Y355-K358 PolarHBondContact O-N 3.4Å; W356-K358 PolarHBondContact O-N 3.48Å; K358-F360 VanDerWaalsContact C-N 3.31Å
359	T	36.3	Very low	35.8	Very low	85 Å²	85	135.8 Å²	135.8	52%	0.521	65%	0.652	S	S	.	*	H	α-helix	trans	-76.4	-18.7	173.8	38.1	0	0	0	0	113	Y355 W356 F357	Y355-T359 PolarHBondContact O-N 2.79Å; Y355-T359 PolarHBondContact O-OG1 3.02Å; W356-T359 WeakPolarHBondContact CA-OG1 3.43Å; W356-T359 PolarHBondContact O-N 3.18Å; W356-T359 PolarHBondContact O-OG1 2.9Å; W356-T359 VanDerWaalsContact O-OG1 3.08Å; F357-T359 PolarHBondContact O-N 3.49Å
360	F	37.8	Very low	35	Very low	102 Å²	102	139.1 Å²	139.1	45%	0.447	67%	0.667	S	S	.	*	H	α-helix	trans	-74.8	-32.9	177.1	-152.5	-87.9	0	0	0	113.9	L194 W356 F357 K358 K362	L194-F360 HydrophobicContact CD1-CD2 4.42Å; L194-F360 HydrophobicContact CD1-CE1 4.09Å; L194-F360 HydrophobicContact CD1-CE2 3.75Å; L194-F360 HydrophobicContact CD1-CZ 3.58Å; L194-F360 HydrophobicContact CD2-CD1 4.45Å; L194-F360 HydrophobicContact CD2-CE1 3.43Å; L194-F360 VanDerWaalsContact CD2-CE1 3.43Å; L194-F360 HydrophobicContact CD2-CE2 4.45Å; L194-F360 HydrophobicContact CD2-CZ 3.45Å; L194-F360 VanDerWaalsContact CD2-CZ 3.45Å; L194-F360 HydrophobicContact CG-CE1 4.4Å; L194-F360 HydrophobicContact CG-CZ 4.06Å; W356-F360 PolarHBondContact O-N 3.45Å; W356-F360 VanDerWaalsContact O-N 3.13Å; F357-F360 WeakPolarHBondContact O-CB 3.18Å; F357-F360 PolarHBondContact O-N 3.49Å; F357-F360 VanDerWaalsContact O-N 3.16Å; K358-F360 VanDerWaalsContact C-N 3.31Å; F360-K362 PolarHBondContact O-N 2.83Å
361	K	35.7	Very low	34.4	Very low	148 Å²	148	140.7 Å²	140.7	64%	0.643	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	23.9	-173.9	-155.8	-179.2	174.7	173	0	115.4	D389	K361-D389 WeakPolarHBondContact CE-OD2 3.36Å; K361-D389 IonicContact NZ-OD1 2.64Å; K361-D389 PolarHBondContact NZ-OD1 3.09Å; K361-D389 IonicContact NZ-OD2 2.78Å; K361-D389 PolarHBondContact NZ-OD2 3.19Å
362	K	32.5	Very low	34.1	Very low	189 Å²	189	141.5 Å²	141.5	82%	0.822	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.7	21.4	-170.1	-135.3	175.4	-173.8	178.6	0	116.9	F360	F360-K362 PolarHBondContact O-N 2.83Å
363	R	31.5	Very low	33.8	Very low	228 Å²	228	145.1 Å²	145.1	86%	0.86	70%	0.698	S	S	*	*	S	Bend	trans	-136.5	142.5	166.5	-72.7	-169.7	168.1	101	-1.2	111.4
364	N	31.7	Very low	33.9	Very low	161 Å²	161	142.9 Å²	142.9	86%	0.861	69%	0.691	S	S	*	*			trans	-71.7	139.5	-162.2	-60.6	-14.6	0	0	0	113.6
365	V	28.3	Very low	33.9	Very low	121 Å²	121	140.6 Å²	140.6	73%	0.733	69%	0.687	S	S	*	*			trans	-116.8	103	171.4	178	0	0	0	0	108.3
366	T	30	Very low	34.5	Very low	127 Å²	127	139.3 Å²	139.3	78%	0.779	69%	0.687	S	S	*	*			trans	-155.4	45.4	178.8	-25.1	0	0	0	0	114.2
367	T	28.4	Very low	34.8	Very low	131 Å²	131	136.3 Å²	136.3	80%	0.804	68%	0.679	S	S	*	*	S	Bend	trans	-158.9	154.4	167.7	-18	0	0	0	0	112.7
368	L	31.3	Very low	35.1	Very low	160 Å²	160	134.4 Å²	134.4	84%	0.838	67%	0.672	S	S	*	*			trans	63.4	82.5	165.2	-77.4	154.2	0	0	0	118.3
369	L	30.5	Very low	35.5	Very low	143 Å²	143	132.7 Å²	132.7	75%	0.749	66%	0.664	S	S	*	*			trans	-135.6	106	145.5	-79.4	-178.9	0	0	0	111.6
370	K	30.6	Very low	36	Very low	188 Å²	188	130.1 Å²	130.1	82%	0.817	65%	0.649	S	S	*	*			trans	-154.3	137	165.4	-77.1	-168.8	-178.3	-179.6	0	104.8
371	N	29.6	Very low	36.4	Very low	131 Å²	131	126.2 Å²	126.2	70%	0.701	63%	0.633	S	S	*	*			cis	-150.4	161.5	13	-97.3	-16.5	0	0	0	111.7
372	L	31.7	Very low	36.7	Very low	149 Å²	149	125.7 Å²	125.7	78%	0.78	63%	0.628	S	S	*	*	S	Bend	trans	63.4	142.6	160.7	-88.4	75.8	0	0	0	121.1	I374	L372-I374 VanDerWaalsContact C-N 3.27Å; L372-I374 WeakPolarHBondContact O-CG1 3.4Å; L372-I374 PolarHBondContact O-N 3.15Å
373	E	37.1	Very low	37.1	Very low	201 Å²	201	123.7 Å²	123.7	94%	0.939	62%	0.62	S	S	*	*	S	Bend	trans	49.4	5.9	167.3	-143.3	165.8	-134	0	0	121.2
374	I	45.8	Very low	37.7	Very low	70 Å²	70	117.6 Å²	117.6	36%	0.359	60%	0.603	S	S	.	*			trans	-100.2	4.7	172.3	-21.8	-174.6	0	0	0	113.3	L372 E376 Q378	L372-I374 VanDerWaalsContact C-N 3.27Å; L372-I374 WeakPolarHBondContact O-CG1 3.4Å; L372-I374 PolarHBondContact O-N 3.15Å; I374-E376 PolarHBondContact O-N 2.88Å; I374-Q378 HydrophobicContact CB-CG 4.08Å; I374-Q378 HydrophobicContact CG2-CG 3.72Å; I374-Q378 VanDerWaalsContact O-CB 3.26Å; I374-Q378 WeakPolarHBondContact O-CB 3.44Å; I374-Q378 WeakPolarHBondContact O-CG 3.34Å; I374-Q378 PolarHBondContact O-N 3.15Å
375	A	39.4	Very low	38.1	Very low	56 Å²	56	114.7 Å²	114.7	46%	0.463	59%	0.587	S	S	.	*	H	α-helix	trans	-61.7	-37.4	-161.6	0	0	0	0	0	115.3	K379	A375-K379 WeakPolarHBondContact O-CB 3.36Å; A375-K379 VanDerWaalsContact O-CD 3.28Å; A375-K379 WeakPolarHBondContact O-CD 3.47Å; A375-K379 WeakPolarHBondContact O-CG 3.38Å; A375-K379 PolarHBondContact O-N 3.18Å
376	E	47.3	Very low	38.6	Very low	139 Å²	139	113.6 Å²	113.6	65%	0.65	57%	0.574	S	S	*	*	H	α-helix	trans	-82	-48.9	-171.9	-150.7	140.2	-123.3	0	0	111.7	I374 Q378 K379 T380	I374-E376 PolarHBondContact O-N 2.88Å; E376-Q378 PolarHBondContact O-N 3.46Å; E376-K379 PolarHBondContact O-N 2.89Å; E376-T380 PolarHBondContact O-N 2.81Å; E376-T380 PolarHBondContact O-OG1 3.11Å
377	I	46.3	Very low	38.8	Very low	57 Å²	57	110.5 Å²	110.5	29%	0.292	56%	0.558	S	S	.	*	H	α-helix	trans	-63.2	-42.3	174.3	-60.9	175.5	0	0	0	110.6	T380 V381	I377-T380 PolarHBondContact O-N 3.35Å; I377-V381 HydrophobicContact CG2-CG2 4.37Å; I377-V381 WeakPolarHBondContact O-CB 3.46Å; I377-V381 VanDerWaalsContact O-CG2 3.24Å; I377-V381 WeakPolarHBondContact O-CG2 3.45Å; I377-V381 PolarHBondContact O-N 3.47Å
378	Q	41.6	Very low	39.2	Very low	60 Å²	60	108.8 Å²	108.8	28%	0.28	55%	0.551	S	S	.	*	H	α-helix	trans	-65.2	-39.4	174.4	-76.9	180	-11.8	0	0	112.2	I374 E376 V381 Y382	I374-Q378 HydrophobicContact CB-CG 4.08Å; I374-Q378 HydrophobicContact CG2-CG 3.72Å; I374-Q378 VanDerWaalsContact O-CB 3.26Å; I374-Q378 WeakPolarHBondContact O-CB 3.44Å; I374-Q378 WeakPolarHBondContact O-CG 3.34Å; I374-Q378 PolarHBondContact O-N 3.15Å; E376-Q378 PolarHBondContact O-N 3.46Å; Q378-V381 PolarHBondContact O-N 3.49Å; Q378-Y382 WeakPolarHBondContact O-CB 3.47Å; Q378-Y382 PolarHBondContact O-N 3.17Å
379	K	43.2	Very low	39.5	Very low	141 Å²	141	105.7 Å²	105.7	61%	0.613	54%	0.535	S	S	*	.	H	α-helix	trans	-61	-49.1	173.9	-81.8	167.3	-169.3	175.2	0	111.5	A375 E376 V381 Y382 F383	A375-K379 WeakPolarHBondContact O-CB 3.36Å; A375-K379 VanDerWaalsContact O-CD 3.28Å; A375-K379 WeakPolarHBondContact O-CD 3.47Å; A375-K379 WeakPolarHBondContact O-CG 3.38Å; A375-K379 PolarHBondContact O-N 3.18Å; E376-K379 PolarHBondContact O-N 2.89Å; K379-V381 VanDerWaalsContact C-N 3.34Å; K379-V381 PolarHBondContact O-N 3.23Å; K379-Y382 PolarHBondContact O-N 2.91Å; K379-F383 WeakPolarHBondContact O-CB 3.35Å; K379-F383 PolarHBondContact O-N 3.13Å
380	T	45.3	Very low	39.9	Very low	31 Å²	31	104.7 Å²	104.7	19%	0.19	54%	0.535	C	S	.	.	H	α-helix	trans	-60.7	-42.8	-179.8	-65.9	0	0	0	0	111.7	D135 E376 I377 L384	D135-T380 HydrophobicContact CB-CG2 4.5Å; D135-T380 VanDerWaalsContact O-CG2 3.25Å; D135-T380 WeakPolarHBondContact O-CG2 3.43Å; E376-T380 PolarHBondContact O-N 2.81Å; E376-T380 PolarHBondContact O-OG1 3.11Å; I377-T380 PolarHBondContact O-N 3.35Å; T380-L384 HydrophobicContact CG2-CD1 4.22Å; T380-L384 WeakPolarHBondContact O-CB 3.47Å; T380-L384 VanDerWaalsContact O-CG 3.26Å; T380-L384 WeakPolarHBondContact O-CG 3.42Å; T380-L384 PolarHBondContact O-N 3.13Å
381	V	47.8	Very low	40.2	Very low	19 Å²	19	104.7 Å²	104.7	12%	0.115	54%	0.54	C	S	.	.	H	α-helix	trans	-71	-43.1	177.8	171.7	0	0	0	0	112	W196 I377 Q378 K379 F383 L384 L385	W196-V381 HydrophobicContact CH2-CB 4.22Å; W196-V381 HydrophobicContact CH2-CG1 3.61Å; W196-V381 HydrophobicContact CH2-CG2 3.55Å; W196-V381 HydrophobicContact CZ2-CG1 3.75Å; W196-V381 HydrophobicContact CZ3-CB 4.31Å; W196-V381 HydrophobicContact CZ3-CG1 4.03Å; W196-V381 HydrophobicContact CZ3-CG2 3.57Å; I377-V381 HydrophobicContact CG2-CG2 4.37Å; I377-V381 WeakPolarHBondContact O-CB 3.46Å; I377-V381 VanDerWaalsContact O-CG2 3.24Å; I377-V381 WeakPolarHBondContact O-CG2 3.45Å; I377-V381 PolarHBondContact O-N 3.47Å; Q378-V381 PolarHBondContact O-N 3.49Å; K379-V381 VanDerWaalsContact C-N 3.34Å; K379-V381 PolarHBondContact O-N 3.23Å; V381-F383 VanDerWaalsContact C-N 3.31Å; V381-F383 PolarHBondContact O-N 3.15Å; V381-L384 PolarHBondContact O-N 3.23Å; V381-L385 HydrophobicContact CG1-CD1 4.1Å; V381-L385 VanDerWaalsContact O-CG 3.3Å; V381-L385 WeakPolarHBondContact O-CG 3.35Å; V381-L385 PolarHBondContact O-N 2.96Å
382	Y	41	Very low	40.4	Very low	137 Å²	137	102.8 Å²	102.8	54%	0.537	54%	0.543	S	S	.	.	H	α-helix	trans	-64	-37.9	175.7	-171.3	-88.9	0	0	0	111.2	Q378 K379 L385 H386	Q378-Y382 WeakPolarHBondContact O-CB 3.47Å; Q378-Y382 PolarHBondContact O-N 3.17Å; K379-Y382 PolarHBondContact O-N 2.91Å; Y382-L385 PolarHBondContact O-N 3.28Å; Y382-H386 AromaticContact CD1-CE1 3.88Å; Y382-H386 AromaticContact CD1-ND1 3.57Å; Y382-H386 AromaticContact CD2-CE1 3.72Å; Y382-H386 AromaticContact CE1-CE1 3.53Å; Y382-H386 AromaticContact CE1-ND1 3.55Å; Y382-H386 AromaticContact CE2-CE1 3.37Å; Y382-H386 WeakPolarHBondContact CE2-CE1 3.43Å; Y382-H386 AromaticContact CG-CE1 3.97Å; Y382-H386 AromaticContact CG-ND1 3.81Å; Y382-H386 AromaticContact CZ-CE1 3.26Å; Y382-H386 AromaticContact CZ-ND1 3.8Å; Y382-H386 AromaticContact CZ-NE2 3.68Å; Y382-H386 PolarHBondContact O-N 3.03Å; Y382-H386 PolarHBondContact O-ND1 3.33Å
383	F	41.7	Very low	40.3	Very low	148 Å²	148	105.3 Å²	105.3	65%	0.649	55%	0.55	S	S	*	*	H	α-helix	trans	-66.5	-44.6	174	-171.4	-103.2	0	0	0	111.3	K379 V381 L385 H386 S387	K379-F383 WeakPolarHBondContact O-CB 3.35Å; K379-F383 PolarHBondContact O-N 3.13Å; V381-F383 VanDerWaalsContact C-N 3.31Å; V381-F383 PolarHBondContact O-N 3.15Å; F383-L385 PolarHBondContact O-N 2.87Å; F383-H386 PolarHBondContact O-N 3.4Å; F383-H386 VanDerWaalsContact O-N 3.15Å; F383-S387 WeakPolarHBondContact CD1-OG 3.38Å; F383-S387 VanDerWaalsContact CE1-OG 3.26Å; F383-S387 WeakPolarHBondContact CE1-OG 3.31Å; F383-S387 WeakPolarHBondContact CZ-OG 3.48Å; F383-S387 VanDerWaalsContact O-CB 3.24Å; F383-S387 WeakPolarHBondContact O-CB 3.5Å; F383-S387 PolarHBondContact O-N 2.67Å; F383-S387 PolarHBondContact O-OG 2.74Å
384	L	42.8	Very low	39.8	Very low	99 Å²	99	100.6 Å²	100.6	52%	0.518	55%	0.545	S	S	.	.	H	α-helix	trans	-60.6	-30.5	172.4	-74.3	166.5	0	0	0	112.8	T380 V381	T380-L384 HydrophobicContact CG2-CD1 4.22Å; T380-L384 WeakPolarHBondContact O-CB 3.47Å; T380-L384 VanDerWaalsContact O-CG 3.26Å; T380-L384 WeakPolarHBondContact O-CG 3.42Å; T380-L384 PolarHBondContact O-N 3.13Å; V381-L384 PolarHBondContact O-N 3.23Å
385	L	40.9	Very low	38.9	Very low	100 Å²	100	103.5 Å²	103.5	52%	0.524	57%	0.567	S	S	.	*	H	α-helix	trans	-78.5	-25	175	-71.9	166.6	0	0	0	114.1	V381 Y382 F383	V381-L385 HydrophobicContact CG1-CD1 4.1Å; V381-L385 VanDerWaalsContact O-CG 3.3Å; V381-L385 WeakPolarHBondContact O-CG 3.35Å; V381-L385 PolarHBondContact O-N 2.96Å; Y382-L385 PolarHBondContact O-N 3.28Å; F383-L385 PolarHBondContact O-N 2.87Å
386	H	38.4	Very low	38.2	Very low	98 Å²	98	110.9 Å²	110.9	45%	0.454	59%	0.589	S	S	.	*	H	α-helix	trans	-106.9	-21	-176.8	-69.9	79.5	0	0	0	114.4	Y382 F383 S388 D389	Y382-H386 AromaticContact CD1-CE1 3.88Å; Y382-H386 AromaticContact CD1-ND1 3.57Å; Y382-H386 AromaticContact CD2-CE1 3.72Å; Y382-H386 AromaticContact CE1-CE1 3.53Å; Y382-H386 AromaticContact CE1-ND1 3.55Å; Y382-H386 AromaticContact CE2-CE1 3.37Å; Y382-H386 WeakPolarHBondContact CE2-CE1 3.43Å; Y382-H386 AromaticContact CG-CE1 3.97Å; Y382-H386 AromaticContact CG-ND1 3.81Å; Y382-H386 AromaticContact CZ-CE1 3.26Å; Y382-H386 AromaticContact CZ-ND1 3.8Å; Y382-H386 AromaticContact CZ-NE2 3.68Å; Y382-H386 PolarHBondContact O-N 3.03Å; Y382-H386 PolarHBondContact O-ND1 3.33Å; F383-H386 PolarHBondContact O-N 3.4Å; F383-H386 VanDerWaalsContact O-N 3.15Å; H386-S388 PolarHBondContact O-N 2.99Å; H386-S388 VanDerWaalsContact O-N 3.13Å; H386-D389 PolarHBondContact O-N 3.22Å
387	S	33.6	Very low	37.3	Very low	63 Å²	63	111.9 Å²	111.9	44%	0.441	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.2	-7.8	179.8	-59.7	0	0	0	0	113.9	F383 D389	F383-S387 WeakPolarHBondContact CD1-OG 3.38Å; F383-S387 VanDerWaalsContact CE1-OG 3.26Å; F383-S387 WeakPolarHBondContact CE1-OG 3.31Å; F383-S387 WeakPolarHBondContact CZ-OG 3.48Å; F383-S387 VanDerWaalsContact O-CB 3.24Å; F383-S387 WeakPolarHBondContact O-CB 3.5Å; F383-S387 PolarHBondContact O-N 2.67Å; F383-S387 PolarHBondContact O-OG 2.74Å; S387-D389 VanDerWaalsContact C-N 3.27Å
388	S	38.4	Very low	36.8	Very low	94 Å²	94	114.3 Å²	114.3	66%	0.657	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-5.9	173.2	-56.4	0	0	0	0	114	H386	H386-S388 PolarHBondContact O-N 2.99Å; H386-S388 VanDerWaalsContact O-N 3.13Å
389	D	37.6	Very low	36	Very low	96 Å²	96	117.3 Å²	117.3	51%	0.513	64%	0.641	S	S	.	*	S	Bend	trans	-108.9	15	-164.6	-128.3	39	0	0	0	114.9	K361 H386 S387	K361-D389 WeakPolarHBondContact CE-OD2 3.36Å; K361-D389 IonicContact NZ-OD1 2.64Å; K361-D389 PolarHBondContact NZ-OD1 3.09Å; K361-D389 IonicContact NZ-OD2 2.78Å; K361-D389 PolarHBondContact NZ-OD2 3.19Å; H386-D389 PolarHBondContact O-N 3.22Å; S387-D389 VanDerWaalsContact C-N 3.27Å
390	V	38.1	Very low	35.4	Very low	122 Å²	122	120.4 Å²	120.4	74%	0.739	65%	0.654	S	S	*	*	S	Bend	trans	-130.1	46.1	-178.7	-160.3	0	0	0	0	113
391	M	36.5	Very low	34.5	Very low	188 Å²	188	125 Å²	125	93%	0.926	69%	0.688	S	S	*	*	S	Bend	trans	-157.4	59.6	163.5	-79.2	-52.3	-88.8	0	0	111.1
392	A	33.9	Very low	33.6	Very low	91 Å²	91	128.7 Å²	128.7	75%	0.752	72%	0.72	S	S	*	*			trans	-153.6	29.8	-171.1	0	0	0	0	0	118.9
393	E	29.1	Very low	33.9	Very low	202 Å²	202	127.9 Å²	127.9	94%	0.944	73%	0.732	S	S	*	*			trans	-156.4	103.4	164.9	-139.6	163	-167.8	0	0	114.2
394	A	27.8	Very low	33.9	Very low	101 Å²	101	126.9 Å²	126.9	84%	0.835	74%	0.74	S	S	*	*			trans	-175.9	79.6	160.8	0	0	0	0	0	110.7
395	T	25.2	Very low	33.4	Very low	132 Å²	132	127 Å²	127	81%	0.81	75%	0.749	S	S	*	*			trans	-129.8	126.6	168.1	-48.3	0	0	0	0	109
396	F	26.6	Very low	33.1	Very low	210 Å²	210	130.4 Å²	130.4	92%	0.921	76%	0.762	S	S	*	*			trans	-141.2	146.1	170.4	-138.5	-93.8	0	0	0	109.3
397	E	27.8	Very low	33.4	Very low	161 Å²	161	131.5 Å²	131.5	75%	0.752	78%	0.778	S	S	*	*			trans	-74.2	153.3	-164.1	-75.5	-70.5	120.2	0	0	114.5
398	P	34.5	Very low	33.4	Very low	108 Å²	108	136.3 Å²	136.3	70%	0.701	79%	0.793	S	S	*	*			trans	-84.4	157.8	178	35.8	-35.5	0	0	0	113.1
399	S	26	Very low	33.4	Very low	123 Å²	123	137.7 Å²	137.7	86%	0.86	80%	0.8	S	S	*	*			trans	-147.9	144.4	164.9	46.9	0	0	0	0	110.9
400	F	30.9	Very low	33.1	Very low	206 Å²	206	137.6 Å²	137.6	90%	0.904	81%	0.806	S	S	*	*			trans	-94.3	140.3	-171.2	-95.5	-98.4	0	0	0	113.1
401	S	25.1	Very low	32.8	Very low	127 Å²	127	141 Å²	141	89%	0.888	81%	0.812	S	S	*	*			trans	-166.3	151.9	157.4	-80.1	0	0	0	0	111.4
402	A	28.7	Very low	33	Very low	97 Å²	97	137.5 Å²	137.5	80%	0.802	80%	0.803	S	S	*	*			trans	-160.1	172.8	-177.6	0	0	0	0	0	110.2
403	P	48.3	Very low	33.4	Very low	120 Å²	120	138.5 Å²	138.5	78%	0.779	80%	0.802	S	S	*	*			cis	-105	-112.9	-3.5	29	-7.1	0	0	0	111.5
404	P	42.1	Very low	33.6	Very low	126 Å²	126	136 Å²	136	82%	0.818	80%	0.8	S	S	*	*			cis	-104.4	-142.7	3.1	43.7	-34.7	0	0	0	113.8
405	S	31.3	Very low	33.7	Very low	101 Å²	101	137.4 Å²	137.4	71%	0.706	79%	0.793	S	S	*	*			trans	-151	141.7	-166.6	53.6	0	0	0	0	117.9
406	H	34.4	Very low	34	Very low	173 Å²	173	141.2 Å²	141.2	80%	0.801	79%	0.794	S	S	*	*			trans	61.4	166.8	150.1	-71.8	-47.3	0	0	0	120.4
407	P	44.7	Very low	34.2	Very low	121 Å²	121	137.1 Å²	137.1	79%	0.786	79%	0.792	S	S	*	*			cis	-132.5	-172.6	14.4	44	-26.5	0	0	0	118.1
408	H	34.1	Very low	34.4	Very low	164 Å²	164	135 Å²	135	76%	0.759	80%	0.795	S	S	*	*			trans	-90.4	168	175.7	-86.7	-93.9	0	0	0	114.3
409	P	39.7	Very low	34.1	Very low	123 Å²	123	135.9 Å²	135.9	80%	0.799	80%	0.804	S	S	*	*				-139.7	176	126	39.3	-27.4	0	0	0	115.8
410	S	31	Very low	34.4	Very low	93 Å²	93	135 Å²	135	65%	0.65	80%	0.797	S	S	*	*			trans	-126.2	-176	175.4	-55.3	0	0	0	0	109.7
411	F	30.4	Very low	34.4	Very low	195 Å²	195	135 Å²	135	86%	0.855	80%	0.797	S	S	*	*			cis	-150	-157.6	20.7	-99.8	-58.3	0	0	0	107.9
412	P	40.4	Very low	34.7	Very low	114 Å²	114	133.8 Å²	133.8	74%	0.74	79%	0.789	S	S	*	*			cis	-132.8	-171.6	1.2	45.5	-27.1	0	0	0	115.5
413	P	43.1	Very low	34.9	Very low	112 Å²	112	138.4 Å²	138.4	73%	0.727	79%	0.791	S	S	*	*			trans	-108.5	174.9	178.1	40.6	-33	0	0	0	115.3
414	V	33.4	Very low	34.5	Very low	149 Å²	149	138.2 Å²	138.2	90%	0.903	79%	0.79	S	S	*	*			trans	-143.4	144.2	169.6	-175.5	0	0	0	0	109.5
415	D	29.4	Very low	34.5	Very low	131 Å²	131	138.5 Å²	138.5	70%	0.701	79%	0.789	S	S	*	*			trans	-117.8	154.3	-169.4	-98.6	-46.2	0	0	0	115.8
416	Y	32.5	Very low	35.2	Very low	211 Å²	211	139 Å²	139	83%	0.827	79%	0.79	S	S	*	*			trans	16	133.6	163.1	-67.4	-87.3	0	0	0	123.1
417	S	29.8	Very low	36.1	Very low	125 Å²	125	136.6 Å²	136.6	87%	0.874	79%	0.79	S	S	*	*				-147.3	155.8	116.8	54.8	0	0	0	0	110.6
418	S	31.7	Very low	36.2	Very low	117 Å²	117	136.3 Å²	136.3	82%	0.818	79%	0.788	S	S	*	*			trans	-120.2	148.5	-170.7	49.3	0	0	0	0	112.7
419	S	29.8	Very low	36.2	Very low	126 Å²	126	133.9 Å²	133.9	88%	0.881	79%	0.79	S	S	*	*			trans	-144.8	147.2	166.5	58.4	0	0	0	0	110.2
420	S	31.4	Very low	35.6	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	79%	0.79	S	S	*	*			trans	-122.7	138.4	-169.3	50.4	0	0	0	0	111.6
421	F	31.2	Very low	35.7	Very low	206 Å²	206	135.2 Å²	135.2	90%	0.904	79%	0.79	S	S	*	*			trans	-145.2	135	160.2	-97.1	-77.3	0	0	0	110.6
422	S	31.9	Very low	35.7	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	79%	0.788	S	S	*	*			trans	-123.4	146.1	-177.3	-49.2	0	0	0	0	109.4
423	F	32	Very low	35.4	Very low	195 Å²	195	131.9 Å²	131.9	86%	0.855	79%	0.794	S	S	*	*			trans	-170.6	157.8	159.9	-87.3	-52.9	0	0	0	109.3
424	P	41	Very low	35	Very low	115 Å²	115	132.2 Å²	132.2	75%	0.747	80%	0.799	S	S	*	*				-130.5	164	-66.4	26.3	-5.5	0	0	0	114.3
425	T	41.9	Very low	35.6	Very low	132 Å²	132	131.3 Å²	131.3	81%	0.81	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-80.1	144	172.3	-41	0	0	0	0	111.7
426	P	45.6	Very low	35.7	Very low	112 Å²	112	129.6 Å²	129.6	73%	0.727	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-75.4	150.1	170.7	30.9	-35.6	0	0	0	113
427	P	52.5	Low	35.8	Very low	122 Å²	122	127.7 Å²	127.7	79%	0.792	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-89.8	161.2	179.3	36.2	-35.9	0	0	0	114
428	P	46.7	Very low	35.8	Very low	115 Å²	115	124.9 Å²	124.9	75%	0.747	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-100.9	160.5	175.5	38.8	-33.9	0	0	0	114.2
429	S	34.3	Very low	35.8	Very low	113 Å²	113	123.9 Å²	123.9	79%	0.79	79%	0.794	S	S	*	*			trans	59.2	144.7	161.7	-53.8	0	0	0	0	117.3
430	D	27.8	Very low	35.8	Very low	150 Å²	150	128.1 Å²	128.1	80%	0.802	80%	0.797	S	S	*	*			cis	-161.2	-153.8	42.3	-143.3	-46.6	0	0	0	113.2
431	S	32.6	Very low	36.1	Very low	95 Å²	95	130.2 Å²	130.2	66%	0.664	80%	0.798	S	S	*	*			trans	-105.9	156.1	-152.7	-52.8	0	0	0	0	117.6
432	S	31.3	Very low	37	Very low	116 Å²	116	125.6 Å²	125.6	81%	0.811	79%	0.789	S	S	*	*			trans	75.9	126.6	155	78.3	0	0	0	0	121.2
433	S	32.9	Very low	36.8	Very low	123 Å²	123	128.5 Å²	128.5	86%	0.86	79%	0.791	S	S	*	*				176.2	146.4	123.7	39.9	0	0	0	0	111.2
434	S	34.8	Very low	36.8	Very low	119 Å²	119	124.6 Å²	124.6	83%	0.832	78%	0.784	S	S	*	*			trans	-96.2	166.1	176.5	-48.6	0	0	0	0	111.4
435	P	45.7	Very low	36.4	Very low	129 Å²	129	127.1 Å²	127.1	84%	0.838	79%	0.789	S	S	*	*			trans	-118.1	154.2	133	35.1	-31.4	0	0	0	111.7
436	A	33.1	Very low	35.8	Very low	96 Å²	96	126 Å²	126	79%	0.793	79%	0.787	S	S	*	*			trans	-104.9	171.1	179	0	0	0	0	0	111.7
437	N	32.8	Very low	36.2	Very low	171 Å²	171	125 Å²	125	91%	0.914	78%	0.78	S	S	*	*			trans	-145.3	141.4	152.7	-114.8	-21.4	0	0	0	110
438	G	30.9	Very low	35.3	Very low	66 Å²	66	127.7 Å²	127.7	68%	0.68	78%	0.782	S	S	*	*			trans	-70.2	156.8	171.9	0	0	0	0	0	111.6
439	A	32.5	Very low	34.7	Very low	95 Å²	95	128.6 Å²	128.6	79%	0.785	79%	0.785	S	S	*	*			cis	72.1	103.4	38.4	0	0	0	0	0	114
440	F	29.4	Very low	35.6	Very low	215 Å²	215	128.6 Å²	128.6	94%	0.943	78%	0.782	S	S	*	*			trans	-160.9	160.9	143	-113.1	-73.1	0	0	0	110.2
441	I	37.1	Very low	36	Very low	148 Å²	148	125.5 Å²	125.5	76%	0.759	78%	0.778	S	S	*	*			trans	-151.5	150.8	-168.2	-155.2	164.6	0	0	0	109.3
442	P	50.3	Low	35.7	Very low	108 Å²	108	127.1 Å²	127.1	70%	0.701	78%	0.779	S	S	*	*				-153.1	145.5	105.6	39.3	-21.1	0	0	0	117.6
443	E	28.6	Very low	35.7	Very low	164 Å²	164	129.8 Å²	129.8	77%	0.766	78%	0.776	S	S	*	*				54.7	124	127.3	-60.5	-160.1	89.2	0	0	126
444	T	31.6	Very low	35.5	Very low	113 Å²	113	129.8 Å²	129.8	69%	0.693	77%	0.771	S	S	*	*				58.2	123.1	112.6	-41.9	0	0	0	0	121.4
445	I	31.8	Very low	35.4	Very low	167 Å²	167	129.7 Å²	129.7	86%	0.856	77%	0.769	S	S	*	*				-173.2	141.4	120.2	-95.7	157.8	0	0	0	111.7
446	S	29.3	Very low	35.5	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	77%	0.77	S	S	*	*			trans	-131.4	152.9	167.6	-156.9	0	0	0	0	105.2
447	P	55.2	Low	35.6	Very low	89 Å²	89	131 Å²	131	58%	0.578	77%	0.772	S	S	*	*				-151.8	-172.8	56.1	36.3	-11.9	0	0	0	116.3
448	H	32	Very low	35.6	Very low	180 Å²	180	129.4 Å²	129.4	83%	0.833	76%	0.764	S	S	*	*				164	138	119.9	-79.9	-63.1	0	0	0	112.5
449	T	35	Very low	36.4	Very low	133 Å²	133	131.8 Å²	131.8	82%	0.816	77%	0.767	S	S	*	*			trans	-117.2	-172.8	-174.5	3.2	0	0	0	0	111.1
450	P	53.9	Low	36.4	Very low	113 Å²	113	135.5 Å²	135.5	73%	0.734	77%	0.768	S	S	*	*			cis	-86.2	-154.3	7.8	38.7	-36.4	0	0	0	113.4
451	A	35	Very low	36.3	Very low	85 Å²	85	132.6 Å²	132.6	70%	0.702	77%	0.768	S	S	*	*			cis	-165.4	169.8	14.3	0	0	0	0	0	110.5
452	D	27.2	Very low	36	Very low	129 Å²	129	130.7 Å²	130.7	69%	0.69	77%	0.769	S	S	*	*			cis	-164.1	179	-14.1	-134.8	-44.6	0	0	0	113
453	F	29.9	Very low	36.3	Very low	172 Å²	172	131 Å²	131	75%	0.754	77%	0.77	S	S	*	*			trans	43.6	87.5	161.3	-81.1	-81	0	0	0	122.5
454	T	30.5	Very low	37.8	Very low	123 Å²	123	128.2 Å²	128.2	76%	0.755	77%	0.766	S	S	*	*				64.1	121.4	113.9	-50.6	0	0	0	0	122.8
455	C	30.9	Very low	37.9	Very low	117 Å²	117	127.9 Å²	127.9	79%	0.791	77%	0.769	S	S	*	*			trans	-101.9	173.1	159.3	-57	0	0	0	0	112
456	P	49.1	Very low	37.9	Very low	131 Å²	131	128.9 Å²	128.9	85%	0.851	77%	0.77	S	S	*	*				-143.1	-170.5	122.9	39.5	-25.7	0	0	0	115.1
457	S	34.3	Very low	38	Very low	121 Å²	121	128.9 Å²	128.9	85%	0.846	77%	0.765	S	S	*	*			trans	-114.7	175.4	-157.2	-51.4	0	0	0	0	116.4
458	N	33.3	Very low	37.1	Very low	139 Å²	139	131.7 Å²	131.7	74%	0.743	77%	0.771	S	S	*	*			trans	-68.4	159.7	177.6	-172.1	64.9	0	0	0	115.5
459	P	47.5	Very low	37.1	Very low	115 Å²	115	131.7 Å²	131.7	75%	0.747	77%	0.771	S	S	*	*			trans	-141.5	169.5	138.5	38.7	-24.5	0	0	0	116.1
460	Q	31.8	Very low	36.7	Very low	173 Å²	173	129.2 Å²	129.2	81%	0.808	77%	0.772	S	S	*	*			trans	-108.8	153.9	174.1	-59.9	172.9	-46.8	0	0	111.9
461	T	27.7	Very low	35.5	Very low	154 Å²	154	131.9 Å²	131.9	95%	0.945	78%	0.775	S	S	*	*			trans	178	177.7	134.2	24	0	0	0	0	113.5
462	S	30.9	Very low	35.2	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	78%	0.778	S	S	*	*			trans	-138.9	-161.6	-172.7	62.9	0	0	0	0	110.3
463	P	55.9	Low	35.2	Very low	113 Å²	113	137.1 Å²	137.1	73%	0.734	79%	0.785	S	S	*	*			cis	-129.4	-124.7	-18.1	38.5	-16.6	0	0	0	111.6
464	P	61.8	Low	35.4	Very low	106 Å²	106	133 Å²	133	69%	0.688	78%	0.783	S	S	*	*				-124.2	173.3	-62.1	36.5	-20.2	0	0	0	116.7
465	S	33.7	Very low	35.3	Very low	107 Å²	107	135.1 Å²	135.1	75%	0.748	79%	0.79	S	S	*	*				146.4	150.5	125.4	-63.8	0	0	0	0	119.9
466	Q	30.7	Very low	35.2	Very low	187 Å²	187	133 Å²	133	87%	0.874	78%	0.78	S	S	*	*			trans	74.4	147.4	157.3	-73.1	-162.6	-10.1	0	0	121.6
467	V	31.2	Very low	34.2	Very low	110 Å²	110	131.2 Å²	131.2	67%	0.667	77%	0.771	S	S	*	*			cis	-163.9	144.7	-19.1	116.7	0	0	0	0	114.7
468	Q	36	Very low	34	Very low	149 Å²	149	133.2 Å²	133.2	70%	0.696	77%	0.773	S	S	*	*			trans	53.9	134.7	152.4	-70.7	178.6	-42	0	0	129.2
469	Q	32.1	Very low	33.7	Very low	179 Å²	179	130.4 Å²	130.4	84%	0.836	78%	0.776	S	S	*	*			trans	79	138.5	130.7	-74.4	172.9	-14.7	0	0	124.9
470	G	27.4	Very low	32.8	Very low	81 Å²	81	136.3 Å²	136.3	84%	0.835	78%	0.784	S	S	*	*			trans	165.2	133.7	170.2	0	0	0	0	0	112.7
471	E	29.1	Very low	32.7	Very low	170 Å²	170	132 Å²	132	79%	0.794	77%	0.772	S	S	*	*			trans	-94.5	165.6	-161.3	-91	-177.5	72	0	0	119.2
472	Q	27.2	Very low	32.7	Very low	167 Å²	167	133.1 Å²	133.1	78%	0.78	77%	0.765	S	S	*	*			trans	93.6	111.9	141.2	-88.2	168.9	51.8	0	0	124.1
473	D	28.8	Very low	32.6	Very low	157 Å²	157	134.2 Å²	134.2	84%	0.84	76%	0.762	S	S	*	*			trans	-60.1	168.9	149.5	-75.1	-69	0	0	0	114.1
474	A	33.1	Very low	31.2	Very low	85 Å²	85	134.4 Å²	134.4	70%	0.702	76%	0.761	S	S	*	*			cis	-176.2	-175.8	-18.9	0	0	0	0	0	111.1
475	N	28.9	Very low	29.8	Very low	167 Å²	167	134.9 Å²	134.9	89%	0.893	77%	0.767	S	S	*	*			trans	103.9	156.1	137.5	-148.2	4	0	0	0	121.1
476	A	28.6	Very low	29.6	Very low	72 Å²	72	134.8 Å²	134.8	60%	0.595	77%	0.773	S	S	*	*			trans	84.9	72.9	151.7	0	0	0	0	0	123.7
477	S	28.9	Very low	29.7	Very low	94 Å²	94	130 Å²	130	66%	0.657	77%	0.765	S	S	*	*				73.3	151.9	117.1	81.6	0	0	0	0	124.3
478	N	29.6	Very low	29.6	Very low	164 Å²	164	133.9 Å²	133.9	88%	0.877	77%	0.774	S	S	*	*			trans	65.4	149.1	151.5	-64.6	-44.1	0	0	0	120.1
479	G	27.3	Very low	29.3	Very low	80 Å²	80	133.6 Å²	133.6	83%	0.825	78%	0.775	S	S	*	*			trans	155.3	79.2	163.9	0	0	0	0	0	118.8
480	R	28.8	Very low	29.3	Very low	238 Å²	238	135.3 Å²	135.3	90%	0.898	78%	0.776	S	S	*	*			trans	-48.3	126.6	166.6	-88.2	179.5	175.2	175.1	-1.5	116.1
481	S	28	Very low	30.6	Very low	82 Å²	82	137.1 Å²	137.1	57%	0.573	77%	0.773	S	S	*	*				52.1	154.1	125.5	68.1	0	0	0	0	124.2
482	F	29.1	Very low	30.7	Very low	178 Å²	178	135.8 Å²	135.8	78%	0.781	77%	0.771	S	S	*	*			trans	100.6	110.1	153.3	-71.2	-65.5	0	0	0	121.1
483	N	27.8	Very low	31	Very low	132 Å²	132	135 Å²	135	71%	0.706	77%	0.771	S	S	*	*				69.2	149.8	124.2	-78.9	5.2	0	0	0	125.2
484	T	28.1	Very low	31.1	Very low	117 Å²	117	135 Å²	135	72%	0.718	77%	0.77	S	S	*	*			trans	73.2	104	145	40.1	0	0	0	0	121.6
485	S	30.9	Very low	31.9	Very low	116 Å²	116	135.9 Å²	135.9	81%	0.811	77%	0.769	S	S	*	*				49.2	119.3	108.7	-48.5	0	0	0	0	121.3
486	A	30.7	Very low	31.8	Very low	105 Å²	105	133.3 Å²	133.3	87%	0.868	76%	0.759	S	S	*	*				-164.9	164	126.8	0	0	0	0	0	111.1
487	A	32.6	Very low	31.9	Very low	87 Å²	87	137.3 Å²	137.3	72%	0.719	77%	0.77	S	S	*	*			trans	-143.4	141.7	171.9	0	0	0	0	0	110.8
488	F	28.2	Very low	31.9	Very low	192 Å²	192	137.7 Å²	137.7	84%	0.842	78%	0.779	S	S	*	*			trans	-161	117.3	162.2	-86	-73.8	0	0	0	106.8
489	I	29.1	Very low	31.8	Very low	143 Å²	143	137 Å²	137	73%	0.733	77%	0.771	S	S	*	*				80.8	115.4	80.9	-71	-176.8	0	0	0	115.1
490	Y	33.3	Very low	32.7	Very low	215 Å²	215	139 Å²	139	84%	0.843	77%	0.769	S	S	*	*			trans	7.2	147.2	147.9	-78.9	-72.6	0	0	0	121.4
491	P	54.2	Low	32.6	Very low	119 Å²	119	134.2 Å²	134.2	77%	0.773	76%	0.757	S	S	*	*				-156.1	140.4	75.8	39.4	-18.1	0	0	0	121.4
492	N	32.3	Very low	32.8	Very low	142 Å²	142	139.8 Å²	139.8	76%	0.759	77%	0.767	S	S	*	*				60.3	158.3	118.1	-148.7	11.8	0	0	0	124.6
493	I	32.7	Very low	32.8	Very low	151 Å²	151	135.3 Å²	135.3	77%	0.774	76%	0.758	S	S	*	*			trans	98.3	141	160.7	-55.6	177.2	0	0	0	119.1
494	L	31.9	Very low	32.9	Very low	155 Å²	155	136.8 Å²	136.8	81%	0.812	77%	0.765	S	S	*	*			trans	-122.8	167.9	-176.8	-153.7	84.5	0	0	0	109.7
495	P	48.3	Very low	32.9	Very low	105 Å²	105	134.9 Å²	134.9	68%	0.682	76%	0.761	S	S	*	*				-162.1	-178.6	91.9	39.1	-16.3	0	0	0	119.6
496	T	28.5	Very low	32.8	Very low	112 Å²	112	136.2 Å²	136.2	69%	0.687	76%	0.764	S	S	*	*			trans	88.9	117.1	145.8	23.2	0	0	0	0	125
497	N	29.8	Very low	33	Very low	156 Å²	156	138.4 Å²	138.4	83%	0.834	76%	0.761	S	S	*	*			trans	38.9	139.4	136.8	-60.4	2.5	0	0	0	121.6
498	A	28.8	Very low	33.2	Very low	102 Å²	102	140.6 Å²	140.6	84%	0.843	77%	0.767	S	S	*	*				-163.5	176.9	53.1	0	0	0	0	0	115.4
499	E	26.8	Very low	33.3	Very low	150 Å²	150	135.2 Å²	135.2	70%	0.701	76%	0.759	S	S	*	*			trans	-123.6	159.2	-174.6	-103.7	-83.7	165	0	0	110.3	E501	E499-E501 PolarHBondContact OE2-N 2.75Å
500	P	45.9	Very low	33.4	Very low	123 Å²	123	136.7 Å²	136.7	80%	0.799	77%	0.768	S	S	*	*				-153	167.4	91.6	39.9	-20.4	0	0	0	118.8
501	E	28.1	Very low	33.1	Very low	137 Å²	137	130.5 Å²	130.5	64%	0.64	77%	0.769	S	S	*	*			trans	-88.4	-163.7	-173.7	-48.6	179.9	91.2	0	0	117.8	E499	E499-E501 PolarHBondContact OE2-N 2.75Å
502	Y	32.1	Very low	32	Very low	198 Å²	198	130.2 Å²	130.2	78%	0.776	77%	0.77	S	S	*	*			trans	93.7	139	160.6	-54.5	-70.2	0	0	0	117.2
503	S	29.5	Very low	31.7	Very low	84 Å²	84	128.6 Å²	128.6	59%	0.587	77%	0.769	S	S	*	*			cis	-168.2	148.7	-3	-121.7	0	0	0	0	113.2
504	L	28.9	Very low	31.6	Very low	164 Å²	164	128.4 Å²	128.4	86%	0.859	77%	0.769	S	S	*	*			trans	58.1	158.5	142.4	-64.8	167.9	0	0	0	120
505	A	29.3	Very low	31.3	Very low	77 Å²	77	126.6 Å²	126.6	64%	0.636	77%	0.765	S	S	*	*			cis	-167.2	151.8	-14.1	0	0	0	0	0	113.9
506	T	28.1	Very low	30.3	Very low	143 Å²	143	130.7 Å²	130.7	88%	0.877	77%	0.772	S	S	*	*			trans	68.9	143.8	141.6	-54.9	0	0	0	0	122.8
507	L	33.8	Very low	30.2	Very low	152 Å²	152	129.3 Å²	129.3	80%	0.796	77%	0.772	S	S	*	*			trans	-84.5	176.6	176	-68.4	161.9	0	0	0	113.4
508	P	38.6	Very low	30.3	Very low	132 Å²	132	130.5 Å²	130.5	86%	0.857	78%	0.778	S	S	*	*				-130.3	-179	117	38.4	-32.2	0	0	0	113.7
509	A	30.2	Very low	30.6	Very low	80 Å²	80	130.4 Å²	130.4	66%	0.661	77%	0.769	S	S	*	*			trans	-136.9	179	-164.2	0	0	0	0	0	114.3
510	N	30.1	Very low	30.7	Very low	174 Å²	174	128.4 Å²	128.4	93%	0.93	77%	0.771	S	S	*	*			trans	76.7	133.7	162.6	-60.1	-22.4	0	0	0	119.3
511	G	28	Very low	30.2	Very low	84 Å²	84	129.7 Å²	129.7	87%	0.866	77%	0.77	S	S	*	*			trans	170.7	121.3	168.7	0	0	0	0	0	110.8
512	S	30	Very low	31.4	Very low	113 Å²	113	128.9 Å²	128.9	79%	0.79	78%	0.777	S	S	*	*			trans	-135.6	133.7	-175.2	177.1	0	0	0	0	111.3
513	C	27.2	Very low	31.5	Very low	109 Å²	109	126.6 Å²	126.6	74%	0.736	77%	0.773	S	S	*	*			trans	154.5	117.4	135.2	-87.4	0	0	0	0	114.3
514	N	29.6	Very low	31.8	Very low	146 Å²	146	128.3 Å²	128.3	78%	0.781	77%	0.772	S	S	*	*				38.7	125.4	129.9	-62.9	-10.8	0	0	0	122.8
515	T	26.1	Very low	32	Very low	118 Å²	118	127.7 Å²	127.7	72%	0.724	77%	0.768	S	S	*	*			trans	94.1	145.4	139.8	-5.2	0	0	0	0	121.5
516	F	27.5	Very low	32.2	Very low	191 Å²	191	131.3 Å²	131.3	84%	0.838	77%	0.769	S	S	*	*			trans	79.6	121.5	157.1	-75.4	-66.1	0	0	0	122.2
517	A	27	Very low	32.3	Very low	83 Å²	83	130.5 Å²	130.5	69%	0.686	77%	0.765	S	S	*	*			trans	61.5	118.9	133.2	0	0	0	0	0	121.9
518	L	30.6	Very low	32	Very low	181 Å²	181	130.5 Å²	130.5	95%	0.948	77%	0.765	S	S	*	*			trans	-99.1	124.6	142.1	-84	167	0	0	0	108.9
519	P	35.7	Very low	31.4	Very low	100 Å²	100	128 Å²	128	65%	0.649	75%	0.75	S	S	*	*			trans	-111.4	157.5	179.1	38.7	-32.1	0	0	0	114.7
520	S	29.1	Very low	31.4	Very low	107 Å²	107	133.5 Å²	133.5	75%	0.748	76%	0.76	S	S	*	*			trans	48.1	123.1	151.5	53.5	0	0	0	0	119.9
521	L	35.1	Very low	32.2	Very low	150 Å²	150	131.4 Å²	131.4	79%	0.785	76%	0.755	S	S	*	*			cis	67.6	131.7	36.8	-152.2	99.1	0	0	0	115.8
522	P	52.5	Low	32.3	Very low	120 Å²	120	134.7 Å²	134.7	78%	0.779	75%	0.753	S	S	*	*				-137.5	156.7	117.9	18.2	3	0	0	0	113.8
523	Q	35.5	Very low	32.3	Very low	150 Å²	150	135.2 Å²	135.2	70%	0.701	75%	0.751	S	S	*	*			cis	-160.4	-42.8	-14.2	-147.2	-161.3	50.4	0	0	116.7
524	Q	34.5	Very low	32.5	Very low	120 Å²	120	135.4 Å²	135.4	56%	0.561	75%	0.754	S	S	*	*			trans	-157.1	175.1	-156.7	-95.7	-168.1	111.8	0	0	111.4	K526	Q524-K526 VanDerWaalsContact OE1-NZ 3.16Å
525	I	33.8	Very low	32.4	Very low	151 Å²	151	132.9 Å²	132.9	77%	0.774	75%	0.753	S	S	*	*			cis	-125.6	122.9	16.2	-99.7	137.4	0	0	0	108.2
526	K	33.8	Very low	32.6	Very low	153 Å²	153	132.8 Å²	132.8	67%	0.665	76%	0.757	S	S	*	*				52.4	135.9	93.6	-75.1	-175	177.9	169.3	0	115.6	Q524	Q524-K526 VanDerWaalsContact OE1-NZ 3.16Å
527	T	29	Very low	32.6	Very low	127 Å²	127	128.3 Å²	128.3	78%	0.779	76%	0.755	S	S	*	*			cis	-166.6	179.8	-1	11.7	0	0	0	0	107.5
528	L	27.2	Very low	32.8	Very low	152 Å²	152	128.6 Å²	128.6	80%	0.796	76%	0.758	S	S	*	*			cis	-141.9	-136.7	13.1	-141.6	176	0	0	0	111
529	S	27.5	Very low	32.6	Very low	79 Å²	79	127.4 Å²	127.4	55%	0.552	75%	0.752	S	S	*	*			trans	-164.5	162.3	-164.8	-51	0	0	0	0	117.4
530	F	28.9	Very low	32.2	Very low	196 Å²	196	129.6 Å²	129.6	86%	0.86	76%	0.758	S	S	*	*			trans	73.8	164.9	157.2	-56.6	-56.8	0	0	0	119.8
531	P	48.6	Very low	32.6	Very low	130 Å²	130	133.7 Å²	133.7	84%	0.844	76%	0.763	S	S	*	*			cis	-129.5	-166.8	-1.6	24.5	1.4	0	0	0	116.9
532	N	29.6	Very low	33.4	Very low	153 Å²	153	131.8 Å²	131.8	82%	0.818	76%	0.759	S	S	*	*			trans	-82	-177.7	-171.8	-177	29.9	0	0	0	116.4
533	V	29.9	Very low	32.2	Very low	124 Å²	124	132.4 Å²	132.4	75%	0.752	76%	0.756	S	S	*	*			trans	108.5	150.4	159	-172.1	0	0	0	0	117.1
534	S	30.4	Very low	32.1	Very low	112 Å²	112	131.8 Å²	131.8	78%	0.783	76%	0.757	S	S	*	*			trans	-93.9	158.7	-160	-33.5	0	0	0	0	116.2
535	A	28.5	Very low	31.9	Very low	94 Å²	94	131.4 Å²	131.4	78%	0.777	76%	0.763	S	S	*	*				150.2	145.7	126.3	0	0	0	0	0	116.2
536	S	29.1	Very low	32.1	Very low	116 Å²	116	132.3 Å²	132.3	81%	0.811	76%	0.763	S	S	*	*			trans	38.2	119.9	142.3	-55	0	0	0	0	124.6
537	A	28.6	Very low	32	Very low	96 Å²	96	133.2 Å²	133.2	79%	0.793	77%	0.77	S	S	*	*				74.9	121.1	123.6	0	0	0	0	0	124.2
538	A	30.1	Very low	32.1	Very low	90 Å²	90	131.3 Å²	131.3	74%	0.744	77%	0.767	S	S	*	*			trans	81	165.8	136.1	0	0	0	0	0	121.8
539	L	28.1	Very low	32.3	Very low	155 Å²	155	132.9 Å²	132.9	81%	0.812	77%	0.77	S	S	*	*			trans	78.1	142	173.7	-51.5	-179.4	0	0	0	117.2
540	N	27	Very low	32.4	Very low	147 Å²	147	138.8 Å²	138.8	79%	0.786	79%	0.786	S	S	*	*			cis	-161.4	169.6	-28.9	-132.1	-0.3	0	0	0	111.9
541	F	37.1	Very low	32.5	Very low	193 Å²	193	133.8 Å²	133.8	85%	0.846	78%	0.781	S	S	*	*			trans	-77.9	166.8	173.3	-80.4	-90.6	0	0	0	114.3
542	P	50.7	Low	31.7	Very low	110 Å²	110	133.3 Å²	133.3	71%	0.714	78%	0.781	S	S	*	*				-136.7	176.7	116.5	43	-32.6	0	0	0	112.4
543	N	29	Very low	31.8	Very low	132 Å²	132	130.4 Å²	130.4	71%	0.706	78%	0.778	S	S	*	*			cis	-161	155.8	13.9	-142.9	-4.1	0	0	0	114.4
544	L	33.2	Very low	32.4	Very low	137 Å²	137	130.5 Å²	130.5	72%	0.717	78%	0.781	S	S	*	*			trans	60.9	149.2	153.7	-69.6	158.2	0	0	0	119.9
545	T	29.7	Very low	32.2	Very low	112 Å²	112	131.6 Å²	131.6	69%	0.687	79%	0.787	S	S	*	*			cis	-143.6	141.3	5.1	44.5	0	0	0	0	113.5
546	H	38.1	Very low	32.3	Very low	170 Å²	170	138.2 Å²	138.2	79%	0.787	79%	0.792	S	S	*	*			trans	48.5	154.6	142.8	-70.6	-98.4	0	0	0	121.9
547	Q	31.1	Very low	32.7	Very low	173 Å²	173	138.4 Å²	138.4	81%	0.808	79%	0.791	S	S	*	*			cis	-158.4	150.7	18.2	-153.9	171.8	-9.5	0	0	113.5
548	A	31.6	Very low	32.8	Very low	86 Å²	86	142.3 Å²	142.3	71%	0.711	79%	0.793	S	S	*	*			trans	64.3	155.1	158.7	0	0	0	0	0	119.7
549	Q	32.5	Very low	32.9	Very low	186 Å²	186	144.5 Å²	144.5	87%	0.869	80%	0.797	S	S	*	*			cis	-154.6	-178.4	-20.1	-114.9	175.3	-9.1	0	0	110.8
550	F	29.2	Very low	33	Very low	203 Å²	203	142.9 Å²	142.9	89%	0.89	79%	0.793	S	S	*	*			trans	-81.4	151.7	-166	-63.3	-101.9	0	0	0	117
551	A	30.8	Very low	33.6	Very low	91 Å²	91	143.1 Å²	143.1	75%	0.752	79%	0.793	S	S	*	*				177.4	139.5	117.7	0	0	0	0	0	116
552	S	30.6	Very low	33.3	Very low	120 Å²	120	143 Å²	143	84%	0.839	80%	0.795	S	S	*	*			trans	28.3	132.9	152.2	57.7	0	0	0	0	124.2
553	A	32	Very low	32.3	Very low	92 Å²	92	148 Å²	148	76%	0.76	80%	0.8	S	S	*	*			trans	-115	-168	160.9	0	0	0	0	0	109.7
554	P	43.3	Very low	32.4	Very low	125 Å²	125	149.8 Å²	149.8	81%	0.812	80%	0.804	S	S	*	*			cis	-131.2	-179	-10	42.9	-27.4	0	0	0	114.2
555	C	25.3	Very low	32.3	Very low	135 Å²	135	146.6 Å²	146.6	91%	0.912	80%	0.797	S	S	*	*			trans	-154.1	159.1	158.3	-141.2	0	0	0	0	114
556	R	30.3	Very low	32.4	Very low	233 Å²	233	151.1 Å²	151.1	88%	0.879	81%	0.808	S	S	*	*			trans	-100.8	156.8	-175.4	-92.6	179.3	159.6	-168.3	-6.4	112.9
557	P	39.5	Very low	32.3	Very low	121 Å²	121	149.7 Å²	149.7	79%	0.786	81%	0.805	S	S	*	*			trans	-107.5	118.2	162.9	35.2	-24.7	0	0	0	112.9
558	E	30	Very low	32.5	Very low	178 Å²	178	147.5 Å²	147.5	83%	0.832	81%	0.805	S	S	*	*			trans	-167.3	-178.2	156.1	-130.9	-167.9	130.9	0	0	112.4
559	V	31.8	Very low	32.6	Very low	136 Å²	136	152 Å²	152	82%	0.824	81%	0.811	S	S	*	*			trans	94.9	121.5	-179.1	-178.3	0	0	0	0	114.9
560	V	29.5	Very low	33.3	Very low	121 Å²	121	148.4 Å²	148.4	73%	0.733	81%	0.805	S	S	*	*			cis	-159.9	157.4	-27.1	106.9	0	0	0	0	109.7
561	L	40.9	Very low	33.3	Very low	152 Å²	152	145.9 Å²	145.9	80%	0.796	81%	0.806	S	S	*	*			trans	-77.9	153.1	175.7	-82.7	152.3	0	0	0	113.5
562	H	30.5	Very low	33.4	Very low	190 Å²	190	146.9 Å²	146.9	88%	0.88	81%	0.807	S	S	*	*			trans	-146.9	169.5	140.2	-112.5	65.3	0	0	0	111.9
563	R	30	Very low	33.7	Very low	215 Å²	215	147.7 Å²	147.7	81%	0.811	81%	0.807	S	S	*	*			trans	-146.8	171	-153.3	-168.7	-175	-179.3	-150.1	2.6	111.5
564	Q	30.9	Very low	34.4	Very low	169 Å²	169	148.8 Å²	148.8	79%	0.79	81%	0.807	S	S	*	*			trans	97.7	146.2	160.8	-62	-177.3	-28.4	0	0	117.1
565	A	31.3	Very low	34.6	Very low	71 Å²	71	148.6 Å²	148.6	59%	0.587	81%	0.805	S	S	*	*			cis	-170.2	178	-18.3	0	0	0	0	0	113.2
566	F	30.4	Very low	35.4	Very low	207 Å²	207	147.9 Å²	147.9	91%	0.908	80%	0.799	S	S	*	*			trans	93.2	156.1	154.3	-71.1	-69.4	0	0	0	121.5
567	I	36	Very low	35.9	Very low	140 Å²	140	141.6 Å²	141.6	72%	0.718	80%	0.797	S	S	*	*			trans	-140.1	148.7	-162.3	-60.8	162.7	0	0	0	107.4	Q569	I567-Q569 HydrophobicContact CG2-CG 4.48Å
568	P	35.5	Very low	35.8	Very low	127 Å²	127	142.8 Å²	142.8	83%	0.825	80%	0.796	S	S	*	*			trans	-120.5	157.7	137	-2.5	23.6	0	0	0	113.1
569	Q	35.1	Very low	36.2	Very low	179 Å²	179	144.1 Å²	144.1	84%	0.836	80%	0.795	S	S	*	*			trans	-98.5	-147.1	170.9	-62.8	-171	-35.5	0	0	111.1	I567	I567-Q569 HydrophobicContact CG2-CG 4.48Å
570	P	46.4	Very low	36.8	Very low	112 Å²	112	142.8 Å²	142.8	73%	0.727	79%	0.789	S	S	*	*				-123.7	156.5	-117.8	36.7	-17.2	0	0	0	115.1
571	T	28.6	Very low	37	Very low	150 Å²	150	141.8 Å²	141.8	92%	0.92	79%	0.793	S	S	*	*			trans	-139.5	153.8	168.3	46.3	0	0	0	0	112.6
572	S	33.3	Very low	36.8	Very low	111 Å²	111	143.8 Å²	143.8	78%	0.776	80%	0.796	S	S	*	*			trans	-99.5	133.5	-169.4	54	0	0	0	0	113.8
573	T	36.7	Very low	37.4	Very low	137 Å²	137	140 Å²	140	84%	0.84	79%	0.789	S	S	*	*			trans	-161.6	129.6	152.9	24.2	0	0	0	0	111.2
574	P	47.7	Very low	37.7	Very low	115 Å²	115	135.3 Å²	135.3	75%	0.747	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-82.4	158.5	161.2	34.8	-33	0	0	0	111.4
575	P	46.9	Very low	37.8	Very low	121 Å²	121	137.6 Å²	137.6	79%	0.786	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.9	155.5	175.7	30.6	-35.3	0	0	0	112.6
576	P	42.3	Very low	38.3	Very low	121 Å²	121	139.6 Å²	139.6	79%	0.786	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-79.4	138.3	-172	31.2	-35.5	0	0	0	113.6
577	A	40.1	Very low	38.5	Very low	101 Å²	101	138.4 Å²	138.4	84%	0.835	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-94.6	132.5	165.3	0	0	0	0	0	110.3
578	L	36.9	Very low	38.4	Very low	145 Å²	145	143.6 Å²	143.6	76%	0.759	81%	0.811	S	S	*	*			trans	-102.6	94.2	-176.7	-75.6	170.6	0	0	0	112.4
579	Y	38.5	Very low	38.6	Very low	206 Å²	206	145.8 Å²	145.8	81%	0.808	82%	0.815	S	S	*	*			trans	65.8	160.9	156.7	-63.6	-81	0	0	0	119.7
580	P	44.6	Very low	38.2	Very low	109 Å²	109	145.9 Å²	145.9	71%	0.708	82%	0.815	S	S	*	*			cis	-120.1	168.7	-28.2	31.5	-14.8	0	0	0	112.7
581	A	34.6	Very low	37.5	Very low	99 Å²	99	147.6 Å²	147.6	82%	0.818	81%	0.813	S	S	*	*			trans	-95.2	151.6	179.1	0	0	0	0	0	113.2
582	F	36.2	Very low	37.5	Very low	195 Å²	195	146.8 Å²	146.8	86%	0.855	80%	0.804	S	S	*	*			trans	-109.3	142.2	166.6	-80.9	-87.9	0	0	0	110.7
583	P	44.4	Very low	38.2	Very low	111 Å²	111	147.3 Å²	147.3	72%	0.721	80%	0.804	S	S	*	*			trans	-80.9	136.7	-173.4	31.6	-34.9	0	0	0	113.1
584	S	35.3	Very low	38	Very low	116 Å²	116	149.3 Å²	149.3	81%	0.811	80%	0.804	S	S	*	*			trans	-85.9	139.4	170.8	50.6	0	0	0	0	111.7
585	Y	33.1	Very low	37.2	Very low	216 Å²	216	149.7 Å²	149.7	85%	0.847	81%	0.809	S	S	*	*			trans	-120.7	151.7	166.6	-98.6	-100.2	0	0	0	110.5
586	P	42.1	Very low	36.4	Very low	114 Å²	114	147.7 Å²	147.7	74%	0.74	80%	0.803	S	S	*	*			trans	-92	156.9	-160.2	35.7	-35.9	0	0	0	114.4
587	L	35.3	Very low	35.9	Very low	181 Å²	181	150.1 Å²	150.1	95%	0.948	81%	0.808	S	S	*	*			trans	-68.3	139.6	167.6	-69.5	167.8	0	0	0	111.2
588	R	32.5	Very low	35.4	Very low	249 Å²	249	150.8 Å²	150.8	94%	0.94	81%	0.807	S	S	*	*			trans	-136.6	132.7	165.2	-121.1	-178.4	-178.1	177.3	0.7	110
589	L	39.6	Very low	35.1	Very low	173 Å²	173	147.9 Å²	147.9	91%	0.906	80%	0.803	S	S	*	*			trans	-81.6	142.1	171.2	-84.3	153.2	0	0	0	110.3
590	H	27.9	Very low	35.6	Very low	182 Å²	182	143.9 Å²	143.9	84%	0.843	80%	0.803	S	S	*	*			trans	-150.9	161.3	153.4	-148.7	-86.3	0	0	0	110.6
591	Q	30.1	Very low	35.1	Very low	147 Å²	147	147 Å²	147	69%	0.687	81%	0.806	S	S	*	*			trans	-103.9	155.6	-169	-64.1	172.3	-109.2	0	0	114.2
592	D	30	Very low	35.2	Very low	134 Å²	134	154 Å²	154	72%	0.717	81%	0.811	S	S	*	*			trans	65.2	166.2	143.9	-61.3	-20.2	0	0	0	118.6
593	P	48.4	Very low	35.2	Very low	122 Å²	122	152.4 Å²	152.4	79%	0.792	81%	0.806	S	S	*	*			cis	-133.2	-169.1	10.9	44.1	-26.2	0	0	0	117.3
594	H	31.7	Very low	34.7	Very low	179 Å²	179	156 Å²	156	83%	0.829	82%	0.818	S	S	*	*			trans	-71.4	152.7	-177.1	-57.8	-101.4	0	0	0	116.4
595	S	30.7	Very low	34.5	Very low	122 Å²	122	160 Å²	160	85%	0.853	82%	0.817	S	S	*	*				162.4	162.3	129.8	-76.1	0	0	0	0	110.7
596	A	29.8	Very low	34.5	Very low	79 Å²	79	161.3 Å²	161.3	65%	0.653	82%	0.82	S	S	*	*			cis	179	167.6	-32.4	0	0	0	0	0	106.5
597	L	32.5	Very low	34	Very low	173 Å²	173	163 Å²	163	91%	0.906	82%	0.818	S	S	*	*			trans	69.4	149.9	173.5	-51.1	173.2	0	0	0	116
598	S	28.3	Very low	33.8	Very low	114 Å²	114	161.8 Å²	161.8	80%	0.797	81%	0.807	S	S	*	*			cis	-155.4	171.4	-26.6	-165.3	0	0	0	0	110.2
599	A	31.6	Very low	33.7	Very low	84 Å²	84	157.1 Å²	157.1	69%	0.694	80%	0.796	S	S	*	*			trans	-85.1	-174.7	-179.1	0	0	0	0	0	111.7
600	P	48.4	Very low	33.3	Very low	123 Å²	123	156.7 Å²	156.7	80%	0.799	79%	0.789	S	S	*	*			cis	-142.2	175.3	28.3	42.7	-22.2	0	0	0	119
601	F	35.8	Very low	33.4	Very low	174 Å²	174	153.8 Å²	153.8	76%	0.763	79%	0.79	S	S	*	*			trans	-64.6	159.4	167.2	-81.2	-120.3	0	0	0	113.6
602	R	34.8	Very low	33.7	Very low	247 Å²	247	155.6 Å²	155.6	93%	0.932	80%	0.798	S	S	*	*			trans	-137	126.2	136.9	-86.9	-165.5	171.1	-175.8	-2.1	111.8
603	H	37	Very low	34.6	Very low	161 Å²	161	155 Å²	155	75%	0.745	80%	0.801	S	S	*	*			trans	-76.7	152.4	158	-73.1	-94.6	0	0	0	109.8
604	L	33.8	Very low	33.9	Very low	185 Å²	185	158 Å²	158	97%	0.969	80%	0.804	S	S	*	*			trans	-141.7	150.3	142.3	-95.7	-174.6	0	0	0	111.4
605	Y	32	Very low	33.9	Very low	201 Å²	201	155.3 Å²	155.3	79%	0.788	81%	0.805	S	S	*	*			trans	-112.7	136.7	-171.1	-149.7	-89.9	0	0	0	108.6
606	R	31.8	Very low	33.9	Very low	244 Å²	244	159 Å²	159	92%	0.921	81%	0.809	S	S	*	*			trans	-157.1	140.1	150.9	-165.7	156.5	-77.5	-161.1	-4.8	112.2
607	Q	31.3	Very low	33.9	Very low	148 Å²	148	159.1 Å²	159.1	69%	0.692	82%	0.817	S	S	*	*			trans	-130.7	175.5	175	-172.8	178.7	1.3	0	0	107.2
608	H	30.9	Very low	33.8	Very low	156 Å²	156	156 Å²	156	72%	0.722	81%	0.81	S	S	*	*			trans	96.8	140.9	-174.2	-72	-103.8	0	0	0	114.8
609	Q	31.6	Very low	34	Very low	152 Å²	152	160.8 Å²	160.8	71%	0.71	81%	0.812	S	S	*	*			cis	-159.2	-174	-24.3	-139.7	172.3	-5.5	0	0	110.3
610	Q	31.9	Very low	34.2	Very low	163 Å²	163	164.9 Å²	164.9	76%	0.762	82%	0.821	S	S	*	*			trans	-68.4	150.4	-175.5	-59.5	137.4	-64.9	0	0	114.3
611	S	29.4	Very low	33.3	Very low	122 Å²	122	164 Å²	164	85%	0.853	82%	0.818	S	S	*	*			trans	-175	149	130.5	35.6	0	0	0	0	113.8
612	H	35.7	Very low	33.6	Very low	185 Å²	185	162.5 Å²	162.5	86%	0.856	82%	0.823	S	S	*	*			trans	-131.5	153.8	165.5	-103.3	-36.6	0	0	0	105.5
613	P	49.8	Very low	33.5	Very low	121 Å²	121	162 Å²	162	79%	0.786	82%	0.821	S	S	*	*				-150.2	-159.7	70.8	40.6	-18.9	0	0	0	115.6
614	H	33	Very low	33.6	Very low	186 Å²	186	158.4 Å²	158.4	86%	0.861	82%	0.82	S	S	*	*			trans	-63.2	156.9	-173	-62.4	-19.1	0	0	0	117.3
615	S	31.7	Very low	33.8	Very low	121 Å²	121	156.6 Å²	156.6	85%	0.846	81%	0.81	S	S	*	*				-151.5	174.9	123.4	68.9	0	0	0	0	111.1
616	Q	31.6	Very low	34	Very low	201 Å²	201	160.3 Å²	160.3	94%	0.939	83%	0.831	S	S	*	*			trans	-95	154.9	-176.6	-62.4	174	-9	0	0	112
617	G	29.9	Very low	34.2	Very low	80 Å²	80	156.1 Å²	156.1	83%	0.825	83%	0.826	S	S	*	*			trans	-162.4	120.2	172.7	0	0	0	0	0	112.5
618	S	30.7	Very low	34.3	Very low	108 Å²	108	156.5 Å²	156.5	76%	0.755	83%	0.833	S	S	*	*			trans	-97.9	149.6	-172.8	-108.9	0	0	0	0	113.2
619	Y	31.6	Very low	34.5	Very low	215 Å²	215	156.6 Å²	156.6	84%	0.843	84%	0.839	S	S	*	*			trans	43.5	126.8	156	-75.8	-99.4	0	0	0	120.3
620	I	35.7	Very low	34.7	Very low	169 Å²	169	156.8 Å²	156.8	87%	0.867	85%	0.847	S	S	*	*				-150.7	149.9	123.5	-106.6	156.7	0	0	0	109
621	S	29.5	Very low	34.8	Very low	105 Å²	105	156.4 Å²	156.4	73%	0.734	85%	0.852	S	S	*	*			trans	-104.4	139.1	-178.7	179.5	0	0	0	0	111.1
622	T	41	Very low	35.2	Very low	142 Å²	142	158.7 Å²	158.7	87%	0.871	85%	0.852	S	S	*	*			trans	-135.8	140.1	162	36.6	0	0	0	0	109.8
623	R	34.6	Very low	35.2	Very low	236 Å²	236	156.9 Å²	156.9	89%	0.891	85%	0.852	S	S	*	*			trans	-141.4	136.2	-171.8	179.4	-173.9	-177.4	-168.5	1.6	109.2
624	A	37.5	Very low	34.1	Very low	87 Å²	87	159.6 Å²	159.6	72%	0.719	86%	0.857	S	S	*	*			trans	65.9	153.6	-178	0	0	0	0	0	113.3
625	L	38.1	Very low	34.1	Very low	146 Å²	146	157.4 Å²	157.4	76%	0.764	86%	0.857	S	S	*	*			cis	-135.9	157.1	27.7	-75.4	155.6	0	0	0	113.6
626	F	37.7	Very low	34.4	Very low	279 Å²	279	160.7 Å²	160.7	100%	1.224	86%	0.857	S	S	*	*			trans	70.9	0	177.9	-59.6	-75.7	0	0	0	116.4

Retrieved 626 of 626 residues in 73.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).