A0A3Q0KIT8_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession A0A3Q0KIT8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 384 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	35.6	Very low	242 Å²	242	156.5 Å²	156.5	100%	1.192	83%	0.832	S	S	*	*				0	93	0	-62.1	-179.1	-166.7	0	0	106.1
2	S	35.7	Very low	35.8	Very low	111 Å²	111	152 Å²	152	78%	0.776	82%	0.819	S	S	*	*				66.8	121.2	96.6	173.6	0	0	0	0	110.9
3	C	35.6	Very low	35.4	Very low	119 Å²	119	153.6 Å²	153.6	80%	0.804	83%	0.825	S	S	*	*			cis	-164.1	146.1	11.9	-107	0	0	0	0	110.3
4	R	32.9	Very low	35.5	Very low	231 Å²	231	148.4 Å²	148.4	87%	0.872	83%	0.825	S	S	*	*			trans	-91.5	157.9	154.9	-113.7	-176.1	-178.8	-176.5	0.1	108.2
5	P	41.5	Very low	35.2	Very low	128 Å²	128	150.8 Å²	150.8	83%	0.831	83%	0.828	S	S	*	*			trans	-114.4	149.9	148.4	7.6	13.4	0	0	0	112.6
6	Q	35.8	Very low	35.2	Very low	157 Å²	157	152.8 Å²	152.8	73%	0.734	84%	0.836	S	S	*	*			trans	-116.2	154	-174.8	-106.2	-175.5	-3.1	0	0	110.3
7	L	33.8	Very low	35.1	Very low	144 Å²	144	154.8 Å²	154.8	75%	0.754	83%	0.834	S	S	*	*			trans	67.5	149	147.2	-61	157.6	0	0	0	116.2
8	I	37.2	Very low	34.9	Very low	162 Å²	162	151.6 Å²	151.6	83%	0.831	83%	0.826	S	S	*	*				-164.3	145.2	52.7	-70.3	158.9	0	0	0	108.2
9	G	31.1	Very low	34.9	Very low	61 Å²	61	152.2 Å²	152.2	63%	0.629	83%	0.828	S	S	*	*			trans	-95.1	176.3	176.1	0	0	0	0	0	115.9
10	R	34	Very low	34.7	Very low	257 Å²	257	148.3 Å²	148.3	97%	0.97	83%	0.825	S	S	*	*			trans	170.8	139.5	137.9	-95.6	178.1	-179.3	-159.9	1.4	111.5
11	S	32.7	Very low	34.6	Very low	109 Å²	109	148.9 Å²	148.9	76%	0.762	83%	0.826	S	S	*	*			trans	-89.1	-167.1	178.6	49.5	0	0	0	0	112.8
12	P	38.6	Very low	33.9	Very low	103 Å²	103	144.7 Å²	144.7	67%	0.669	81%	0.808	S	S	*	*				-131.8	-179.1	-55.1	34.9	-16.2	0	0	0	113.9
13	L	30.6	Very low	33.7	Very low	173 Å²	173	145.7 Å²	145.7	91%	0.906	81%	0.809	S	S	*	*			trans	65.7	113.8	154.5	-79.4	147.8	0	0	0	120.2
14	G	36.4	Very low	33.3	Very low	80 Å²	80	145.8 Å²	145.8	83%	0.825	81%	0.811	S	S	*	*			trans	-152.7	118.2	162.4	0	0	0	0	0	111
15	Q	31	Very low	33.1	Very low	185 Å²	185	137.9 Å²	137.9	86%	0.864	80%	0.802	S	S	*	*			trans	-67	147.5	179.5	-63.9	173.8	-16.3	0	0	112.4
16	L	35.3	Very low	32.4	Very low	182 Å²	182	137.3 Å²	137.3	95%	0.953	80%	0.8	S	S	*	*			trans	-149.3	133.9	152.1	-102	156.2	0	0	0	110.4
17	K	33.5	Very low	32	Very low	187 Å²	187	138.6 Å²	138.6	81%	0.813	80%	0.803	S	S	*	*			trans	-82.8	154.6	-168.4	-77.1	176.1	170.8	178	0	113.7
18	S	31.6	Very low	31.7	Very low	97 Å²	97	141.9 Å²	141.9	68%	0.678	81%	0.807	S	S	*	*			trans	13.4	125.1	147.9	61.4	0	0	0	0	120.1
19	D	35.8	Very low	31.7	Very low	163 Å²	163	141.5 Å²	141.5	87%	0.872	80%	0.801	S	S	*	*				-167.8	147	110.1	-85.1	-20.5	0	0	0	110.8
20	G	30.7	Very low	32.6	Very low	75 Å²	75	142.2 Å²	142.2	77%	0.773	80%	0.796	S	S	*	*			trans	-83.5	163.3	-154.1	0	0	0	0	0	117.9
21	L	31.7	Very low	33.9	Very low	161 Å²	161	133 Å²	133	84%	0.843	77%	0.771	S	S	*	*			trans	-170.4	132.1	136.5	-145.2	65.4	0	0	0	110.8
22	L	27	Very low	35.9	Very low	154 Å²	154	133.2 Å²	133.2	81%	0.806	76%	0.759	S	S	*	*			trans	-11.2	123.7	159	-63.9	138.6	0	0	0	117.4
23	T	29.9	Very low	38.2	Very low	132 Å²	132	128.4 Å²	128.4	81%	0.81	73%	0.729	S	S	*	*			trans	-174.5	123.1	131	44.7	0	0	0	0	111.7
24	S	27.6	Very low	41	Very low	120 Å²	120	125.1 Å²	125.1	84%	0.839	71%	0.707	S	S	*	*			trans	-0.2	122.4	150.6	53.9	0	0	0	0	118.6
25	G	29.5	Very low	43.5	Very low	65 Å²	65	121.3 Å²	121.3	67%	0.67	67%	0.668	S	S	*	*			trans	-165.1	60.9	171.9	0	0	0	0	0	113.5	K27	G25-K27 VanDerWaalsContact C-N 3.35Å; G25-K27 PolarHBondContact O-N 3.4Å
26	C	26.4	Very low	46.4	Very low	117 Å²	117	113.9 Å²	113.9	79%	0.791	64%	0.635	S	S	*	*			trans	-70.2	94.8	163.8	-157.9	0	0	0	0	107.6
27	K	27.8	Very low	49.1	Very low	184 Å²	184	105.6 Å²	105.6	80%	0.8	59%	0.591	S	S	*	*			trans	-116.7	70	176.5	-80.1	-171.1	177.7	-179	0	110.4	G25	G25-K27 VanDerWaalsContact C-N 3.35Å; G25-K27 PolarHBondContact O-N 3.4Å
28	Y	27.8	Very low	51.7	Low	213 Å²	213	99.8 Å²	99.8	84%	0.835	57%	0.573	S	S	*	*			trans	-131.4	-178.3	149.1	-71.6	-84.8	0	0	0	104.9
29	H	36.7	Very low	54.5	Low	154 Å²	154	103.7 Å²	103.7	71%	0.713	59%	0.586	S	S	*	*			trans	100.2	69.5	179.7	-49.9	68.8	0	0	0	115.3
30	S	49.9	Very low	57.3	Low	75 Å²	75	99.8 Å²	99.8	52%	0.524	57%	0.568	S	S	.	*			trans	-153.4	43.1	142.8	175.3	0	0	0	0	110
31	C	60.6	Low	60.2	Low	65 Å²	65	97.3 Å²	97.3	44%	0.439	54%	0.539	S	S	.	.			trans	-124.9	35.1	-179.5	-59.2	0	0	0	0	111.7	I117	C31-I117 WeakPolarHBondContact O-CD1 3.31Å
32	Q	76.4	Confident	63	Low	112 Å²	112	97.3 Å²	97.3	52%	0.523	53%	0.534	S	S	.	.			trans	-110.9	120.9	175.4	-70.7	-178.8	-56.4	0	0	109.2	E45 F46	Q32-E45 PolarHBondContact NE2-OE2 3.08Å; Q32-E45 VanDerWaalsContact NE2-OE2 3.1Å; Q32-F46 WeakPolarHBondContact CA-O 3.45Å
33	G	86.2	Confident	66	Low	2 Å²	2	93.2 Å²	93.2	2%	0.021	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	174.8	166.6	0	0	0	0	0	110.8	E45 F46 A116	G33-E45 WeakPolarHBondContact O-CA 3.43Å; G33-F46 VanDerWaalsContact C-CD1 3.47Å; G33-F46 PolarHBondContact N-O 2.71Å; G33-F46 WeakPolarHBondContact O-CD1 3.13Å; G33-F46 PolarHBondContact O-N 3.11Å; G33-A116 VanDerWaalsContact CA-O 3.32Å; G33-A116 WeakPolarHBondContact CA-O 3.38Å
34	K	88.7	Confident	68.9	Low	105 Å²	105	90 Å²	90	46%	0.457	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137.6	169.6	-69.7	-173.4	174.2	-167.7	0	110.4	L44 F46 G115	K34-L44 CarbonylContact C-O 3.59Å; K34-F46 WeakPolarHBondContact O-CE1 3.29Å; K34-G115 VanDerWaalsContact O-CA 3.23Å; K34-G115 WeakPolarHBondContact O-CA 3.38Å
35	L	90.5	Very high	72	Confident	0 Å²	0	89.7 Å²	89.7	0%	0	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	120.6	-178	-159.4	74.3	0	0	0	110.6	I37 C41 D43 L44 F46 M77 Y114 C126	L35-I37 HydrophobicContact CD2-CD1 3.54Å; L35-I37 HydrophobicContact CD2-CG1 4.18Å; L35-I37 HydrophobicContact CG-CD1 3.99Å; L35-I37 HydrophobicContact CG-CG1 4.06Å; L35-C41 PolarHBondContact O-SG 2.86Å; L35-C41 VanDerWaalsContact O-SG 3.42Å; L35-D43 PolarHBondContact O-N 2.65Å; L35-L44 HydrophobicContact CB-CB 4.49Å; L35-L44 PolarHBondContact N-O 2.81Å; L35-L44 PolarHBondContact O-N 2.93Å; L35-F46 HydrophobicContact CB-CD1 3.62Å; L35-F46 HydrophobicContact CB-CE1 3.96Å; L35-F46 HydrophobicContact CB-CG 4.24Å; L35-F46 HydrophobicContact CD1-CD1 4.39Å; L35-F46 HydrophobicContact CD1-CE1 4.08Å; L35-F46 HydrophobicContact CD1-CZ 4.21Å; L35-F46 HydrophobicContact CG-CD1 4.49Å; L35-M77 HydrophobicContact CD2-CE 4.27Å; L35-Y114 CarbonylContact C-O 3.56Å; L35-Y114 WeakPolarHBondContact CA-O 3.39Å; L35-Y114 VanDerWaalsContact CD1-CB 3.5Å; L35-C126 HydrophobicContact CD1-CB 4Å
36	T	91.4	Very high	75.1	Confident	29 Å²	29	86.8 Å²	86.8	18%	0.178	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	110.7	172.3	-67.2	0	0	0	0	108.3	C41 D43 Y114	T36-C41 CarbonylContact C-O 3.53Å; T36-C41 WeakPolarHBondContact CA-O 3.48Å; T36-D43 PolarHBondContact OG1-N 2.94Å; T36-Y114 PolarHBondContact N-O 3.38Å; T36-Y114 WeakPolarHBondContact O-CA 3.39Å
37	I	91.3	Very high	78.3	Confident	7 Å²	7	82.4 Å²	82.4	4%	0.036	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.1	178	-62.1	161.6	0	0	0	107.2	L35 N39 V40 C41 T73 T75 M77 Y114	L35-I37 HydrophobicContact CD2-CD1 3.54Å; L35-I37 HydrophobicContact CD2-CG1 4.18Å; L35-I37 HydrophobicContact CG-CD1 3.99Å; L35-I37 HydrophobicContact CG-CG1 4.06Å; I37-N39 PolarHBondContact O-N 3.27Å; I37-V40 HydrophobicContact CB-CB 3.91Å; I37-V40 HydrophobicContact CB-CG1 4.45Å; I37-V40 HydrophobicContact CG2-CB 3.68Å; I37-V40 HydrophobicContact CG2-CG1 4.37Å; I37-V40 HydrophobicContact CG2-CG2 3.78Å; I37-V40 PolarHBondContact O-N 3.45Å; I37-C41 PolarHBondContact N-O 2.82Å; I37-C41 PolarHBondContact O-N 2.84Å; I37-T73 HydrophobicContact CD1-CG2 4.33Å; I37-T75 HydrophobicContact CD1-CG2 3.92Å; I37-T75 HydrophobicContact CG2-CG2 4.22Å; I37-M77 HydrophobicContact CD1-CE 4.39Å; I37-Y114 HydrophobicContact CB-CD1 4.33Å; I37-Y114 HydrophobicContact CG1-CD1 3.85Å; I37-Y114 HydrophobicContact CG1-CD2 4.09Å; I37-Y114 HydrophobicContact CG1-CE1 4.31Å; I37-Y114 HydrophobicContact CG1-CG 3.72Å; I37-Y114 HydrophobicContact CG2-CD1 4.39Å; I37-Y114 HydrophobicContact CG2-CE1 4.08Å
38	P	89.1	Confident	81.4	Confident	66 Å²	66	75.2 Å²	75.2	43%	0.429	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	129.7	-179.6	-28.6	34.9	0	0	0	112.2	V40 L112	P38-V40 PolarHBondContact O-N 3.23Å; P38-V40 VanDerWaalsContact O-N 3.15Å; P38-L112 HydrophobicContact CG-CD2 4.33Å
39	N	90.4	Very high	84.5	Confident	179 Å²	179	72.2 Å²	72.2	96%	0.957	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	9.6	-179.1	-49.7	-50.3	0	0	0	116.2	I37	I37-N39 PolarHBondContact O-N 3.27Å
40	V	93.2	Very high	87.3	Confident	80 Å²	80	67 Å²	67	49%	0.485	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.6	-52.2	-177.5	178.4	0	0	0	0	111.9	I37 P38 T73	I37-V40 HydrophobicContact CB-CB 3.91Å; I37-V40 HydrophobicContact CB-CG1 4.45Å; I37-V40 HydrophobicContact CG2-CB 3.68Å; I37-V40 HydrophobicContact CG2-CG1 4.37Å; I37-V40 HydrophobicContact CG2-CG2 3.78Å; I37-V40 PolarHBondContact O-N 3.45Å; P38-V40 PolarHBondContact O-N 3.23Å; P38-V40 VanDerWaalsContact O-N 3.15Å; V40-T73 HydrophobicContact CG1-CG2 3.87Å
41	C	92.5	Very high	89.5	Confident	24 Å²	24	64 Å²	64	16%	0.162	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	154.8	177.6	69.2	0	0	0	0	111.9	L35 T36 I37 L44 T73	L35-C41 PolarHBondContact O-SG 2.86Å; L35-C41 VanDerWaalsContact O-SG 3.42Å; T36-C41 CarbonylContact C-O 3.53Å; T36-C41 WeakPolarHBondContact CA-O 3.48Å; I37-C41 PolarHBondContact N-O 2.82Å; I37-C41 PolarHBondContact O-N 2.84Å; C41-L44 HydrophobicContact CB-CB 4.06Å; C41-L44 HydrophobicContact CB-CD2 4.13Å; C41-T73 HydrophobicContact CB-CG2 4.29Å
42	Q	90.9	Very high	91.3	Very high	160 Å²	160	63.4 Å²	63.4	75%	0.748	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	128	176	-176.6	174.4	13.3	0	0	109.1	L44	Q42-L44 PolarHBondContact O-N 3.2Å; Q42-L44 VanDerWaalsContact O-N 3.1Å
43	D	88.2	Confident	92.2	Very high	69 Å²	69	62.2 Å²	62.2	37%	0.369	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	49.9	34.3	178.3	-68	-42.2	0	0	0	114.6	L35 T36 E45	L35-D43 PolarHBondContact O-N 2.65Å; T36-D43 PolarHBondContact OG1-N 2.94Å; D43-E45 PolarHBondContact O-N 3.44Å
44	L	92.4	Very high	92.6	Very high	63 Å²	63	65.8 Å²	65.8	33%	0.33	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	120.4	179.5	179.5	63.3	0	0	0	109.5	K34 L35 C41 Q42 F46 T73	K34-L44 CarbonylContact C-O 3.59Å; L35-L44 HydrophobicContact CB-CB 4.49Å; L35-L44 PolarHBondContact N-O 2.81Å; L35-L44 PolarHBondContact O-N 2.93Å; C41-L44 HydrophobicContact CB-CB 4.06Å; C41-L44 HydrophobicContact CB-CD2 4.13Å; Q42-L44 PolarHBondContact O-N 3.2Å; Q42-L44 VanDerWaalsContact O-N 3.1Å; L44-F46 PolarHBondContact O-N 3.17Å; L44-T73 HydrophobicContact CD2-CG2 3.9Å
45	E	92.7	Very high	92.8	Very high	115 Å²	115	62.3 Å²	62.3	54%	0.537	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	132.1	171.7	-66.9	-174.5	176.7	0	0	110	Q32 G33 D43	Q32-E45 PolarHBondContact NE2-OE2 3.08Å; Q32-E45 VanDerWaalsContact NE2-OE2 3.1Å; G33-E45 WeakPolarHBondContact O-CA 3.43Å; D43-E45 PolarHBondContact O-N 3.44Å
46	F	93.6	Very high	92.8	Very high	3 Å²	3	66.4 Å²	66.4	1%	0.013	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	157.4	179	80.3	-73	0	0	0	111.3	Q32 G33 K34 L35 L44 L51 I117	Q32-F46 WeakPolarHBondContact CA-O 3.45Å; G33-F46 VanDerWaalsContact C-CD1 3.47Å; G33-F46 PolarHBondContact N-O 2.71Å; G33-F46 WeakPolarHBondContact O-CD1 3.13Å; G33-F46 PolarHBondContact O-N 3.11Å; K34-F46 WeakPolarHBondContact O-CE1 3.29Å; L35-F46 HydrophobicContact CB-CD1 3.62Å; L35-F46 HydrophobicContact CB-CE1 3.96Å; L35-F46 HydrophobicContact CB-CG 4.24Å; L35-F46 HydrophobicContact CD1-CD1 4.39Å; L35-F46 HydrophobicContact CD1-CE1 4.08Å; L35-F46 HydrophobicContact CD1-CZ 4.21Å; L35-F46 HydrophobicContact CG-CD1 4.49Å; L44-F46 PolarHBondContact O-N 3.17Å; F46-L51 HydrophobicContact CE2-CD1 4.15Å; F46-I117 HydrophobicContact CE2-CB 4.34Å; F46-I117 HydrophobicContact CE2-CG2 3.9Å; F46-I117 HydrophobicContact CZ-CB 4.03Å; F46-I117 HydrophobicContact CZ-CG2 3.92Å
47	S	93.6	Very high	92.7	Very high	25 Å²	25	66.5 Å²	66.5	18%	0.175	36%	0.356	C	S	.	.			trans	-121.1	171	175.3	70.7	0	0	0	0	111	E49 D50	S47-E49 PolarHBondContact O-N 3.2Å; S47-E49 WeakPolarHBondContact OG-CB 3.48Å; S47-E49 PolarHBondContact OG-N 3.4Å; S47-D50 PolarHBondContact N-OD2 3.26Å; S47-D50 WeakPolarHBondContact O-CB 3.44Å; S47-D50 PolarHBondContact O-N 2.97Å; S47-D50 VanDerWaalsContact O-N 3.15Å; S47-D50 PolarHBondContact OG-OD2 3.34Å
48	T	93.1	Very high	92.2	Very high	34 Å²	34	66.9 Å²	66.9	21%	0.209	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-62	-26.3	170.2	46.4	0	0	0	0	112.9	D50 L51 I117 T119 W124	T48-D50 PolarHBondContact O-N 3.01Å; T48-L51 PolarHBondContact O-N 3.32Å; T48-I117 HydrophobicContact CG2-CD1 4.4Å; T48-T119 HydrophobicContact CG2-CG2 3.22Å; T48-W124 HydrophobicContact CG2-CD2 4.1Å; T48-W124 HydrophobicContact CG2-CE3 3.88Å; T48-W124 HydrophobicContact CG2-CH2 3.89Å; T48-W124 HydrophobicContact CG2-CZ2 4.08Å; T48-W124 HydrophobicContact CG2-CZ3 3.79Å
49	E	93.5	Very high	91.9	Very high	149 Å²	149	71.8 Å²	71.8	70%	0.696	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-60.4	-39.7	176.5	-63.2	-177.6	-179.8	0	0	109.1	S47 L51 R71	S47-E49 PolarHBondContact O-N 3.2Å; S47-E49 WeakPolarHBondContact OG-CB 3.48Å; S47-E49 PolarHBondContact OG-N 3.4Å; E49-L51 PolarHBondContact O-N 2.85Å; E49-L51 VanDerWaalsContact O-N 3.11Å; E49-R71 VanDerWaalsContact C-NH2 3.33Å; E49-R71 PolarHBondContact O-NH1 3.14Å; E49-R71 PolarHBondContact O-NH2 2.94Å
50	D	95.8	Very high	90.8	Very high	44 Å²	44	65.6 Å²	65.6	24%	0.235	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-67.1	-11.1	-177.2	-58.9	-60.8	0	0	0	114.8	S47 T48 R71 P72	S47-D50 PolarHBondContact N-OD2 3.26Å; S47-D50 WeakPolarHBondContact O-CB 3.44Å; S47-D50 PolarHBondContact O-N 2.97Å; S47-D50 VanDerWaalsContact O-N 3.15Å; S47-D50 PolarHBondContact OG-OD2 3.34Å; T48-D50 PolarHBondContact O-N 3.01Å; D50-R71 PolarHBondContact O-N 2.94Å; D50-P72 HydrophobicContact CB-CG 4.34Å
51	L	96.3	Very high	89.5	Confident	13 Å²	13	66.2 Å²	66.2	7%	0.068	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.2	179.8	-59.5	176.3	0	0	0	110.7	F46 T48 E49 M68 H70 M77 V79 W124	F46-L51 HydrophobicContact CE2-CD1 4.15Å; T48-L51 PolarHBondContact O-N 3.32Å; E49-L51 PolarHBondContact O-N 2.85Å; E49-L51 VanDerWaalsContact O-N 3.11Å; L51-M68 HydrophobicContact CB-SD 3.99Å; L51-M68 HydrophobicContact CD1-SD 4.14Å; L51-H70 HydrophobicContact CD2-CB 3.92Å; L51-M77 HydrophobicContact CD2-SD 3.8Å; L51-V79 HydrophobicContact CD1-CG2 4.41Å; L51-W124 HydrophobicContact CD1-CE3 3.94Å; L51-W124 HydrophobicContact CD1-CZ3 4.11Å
52	V	97.1	Very high	88.3	Confident	52 Å²	52	67.7 Å²	67.7	32%	0.315	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	118.4	170	178.3	0	0	0	0	108.2	M68 M69 R71	V52-M68 CarbonylContact O-C 3.59Å; V52-M68 WeakPolarHBondContact O-CA 3.45Å; V52-M68 WeakPolarHBondContact O-CB 3.39Å; V52-M69 PolarHBondContact N-O 2.86Å; V52-M69 PolarHBondContact O-N 3.35Å; V52-R71 VanDerWaalsContact CG2-CD 3.46Å; V52-R71 HydrophobicContact CG2-CG 3.39Å
53	D	96.1	Very high	87.6	Confident	87 Å²	87	60.9 Å²	60.9	47%	0.465	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	124.8	173.7	-168.5	-4.1	0	0	0	110.5	G55 N66 M68	D53-G55 PolarHBondContact OD1-N 3.03Å; D53-N66 PolarHBondContact OD1-ND2 3.47Å; D53-N66 PolarHBondContact OD2-ND2 3.28Å; D53-N66 VanDerWaalsContact OD2-ND2 3.13Å; D53-M68 HydrophobicContact CB-CE 4.2Å
54	E	95.1	Very high	87.5	Confident	77 Å²	77	60.2 Å²	60.2	36%	0.36	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	6	180	-59.9	179.4	109.2	0	0	112	R67	E54-R67 WeakPolarHBondContact CA-O 3.48Å; E54-R67 HydrophobicContact CB-CB 4.41Å; E54-R67 HydrophobicContact CB-CG 4.23Å; E54-R67 WeakPolarHBondContact CB-O 3.44Å; E54-R67 PolarHBondContact N-O 3.2Å; E54-R67 IonicContact OE1-CZ 3.02Å; E54-R67 IonicContact OE1-NH1 3.61Å; E54-R67 PolarHBondContact OE1-NH1 3.49Å; E54-R67 IonicContact OE1-NH2 2.81Å; E54-R67 IonicContact OE2-CZ 2.68Å; E54-R67 IonicContact OE2-NE 3.94Å; E54-R67 IonicContact OE2-NH1 3.78Å; E54-R67 PolarHBondContact OE2-NH1 3.01Å; E54-R67 IonicContact OE2-NH2 2.73Å
55	G	92.2	Very high	87.5	Confident	32 Å²	32	58.7 Å²	58.7	33%	0.33	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	123.7	158	172.1	0	0	0	0	0	115.1	D53 N66 R67	D53-G55 PolarHBondContact OD1-N 3.03Å; G55-N66 CarbonylContact O-C 3.19Å; G55-N66 VanDerWaalsContact O-CA 3.3Å; G55-N66 WeakPolarHBondContact O-CA 3.35Å; G55-R67 PolarHBondContact O-N 2.92Å
56	E	90.9	Very high	87.6	Confident	87 Å²	87	53.6 Å²	53.6	41%	0.407	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	127.4	176.8	-170.9	176.7	131.5	0	0	110.1	R59 F64 N66	E56-R59 IonicContact OE1-CZ 3.65Å; E56-R59 IonicContact OE1-NE 3.79Å; E56-R59 PolarHBondContact OE1-NE 3.48Å; E56-R59 VanDerWaalsContact OE1-NE 3.14Å; E56-R59 IonicContact OE1-NH2 2.92Å; E56-R59 IonicContact OE2-CZ 2.67Å; E56-R59 IonicContact OE2-NE 2.71Å; E56-R59 IonicContact OE2-NH2 2.88Å; E56-R59 PolarHBondContact OE2-NH2 2.8Å; E56-F64 HydrophobicContact CG-CB 4.46Å; E56-N66 PolarHBondContact N-ND2 3.24Å
57	I	89	Confident	87.7	Confident	31 Å²	31	57.5 Å²	57.5	16%	0.159	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-12.5	176.6	60.7	172.7	0	0	0	112.7	V65 R67 A78 M129 K136	I57-V65 HydrophobicContact CD1-CG1 3.79Å; I57-V65 HydrophobicContact CG1-CB 4.03Å; I57-V65 HydrophobicContact CG1-CG1 3.77Å; I57-V65 WeakPolarHBondContact CG1-O 3.36Å; I57-V65 PolarHBondContact N-O 3.38Å; I57-R67 HydrophobicContact CG2-CB 3.73Å; I57-A78 HydrophobicContact CD1-CB 4.08Å; I57-M129 HydrophobicContact CD1-CE 3.68Å; I57-M129 HydrophobicContact CD1-SD 3.77Å; I57-M129 HydrophobicContact CG2-CE 4.2Å; I57-K136 PolarHBondContact O-NZ 2.89Å
58	G	80.5	Confident	87.8	Confident	15 Å²	15	56.5 Å²	56.5	16%	0.155	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	156.6	176.3	0	0	0	0	0	112.9	F64 V65	G58-F64 CarbonylContact O-C 3.36Å; G58-F64 WeakPolarHBondContact O-CA 3.44Å; G58-V65 PolarHBondContact N-O 3.27Å; G58-V65 PolarHBondContact O-N 3.15Å
59	R	81.9	Confident	88.1	Confident	169 Å²	169	57.3 Å²	57.3	64%	0.638	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	123.3	175.3	-172.8	172.2	-74.5	-122.6	-5.3	108.9	E56	E56-R59 IonicContact OE1-CZ 3.65Å; E56-R59 IonicContact OE1-NE 3.79Å; E56-R59 PolarHBondContact OE1-NE 3.48Å; E56-R59 VanDerWaalsContact OE1-NE 3.14Å; E56-R59 IonicContact OE1-NH2 2.92Å; E56-R59 IonicContact OE2-CZ 2.67Å; E56-R59 IonicContact OE2-NE 2.71Å; E56-R59 IonicContact OE2-NH2 2.88Å; E56-R59 PolarHBondContact OE2-NH2 2.8Å
60	G	68.7	Low	88.3	Confident	48 Å²	48	50.2 Å²	50.2	50%	0.495	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	178.6	172.4	0	0	0	0	0	111.3	Y62 G63	G60-Y62 PolarHBondContact O-N 2.83Å; G60-Y62 VanDerWaalsContact O-N 3.17Å; G60-G63 PolarHBondContact N-O 3.46Å; G60-G63 VanDerWaalsContact O-O 3.11Å
61	A	64.6	Low	88.3	Confident	94 Å²	94	53 Å²	53	78%	0.777	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.9	178	0	0	0	0	0	113.9
62	Y	67.3	Low	88.3	Confident	55 Å²	55	56 Å²	56	22%	0.216	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	1.4	-169.7	-52.5	-78.3	0	0	0	114.1	G60 V204 I207 A208 A213	G60-Y62 PolarHBondContact O-N 2.83Å; G60-Y62 VanDerWaalsContact O-N 3.17Å; Y62-V204 HydrophobicContact CD1-CG1 3.98Å; Y62-V204 HydrophobicContact CD2-CB 4.19Å; Y62-V204 HydrophobicContact CD2-CG1 3.3Å; Y62-V204 HydrophobicContact CD2-CG2 3.87Å; Y62-V204 HydrophobicContact CE1-CG1 3.88Å; Y62-V204 HydrophobicContact CE2-CB 4.47Å; Y62-V204 HydrophobicContact CE2-CG1 3.18Å; Y62-V204 HydrophobicContact CG-CB 4.3Å; Y62-V204 HydrophobicContact CG-CG1 3.7Å; Y62-V204 HydrophobicContact CG-CG2 3.96Å; Y62-V204 VanDerWaalsContact CZ-CG1 3.48Å; Y62-I207 HydrophobicContact CD1-CG2 4.3Å; Y62-A208 HydrophobicContact CE1-CB 3.98Å; Y62-A213 HydrophobicContact CE1-CB 4.5Å
63	G	77.1	Confident	88.3	Confident	17 Å²	17	55 Å²	55	18%	0.175	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.9	178.9	-171	0	0	0	0	0	113.2	G60 R81	G60-G63 PolarHBondContact N-O 3.46Å; G60-G63 VanDerWaalsContact O-O 3.11Å; G63-R81 WeakPolarHBondContact CA-O 3.21Å
64	F	87	Confident	88.3	Confident	54 Å²	54	57.6 Å²	57.6	24%	0.237	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	157.4	175.8	55.1	-80.1	0	0	0	109.4	E56 G58 N66 R81	E56-F64 HydrophobicContact CG-CB 4.46Å; G58-F64 CarbonylContact O-C 3.36Å; G58-F64 WeakPolarHBondContact O-CA 3.44Å; F64-N66 WeakPolarHBondContact CD2-OD1 3.25Å; F64-N66 WeakPolarHBondContact CE2-OD1 3.47Å; F64-R81 HydrophobicContact CE1-CB 4.25Å; F64-R81 HydrophobicContact CE2-CB 4.38Å; F64-R81 VanDerWaalsContact CE2-CD 3.45Å; F64-R81 HydrophobicContact CE2-CG 4.34Å; F64-R81 HydrophobicContact CZ-CB 4.16Å; F64-R81 HydrophobicContact CZ-CG 4.41Å; F64-R81 VanDerWaalsContact CZ-CZ 3.45Å; F64-R81 VanDerWaalsContact CZ-NE 3.34Å; F64-R81 PolarHBondContact O-N 3.17Å
65	V	91.9	Very high	88.4	Confident	31 Å²	31	55 Å²	55	19%	0.188	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124.4	-179.5	-171.1	0	0	0	0	107.1	I57 G58 A78 V79 K80	I57-V65 HydrophobicContact CD1-CG1 3.79Å; I57-V65 HydrophobicContact CG1-CB 4.03Å; I57-V65 HydrophobicContact CG1-CG1 3.77Å; I57-V65 WeakPolarHBondContact CG1-O 3.36Å; I57-V65 PolarHBondContact N-O 3.38Å; G58-V65 PolarHBondContact N-O 3.27Å; G58-V65 PolarHBondContact O-N 3.15Å; V65-A78 HydrophobicContact CG1-CB 4.02Å; V65-V79 WeakPolarHBondContact CA-O 3.5Å; V65-K80 HydrophobicContact CG2-CB 4.14Å; V65-K80 HydrophobicContact CG2-CD 4.48Å; V65-K80 HydrophobicContact CG2-CG 4.05Å
66	N	93.9	Very high	88.6	Confident	8 Å²	8	55.6 Å²	55.6	4%	0.043	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	147.5	174.8	-69.9	87.5	0	0	0	110.3	D53 G55 E56 F64 M68 A78 V79	D53-N66 PolarHBondContact OD1-ND2 3.47Å; D53-N66 PolarHBondContact OD2-ND2 3.28Å; D53-N66 VanDerWaalsContact OD2-ND2 3.13Å; G55-N66 CarbonylContact O-C 3.19Å; G55-N66 VanDerWaalsContact O-CA 3.3Å; G55-N66 WeakPolarHBondContact O-CA 3.35Å; E56-N66 PolarHBondContact N-ND2 3.24Å; F64-N66 WeakPolarHBondContact CD2-OD1 3.25Å; F64-N66 WeakPolarHBondContact CE2-OD1 3.47Å; N66-M68 HydrophobicContact CB-CE 3.55Å; N66-M68 HydrophobicContact CB-CG 3.88Å; N66-A78 WeakPolarHBondContact O-CA 3.45Å; N66-V79 PolarHBondContact N-O 3.28Å; N66-V79 PolarHBondContact O-N 3.06Å
67	R	95.7	Very high	88.8	Confident	86 Å²	86	51.4 Å²	51.4	33%	0.325	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	125.6	158	-177.5	176.4	-178.3	-87.8	-11.8	107.2	E54 G55 I57 V76 M129	E54-R67 WeakPolarHBondContact CA-O 3.48Å; E54-R67 HydrophobicContact CB-CB 4.41Å; E54-R67 HydrophobicContact CB-CG 4.23Å; E54-R67 WeakPolarHBondContact CB-O 3.44Å; E54-R67 PolarHBondContact N-O 3.2Å; E54-R67 IonicContact OE1-CZ 3.02Å; E54-R67 IonicContact OE1-NH1 3.61Å; E54-R67 PolarHBondContact OE1-NH1 3.49Å; E54-R67 IonicContact OE1-NH2 2.81Å; E54-R67 IonicContact OE2-CZ 2.68Å; E54-R67 IonicContact OE2-NE 3.94Å; E54-R67 IonicContact OE2-NH1 3.78Å; E54-R67 PolarHBondContact OE2-NH1 3.01Å; E54-R67 IonicContact OE2-NH2 2.73Å; G55-R67 PolarHBondContact O-N 2.92Å; I57-R67 HydrophobicContact CG2-CB 3.73Å; R67-V76 HydrophobicContact CG-CG1 3.91Å; R67-M129 HydrophobicContact CB-CE 4.39Å; R67-M129 HydrophobicContact CG-CE 4.27Å; R67-M129 HydrophobicContact CG-SD 4.3Å
68	M	97.2	Very high	89.1	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.015	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	150.9	177.4	-55.4	-163.1	171.6	0	0	111	L51 V52 D53 N66 V76 M77 V79 W124	L51-M68 HydrophobicContact CB-SD 3.99Å; L51-M68 HydrophobicContact CD1-SD 4.14Å; V52-M68 CarbonylContact O-C 3.59Å; V52-M68 WeakPolarHBondContact O-CA 3.45Å; V52-M68 WeakPolarHBondContact O-CB 3.39Å; D53-M68 HydrophobicContact CB-CE 4.2Å; N66-M68 HydrophobicContact CB-CE 3.55Å; N66-M68 HydrophobicContact CB-CG 3.88Å; M68-V76 CarbonylContact O-C 3.58Å; M68-V76 WeakPolarHBondContact O-CA 2.97Å; M68-M77 HydrophobicContact CB-CG 4.45Å; M68-M77 PolarHBondContact N-O 2.87Å; M68-M77 WeakPolarHBondContact O-CG 3.18Å; M68-M77 PolarHBondContact O-N 2.85Å; M68-V79 HydrophobicContact CB-CG2 3.77Å; M68-V79 HydrophobicContact CE-CB 4.25Å; M68-V79 HydrophobicContact CE-CG1 4.34Å; M68-V79 HydrophobicContact CG-CB 3.94Å; M68-V79 HydrophobicContact CG-CG2 3.69Å; M68-V79 HydrophobicContact SD-CB 3.74Å; M68-V79 HydrophobicContact SD-CG1 4.01Å; M68-V79 HydrophobicContact SD-CG2 3.66Å; M68-W124 HydrophobicContact CE-CE3 4.35Å; M68-W124 HydrophobicContact CE-CH2 4.26Å; M68-W124 HydrophobicContact CE-CZ3 3.77Å; M68-W124 HydrophobicContact SD-CE3 4.35Å; M68-W124 HydrophobicContact SD-CZ3 3.9Å
69	M	97.8	Very high	89.8	Confident	51 Å²	51	49.6 Å²	49.6	25%	0.251	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.4	171.2	178.5	177.2	52.5	0	0	110.2	V52 R71 K74 T75	V52-M69 PolarHBondContact N-O 2.86Å; V52-M69 PolarHBondContact O-N 3.35Å; M69-R71 PolarHBondContact O-N 3.19Å; M69-K74 HydrophobicContact SD-CD 4.48Å; M69-T75 WeakPolarHBondContact CA-O 3.36Å
70	H	97.4	Very high	90.2	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	111.6	170.3	-180	-119.8	0	0	0	110	L51 P72 T73 K74 T75 M77	L51-H70 HydrophobicContact CD2-CB 3.92Å; H70-P72 WeakPolarHBondContact NE2-CD 3.48Å; H70-T73 WeakPolarHBondContact ND1-CG2 3.29Å; H70-T73 PolarHBondContact ND1-OG1 3.4Å; H70-T73 PolarHBondContact O-N 2.91Å; H70-K74 VanDerWaalsContact O-CA 3.32Å; H70-K74 WeakPolarHBondContact O-CA 3.3Å; H70-K74 PolarHBondContact O-N 3.24Å; H70-T75 PolarHBondContact N-O 2.94Å; H70-M77 HydrophobicContact CB-CE 3.32Å; H70-M77 HydrophobicContact CB-SD 4.37Å
71	R	97	Very high	91.3	Very high	101 Å²	101	42.2 Å²	42.2	38%	0.381	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-40.1	-170.1	-66	-163.8	-66	-82.6	2.5	114.7	E49 D50 V52 M69 K74	E49-R71 VanDerWaalsContact C-NH2 3.33Å; E49-R71 PolarHBondContact O-NH1 3.14Å; E49-R71 PolarHBondContact O-NH2 2.94Å; D50-R71 PolarHBondContact O-N 2.94Å; V52-R71 VanDerWaalsContact CG2-CD 3.46Å; V52-R71 HydrophobicContact CG2-CG 3.39Å; M69-R71 PolarHBondContact O-N 3.19Å; R71-K74 WeakPolarHBondContact O-CD 3.23Å; R71-K74 VanDerWaalsContact O-CE 3.31Å; R71-K74 WeakPolarHBondContact O-CE 3.31Å; R71-K74 PolarHBondContact O-NZ 3.49Å
72	P	96.3	Very high	92.3	Very high	77 Å²	77	37.8 Å²	37.8	50%	0.5	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-44.6	178.7	-25.2	35.3	0	0	0	113.1	D50 H70	D50-P72 HydrophobicContact CB-CG 4.34Å; H70-P72 WeakPolarHBondContact NE2-CD 3.48Å
73	T	96.4	Very high	93.1	Very high	30 Å²	30	42.4 Å²	42.4	18%	0.184	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-10.9	-175.3	64.6	0	0	0	0	114	I37 V40 C41 L44 H70 T75	I37-T73 HydrophobicContact CD1-CG2 4.33Å; V40-T73 HydrophobicContact CG1-CG2 3.87Å; C41-T73 HydrophobicContact CB-CG2 4.29Å; L44-T73 HydrophobicContact CD2-CG2 3.9Å; H70-T73 WeakPolarHBondContact ND1-CG2 3.29Å; H70-T73 PolarHBondContact ND1-OG1 3.4Å; H70-T73 PolarHBondContact O-N 2.91Å; T73-T75 WeakPolarHBondContact CB-OG1 3.43Å; T73-T75 PolarHBondContact O-N 3Å; T73-T75 VanDerWaalsContact O-N 3.17Å; T73-T75 WeakPolarHBondContact OG1-CB 3.35Å; T73-T75 PolarHBondContact OG1-N 2.88Å; T73-T75 PolarHBondContact OG1-OG1 3.48Å
74	K	96.8	Very high	93.4	Very high	142 Å²	142	42.4 Å²	42.4	62%	0.617	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	16.6	-171.5	-52.7	-57.9	-178.5	-157.5	0	114	M69 H70 R71	M69-K74 HydrophobicContact SD-CD 4.48Å; H70-K74 VanDerWaalsContact O-CA 3.32Å; H70-K74 WeakPolarHBondContact O-CA 3.3Å; H70-K74 PolarHBondContact O-N 3.24Å; R71-K74 WeakPolarHBondContact O-CD 3.23Å; R71-K74 VanDerWaalsContact O-CE 3.31Å; R71-K74 WeakPolarHBondContact O-CE 3.31Å; R71-K74 PolarHBondContact O-NZ 3.49Å
75	T	96.7	Very high	93	Very high	22 Å²	22	44.6 Å²	44.6	14%	0.135	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	126.6	179.7	-50.3	0	0	0	0	110.2	I37 M69 H70 T73 M77 Y114	I37-T75 HydrophobicContact CD1-CG2 3.92Å; I37-T75 HydrophobicContact CG2-CG2 4.22Å; M69-T75 WeakPolarHBondContact CA-O 3.36Å; H70-T75 PolarHBondContact N-O 2.94Å; T73-T75 WeakPolarHBondContact CB-OG1 3.43Å; T73-T75 PolarHBondContact O-N 3Å; T73-T75 VanDerWaalsContact O-N 3.17Å; T73-T75 WeakPolarHBondContact OG1-CB 3.35Å; T73-T75 PolarHBondContact OG1-N 2.88Å; T73-T75 PolarHBondContact OG1-OG1 3.48Å; T75-M77 HydrophobicContact CG2-CE 4.39Å; T75-Y114 HydrophobicContact CG2-CE2 4.07Å
76	V	96.6	Very high	92.5	Very high	45 Å²	45	44.6 Å²	44.6	27%	0.273	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	136	168.9	177.2	0	0	0	0	108.6	R67 M68 M129	R67-V76 HydrophobicContact CG-CG1 3.91Å; M68-V76 CarbonylContact O-C 3.58Å; M68-V76 WeakPolarHBondContact O-CA 2.97Å; V76-M129 HydrophobicContact CG1-CB 4.4Å; V76-M129 HydrophobicContact CG1-CG 4.31Å
77	M	95.9	Very high	92	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	157.7	-175	56.7	-173.1	70.3	0	0	111.3	L35 I37 L51 M68 H70 T75 V79 Y114 C126 M127	L35-M77 HydrophobicContact CD2-CE 4.27Å; I37-M77 HydrophobicContact CD1-CE 4.39Å; L51-M77 HydrophobicContact CD2-SD 3.8Å; M68-M77 HydrophobicContact CB-CG 4.45Å; M68-M77 PolarHBondContact N-O 2.87Å; M68-M77 WeakPolarHBondContact O-CG 3.18Å; M68-M77 PolarHBondContact O-N 2.85Å; H70-M77 HydrophobicContact CB-CE 3.32Å; H70-M77 HydrophobicContact CB-SD 4.37Å; T75-M77 HydrophobicContact CG2-CE 4.39Å; M77-V79 HydrophobicContact CG-CG2 3.87Å; M77-V79 HydrophobicContact SD-CG2 4.13Å; M77-Y114 HydrophobicContact CB-CD2 4Å; M77-Y114 HydrophobicContact CB-CE2 3.99Å; M77-Y114 HydrophobicContact CE-CD2 4.25Å; M77-C126 HydrophobicContact SD-CB 3.79Å; M77-M127 WeakPolarHBondContact CA-O 3.49Å; M77-M127 VanDerWaalsContact CB-O 3.28Å; M77-M127 WeakPolarHBondContact CB-O 3.27Å
78	A	95	Very high	91.5	Very high	7 Å²	7	50.4 Å²	50.4	6%	0.058	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	129.7	163.7	0	0	0	0	0	108.7	I57 V65 N66 M127 M129	I57-A78 HydrophobicContact CD1-CB 4.08Å; V65-A78 HydrophobicContact CG1-CB 4.02Å; N66-A78 WeakPolarHBondContact O-CA 3.45Å; A78-M127 HydrophobicContact CB-CG 3.82Å; A78-M127 PolarHBondContact N-O 3.42Å; A78-M127 WeakPolarHBondContact O-CG 3.21Å; A78-M127 PolarHBondContact O-N 3.27Å; A78-M129 HydrophobicContact CB-SD 4.11Å
79	V	94.6	Very high	90.9	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	109.9	177.7	-178.2	0	0	0	0	109	L51 V65 N66 M68 M77 W124 I125	L51-V79 HydrophobicContact CD1-CG2 4.41Å; V65-V79 WeakPolarHBondContact CA-O 3.5Å; N66-V79 PolarHBondContact N-O 3.28Å; N66-V79 PolarHBondContact O-N 3.06Å; M68-V79 HydrophobicContact CB-CG2 3.77Å; M68-V79 HydrophobicContact CE-CB 4.25Å; M68-V79 HydrophobicContact CE-CG1 4.34Å; M68-V79 HydrophobicContact CG-CB 3.94Å; M68-V79 HydrophobicContact CG-CG2 3.69Å; M68-V79 HydrophobicContact SD-CB 3.74Å; M68-V79 HydrophobicContact SD-CG1 4.01Å; M68-V79 HydrophobicContact SD-CG2 3.66Å; M77-V79 HydrophobicContact CG-CG2 3.87Å; M77-V79 HydrophobicContact SD-CG2 4.13Å; V79-W124 HydrophobicContact CG1-CB 3.99Å; V79-W124 HydrophobicContact CG1-CD2 4.24Å; V79-W124 HydrophobicContact CG1-CE3 3.77Å; V79-W124 HydrophobicContact CG1-CG 4.37Å; V79-I125 WeakPolarHBondContact CA-O 3.26Å
80	K	91.4	Very high	90.2	Very high	20 Å²	20	60.3 Å²	60.3	9%	0.087	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	120.9	177	-177.1	172.7	179.3	178.8	0	109.9	V65 I82 W124 I125 M127 D196	V65-K80 HydrophobicContact CG2-CB 4.14Å; V65-K80 HydrophobicContact CG2-CD 4.48Å; V65-K80 HydrophobicContact CG2-CG 4.05Å; K80-I82 HydrophobicContact CD-CD1 4.19Å; K80-I82 HydrophobicContact CD-CG1 4.31Å; K80-I82 HydrophobicContact CG-CD1 4.34Å; K80-I82 HydrophobicContact CG-CG1 3.98Å; K80-W124 WeakPolarHBondContact O-CA 3.4Å; K80-I125 PolarHBondContact N-O 3.26Å; K80-I125 PolarHBondContact O-N 2.95Å; K80-M127 HydrophobicContact CB-CE 3.83Å; K80-D196 IonicContact NZ-OD1 2.69Å; K80-D196 PolarHBondContact NZ-OD1 2.84Å; K80-D196 IonicContact NZ-OD2 2.64Å; K80-D196 PolarHBondContact NZ-OD2 2.86Å
81	R	91.1	Very high	89.7	Confident	42 Å²	42	62 Å²	62	16%	0.158	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	115.7	178.4	-65.5	-178.8	54.2	171.2	7.9	110.1	G63 F64 D122 W124	G63-R81 WeakPolarHBondContact CA-O 3.21Å; F64-R81 HydrophobicContact CE1-CB 4.25Å; F64-R81 HydrophobicContact CE2-CB 4.38Å; F64-R81 VanDerWaalsContact CE2-CD 3.45Å; F64-R81 HydrophobicContact CE2-CG 4.34Å; F64-R81 HydrophobicContact CZ-CB 4.16Å; F64-R81 HydrophobicContact CZ-CG 4.41Å; F64-R81 VanDerWaalsContact CZ-CZ 3.45Å; F64-R81 VanDerWaalsContact CZ-NE 3.34Å; F64-R81 PolarHBondContact O-N 3.17Å; R81-D122 IonicContact CZ-OD2 3.14Å; R81-D122 IonicContact NE-OD2 2.88Å; R81-D122 PolarHBondContact NE-OD2 3.26Å; R81-D122 IonicContact NH2-OD2 3.75Å; R81-D122 PolarHBondContact NH2-OD2 3.49Å; R81-W124 HydrophobicContact CG-CD2 3.88Å; R81-W124 HydrophobicContact CG-CG 3.9Å
82	I	85.8	Confident	89	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	123.4	-179.1	-55.5	178.8	0	0	0	108.5	K80 S84 D122 C123 I125 L203 V204 I207	K80-I82 HydrophobicContact CD-CD1 4.19Å; K80-I82 HydrophobicContact CD-CG1 4.31Å; K80-I82 HydrophobicContact CG-CD1 4.34Å; K80-I82 HydrophobicContact CG-CG1 3.98Å; I82-S84 PolarHBondContact O-N 2.75Å; I82-D122 CarbonylContact O-C 3.28Å; I82-D122 WeakPolarHBondContact O-CA 3.34Å; I82-C123 PolarHBondContact N-O 3.36Å; I82-C123 PolarHBondContact O-N 3.46Å; I82-I125 HydrophobicContact CD1-CD1 3.79Å; I82-L203 HydrophobicContact CG2-CB 4.49Å; I82-V204 HydrophobicContact CD1-CG2 4.41Å; I82-I207 HydrophobicContact CG2-CD1 3.37Å
83	R	84.2	Confident	88.4	Confident	152 Å²	152	64.2 Å²	64.2	57%	0.574	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	125.7	177.9	-174.7	168	178.9	163.1	-0.1	110.8	D122 I207	R83-D122 WeakPolarHBondContact CA-OD1 3.3Å; R83-I207 WeakPolarHBondContact O-CD1 3.26Å
84	S	82	Confident	87.6	Confident	16 Å²	16	63.8 Å²	63.8	11%	0.112	30%	0.295	C	S	.	.			trans	-105.4	135.1	179.9	-175.8	0	0	0	0	111.1	I82 L86 F118 G121	I82-S84 PolarHBondContact O-N 2.75Å; S84-L86 WeakPolarHBondContact OG-CB 3.49Å; S84-L86 PolarHBondContact OG-N 3.02Å; S84-F118 WeakPolarHBondContact OG-CE1 3.34Å; S84-G121 WeakPolarHBondContact CA-O 3.37Å; S84-G121 WeakPolarHBondContact CB-O 3.23Å; S84-G121 PolarHBondContact N-O 2.95Å
85	T	79.8	Confident	86.9	Confident	101 Å²	101	59.3 Å²	59.3	62%	0.62	28%	0.278	S	S	*	.			trans	-107.6	10.9	168	59.7	0	0	0	0	111.9
86	L	80.3	Confident	86.1	Confident	30 Å²	30	64.7 Å²	64.7	16%	0.157	30%	0.299	C	S	.	.			trans	-77.7	143.1	-175	-60.5	-177.2	0	0	0	111.2	S84 E90 Q91 T94 F118 L203	S84-L86 WeakPolarHBondContact OG-CB 3.49Å; S84-L86 PolarHBondContact OG-N 3.02Å; L86-E90 WeakPolarHBondContact CA-OE2 3.23Å; L86-E90 HydrophobicContact CB-CB 3.8Å; L86-E90 HydrophobicContact CD1-CB 4.35Å; L86-E90 HydrophobicContact CD2-CB 4.11Å; L86-E90 HydrophobicContact CG-CB 4.3Å; L86-Q91 HydrophobicContact CB-CG 3.85Å; L86-Q91 PolarHBondContact O-NE2 3.18Å; L86-T94 WeakPolarHBondContact CD1-OG1 3.45Å; L86-F118 HydrophobicContact CD1-CZ 4.33Å; L86-L203 HydrophobicContact CD1-CD2 3.65Å
87	N	84.2	Confident	85.2	Confident	83 Å²	83	66.5 Å²	66.5	44%	0.444	31%	0.308	S	S	.	.			trans	-75.4	166.8	170.3	68.2	56	0	0	0	111.6	R89 E90 Q91	N87-R89 PolarHBondContact O-N 3.27Å; N87-R89 VanDerWaalsContact O-N 3.09Å; N87-R89 WeakPolarHBondContact OD1-CA 3.41Å; N87-R89 WeakPolarHBondContact OD1-CB 3.49Å; N87-R89 PolarHBondContact OD1-N 2.97Å; N87-E90 PolarHBondContact N-OE2 2.98Å; N87-E90 PolarHBondContact ND2-OE2 3.12Å; N87-E90 WeakPolarHBondContact O-CB 3.37Å; N87-E90 PolarHBondContact O-N 2.72Å; N87-E90 PolarHBondContact OD1-N 3.28Å; N87-Q91 VanDerWaalsContact O-CG 3.29Å; N87-Q91 WeakPolarHBondContact O-CG 3.43Å; N87-Q91 PolarHBondContact O-N 3.01Å
88	E	84.3	Confident	84.3	Confident	133 Å²	133	66.7 Å²	66.7	62%	0.621	31%	0.309	S	S	*	.	H	α-helix	trans	-56.4	-30.2	-176.8	-64.9	178.2	177.5	0	0	114.6	R92	E88-R92 WeakPolarHBondContact O-CG 3.43Å; E88-R92 PolarHBondContact O-N 3.17Å; E88-R92 PolarHBondContact O-NE 2.75Å
89	R	85.2	Confident	83.4	Confident	179 Å²	179	69.3 Å²	69.3	68%	0.675	32%	0.322	S	S	*	.	H	α-helix	trans	-73	-44.9	176.5	-178.6	-178	177.8	179	-1.1	110.7	N87 R92 N93	N87-R89 PolarHBondContact O-N 3.27Å; N87-R89 VanDerWaalsContact O-N 3.09Å; N87-R89 WeakPolarHBondContact OD1-CA 3.41Å; N87-R89 WeakPolarHBondContact OD1-CB 3.49Å; N87-R89 PolarHBondContact OD1-N 2.97Å; R89-R92 PolarHBondContact O-N 3.42Å; R89-N93 PolarHBondContact O-N 3.33Å; R89-N93 VanDerWaalsContact O-N 3.11Å
90	E	84.3	Confident	82.4	Confident	84 Å²	84	73.8 Å²	73.8	39%	0.393	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-44.2	176.3	-70.2	168.4	157.9	0	0	111.1	L86 N87 R92 N93 T94	L86-E90 WeakPolarHBondContact CA-OE2 3.23Å; L86-E90 HydrophobicContact CB-CB 3.8Å; L86-E90 HydrophobicContact CD1-CB 4.35Å; L86-E90 HydrophobicContact CD2-CB 4.11Å; L86-E90 HydrophobicContact CG-CB 4.3Å; N87-E90 PolarHBondContact N-OE2 2.98Å; N87-E90 PolarHBondContact ND2-OE2 3.12Å; N87-E90 WeakPolarHBondContact O-CB 3.37Å; N87-E90 PolarHBondContact O-N 2.72Å; N87-E90 PolarHBondContact OD1-N 3.28Å; E90-R92 PolarHBondContact O-N 3.38Å; E90-N93 PolarHBondContact O-N 2.73Å; E90-N93 VanDerWaalsContact O-N 3.14Å; E90-T94 PolarHBondContact O-N 2.54Å; E90-T94 PolarHBondContact O-OG1 3.06Å; E90-T94 VanDerWaalsContact O-OG1 3.05Å
91	Q	85.1	Confident	81.3	Confident	36 Å²	36	74 Å²	74	17%	0.168	35%	0.351	C	S	.	.	H	α-helix	trans	-55.3	-48.5	174.9	-70.2	177.7	6.6	0	0	111.8	L86 N87 N93 T94 L95 F118	L86-Q91 HydrophobicContact CB-CG 3.85Å; L86-Q91 PolarHBondContact O-NE2 3.18Å; N87-Q91 VanDerWaalsContact O-CG 3.29Å; N87-Q91 WeakPolarHBondContact O-CG 3.43Å; N87-Q91 PolarHBondContact O-N 3.01Å; Q91-N93 VanDerWaalsContact C-N 3.32Å; Q91-N93 PolarHBondContact O-N 3.17Å; Q91-T94 PolarHBondContact O-N 3.17Å; Q91-L95 WeakPolarHBondContact O-CG 3.23Å; Q91-L95 PolarHBondContact O-N 3.17Å; Q91-F118 HydrophobicContact CB-CD1 4.27Å; Q91-F118 HydrophobicContact CB-CD2 3.67Å; Q91-F118 HydrophobicContact CB-CE1 4.34Å; Q91-F118 HydrophobicContact CB-CE2 3.76Å; Q91-F118 HydrophobicContact CB-CG 3.94Å; Q91-F118 HydrophobicContact CB-CZ 4.09Å; Q91-F118 HydrophobicContact CG-CB 4.48Å; Q91-F118 HydrophobicContact CG-CD1 3.67Å; Q91-F118 HydrophobicContact CG-CD2 4.02Å; Q91-F118 HydrophobicContact CG-CE1 3.76Å; Q91-F118 HydrophobicContact CG-CE2 4.11Å; Q91-F118 HydrophobicContact CG-CG 3.79Å; Q91-F118 HydrophobicContact CG-CZ 3.98Å; Q91-F118 WeakPolarHBondContact O-CE2 3.22Å
92	R	83.1	Confident	80.4	Confident	148 Å²	148	72.8 Å²	72.8	56%	0.558	35%	0.348	S	S	*	.	H	α-helix	trans	-61.7	-38.4	177	-77	-177.6	-67.2	172.1	-3.8	112.9	E88 R89 E90 K96	E88-R92 WeakPolarHBondContact O-CG 3.43Å; E88-R92 PolarHBondContact O-N 3.17Å; E88-R92 PolarHBondContact O-NE 2.75Å; R89-R92 PolarHBondContact O-N 3.42Å; E90-R92 PolarHBondContact O-N 3.38Å; R92-K96 WeakPolarHBondContact O-CG 3.4Å; R92-K96 PolarHBondContact O-N 2.81Å
93	N	83.3	Confident	79.5	Confident	77 Å²	77	76.5 Å²	76.5	41%	0.412	37%	0.368	S	S	.	.	H	α-helix	trans	-68	-44.9	176.1	-70	-11.9	0	0	0	110.8	R89 E90 Q91 L95 K96 D97	R89-N93 PolarHBondContact O-N 3.33Å; R89-N93 VanDerWaalsContact O-N 3.11Å; E90-N93 PolarHBondContact O-N 2.73Å; E90-N93 VanDerWaalsContact O-N 3.14Å; Q91-N93 VanDerWaalsContact C-N 3.32Å; Q91-N93 PolarHBondContact O-N 3.17Å; N93-L95 VanDerWaalsContact C-N 3.35Å; N93-L95 PolarHBondContact O-N 3.41Å; N93-K96 WeakPolarHBondContact O-CB 3.38Å; N93-K96 PolarHBondContact O-N 3.21Å; N93-K96 VanDerWaalsContact O-N 3.15Å; N93-D97 VanDerWaalsContact O-CG 3.29Å; N93-D97 PolarHBondContact O-N 3.49Å
94	T	80.1	Confident	78.6	Confident	20 Å²	20	72.3 Å²	72.3	12%	0.123	36%	0.362	C	S	.	.	H	α-helix	trans	-58.9	-43.3	176	-59	0	0	0	0	112.2	L86 E90 Q91 K96 D97 L98 F118 I199 L203	L86-T94 WeakPolarHBondContact CD1-OG1 3.45Å; E90-T94 PolarHBondContact O-N 2.54Å; E90-T94 PolarHBondContact O-OG1 3.06Å; E90-T94 VanDerWaalsContact O-OG1 3.05Å; Q91-T94 PolarHBondContact O-N 3.17Å; T94-K96 VanDerWaalsContact C-N 3.35Å; T94-K96 PolarHBondContact O-N 2.87Å; T94-D97 PolarHBondContact O-N 3.13Å; T94-L98 HydrophobicContact CG2-CD1 3.93Å; T94-L98 HydrophobicContact CG2-CG 4.37Å; T94-L98 WeakPolarHBondContact O-CB 3.43Å; T94-L98 VanDerWaalsContact O-CG 3.25Å; T94-L98 WeakPolarHBondContact O-CG 3.45Å; T94-L98 PolarHBondContact O-N 3.11Å; T94-F118 HydrophobicContact CG2-CE2 4.42Å; T94-F118 HydrophobicContact CG2-CZ 4.1Å; T94-I199 HydrophobicContact CG2-CG2 3.76Å; T94-L203 HydrophobicContact CG2-CD1 3.95Å; T94-L203 HydrophobicContact CG2-CD2 3.98Å; T94-L203 HydrophobicContact CG2-CG 4.08Å
95	L	82.1	Confident	77.9	Confident	48 Å²	48	72.4 Å²	72.4	25%	0.251	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-42.2	175.7	-71.6	-179	0	0	0	111.9	Q91 N93 L98 D99 A116 F118	Q91-L95 WeakPolarHBondContact O-CG 3.23Å; Q91-L95 PolarHBondContact O-N 3.17Å; N93-L95 VanDerWaalsContact C-N 3.35Å; N93-L95 PolarHBondContact O-N 3.41Å; L95-L98 PolarHBondContact O-N 2.82Å; L95-D99 WeakPolarHBondContact O-CB 3.28Å; L95-D99 PolarHBondContact O-N 2.75Å; L95-A116 HydrophobicContact CD2-CB 3.66Å; L95-F118 HydrophobicContact CD1-CD2 3.95Å; L95-F118 HydrophobicContact CD1-CE2 4.44Å; L95-F118 HydrophobicContact CD2-CD2 3.78Å; L95-F118 HydrophobicContact CD2-CE2 3.76Å; L95-F118 HydrophobicContact CG-CD2 3.68Å; L95-F118 HydrophobicContact CG-CE2 3.68Å
96	K	80.3	Confident	77.9	Confident	135 Å²	135	74.7 Å²	74.7	59%	0.587	37%	0.372	S	S	*	.	H	α-helix	trans	-64	-43.7	176.8	-73.5	175.9	179.2	-175.5	0	112.1	R92 N93 T94 L98 D99 V100	R92-K96 WeakPolarHBondContact O-CG 3.4Å; R92-K96 PolarHBondContact O-N 2.81Å; N93-K96 WeakPolarHBondContact O-CB 3.38Å; N93-K96 PolarHBondContact O-N 3.21Å; N93-K96 VanDerWaalsContact O-N 3.15Å; T94-K96 VanDerWaalsContact C-N 3.35Å; T94-K96 PolarHBondContact O-N 2.87Å; K96-L98 VanDerWaalsContact C-N 3.32Å; K96-D99 WeakPolarHBondContact O-CB 3.34Å; K96-D99 PolarHBondContact O-N 3.07Å; K96-V100 WeakPolarHBondContact O-CG2 3.26Å; K96-V100 PolarHBondContact O-N 2.96Å
97	D	77.8	Confident	78.4	Confident	84 Å²	84	73.9 Å²	73.9	45%	0.449	37%	0.368	S	S	.	.	H	α-helix	trans	-65.4	-40.7	178.8	-64.9	-21.1	0	0	0	110.1	N93 T94 V100 V101 I199	N93-D97 VanDerWaalsContact O-CG 3.29Å; N93-D97 PolarHBondContact O-N 3.49Å; T94-D97 PolarHBondContact O-N 3.13Å; D97-V100 PolarHBondContact O-N 2.95Å; D97-V101 WeakPolarHBondContact O-CG2 3.44Å; D97-V101 PolarHBondContact O-N 3.13Å; D97-I199 HydrophobicContact CB-CD1 3.45Å; D97-I199 VanDerWaalsContact CB-CD1 3.45Å; D97-I199 HydrophobicContact CB-CG1 4.32Å; D97-I199 WeakPolarHBondContact O-CD1 3.42Å
98	L	76.7	Confident	78.9	Confident	4 Å²	4	74.3 Å²	74.3	2%	0.021	38%	0.375	C	S	.	.	H	α-helix	trans	-59.1	-50.1	176.3	-79	166.2	0	0	0	109.6	T94 L95 K96 V100 V101 M102 A116 I199	T94-L98 HydrophobicContact CG2-CD1 3.93Å; T94-L98 HydrophobicContact CG2-CG 4.37Å; T94-L98 WeakPolarHBondContact O-CB 3.43Å; T94-L98 VanDerWaalsContact O-CG 3.25Å; T94-L98 WeakPolarHBondContact O-CG 3.45Å; T94-L98 PolarHBondContact O-N 3.11Å; L95-L98 PolarHBondContact O-N 2.82Å; K96-L98 VanDerWaalsContact C-N 3.32Å; L98-V100 VanDerWaalsContact C-N 3.34Å; L98-V100 PolarHBondContact O-N 3.48Å; L98-V101 PolarHBondContact O-N 3.1Å; L98-M102 HydrophobicContact CB-SD 4.05Å; L98-M102 HydrophobicContact CD2-CE 3.24Å; L98-M102 HydrophobicContact CD2-SD 3.73Å; L98-M102 HydrophobicContact CG-SD 4.5Å; L98-M102 WeakPolarHBondContact O-CB 3.14Å; L98-M102 WeakPolarHBondContact O-CG 3.45Å; L98-M102 PolarHBondContact O-N 3.34Å; L98-A116 HydrophobicContact CD1-CB 3.86Å; L98-I199 HydrophobicContact CB-CD1 4.47Å; L98-I199 HydrophobicContact CD1-CG2 4.4Å; L98-I199 HydrophobicContact CD2-CB 3.61Å; L98-I199 HydrophobicContact CD2-CD1 4.23Å; L98-I199 HydrophobicContact CD2-CG2 3.7Å; L98-I199 HydrophobicContact CG-CB 4.08Å; L98-I199 HydrophobicContact CG-CD1 4.2Å; L98-I199 HydrophobicContact CG-CG2 3.71Å
99	D	75.3	Confident	79.5	Confident	62 Å²	62	69.6 Å²	69.6	33%	0.332	36%	0.355	S	S	.	.	H	α-helix	trans	-56.1	-45.4	178.9	-165.6	51.7	0	0	0	112.2	L95 K96 M102 N103	L95-D99 WeakPolarHBondContact O-CB 3.28Å; L95-D99 PolarHBondContact O-N 2.75Å; K96-D99 WeakPolarHBondContact O-CB 3.34Å; K96-D99 PolarHBondContact O-N 3.07Å; D99-M102 PolarHBondContact O-N 3.36Å; D99-N103 VanDerWaalsContact CG-ND2 3.27Å; D99-N103 VanDerWaalsContact O-CB 3.25Å; D99-N103 WeakPolarHBondContact O-CB 3.43Å; D99-N103 PolarHBondContact O-N 3.23Å; D99-N103 PolarHBondContact O-ND2 2.68Å; D99-N103 PolarHBondContact OD1-ND2 2.68Å
100	V	73.3	Confident	79.9	Confident	93 Å²	93	61.2 Å²	61.2	56%	0.564	32%	0.323	S	S	*	.	H	α-helix	trans	-63.8	-48.7	178	171.6	0	0	0	0	111.8	K96 D97 L98 M102 S104	K96-V100 WeakPolarHBondContact O-CG2 3.26Å; K96-V100 PolarHBondContact O-N 2.96Å; D97-V100 PolarHBondContact O-N 2.95Å; L98-V100 VanDerWaalsContact C-N 3.34Å; L98-V100 PolarHBondContact O-N 3.48Å; V100-M102 VanDerWaalsContact C-N 3.31Å; V100-M102 PolarHBondContact O-N 3.14Å; V100-S104 VanDerWaalsContact O-CB 3.28Å; V100-S104 WeakPolarHBondContact O-CB 3.48Å; V100-S104 PolarHBondContact O-N 3.3Å; V100-S104 PolarHBondContact O-OG 3Å
101	V	69.9	Low	80.3	Confident	24 Å²	24	57.2 Å²	57.2	15%	0.145	31%	0.305	C	S	.	.	H	α-helix	trans	-66.3	-38.1	-177.8	172.6	0	0	0	0	110.8	D97 L98 L172 V174 F197 I199	D97-V101 WeakPolarHBondContact O-CG2 3.44Å; D97-V101 PolarHBondContact O-N 3.13Å; L98-V101 PolarHBondContact O-N 3.1Å; V101-L172 HydrophobicContact CG1-CD1 4.13Å; V101-V174 HydrophobicContact CG1-CG2 4.47Å; V101-F197 HydrophobicContact CG1-CE2 4.05Å; V101-I199 HydrophobicContact CB-CD1 4.18Å; V101-I199 HydrophobicContact CG2-CD1 3.72Å
102	M	71.3	Confident	80.5	Confident	17 Å²	17	58.4 Å²	58.4	8%	0.084	31%	0.312	C	S	.	.	H	α-helix	trans	-86.1	-39.6	-168.9	-71	173.3	174.1	0	0	112.8	L98 D99 V100 S104 A105 F113	L98-M102 HydrophobicContact CB-SD 4.05Å; L98-M102 HydrophobicContact CD2-CE 3.24Å; L98-M102 HydrophobicContact CD2-SD 3.73Å; L98-M102 HydrophobicContact CG-SD 4.5Å; L98-M102 WeakPolarHBondContact O-CB 3.14Å; L98-M102 WeakPolarHBondContact O-CG 3.45Å; L98-M102 PolarHBondContact O-N 3.34Å; D99-M102 PolarHBondContact O-N 3.36Å; V100-M102 VanDerWaalsContact C-N 3.31Å; V100-M102 PolarHBondContact O-N 3.14Å; M102-S104 PolarHBondContact O-N 3.31Å; M102-A105 PolarHBondContact O-N 3.19Å; M102-F113 HydrophobicContact CB-CB 3.68Å; M102-F113 HydrophobicContact CB-CG 4.27Å; M102-F113 HydrophobicContact CE-CB 4.21Å; M102-F113 HydrophobicContact CE-CD1 3.18Å; M102-F113 HydrophobicContact CE-CD2 3.84Å; M102-F113 HydrophobicContact CE-CE1 3.3Å; M102-F113 HydrophobicContact CE-CE2 3.97Å; M102-F113 HydrophobicContact CE-CG 3.46Å; M102-F113 VanDerWaalsContact CE-CG 3.46Å; M102-F113 HydrophobicContact CE-CZ 3.7Å; M102-F113 HydrophobicContact CG-CB 3.53Å; M102-F113 HydrophobicContact CG-CD1 4.25Å; M102-F113 HydrophobicContact CG-CD2 3.76Å; M102-F113 HydrophobicContact CG-CG 3.58Å; M102-F113 HydrophobicContact SD-CB 3.41Å; M102-F113 WeakPolarHBondContact SD-CB 3.38Å; M102-F113 HydrophobicContact SD-CD1 3.45Å; M102-F113 WeakPolarHBondContact SD-CD1 3.46Å; M102-F113 HydrophobicContact SD-CD2 4.08Å; M102-F113 HydrophobicContact SD-CE1 4.22Å; M102-F113 HydrophobicContact SD-CG 3.36Å; M102-F113 WeakPolarHBondContact SD-CG 3.25Å
103	N	67.5	Low	80.9	Confident	81 Å²	81	52 Å²	52	43%	0.433	29%	0.288	S	S	.	.	H	α-helix	trans	-72	-16.9	173.8	-68.5	-29	0	0	0	113	D99	D99-N103 VanDerWaalsContact CG-ND2 3.27Å; D99-N103 VanDerWaalsContact O-CB 3.25Å; D99-N103 WeakPolarHBondContact O-CB 3.43Å; D99-N103 PolarHBondContact O-N 3.23Å; D99-N103 PolarHBondContact O-ND2 2.68Å; D99-N103 PolarHBondContact OD1-ND2 2.68Å
104	S	64.9	Low	81.2	Confident	64 Å²	64	49.8 Å²	49.8	45%	0.448	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-12.7	175.8	-58.5	0	0	0	0	112.9	V100 M102 N106 Y167	V100-S104 VanDerWaalsContact O-CB 3.28Å; V100-S104 WeakPolarHBondContact O-CB 3.48Å; V100-S104 PolarHBondContact O-N 3.3Å; V100-S104 PolarHBondContact O-OG 3Å; M102-S104 PolarHBondContact O-N 3.31Å; S104-N106 PolarHBondContact O-N 3.28Å; S104-Y167 PolarHBondContact O-OH 3.42Å
105	A	67.2	Low	81.7	Confident	17 Å²	17	49.5 Å²	49.5	14%	0.14	28%	0.275	C	S	.	.			trans	-82.6	103.5	-173.4	0	0	0	0	0	111.4	M102 Y167 L172	M102-A105 PolarHBondContact O-N 3.19Å; A105-Y167 HydrophobicContact CB-CE1 4.45Å; A105-L172 HydrophobicContact CB-CD1 4.16Å
106	N	80.4	Confident	82.2	Confident	150 Å²	150	47.6 Å²	47.6	80%	0.802	27%	0.266	S	S	*	.			trans	-115.5	41.1	178.6	-141	8.7	0	0	0	111.3	S104 Y167	S104-N106 PolarHBondContact O-N 3.28Å; N106-Y167 PolarHBondContact N-OH 3.31Å
107	C	90.7	Very high	82.7	Confident	12 Å²	12	41.2 Å²	41.2	8%	0.081	24%	0.238	C	C	.	.			trans	-110.1	124.9	-177.8	-177.8	0	0	0	0	110.5	N109 I110 Y167	C107-N109 PolarHBondContact O-N 2.86Å; C107-N109 VanDerWaalsContact O-N 3.16Å; C107-I110 HydrophobicContact CB-CB 4.11Å; C107-I110 HydrophobicContact CB-CD1 3.78Å; C107-I110 HydrophobicContact CB-CG1 3.9Å; C107-I110 PolarHBondContact O-N 3.49Å; C107-Y167 HydrophobicContact CB-CD1 3.58Å; C107-Y167 HydrophobicContact CB-CD2 3.84Å; C107-Y167 HydrophobicContact CB-CE1 3.85Å; C107-Y167 HydrophobicContact CB-CE2 4.1Å; C107-Y167 HydrophobicContact CB-CG 3.57Å
108	P	94.4	Very high	83.2	Confident	92 Å²	92	37.7 Å²	37.7	60%	0.597	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.5	-179.8	27.9	-35.7	0	0	0	113.5	K193	P108-K193 VanDerWaalsContact O-CE 3.25Å; P108-K193 WeakPolarHBondContact O-CE 3.43Å; P108-K193 WeakPolarHBondContact O-CG 3.3Å
109	N	96.1	Very high	83.8	Confident	34 Å²	34	38.1 Å²	38.1	18%	0.182	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	14.5	178.9	-55	116.8	0	0	0	113.1	C107 A160 S163 A164 V192 K193 L194	C107-N109 PolarHBondContact O-N 2.86Å; C107-N109 VanDerWaalsContact O-N 3.16Å; N109-A160 HydrophobicContact CB-CB 4.3Å; N109-A160 VanDerWaalsContact CB-O 3.26Å; N109-A160 WeakPolarHBondContact CB-O 3.19Å; N109-A160 VanDerWaalsContact ND2-CB 3.29Å; N109-A160 WeakPolarHBondContact ND2-CB 3.4Å; N109-S163 PolarHBondContact OD1-OG 3.3Å; N109-S163 VanDerWaalsContact OD1-OG 3.12Å; N109-A164 HydrophobicContact CB-CB 3.93Å; N109-A164 VanDerWaalsContact O-CB 3.23Å; N109-A164 WeakPolarHBondContact O-CB 3.43Å; N109-V192 PolarHBondContact ND2-O 2.88Å; N109-K193 CarbonylContact O-C 3.59Å; N109-K193 VanDerWaalsContact O-CA 3.31Å; N109-K193 WeakPolarHBondContact O-CA 3.45Å; N109-L194 PolarHBondContact O-N 2.83Å
110	I	93.6	Very high	84.2	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.015	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-121.6	135.7	175.8	-68	-179.1	0	0	0	108.2	C107 L112 A164 Y167 L168 F197	C107-I110 HydrophobicContact CB-CB 4.11Å; C107-I110 HydrophobicContact CB-CD1 3.78Å; C107-I110 HydrophobicContact CB-CG1 3.9Å; C107-I110 PolarHBondContact O-N 3.49Å; I110-L112 PolarHBondContact O-N 3.08Å; I110-A164 HydrophobicContact CD1-CB 4.5Å; I110-A164 HydrophobicContact CG1-CB 3.79Å; I110-Y167 HydrophobicContact CD1-CD1 3.47Å; I110-Y167 VanDerWaalsContact CD1-CD1 3.47Å; I110-Y167 HydrophobicContact CD1-CE1 4.22Å; I110-Y167 HydrophobicContact CD1-CG 4.24Å; I110-L168 HydrophobicContact CD1-CD2 3.67Å; I110-L168 HydrophobicContact CD1-CG 3.83Å; I110-F197 HydrophobicContact CG2-CD1 4.32Å; I110-F197 HydrophobicContact CG2-CE1 3.24Å; I110-F197 HydrophobicContact CG2-CE2 4.45Å; I110-F197 HydrophobicContact CG2-CZ 3.3Å
111	V	93	Very high	84.7	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-61.4	124.9	176.2	172.7	0	0	0	0	109.9	F113 M127 E128 M130 L185 K193 L194 C195	V111-F113 WeakPolarHBondContact O-CD2 3.29Å; V111-F113 WeakPolarHBondContact O-CE2 3.21Å; V111-F113 PolarHBondContact O-N 2.87Å; V111-M127 HydrophobicContact CG1-CB 3.93Å; V111-M127 HydrophobicContact CG1-CG 4.09Å; V111-M127 HydrophobicContact CG1-SD 4.16Å; V111-E128 VanDerWaalsContact CA-OE1 3.29Å; V111-E128 WeakPolarHBondContact CA-OE1 3.32Å; V111-E128 HydrophobicContact CB-CG 4.49Å; V111-E128 HydrophobicContact CG1-CG 3.69Å; V111-M130 HydrophobicContact CG2-CG 4.37Å; V111-L185 HydrophobicContact CG2-CD1 3.93Å; V111-L185 HydrophobicContact CG2-CG 4.48Å; V111-K193 HydrophobicContact CG2-CB 3.72Å; V111-L194 PolarHBondContact N-O 3.04Å; V111-C195 HydrophobicContact CB-CB 4.07Å; V111-C195 HydrophobicContact CG2-CB 3.65Å
112	L	90.7	Very high	85.6	Confident	61 Å²	61	40.4 Å²	40.4	32%	0.319	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-66	126.4	175.7	-72.2	156.9	0	0	0	109.8	P38 I110 Y114 M127 E128	P38-L112 HydrophobicContact CG-CD2 4.33Å; I110-L112 PolarHBondContact O-N 3.08Å; L112-Y114 HydrophobicContact CB-CE1 4.33Å; L112-M127 CarbonylContact O-C 3.52Å; L112-M127 VanDerWaalsContact O-CA 3.29Å; L112-M127 WeakPolarHBondContact O-CA 3.48Å; L112-M127 WeakPolarHBondContact O-CB 3.38Å; L112-E128 HydrophobicContact CB-CB 4.07Å; L112-E128 HydrophobicContact CB-CG 3.92Å; L112-E128 WeakPolarHBondContact CB-OE1 3.49Å; L112-E128 PolarHBondContact N-OE1 3.05Å; L112-E128 PolarHBondContact O-N 3.18Å
113	F	89.9	Confident	86.5	Confident	14 Å²	14	39.6 Å²	39.6	6%	0.061	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	132.5	173.6	-71.1	-91.5	0	0	0	109	M102 V111 I125 M127 F197	M102-F113 HydrophobicContact CB-CB 3.68Å; M102-F113 HydrophobicContact CB-CG 4.27Å; M102-F113 HydrophobicContact CE-CB 4.21Å; M102-F113 HydrophobicContact CE-CD1 3.18Å; M102-F113 HydrophobicContact CE-CD2 3.84Å; M102-F113 HydrophobicContact CE-CE1 3.3Å; M102-F113 HydrophobicContact CE-CE2 3.97Å; M102-F113 HydrophobicContact CE-CG 3.46Å; M102-F113 VanDerWaalsContact CE-CG 3.46Å; M102-F113 HydrophobicContact CE-CZ 3.7Å; M102-F113 HydrophobicContact CG-CB 3.53Å; M102-F113 HydrophobicContact CG-CD1 4.25Å; M102-F113 HydrophobicContact CG-CD2 3.76Å; M102-F113 HydrophobicContact CG-CG 3.58Å; M102-F113 HydrophobicContact SD-CB 3.41Å; M102-F113 WeakPolarHBondContact SD-CB 3.38Å; M102-F113 HydrophobicContact SD-CD1 3.45Å; M102-F113 WeakPolarHBondContact SD-CD1 3.46Å; M102-F113 HydrophobicContact SD-CD2 4.08Å; M102-F113 HydrophobicContact SD-CE1 4.22Å; M102-F113 HydrophobicContact SD-CG 3.36Å; M102-F113 WeakPolarHBondContact SD-CG 3.25Å; V111-F113 WeakPolarHBondContact O-CD2 3.29Å; V111-F113 WeakPolarHBondContact O-CE2 3.21Å; V111-F113 PolarHBondContact O-N 2.87Å; F113-I125 HydrophobicContact CD1-CG2 3.6Å; F113-I125 HydrophobicContact CE1-CG2 3.72Å; F113-M127 HydrophobicContact CD1-CB 4.13Å; F113-M127 HydrophobicContact CE1-CB 4.45Å; F113-M127 HydrophobicContact CE1-CE 4.01Å; F113-F197 HydrophobicContact CD2-CZ 4.13Å; F113-F197 AromaticContact CE2-CE1 3.49Å; F113-F197 HydrophobicContact CE2-CE1 3.49Å; F113-F197 VanDerWaalsContact CE2-CE1 3.49Å; F113-F197 HydrophobicContact CE2-CE2 4.36Å; F113-F197 AromaticContact CE2-CZ 3.41Å; F113-F197 HydrophobicContact CE2-CZ 3.41Å; F113-F197 VanDerWaalsContact CE2-CZ 3.41Å; F113-F197 HydrophobicContact CZ-CE1 4.1Å; F113-F197 HydrophobicContact CZ-CZ 4.28Å
114	Y	91.1	Very high	87.6	Confident	30 Å²	30	36.8 Å²	36.8	12%	0.118	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-33.3	178	-58	-33.9	0	0	0	111.9	L35 T36 I37 T75 M77 L112 C126 E128	L35-Y114 CarbonylContact C-O 3.56Å; L35-Y114 WeakPolarHBondContact CA-O 3.39Å; L35-Y114 VanDerWaalsContact CD1-CB 3.5Å; T36-Y114 PolarHBondContact N-O 3.38Å; T36-Y114 WeakPolarHBondContact O-CA 3.39Å; I37-Y114 HydrophobicContact CB-CD1 4.33Å; I37-Y114 HydrophobicContact CG1-CD1 3.85Å; I37-Y114 HydrophobicContact CG1-CD2 4.09Å; I37-Y114 HydrophobicContact CG1-CE1 4.31Å; I37-Y114 HydrophobicContact CG1-CG 3.72Å; I37-Y114 HydrophobicContact CG2-CD1 4.39Å; I37-Y114 HydrophobicContact CG2-CE1 4.08Å; T75-Y114 HydrophobicContact CG2-CE2 4.07Å; M77-Y114 HydrophobicContact CB-CD2 4Å; M77-Y114 HydrophobicContact CB-CE2 3.99Å; M77-Y114 HydrophobicContact CE-CD2 4.25Å; L112-Y114 HydrophobicContact CB-CE1 4.33Å; Y114-C126 PolarHBondContact N-O 2.95Å; Y114-E128 HydrophobicContact CE1-CB 4.41Å; Y114-E128 HydrophobicContact CE2-CB 4.41Å; Y114-E128 WeakPolarHBondContact OH-CB 3.41Å
115	G	90.3	Very high	88.9	Confident	13 Å²	13	33.8 Å²	33.8	13%	0.134	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.6	-179.9	-176.9	0	0	0	0	0	113.5	K34 C126	K34-G115 VanDerWaalsContact O-CA 3.23Å; K34-G115 WeakPolarHBondContact O-CA 3.38Å; G115-C126 PolarHBondContact N-O 3.47Å; G115-C126 PolarHBondContact O-N 2.8Å
116	A	91	Very high	90.1	Very high	8 Å²	8	33 Å²	33	7%	0.066	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	154.6	175	0	0	0	0	0	111.8	G33 L95 L98 W124	G33-A116 VanDerWaalsContact CA-O 3.32Å; G33-A116 WeakPolarHBondContact CA-O 3.38Å; L95-A116 HydrophobicContact CD2-CB 3.66Å; L98-A116 HydrophobicContact CD1-CB 3.86Å; A116-W124 CarbonylContact C-O 3.55Å; A116-W124 WeakPolarHBondContact CA-O 3.38Å
117	I	90.9	Very high	90.7	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	140	177.5	-179.1	172.1	0	0	0	109.8	C31 F46 T48 W124	C31-I117 WeakPolarHBondContact O-CD1 3.31Å; F46-I117 HydrophobicContact CE2-CB 4.34Å; F46-I117 HydrophobicContact CE2-CG2 3.9Å; F46-I117 HydrophobicContact CZ-CB 4.03Å; F46-I117 HydrophobicContact CZ-CG2 3.92Å; T48-I117 HydrophobicContact CG2-CD1 4.4Å; I117-W124 HydrophobicContact CG2-CB 3.72Å; I117-W124 HydrophobicContact CG2-CG 4.4Å; I117-W124 PolarHBondContact N-O 3.45Å; I117-W124 PolarHBondContact O-N 3.35Å
118	F	89.6	Confident	90.8	Very high	11 Å²	11	26.7 Å²	26.7	5%	0.048	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127.8	167.3	-76.9	-83.7	0	0	0	109.6	S84 L86 Q91 T94 L95 D122 C123	S84-F118 WeakPolarHBondContact OG-CE1 3.34Å; L86-F118 HydrophobicContact CD1-CZ 4.33Å; Q91-F118 HydrophobicContact CB-CD1 4.27Å; Q91-F118 HydrophobicContact CB-CD2 3.67Å; Q91-F118 HydrophobicContact CB-CE1 4.34Å; Q91-F118 HydrophobicContact CB-CE2 3.76Å; Q91-F118 HydrophobicContact CB-CG 3.94Å; Q91-F118 HydrophobicContact CB-CZ 4.09Å; Q91-F118 HydrophobicContact CG-CB 4.48Å; Q91-F118 HydrophobicContact CG-CD1 3.67Å; Q91-F118 HydrophobicContact CG-CD2 4.02Å; Q91-F118 HydrophobicContact CG-CE1 3.76Å; Q91-F118 HydrophobicContact CG-CE2 4.11Å; Q91-F118 HydrophobicContact CG-CG 3.79Å; Q91-F118 HydrophobicContact CG-CZ 3.98Å; Q91-F118 WeakPolarHBondContact O-CE2 3.22Å; T94-F118 HydrophobicContact CG2-CE2 4.42Å; T94-F118 HydrophobicContact CG2-CZ 4.1Å; L95-F118 HydrophobicContact CD1-CD2 3.95Å; L95-F118 HydrophobicContact CD1-CE2 4.44Å; L95-F118 HydrophobicContact CD2-CD2 3.78Å; L95-F118 HydrophobicContact CD2-CE2 3.76Å; L95-F118 HydrophobicContact CG-CD2 3.68Å; L95-F118 HydrophobicContact CG-CE2 3.68Å; F118-D122 WeakPolarHBondContact CA-O 3.41Å; F118-C123 HydrophobicContact CD1-CB 3.89Å; F118-C123 HydrophobicContact CE1-CB 3.46Å; F118-C123 VanDerWaalsContact CE1-CB 3.46Å; F118-C123 HydrophobicContact CZ-CB 3.95Å
119	T	89.1	Confident	90.8	Very high	12 Å²	12	25 Å²	25	7%	0.074	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	139.2	-174.5	-172.8	0	0	0	0	109.8	T48 G121 D122 W124	T48-T119 HydrophobicContact CG2-CG2 3.22Å; T119-G121 PolarHBondContact O-N 3.4Å; T119-D122 PolarHBondContact N-O 3.02Å; T119-D122 WeakPolarHBondContact O-CA 3.24Å; T119-D122 PolarHBondContact O-N 3.21Å; T119-D122 VanDerWaalsContact O-O 3.07Å; T119-W124 VanDerWaalsContact CG2-CD1 3.49Å; T119-W124 HydrophobicContact CG2-CD2 3.9Å; T119-W124 HydrophobicContact CG2-CG 3.89Å; T119-W124 HydrophobicContact CG2-CZ2 4.12Å; T119-W124 VanDerWaalsContact CG2-NE1 3.27Å
120	E	84.4	Confident	90.7	Very high	160 Å²	160	24.1 Å²	24.1	75%	0.748	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	26.6	177.4	-57.3	-175.5	161.1	0	0	115.4	D122	E120-D122 VanDerWaalsContact C-N 3.28Å; E120-D122 PolarHBondContact O-N 3.15Å
121	G	83.8	Confident	90.7	Very high	41 Å²	41	25.8 Å²	25.8	42%	0.423	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	6	-175.9	0	0	0	0	0	114.6	S84 T119	S84-G121 WeakPolarHBondContact CA-O 3.37Å; S84-G121 WeakPolarHBondContact CB-O 3.23Å; S84-G121 PolarHBondContact N-O 2.95Å; T119-G121 PolarHBondContact O-N 3.4Å
122	D	88.3	Confident	90.7	Very high	27 Å²	27	26 Å²	26	14%	0.144	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	151.3	173.2	-66.6	-23.5	0	0	0	110.8	R81 I82 R83 F118 T119 E120	R81-D122 IonicContact CZ-OD2 3.14Å; R81-D122 IonicContact NE-OD2 2.88Å; R81-D122 PolarHBondContact NE-OD2 3.26Å; R81-D122 IonicContact NH2-OD2 3.75Å; R81-D122 PolarHBondContact NH2-OD2 3.49Å; I82-D122 CarbonylContact O-C 3.28Å; I82-D122 WeakPolarHBondContact O-CA 3.34Å; R83-D122 WeakPolarHBondContact CA-OD1 3.3Å; F118-D122 WeakPolarHBondContact CA-O 3.41Å; T119-D122 PolarHBondContact N-O 3.02Å; T119-D122 WeakPolarHBondContact O-CA 3.24Å; T119-D122 PolarHBondContact O-N 3.21Å; T119-D122 VanDerWaalsContact O-O 3.07Å; E120-D122 VanDerWaalsContact C-N 3.28Å; E120-D122 PolarHBondContact O-N 3.15Å
123	C	88.8	Confident	90.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	120	161.3	-173.7	0	0	0	0	108.2	I82 F118 L203	I82-C123 PolarHBondContact N-O 3.36Å; I82-C123 PolarHBondContact O-N 3.46Å; F118-C123 HydrophobicContact CD1-CB 3.89Å; F118-C123 HydrophobicContact CE1-CB 3.46Å; F118-C123 VanDerWaalsContact CE1-CB 3.46Å; F118-C123 HydrophobicContact CZ-CB 3.95Å; C123-L203 HydrophobicContact CB-CD1 4.3Å
124	W	92.1	Very high	91.2	Very high	22 Å²	22	23.1 Å²	23.1	8%	0.083	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	119.1	175.6	-66.8	33.3	0	0	0	108	T48 L51 M68 V79 K80 R81 A116 I117 T119	T48-W124 HydrophobicContact CG2-CD2 4.1Å; T48-W124 HydrophobicContact CG2-CE3 3.88Å; T48-W124 HydrophobicContact CG2-CH2 3.89Å; T48-W124 HydrophobicContact CG2-CZ2 4.08Å; T48-W124 HydrophobicContact CG2-CZ3 3.79Å; L51-W124 HydrophobicContact CD1-CE3 3.94Å; L51-W124 HydrophobicContact CD1-CZ3 4.11Å; M68-W124 HydrophobicContact CE-CE3 4.35Å; M68-W124 HydrophobicContact CE-CH2 4.26Å; M68-W124 HydrophobicContact CE-CZ3 3.77Å; M68-W124 HydrophobicContact SD-CE3 4.35Å; M68-W124 HydrophobicContact SD-CZ3 3.9Å; V79-W124 HydrophobicContact CG1-CB 3.99Å; V79-W124 HydrophobicContact CG1-CD2 4.24Å; V79-W124 HydrophobicContact CG1-CE3 3.77Å; V79-W124 HydrophobicContact CG1-CG 4.37Å; K80-W124 WeakPolarHBondContact O-CA 3.4Å; R81-W124 HydrophobicContact CG-CD2 3.88Å; R81-W124 HydrophobicContact CG-CG 3.9Å; A116-W124 CarbonylContact C-O 3.55Å; A116-W124 WeakPolarHBondContact CA-O 3.38Å; I117-W124 HydrophobicContact CG2-CB 3.72Å; I117-W124 HydrophobicContact CG2-CG 4.4Å; I117-W124 PolarHBondContact N-O 3.45Å; I117-W124 PolarHBondContact O-N 3.35Å; T119-W124 VanDerWaalsContact CG2-CD1 3.49Å; T119-W124 HydrophobicContact CG2-CD2 3.9Å; T119-W124 HydrophobicContact CG2-CG 3.89Å; T119-W124 HydrophobicContact CG2-CZ2 4.12Å; T119-W124 VanDerWaalsContact CG2-NE1 3.27Å
125	I	90.7	Very high	91.4	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	117.5	179.5	-54.7	176.9	0	0	0	108	V79 K80 I82 F113 M127	V79-I125 WeakPolarHBondContact CA-O 3.26Å; K80-I125 PolarHBondContact N-O 3.26Å; K80-I125 PolarHBondContact O-N 2.95Å; I82-I125 HydrophobicContact CD1-CD1 3.79Å; F113-I125 HydrophobicContact CD1-CG2 3.6Å; F113-I125 HydrophobicContact CE1-CG2 3.72Å; I125-M127 HydrophobicContact CB-CE 4.14Å; I125-M127 HydrophobicContact CG2-CE 3.77Å
126	C	92.9	Very high	91.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	126.9	179.5	-57	0	0	0	0	109.5	L35 M77 Y114 G115	L35-C126 HydrophobicContact CD1-CB 4Å; M77-C126 HydrophobicContact SD-CB 3.79Å; Y114-C126 PolarHBondContact N-O 2.95Å; G115-C126 PolarHBondContact N-O 3.47Å; G115-C126 PolarHBondContact O-N 2.8Å
127	M	92.8	Very high	91.6	Very high	12 Å²	12	22.6 Å²	22.6	6%	0.059	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	166.1	-177.3	67.3	-164.8	72.6	0	0	111.6	M77 A78 K80 V111 L112 F113 I125	M77-M127 WeakPolarHBondContact CA-O 3.49Å; M77-M127 VanDerWaalsContact CB-O 3.28Å; M77-M127 WeakPolarHBondContact CB-O 3.27Å; A78-M127 HydrophobicContact CB-CG 3.82Å; A78-M127 PolarHBondContact N-O 3.42Å; A78-M127 WeakPolarHBondContact O-CG 3.21Å; A78-M127 PolarHBondContact O-N 3.27Å; K80-M127 HydrophobicContact CB-CE 3.83Å; V111-M127 HydrophobicContact CG1-CB 3.93Å; V111-M127 HydrophobicContact CG1-CG 4.09Å; V111-M127 HydrophobicContact CG1-SD 4.16Å; L112-M127 CarbonylContact O-C 3.52Å; L112-M127 VanDerWaalsContact O-CA 3.29Å; L112-M127 WeakPolarHBondContact O-CA 3.48Å; L112-M127 WeakPolarHBondContact O-CB 3.38Å; F113-M127 HydrophobicContact CD1-CB 4.13Å; F113-M127 HydrophobicContact CE1-CB 4.45Å; F113-M127 HydrophobicContact CE1-CE 4.01Å; I125-M127 HydrophobicContact CB-CE 4.14Å; I125-M127 HydrophobicContact CG2-CE 3.77Å
128	E	93.2	Very high	91.9	Very high	19 Å²	19	23.2 Å²	23.2	9%	0.089	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	147.3	175.2	67.1	175.2	139.3	0	0	111.9	V111 L112 Y114 M130 K193	V111-E128 VanDerWaalsContact CA-OE1 3.29Å; V111-E128 WeakPolarHBondContact CA-OE1 3.32Å; V111-E128 HydrophobicContact CB-CG 4.49Å; V111-E128 HydrophobicContact CG1-CG 3.69Å; L112-E128 HydrophobicContact CB-CB 4.07Å; L112-E128 HydrophobicContact CB-CG 3.92Å; L112-E128 WeakPolarHBondContact CB-OE1 3.49Å; L112-E128 PolarHBondContact N-OE1 3.05Å; L112-E128 PolarHBondContact O-N 3.18Å; Y114-E128 HydrophobicContact CE1-CB 4.41Å; Y114-E128 HydrophobicContact CE2-CB 4.41Å; Y114-E128 WeakPolarHBondContact OH-CB 3.41Å; E128-M130 HydrophobicContact CG-SD 4.35Å; E128-K193 WeakPolarHBondContact OE1-CD 3.46Å; E128-K193 IonicContact OE1-NZ 2.73Å; E128-K193 PolarHBondContact OE1-NZ 3.38Å; E128-K193 IonicContact OE2-NZ 3.12Å; E128-K193 PolarHBondContact OE2-NZ 3.33Å
129	M	94.6	Very high	92.1	Very high	57 Å²	57	24.9 Å²	24.9	28%	0.281	13%	0.134	S	C	.	.			trans	-85.8	122.3	179.4	-174.6	67.6	-171.4	0	0	109.6	I57 R67 V76 A78	I57-M129 HydrophobicContact CD1-CE 3.68Å; I57-M129 HydrophobicContact CD1-SD 3.77Å; I57-M129 HydrophobicContact CG2-CE 4.2Å; R67-M129 HydrophobicContact CB-CE 4.39Å; R67-M129 HydrophobicContact CG-CE 4.27Å; R67-M129 HydrophobicContact CG-SD 4.3Å; V76-M129 HydrophobicContact CG1-CB 4.4Å; V76-M129 HydrophobicContact CG1-CG 4.31Å; A78-M129 HydrophobicContact CB-SD 4.11Å
130	M	94.9	Very high	92.3	Very high	14 Å²	14	24.3 Å²	24.3	7%	0.069	13%	0.131	C	C	.	.			trans	-105.1	160.2	172	-58.7	-63.4	-67.7	0	0	110.1	V111 E128 L185 D187 K193	V111-M130 HydrophobicContact CG2-CG 4.37Å; E128-M130 HydrophobicContact CG-SD 4.35Å; M130-L185 HydrophobicContact CB-CB 3.79Å; M130-L185 HydrophobicContact CB-CD1 3.93Å; M130-L185 HydrophobicContact CB-CG 4.48Å; M130-L185 HydrophobicContact CE-CB 4.19Å; M130-L185 HydrophobicContact CG-CB 3.71Å; M130-L185 HydrophobicContact CG-CD1 3.67Å; M130-L185 HydrophobicContact CG-CG 4.35Å; M130-D187 HydrophobicContact CE-CB 3.87Å; M130-D187 HydrophobicContact SD-CB 4.44Å; M130-K193 HydrophobicContact CE-CB 4.1Å; M130-K193 HydrophobicContact CE-CD 4Å; M130-K193 HydrophobicContact CE-CG 3.91Å; M130-K193 HydrophobicContact SD-CD 3.94Å; M130-K193 HydrophobicContact SD-CG 4.47Å
131	S	93.2	Very high	92.7	Very high	38 Å²	38	16.7 Å²	16.7	27%	0.266	10%	0.096	S	C	.	.	S	Bend	trans	-71.2	-46.2	-177.5	-59.8	0	0	0	0	112.6	I186 D187 C188	S131-I186 WeakPolarHBondContact CB-O 3.28Å; S131-I186 PolarHBondContact N-O 3.42Å; S131-D187 WeakPolarHBondContact OG-CA 3.48Å; S131-C188 PolarHBondContact OG-N 3.39Å; S131-C188 PolarHBondContact OG-SG 3.21Å
132	T	93	Very high	93.2	Very high	7 Å²	7	15 Å²	15	4%	0.043	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	173.9	176.8	-157.6	0	0	0	0	112.4	F137 L185 I186 F363 M376	T132-F137 HydrophobicContact CG2-CB 4.03Å; T132-L185 WeakPolarHBondContact O-CA 3.23Å; T132-I186 HydrophobicContact CG2-CG2 3.88Å; T132-I186 PolarHBondContact N-O 3.49Å; T132-I186 VanDerWaalsContact N-O 3.14Å; T132-I186 PolarHBondContact O-N 2.82Å; T132-F363 HydrophobicContact CG2-CE2 3.98Å; T132-F363 HydrophobicContact CG2-CZ 3.92Å; T132-M376 HydrophobicContact CG2-CE 4.08Å
133	S	94.6	Very high	93.4	Very high	14 Å²	14	18 Å²	18	10%	0.098	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	154	168.6	67.1	0	0	0	0	111.3	D135 K136 F137 I184	S133-D135 PolarHBondContact O-N 3.43Å; S133-K136 PolarHBondContact O-N 2.78Å; S133-K136 VanDerWaalsContact O-N 3.15Å; S133-F137 PolarHBondContact O-N 3.46Å; S133-I184 CarbonylContact C-O 3.52Å; S133-I184 WeakPolarHBondContact CA-O 3.31Å
134	L	96.3	Very high	93.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.8	-28.3	177.1	-65.9	-171.8	0	0	0	112.1	K136 F137 Y138 I157 P181 I184 I186 L249	L134-K136 PolarHBondContact O-N 3.37Å; L134-F137 HydrophobicContact CD2-CD1 4.25Å; L134-F137 PolarHBondContact O-N 3.2Å; L134-Y138 WeakPolarHBondContact O-CD1 3.49Å; L134-Y138 PolarHBondContact O-N 3.15Å; L134-I157 HydrophobicContact CD1-CB 4.46Å; L134-I157 HydrophobicContact CD1-CD1 3.92Å; L134-I157 HydrophobicContact CD1-CG1 4.11Å; L134-I157 HydrophobicContact CD1-CG2 3.51Å; L134-I157 HydrophobicContact CD2-CD1 4.25Å; L134-P181 HydrophobicContact CB-CB 4.42Å; L134-P181 PolarHBondContact N-O 3.49Å; L134-I184 HydrophobicContact CD1-CB 3.8Å; L134-I184 HydrophobicContact CD1-CD1 4.45Å; L134-I184 HydrophobicContact CD1-CG2 3.4Å; L134-I184 VanDerWaalsContact CD1-CG2 3.4Å; L134-I184 HydrophobicContact CG-CB 4.06Å; L134-I184 HydrophobicContact CG-CG2 3.88Å; L134-I184 PolarHBondContact N-O 2.79Å; L134-I186 HydrophobicContact CD2-CB 4.12Å; L134-I186 HydrophobicContact CD2-CG2 3.95Å; L134-L249 HydrophobicContact CB-CD2 3.92Å; L134-L249 HydrophobicContact CD1-CD1 3.82Å; L134-L249 HydrophobicContact CD1-CD2 4.5Å
135	D	94.1	Very high	93.4	Very high	22 Å²	22	24.3 Å²	24.3	12%	0.118	12%	0.12	C	C	.	.	H	α-helix	trans	-54.8	-49.3	172.4	-178.6	81.2	0	0	0	112.7	S133 Y138 K139 P181	S133-D135 PolarHBondContact O-N 3.43Å; D135-Y138 WeakPolarHBondContact O-CD1 3.31Å; D135-Y138 WeakPolarHBondContact O-CE1 3.45Å; D135-K139 WeakPolarHBondContact O-CD 3.19Å; D135-K139 VanDerWaalsContact O-CG 3.26Å; D135-K139 WeakPolarHBondContact O-CG 3.42Å; D135-K139 PolarHBondContact O-N 3.26Å; D135-K139 WeakPolarHBondContact OD1-CE 3.35Å; D135-K139 IonicContact OD1-NZ 2.66Å; D135-K139 PolarHBondContact OD1-NZ 3.23Å; D135-K139 IonicContact OD2-NZ 3.6Å; D135-K139 PolarHBondContact OD2-NZ 3.33Å; D135-P181 HydrophobicContact CB-CB 3.93Å; D135-P181 PolarHBondContact N-O 3.13Å; D135-P181 VanDerWaalsContact N-O 3.11Å
136	K	91.8	Very high	93.4	Very high	16 Å²	16	29.1 Å²	29.1	7%	0.07	14%	0.142	C	C	.	.	H	α-helix	trans	-72.2	-39.6	178.6	-60.5	-173.4	-167.4	-178.5	0	110.8	I57 S133 L134 F140 M376 N377	I57-K136 PolarHBondContact O-NZ 2.89Å; S133-K136 PolarHBondContact O-N 2.78Å; S133-K136 VanDerWaalsContact O-N 3.15Å; L134-K136 PolarHBondContact O-N 3.37Å; K136-F140 PolarHBondContact O-N 2.64Å; K136-F140 VanDerWaalsContact O-N 3.08Å; K136-M376 WeakPolarHBondContact CD-O 3.49Å; K136-N377 VanDerWaalsContact NZ-CA 3.28Å; K136-N377 PolarHBondContact NZ-O 2.75Å; K136-N377 PolarHBondContact NZ-OD1 2.84Å
137	F	95.1	Very high	93.3	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-62.2	-52.7	-178.1	-179.4	-112.7	0	0	0	112.8	T132 S133 L134 K139 F140 V141 I149 Y362 F363 I366	T132-F137 HydrophobicContact CG2-CB 4.03Å; S133-F137 PolarHBondContact O-N 3.46Å; L134-F137 HydrophobicContact CD2-CD1 4.25Å; L134-F137 PolarHBondContact O-N 3.2Å; F137-K139 VanDerWaalsContact C-N 3.33Å; F137-K139 PolarHBondContact O-N 2.81Å; F137-F140 WeakPolarHBondContact O-CB 3.26Å; F137-F140 PolarHBondContact O-N 3.5Å; F137-V141 HydrophobicContact CD2-CG2 4.42Å; F137-V141 HydrophobicContact CE1-CG2 4.11Å; F137-V141 HydrophobicContact CE2-CG2 4.03Å; F137-V141 HydrophobicContact CZ-CG2 3.86Å; F137-V141 WeakPolarHBondContact O-CG2 3.41Å; F137-V141 PolarHBondContact O-N 3.04Å; F137-I149 HydrophobicContact CD1-CD1 3.97Å; F137-I149 HydrophobicContact CE1-CD1 3.9Å; F137-I149 HydrophobicContact CE1-CG1 4.16Å; F137-Y362 AromaticContact CE1-CE1 3.96Å; F137-Y362 HydrophobicContact CE1-CE1 3.96Å; F137-Y362 HydrophobicContact CZ-CD1 4.38Å; F137-Y362 AromaticContact CZ-CE1 3.64Å; F137-Y362 HydrophobicContact CZ-CE1 3.64Å; F137-F363 AromaticContact CD2-CD2 3.69Å; F137-F363 HydrophobicContact CD2-CD2 3.69Å; F137-F363 AromaticContact CD2-CE2 3.45Å; F137-F363 HydrophobicContact CD2-CE2 3.45Å; F137-F363 VanDerWaalsContact CD2-CE2 3.45Å; F137-F363 AromaticContact CE2-CD2 3.33Å; F137-F363 HydrophobicContact CE2-CD2 3.33Å; F137-F363 AromaticContact CE2-CE2 3.61Å; F137-F363 HydrophobicContact CE2-CE2 3.61Å; F137-F363 HydrophobicContact CG-CD2 4.45Å; F137-F363 HydrophobicContact CG-CE2 4.2Å; F137-F363 AromaticContact CZ-CD2 3.85Å; F137-F363 HydrophobicContact CZ-CD2 3.85Å; F137-F363 HydrophobicContact CZ-CE2 4.46Å; F137-I366 HydrophobicContact CD2-CG2 4.35Å; F137-I366 HydrophobicContact CE2-CB 3.86Å; F137-I366 HydrophobicContact CE2-CG1 4.15Å; F137-I366 HydrophobicContact CE2-CG2 3.55Å; F137-I366 HydrophobicContact CZ-CB 4.3Å; F137-I366 HydrophobicContact CZ-CG1 4.07Å; F137-I366 HydrophobicContact CZ-CG2 4.24Å
138	Y	95.8	Very high	93.3	Very high	14 Å²	14	30.7 Å²	30.7	6%	0.055	15%	0.15	C	C	.	.	H	α-helix	trans	-65.2	-39.6	-177.9	90.1	-103.4	0	0	0	110.7	L134 D135 F140 V141 Y142 P181 E248 L249	L134-Y138 WeakPolarHBondContact O-CD1 3.49Å; L134-Y138 PolarHBondContact O-N 3.15Å; D135-Y138 WeakPolarHBondContact O-CD1 3.31Å; D135-Y138 WeakPolarHBondContact O-CE1 3.45Å; Y138-F140 VanDerWaalsContact C-N 3.26Å; Y138-F140 PolarHBondContact O-N 2.68Å; Y138-V141 PolarHBondContact O-N 2.73Å; Y138-V141 VanDerWaalsContact O-N 3.12Å; Y138-Y142 HydrophobicContact CD2-CD2 4.28Å; Y138-Y142 VanDerWaalsContact O-CD2 3.28Å; Y138-Y142 WeakPolarHBondContact O-CD2 3.44Å; Y138-Y142 PolarHBondContact O-N 2.97Å; Y138-P181 HydrophobicContact CD1-CB 4.33Å; Y138-P181 HydrophobicContact CE1-CB 4.19Å; Y138-P181 HydrophobicContact CE1-CG 4.35Å; Y138-E248 HydrophobicContact CE1-CG 4.13Å; Y138-E248 WeakPolarHBondContact CE1-OE1 3.42Å; Y138-E248 HydrophobicContact CE2-CG 4.37Å; Y138-E248 VanDerWaalsContact CZ-OE1 3.26Å; Y138-E248 PolarHBondContact OH-OE1 3.3Å; Y138-L249 HydrophobicContact CD1-CD2 3.7Å; Y138-L249 HydrophobicContact CG-CD2 4.07Å
139	K	94.2	Very high	93.5	Very high	46 Å²	46	30 Å²	30	20%	0.2	15%	0.147	C	C	.	.	H	α-helix	trans	-59.1	-40.2	176.3	-72.5	172.8	-171.4	162.4	0	111.4	D135 F137 N143	D135-K139 WeakPolarHBondContact O-CD 3.19Å; D135-K139 VanDerWaalsContact O-CG 3.26Å; D135-K139 WeakPolarHBondContact O-CG 3.42Å; D135-K139 PolarHBondContact O-N 3.26Å; D135-K139 WeakPolarHBondContact OD1-CE 3.35Å; D135-K139 IonicContact OD1-NZ 2.66Å; D135-K139 PolarHBondContact OD1-NZ 3.23Å; D135-K139 IonicContact OD2-NZ 3.6Å; D135-K139 PolarHBondContact OD2-NZ 3.33Å; F137-K139 VanDerWaalsContact C-N 3.33Å; F137-K139 PolarHBondContact O-N 2.81Å; K139-N143 WeakPolarHBondContact O-CA 3.13Å; K139-N143 WeakPolarHBondContact O-CB 3.48Å; K139-N143 PolarHBondContact O-N 3.36Å; K139-N143 PolarHBondContact O-ND2 2.75Å
140	F	92.7	Very high	93.5	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	15%	0.149	C	C	.	.	I	π-helix	trans	-63.5	-48	173.8	-177.2	-104.9	0	0	0	111.9	K136 F137 Y138 Y142 Y144 L145 I366 V370 M376 L379	K136-F140 PolarHBondContact O-N 2.64Å; K136-F140 VanDerWaalsContact O-N 3.08Å; F137-F140 WeakPolarHBondContact O-CB 3.26Å; F137-F140 PolarHBondContact O-N 3.5Å; Y138-F140 VanDerWaalsContact C-N 3.26Å; Y138-F140 PolarHBondContact O-N 2.68Å; F140-Y142 PolarHBondContact O-N 2.95Å; F140-Y144 AromaticContact CD2-CD1 3.96Å; F140-Y144 HydrophobicContact CD2-CD1 3.96Å; F140-Y144 AromaticContact CD2-CG 3.96Å; F140-Y144 HydrophobicContact CD2-CG 3.96Å; F140-Y144 AromaticContact CE2-CD1 3.19Å; F140-Y144 HydrophobicContact CE2-CD1 3.19Å; F140-Y144 AromaticContact CE2-CE1 3.88Å; F140-Y144 HydrophobicContact CE2-CE1 3.88Å; F140-Y144 AromaticContact CE2-CG 3.6Å; F140-Y144 HydrophobicContact CE2-CG 3.6Å; F140-Y144 AromaticContact CZ-CD1 3.53Å; F140-Y144 HydrophobicContact CZ-CD1 3.53Å; F140-Y144 HydrophobicContact CZ-CE1 4.08Å; F140-Y144 HydrophobicContact CZ-CG 4.35Å; F140-Y144 WeakPolarHBondContact O-CA 3.36Å; F140-Y144 VanDerWaalsContact O-CB 3.26Å; F140-Y144 WeakPolarHBondContact O-CB 3.32Å; F140-Y144 PolarHBondContact O-N 3.12Å; F140-L145 HydrophobicContact CD1-CD1 4.07Å; F140-L145 HydrophobicContact CD1-CG 4.2Å; F140-L145 HydrophobicContact CE1-CD1 3.6Å; F140-L145 HydrophobicContact CE1-CD2 4.09Å; F140-L145 HydrophobicContact CE1-CG 3.71Å; F140-L145 HydrophobicContact CZ-CD1 4.36Å; F140-L145 HydrophobicContact CZ-CD2 4.01Å; F140-L145 HydrophobicContact CZ-CG 4.04Å; F140-L145 PolarHBondContact O-N 3.07Å; F140-I366 HydrophobicContact CD1-CG2 3.69Å; F140-I366 HydrophobicContact CE1-CG2 3.77Å; F140-V370 HydrophobicContact CD1-CG2 4.34Å; F140-V370 HydrophobicContact CE1-CG2 3.58Å; F140-V370 HydrophobicContact CE2-CG2 4.05Å; F140-V370 HydrophobicContact CZ-CB 4.08Å; F140-V370 HydrophobicContact CZ-CG2 3.44Å; F140-V370 VanDerWaalsContact CZ-CG2 3.44Å; F140-M376 HydrophobicContact CD1-SD 4.37Å; F140-M376 HydrophobicContact CG-SD 4.47Å; F140-L379 HydrophobicContact CB-CD1 3.95Å; F140-L379 HydrophobicContact CD2-CD1 3.63Å; F140-L379 HydrophobicContact CG-CD1 4.17Å
141	V	94.6	Very high	93.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.153	C	C	.	.	I	π-helix	trans	-60.3	-48.4	179.7	173.4	0	0	0	0	112.1	F137 Y138 L145 Q146 S147 I149 I366	F137-V141 HydrophobicContact CD2-CG2 4.42Å; F137-V141 HydrophobicContact CE1-CG2 4.11Å; F137-V141 HydrophobicContact CE2-CG2 4.03Å; F137-V141 HydrophobicContact CZ-CG2 3.86Å; F137-V141 WeakPolarHBondContact O-CG2 3.41Å; F137-V141 PolarHBondContact O-N 3.04Å; Y138-V141 PolarHBondContact O-N 2.73Å; Y138-V141 VanDerWaalsContact O-N 3.12Å; V141-L145 CarbonylContact O-C 3.48Å; V141-L145 WeakPolarHBondContact O-CB 3.2Å; V141-Q146 PolarHBondContact O-N 2.95Å; V141-S147 PolarHBondContact O-N 3Å; V141-I149 HydrophobicContact CB-CG1 4.36Å; V141-I149 HydrophobicContact CG1-CG1 4.05Å; V141-I149 HydrophobicContact CG2-CG1 4.38Å; V141-I366 HydrophobicContact CG2-CD1 4.35Å; V141-I366 HydrophobicContact CG2-CG1 4.38Å; V141-I366 HydrophobicContact CG2-CG2 3.89Å
142	Y	94.3	Very high	93.8	Very high	5 Å²	5	30.6 Å²	30.6	2%	0.02	15%	0.153	C	C	.	.	I	π-helix	trans	-82	-43.7	-174.5	-76.1	-98.3	0	0	0	112.7	Y138 F140 Q146 R148 I149 L249 S250 T251 I285	Y138-Y142 HydrophobicContact CD2-CD2 4.28Å; Y138-Y142 VanDerWaalsContact O-CD2 3.28Å; Y138-Y142 WeakPolarHBondContact O-CD2 3.44Å; Y138-Y142 PolarHBondContact O-N 2.97Å; F140-Y142 PolarHBondContact O-N 2.95Å; Y142-Q146 WeakPolarHBondContact O-CA 3.38Å; Y142-Q146 PolarHBondContact O-NE2 3.14Å; Y142-R148 HydrophobicContact CE1-CB 4.23Å; Y142-R148 HydrophobicContact CE1-CG 3.91Å; Y142-I149 HydrophobicContact CE2-CB 4.44Å; Y142-I149 HydrophobicContact CE2-CD1 4.25Å; Y142-I149 HydrophobicContact CE2-CG1 3.95Å; Y142-I149 PolarHBondContact OH-N 3.1Å; Y142-L249 WeakPolarHBondContact CE2-O 3.33Å; Y142-L249 PolarHBondContact OH-O 3.04Å; Y142-S250 PolarHBondContact OH-O 2.96Å; Y142-T251 WeakPolarHBondContact CE1-O 3.45Å; Y142-I285 HydrophobicContact CD1-CD1 3.95Å; Y142-I285 HydrophobicContact CE1-CD1 4.46Å
143	N	91.7	Very high	94.1	Very high	91 Å²	91	30.4 Å²	30.4	49%	0.487	15%	0.152	S	C	.	.	I	π-helix	trans	-89.6	-36.8	-172.9	-56.3	-31.1	0	0	0	112.9	K139 Q146	K139-N143 WeakPolarHBondContact O-CA 3.13Å; K139-N143 WeakPolarHBondContact O-CB 3.48Å; K139-N143 PolarHBondContact O-N 3.36Å; K139-N143 PolarHBondContact O-ND2 2.75Å; N143-Q146 PolarHBondContact O-NE2 2.88Å
144	Y	89.4	Confident	94.2	Very high	112 Å²	112	29.8 Å²	29.8	44%	0.439	15%	0.147	S	C	.	.	I	π-helix	trans	-92.6	-52.4	-177.5	-173.1	-93.8	0	0	0	111.7	F140 Q146 P371 I374	F140-Y144 AromaticContact CD2-CD1 3.96Å; F140-Y144 HydrophobicContact CD2-CD1 3.96Å; F140-Y144 AromaticContact CD2-CG 3.96Å; F140-Y144 HydrophobicContact CD2-CG 3.96Å; F140-Y144 AromaticContact CE2-CD1 3.19Å; F140-Y144 HydrophobicContact CE2-CD1 3.19Å; F140-Y144 AromaticContact CE2-CE1 3.88Å; F140-Y144 HydrophobicContact CE2-CE1 3.88Å; F140-Y144 AromaticContact CE2-CG 3.6Å; F140-Y144 HydrophobicContact CE2-CG 3.6Å; F140-Y144 AromaticContact CZ-CD1 3.53Å; F140-Y144 HydrophobicContact CZ-CD1 3.53Å; F140-Y144 HydrophobicContact CZ-CE1 4.08Å; F140-Y144 HydrophobicContact CZ-CG 4.35Å; F140-Y144 WeakPolarHBondContact O-CA 3.36Å; F140-Y144 VanDerWaalsContact O-CB 3.26Å; F140-Y144 WeakPolarHBondContact O-CB 3.32Å; F140-Y144 PolarHBondContact O-N 3.12Å; Y144-Q146 VanDerWaalsContact C-N 3.31Å; Y144-Q146 PolarHBondContact O-N 3.38Å; Y144-P371 HydrophobicContact CE1-CG 3.96Å; Y144-P371 WeakPolarHBondContact OH-CG 3.47Å; Y144-I374 HydrophobicContact CD2-CD1 4.05Å; Y144-I374 HydrophobicContact CE2-CD1 3.52Å
145	L	90.9	Very high	94.3	Very high	42 Å²	42	29.8 Å²	29.8	22%	0.22	15%	0.147	C	C	.	.	S	Bend	trans	-81.2	-10.6	-179.8	-60.6	-177.9	0	0	0	113.7	F140 V141 S147 I366 K369	F140-L145 HydrophobicContact CD1-CD1 4.07Å; F140-L145 HydrophobicContact CD1-CG 4.2Å; F140-L145 HydrophobicContact CE1-CD1 3.6Å; F140-L145 HydrophobicContact CE1-CD2 4.09Å; F140-L145 HydrophobicContact CE1-CG 3.71Å; F140-L145 HydrophobicContact CZ-CD1 4.36Å; F140-L145 HydrophobicContact CZ-CD2 4.01Å; F140-L145 HydrophobicContact CZ-CG 4.04Å; F140-L145 PolarHBondContact O-N 3.07Å; V141-L145 CarbonylContact O-C 3.48Å; V141-L145 WeakPolarHBondContact O-CB 3.2Å; L145-S147 PolarHBondContact O-N 3.01Å; L145-I366 HydrophobicContact CD1-CD1 3.83Å; L145-I366 HydrophobicContact CD1-CG2 3.84Å; L145-K369 HydrophobicContact CD1-CB 4.32Å; L145-K369 HydrophobicContact CD1-CD 4Å; L145-K369 HydrophobicContact CD2-CB 3.77Å; L145-K369 HydrophobicContact CD2-CD 4.15Å
146	Q	90.5	Very high	94.5	Very high	101 Å²	101	30.7 Å²	30.7	47%	0.472	15%	0.15	S	C	.	.			trans	50	41.7	-175.8	-61.7	-67.7	-40.9	0	0	111.5	V141 Y142 N143 Y144 I285	V141-Q146 PolarHBondContact O-N 2.95Å; Y142-Q146 WeakPolarHBondContact O-CA 3.38Å; Y142-Q146 PolarHBondContact O-NE2 3.14Å; N143-Q146 PolarHBondContact O-NE2 2.88Å; Y144-Q146 VanDerWaalsContact C-N 3.31Å; Y144-Q146 PolarHBondContact O-N 3.38Å; Q146-I285 VanDerWaalsContact O-CG2 3.29Å; Q146-I285 WeakPolarHBondContact O-CG2 3.35Å
147	S	92.1	Very high	94.9	Very high	13 Å²	13	30 Å²	30	9%	0.091	15%	0.147	C	C	.	.			trans	-124.8	-175	-179.8	-152.5	0	0	0	0	111.3	V141 L145 I285	V141-S147 PolarHBondContact O-N 3Å; L145-S147 PolarHBondContact O-N 3.01Å; S147-I285 VanDerWaalsContact C-CG2 3.43Å; S147-I285 WeakPolarHBondContact O-CG2 3.38Å
148	R	92.6	Very high	95	Very high	31 Å²	31	29.9 Å²	29.9	12%	0.117	15%	0.147	C	C	.	.			trans	-124.8	154.4	-179.3	-58.8	-167.7	-171	-93	0.8	111.4	Y142 P150 L281 P282 I285	Y142-R148 HydrophobicContact CE1-CB 4.23Å; Y142-R148 HydrophobicContact CE1-CG 3.91Å; R148-P150 WeakPolarHBondContact O-CD 3.15Å; R148-L281 VanDerWaalsContact CZ-CD1 3.44Å; R148-P282 PolarHBondContact NH2-O 3.18Å; R148-I285 HydrophobicContact CG-CB 4.34Å; R148-I285 HydrophobicContact CG-CG2 3.49Å; R148-I285 VanDerWaalsContact CG-CG2 3.49Å
149	I	96.3	Very high	95.2	Very high	6 Å²	6	30 Å²	30	3%	0.031	15%	0.148	C	C	.	.			trans	-79.9	123	166	-59	172.9	0	0	0	107.5	F137 V141 Y142 V153 I154 Y362	F137-I149 HydrophobicContact CD1-CD1 3.97Å; F137-I149 HydrophobicContact CE1-CD1 3.9Å; F137-I149 HydrophobicContact CE1-CG1 4.16Å; V141-I149 HydrophobicContact CB-CG1 4.36Å; V141-I149 HydrophobicContact CG1-CG1 4.05Å; V141-I149 HydrophobicContact CG2-CG1 4.38Å; Y142-I149 HydrophobicContact CE2-CB 4.44Å; Y142-I149 HydrophobicContact CE2-CD1 4.25Å; Y142-I149 HydrophobicContact CE2-CG1 3.95Å; Y142-I149 PolarHBondContact OH-N 3.1Å; I149-V153 HydrophobicContact CG2-CB 3.9Å; I149-V153 HydrophobicContact CG2-CG1 3.85Å; I149-I154 HydrophobicContact CB-CD1 4.03Å; I149-I154 HydrophobicContact CB-CG1 4.43Å; I149-I154 HydrophobicContact CG2-CD1 3.57Å; I149-I154 HydrophobicContact CG2-CG1 3.9Å; I149-Y362 HydrophobicContact CG2-CE1 4.4Å
150	P	96.1	Very high	95.3	Very high	51 Å²	51	28.1 Å²	28.1	33%	0.331	14%	0.142	S	C	.	.			trans	-60.2	143	178.3	-23.4	33.6	0	0	0	112.1	R148 S152 V153 I154 Y362	R148-P150 WeakPolarHBondContact O-CD 3.15Å; P150-S152 PolarHBondContact O-N 3.41Å; P150-S152 VanDerWaalsContact O-N 3.14Å; P150-V153 HydrophobicContact CB-CG2 4.23Å; P150-V153 HydrophobicContact CG-CG2 4.21Å; P150-V153 WeakPolarHBondContact O-CB 3.44Å; P150-V153 PolarHBondContact O-N 2.83Å; P150-I154 PolarHBondContact O-N 3.05Å; P150-Y362 WeakPolarHBondContact CD-OH 3.29Å; P150-Y362 HydrophobicContact CG-CE2 4.09Å
151	E	97.2	Very high	95.6	Very high	34 Å²	34	28.2 Å²	28.2	16%	0.159	14%	0.142	C	C	.	.	H	α-helix	trans	-54.6	-35.3	177.6	-176.8	179.5	128.5	0	0	112.1	V153 I154 G155 F318 S319 F322 F348 R351	E151-V153 VanDerWaalsContact C-N 3.32Å; E151-V153 PolarHBondContact O-N 2.9Å; E151-I154 CarbonylContact O-C 3.57Å; E151-I154 WeakPolarHBondContact O-CB 3.42Å; E151-I154 PolarHBondContact O-N 3.17Å; E151-G155 PolarHBondContact O-N 3.15Å; E151-F318 WeakPolarHBondContact OE2-CA 3.26Å; E151-S319 VanDerWaalsContact OE1-CB 3.23Å; E151-S319 WeakPolarHBondContact OE1-CB 3.27Å; E151-S319 PolarHBondContact OE1-OG 3.39Å; E151-S319 PolarHBondContact OE2-N 2.67Å; E151-F322 HydrophobicContact CG-CB 4.28Å; E151-F322 HydrophobicContact CG-CD1 3.73Å; E151-F322 HydrophobicContact CG-CE1 4.35Å; E151-F322 HydrophobicContact CG-CG 4.12Å; E151-F322 WeakPolarHBondContact OE1-CB 3.48Å; E151-F348 HydrophobicContact CG-CE2 4.03Å; E151-R351 IonicContact OE1-CZ 4Å; E151-R351 IonicContact OE1-NH2 3.57Å; E151-R351 PolarHBondContact OE1-NH2 2.94Å
152	S	96.9	Very high	95.8	Very high	35 Å²	35	28.2 Å²	28.2	25%	0.245	14%	0.142	C	C	.	.	H	α-helix	trans	-63.9	-34.9	177.3	60	0	0	0	0	113.1	P150 G155 K156 E355	P150-S152 PolarHBondContact O-N 3.41Å; P150-S152 VanDerWaalsContact O-N 3.14Å; S152-G155 PolarHBondContact O-N 3.49Å; S152-K156 PolarHBondContact O-N 3.49Å; S152-E355 WeakPolarHBondContact CB-OE2 3.32Å
153	V	97.9	Very high	95.9	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.024	15%	0.153	C	C	.	.	H	α-helix	trans	-71.6	-41	172.4	178.6	0	0	0	0	110.4	I149 P150 E151 G155 K156 I157 I357 Y362	I149-V153 HydrophobicContact CG2-CB 3.9Å; I149-V153 HydrophobicContact CG2-CG1 3.85Å; P150-V153 HydrophobicContact CB-CG2 4.23Å; P150-V153 HydrophobicContact CG-CG2 4.21Å; P150-V153 WeakPolarHBondContact O-CB 3.44Å; P150-V153 PolarHBondContact O-N 2.83Å; E151-V153 VanDerWaalsContact C-N 3.32Å; E151-V153 PolarHBondContact O-N 2.9Å; V153-G155 PolarHBondContact O-N 2.88Å; V153-K156 PolarHBondContact O-N 3.12Å; V153-K156 VanDerWaalsContact O-N 3.17Å; V153-I157 HydrophobicContact CG1-CD1 4.08Å; V153-I157 WeakPolarHBondContact O-CG1 3.41Å; V153-I157 PolarHBondContact O-N 3.22Å; V153-I357 HydrophobicContact CG2-CG2 4.21Å; V153-Y362 HydrophobicContact CB-CD1 4.37Å; V153-Y362 HydrophobicContact CB-CE1 4.41Å; V153-Y362 HydrophobicContact CG1-CD1 3.85Å; V153-Y362 HydrophobicContact CG1-CE1 3.91Å; V153-Y362 HydrophobicContact CG2-CD1 3.72Å; V153-Y362 HydrophobicContact CG2-CD2 4.49Å; V153-Y362 HydrophobicContact CG2-CE1 4.08Å; V153-Y362 HydrophobicContact CG2-CG 3.94Å
154	I	98.4	Very high	96.2	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-59.5	-38.2	172.3	-60.2	-63.1	0	0	0	111	I149 P150 E151 I157 T158 L246 L249 F322	I149-I154 HydrophobicContact CB-CD1 4.03Å; I149-I154 HydrophobicContact CB-CG1 4.43Å; I149-I154 HydrophobicContact CG2-CD1 3.57Å; I149-I154 HydrophobicContact CG2-CG1 3.9Å; P150-I154 PolarHBondContact O-N 3.05Å; E151-I154 CarbonylContact O-C 3.57Å; E151-I154 WeakPolarHBondContact O-CB 3.42Å; E151-I154 PolarHBondContact O-N 3.17Å; I154-I157 HydrophobicContact CD1-CD1 4.37Å; I154-I157 PolarHBondContact O-N 2.71Å; I154-T158 WeakPolarHBondContact O-CB 3.16Å; I154-T158 PolarHBondContact O-N 3.02Å; I154-T158 PolarHBondContact O-OG1 3.42Å; I154-L246 HydrophobicContact CG2-CD2 3.98Å; I154-L249 HydrophobicContact CD1-CB 3.71Å; I154-F322 HydrophobicContact CG2-CE1 4.31Å; I154-F322 HydrophobicContact CG2-CE2 4.01Å; I154-F322 HydrophobicContact CG2-CZ 3.62Å
155	G	98.4	Very high	96.5	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-57.9	-48.5	173.2	0	0	0	0	0	111.9	E151 S152 V153 I157 T158 T159 S352	E151-G155 PolarHBondContact O-N 3.15Å; S152-G155 PolarHBondContact O-N 3.49Å; V153-G155 PolarHBondContact O-N 2.88Å; G155-I157 PolarHBondContact O-N 3.3Å; G155-T158 WeakPolarHBondContact O-CB 3.29Å; G155-T158 PolarHBondContact O-N 3Å; G155-T159 WeakPolarHBondContact O-CG2 3.3Å; G155-T159 PolarHBondContact O-N 3.35Å; G155-T159 PolarHBondContact O-OG1 3.03Å; G155-S352 WeakPolarHBondContact CA-OG 3.28Å
156	K	98.3	Very high	96.7	Very high	41 Å²	41	19 Å²	19	18%	0.178	10%	0.104	C	C	.	.	H	α-helix	trans	-61.9	-44.5	175.4	-66.3	-59.5	-173.3	-171.8	0	112.5	S152 V153 T158 T159 A160 S352 L353 E355 I357 V359	S152-K156 PolarHBondContact O-N 3.49Å; V153-K156 PolarHBondContact O-N 3.12Å; V153-K156 VanDerWaalsContact O-N 3.17Å; K156-T158 VanDerWaalsContact C-N 3.28Å; K156-T158 PolarHBondContact O-N 3.32Å; K156-T159 WeakPolarHBondContact CA-OG1 3.36Å; K156-T159 PolarHBondContact O-N 2.89Å; K156-T159 PolarHBondContact O-OG1 2.94Å; K156-A160 PolarHBondContact O-N 2.86Å; K156-S352 VanDerWaalsContact CE-O 3.3Å; K156-S352 WeakPolarHBondContact CE-O 3.4Å; K156-S352 PolarHBondContact NZ-O 2.89Å; K156-L353 PolarHBondContact NZ-O 3.37Å; K156-E355 WeakPolarHBondContact CE-O 3.35Å; K156-E355 PolarHBondContact NZ-O 3.05Å; K156-I357 HydrophobicContact CG-CB 4.13Å; K156-I357 HydrophobicContact CG-CG2 4.44Å; K156-V359 HydrophobicContact CB-CG2 3.61Å; K156-V359 HydrophobicContact CG-CG2 3.7Å
157	I	98.6	Very high	96.9	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-57.9	-43.2	174.1	-69.4	161.3	0	0	0	111.1	L134 V153 I154 G155 T161 V192 L249	L134-I157 HydrophobicContact CD1-CB 4.46Å; L134-I157 HydrophobicContact CD1-CD1 3.92Å; L134-I157 HydrophobicContact CD1-CG1 4.11Å; L134-I157 HydrophobicContact CD1-CG2 3.51Å; L134-I157 HydrophobicContact CD2-CD1 4.25Å; V153-I157 HydrophobicContact CG1-CD1 4.08Å; V153-I157 WeakPolarHBondContact O-CG1 3.41Å; V153-I157 PolarHBondContact O-N 3.22Å; I154-I157 HydrophobicContact CD1-CD1 4.37Å; I154-I157 PolarHBondContact O-N 2.71Å; G155-I157 PolarHBondContact O-N 3.3Å; I157-T161 WeakPolarHBondContact O-CB 3.47Å; I157-T161 PolarHBondContact O-N 2.73Å; I157-T161 PolarHBondContact O-OG1 3.3Å; I157-V192 HydrophobicContact CG1-CG1 4.39Å; I157-V192 HydrophobicContact CG1-CG2 4.08Å; I157-V192 HydrophobicContact CG2-CG1 4.42Å; I157-L249 HydrophobicContact CG2-CD1 4.21Å
158	T	98.7	Very high	96.8	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61.9	-48	177.8	-57.3	0	0	0	0	110.8	I154 G155 K156 A160 T161 V162 L246 F325 F348	I154-T158 WeakPolarHBondContact O-CB 3.16Å; I154-T158 PolarHBondContact O-N 3.02Å; I154-T158 PolarHBondContact O-OG1 3.42Å; G155-T158 WeakPolarHBondContact O-CB 3.29Å; G155-T158 PolarHBondContact O-N 3Å; K156-T158 VanDerWaalsContact C-N 3.28Å; K156-T158 PolarHBondContact O-N 3.32Å; T158-A160 PolarHBondContact O-N 3.24Å; T158-T161 PolarHBondContact O-N 3.43Å; T158-V162 HydrophobicContact CG2-CG2 4.3Å; T158-V162 WeakPolarHBondContact O-CG2 3.5Å; T158-V162 PolarHBondContact O-N 3.27Å; T158-L246 HydrophobicContact CG2-CD1 4.14Å; T158-L246 WeakPolarHBondContact OG1-CD2 3.31Å; T158-F325 HydrophobicContact CG2-CD1 4.39Å; T158-F325 HydrophobicContact CG2-CE1 3.54Å; T158-F325 HydrophobicContact CG2-CE2 4.33Å; T158-F325 HydrophobicContact CG2-CZ 3.51Å; T158-F348 HydrophobicContact CG2-CD1 4.48Å; T158-F348 HydrophobicContact CG2-CE1 4.08Å
159	T	98.4	Very high	96.7	Very high	15 Å²	15	18.2 Å²	18.2	9%	0.092	10%	0.097	C	C	.	.	H	α-helix	trans	-60.6	-44.9	-179.2	58.2	0	0	0	0	112.5	G155 K156 S163 Y349 L353	G155-T159 WeakPolarHBondContact O-CG2 3.3Å; G155-T159 PolarHBondContact O-N 3.35Å; G155-T159 PolarHBondContact O-OG1 3.03Å; K156-T159 WeakPolarHBondContact CA-OG1 3.36Å; K156-T159 PolarHBondContact O-N 2.89Å; K156-T159 PolarHBondContact O-OG1 2.94Å; T159-S163 WeakPolarHBondContact O-CB 3.42Å; T159-S163 PolarHBondContact O-N 3.42Å; T159-Y349 VanDerWaalsContact CA-CE2 3.5Å; T159-Y349 HydrophobicContact CG2-CD2 3.95Å; T159-Y349 HydrophobicContact CG2-CE2 3.91Å; T159-Y349 HydrophobicContact CG2-CG 4.25Å; T159-Y349 PolarHBondContact O-OH 2.81Å; T159-L353 HydrophobicContact CG2-CD2 3.95Å; T159-L353 HydrophobicContact CG2-CG 4.07Å
160	A	98.2	Very high	96.5	Very high	8 Å²	8	21.1 Å²	21.1	7%	0.066	12%	0.115	C	C	.	.	H	α-helix	trans	-62	-46.4	176	0	0	0	0	0	112.1	N109 K156 T158 S163 A164 V192	N109-A160 HydrophobicContact CB-CB 4.3Å; N109-A160 VanDerWaalsContact CB-O 3.26Å; N109-A160 WeakPolarHBondContact CB-O 3.19Å; N109-A160 VanDerWaalsContact ND2-CB 3.29Å; N109-A160 WeakPolarHBondContact ND2-CB 3.4Å; K156-A160 PolarHBondContact O-N 2.86Å; T158-A160 PolarHBondContact O-N 3.24Å; A160-S163 WeakPolarHBondContact O-CB 3.41Å; A160-S163 PolarHBondContact O-N 2.88Å; A160-A164 WeakPolarHBondContact O-CB 3.31Å; A160-A164 PolarHBondContact O-N 3.07Å; A160-V192 HydrophobicContact CB-CB 3.71Å; A160-V192 HydrophobicContact CB-CG1 3.89Å
161	T	98.4	Very high	96.2	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.012	12%	0.12	C	C	.	.	H	α-helix	trans	-67.4	-44.6	-176.8	-54	0	0	0	0	111.8	I157 T158 A164 L165 V179 I184 L194 L242	I157-T161 WeakPolarHBondContact O-CB 3.47Å; I157-T161 PolarHBondContact O-N 2.73Å; I157-T161 PolarHBondContact O-OG1 3.3Å; T158-T161 PolarHBondContact O-N 3.43Å; T161-A164 PolarHBondContact O-N 3.12Å; T161-L165 HydrophobicContact CG2-CD1 4.15Å; T161-L165 WeakPolarHBondContact O-CB 3.44Å; T161-L165 VanDerWaalsContact O-CG 3.28Å; T161-L165 WeakPolarHBondContact O-CG 3.42Å; T161-L165 PolarHBondContact O-N 3.15Å; T161-V179 HydrophobicContact CG2-CG1 4.45Å; T161-I184 HydrophobicContact CG2-CD1 4.05Å; T161-L194 HydrophobicContact CG2-CD1 4.5Å; T161-L242 HydrophobicContact CG2-CD1 3.89Å
162	V	98.4	Very high	95.7	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-67.5	-37.9	177.4	171.5	0	0	0	0	111.2	T158 L165 D166 L242 F325 L343 M344 Y349	T158-V162 HydrophobicContact CG2-CG2 4.3Å; T158-V162 WeakPolarHBondContact O-CG2 3.5Å; T158-V162 PolarHBondContact O-N 3.27Å; V162-L165 PolarHBondContact O-N 3.15Å; V162-D166 WeakPolarHBondContact O-CB 3.35Å; V162-D166 PolarHBondContact O-N 3.49Å; V162-L242 HydrophobicContact CG2-CD2 3.47Å; V162-L242 VanDerWaalsContact CG2-CD2 3.47Å; V162-F325 HydrophobicContact CG2-CZ 4.32Å; V162-L343 HydrophobicContact CG1-CB 4.26Å; V162-L343 HydrophobicContact CG2-CD1 4.37Å; V162-M344 HydrophobicContact CG1-CE 4.02Å; V162-M344 HydrophobicContact CG1-CG 3.73Å; V162-Y349 HydrophobicContact CB-CD2 4.42Å; V162-Y349 HydrophobicContact CB-CE2 3.83Å; V162-Y349 HydrophobicContact CG1-CD2 4.42Å; V162-Y349 HydrophobicContact CG1-CE2 3.88Å
163	S	97.2	Very high	95.2	Very high	34 Å²	34	26.5 Å²	26.5	24%	0.238	14%	0.139	C	C	.	.	H	α-helix	trans	-57.3	-48.9	171.8	174.2	0	0	0	0	111.6	N109 T159 A160 D166 Y167	N109-S163 PolarHBondContact OD1-OG 3.3Å; N109-S163 VanDerWaalsContact OD1-OG 3.12Å; T159-S163 WeakPolarHBondContact O-CB 3.42Å; T159-S163 PolarHBondContact O-N 3.42Å; A160-S163 WeakPolarHBondContact O-CB 3.41Å; A160-S163 PolarHBondContact O-N 2.88Å; S163-D166 PolarHBondContact O-N 3.42Å; S163-Y167 WeakPolarHBondContact O-CB 3.48Å; S163-Y167 PolarHBondContact O-N 2.94Å
164	A	96.3	Very high	94.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.7	-46.8	176.9	0	0	0	0	0	112.5	N109 I110 A160 T161 Y167 L168 L194	N109-A164 HydrophobicContact CB-CB 3.93Å; N109-A164 VanDerWaalsContact O-CB 3.23Å; N109-A164 WeakPolarHBondContact O-CB 3.43Å; I110-A164 HydrophobicContact CD1-CB 4.5Å; I110-A164 HydrophobicContact CG1-CB 3.79Å; A160-A164 WeakPolarHBondContact O-CB 3.31Å; A160-A164 PolarHBondContact O-N 3.07Å; T161-A164 PolarHBondContact O-N 3.12Å; A164-Y167 PolarHBondContact O-N 2.99Å; A164-L168 VanDerWaalsContact O-CG 3.31Å; A164-L168 WeakPolarHBondContact O-CG 3.39Å; A164-L168 PolarHBondContact O-N 3.46Å; A164-L194 HydrophobicContact CB-CB 3.76Å; A164-L194 HydrophobicContact CB-CD2 3.87Å
165	L	96.1	Very high	94	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-63.2	-42.7	179	-73	172.7	0	0	0	112.7	T161 V162 L168 K169 H176 V179 L194 D238 Y340	T161-L165 HydrophobicContact CG2-CD1 4.15Å; T161-L165 WeakPolarHBondContact O-CB 3.44Å; T161-L165 VanDerWaalsContact O-CG 3.28Å; T161-L165 WeakPolarHBondContact O-CG 3.42Å; T161-L165 PolarHBondContact O-N 3.15Å; V162-L165 PolarHBondContact O-N 3.15Å; L165-L168 PolarHBondContact O-N 2.88Å; L165-K169 PolarHBondContact O-N 3.35Å; L165-K169 VanDerWaalsContact O-N 3.13Å; L165-H176 HydrophobicContact CD2-CB 3.58Å; L165-V179 HydrophobicContact CD1-CG2 4.24Å; L165-V179 HydrophobicContact CD2-CG2 3.73Å; L165-L194 HydrophobicContact CD2-CD2 3.76Å; L165-L194 HydrophobicContact CG-CD2 4.03Å; L165-D238 HydrophobicContact CD2-CB 4.21Å; L165-Y340 HydrophobicContact CB-CD1 4.11Å; L165-Y340 HydrophobicContact CB-CE1 3.67Å; L165-Y340 HydrophobicContact CB-CE2 4.09Å; L165-Y340 HydrophobicContact CD1-CE1 3.97Å; L165-Y340 HydrophobicContact CG-CE1 4.35Å; L165-Y340 WeakPolarHBondContact O-CE2 3.17Å
166	D	95.9	Very high	93.5	Very high	22 Å²	22	28.8 Å²	28.8	12%	0.118	15%	0.151	C	C	.	.	H	α-helix	trans	-62.6	-46	174.6	-172.8	78.9	0	0	0	110.9	V162 S163 L168 K169 T170 Y340 Q341 M344	V162-D166 WeakPolarHBondContact O-CB 3.35Å; V162-D166 PolarHBondContact O-N 3.49Å; S163-D166 PolarHBondContact O-N 3.42Å; D166-L168 PolarHBondContact O-N 3.05Å; D166-K169 CarbonylContact O-C 3.55Å; D166-K169 PolarHBondContact O-N 3.17Å; D166-K169 VanDerWaalsContact O-N 3.09Å; D166-T170 WeakPolarHBondContact O-CB 3.42Å; D166-T170 WeakPolarHBondContact O-CG2 3.49Å; D166-T170 PolarHBondContact O-N 3.41Å; D166-T170 PolarHBondContact O-OG1 2.95Å; D166-T170 WeakPolarHBondContact OD2-CG2 3.41Å; D166-T170 PolarHBondContact OD2-OG1 3.43Å; D166-Y340 HydrophobicContact CB-CD2 4.19Å; D166-Y340 HydrophobicContact CB-CG 4.34Å; D166-Q341 VanDerWaalsContact CG-NE2 3.27Å; D166-Q341 PolarHBondContact OD1-NE2 2.97Å; D166-Q341 PolarHBondContact OD2-NE2 3.49Å; D166-M344 HydrophobicContact CB-CE 3.38Å; D166-M344 HydrophobicContact CB-SD 4.28Å
167	Y	94.1	Very high	93	Very high	49 Å²	49	31.4 Å²	31.4	19%	0.192	16%	0.16	C	C	.	.	H	α-helix	trans	-59.3	-46.6	177.7	-175.5	-87.4	0	0	0	112.5	S104 A105 N106 C107 I110 S163 A164 K169 T170 A171 L172	S104-Y167 PolarHBondContact O-OH 3.42Å; A105-Y167 HydrophobicContact CB-CE1 4.45Å; N106-Y167 PolarHBondContact N-OH 3.31Å; C107-Y167 HydrophobicContact CB-CD1 3.58Å; C107-Y167 HydrophobicContact CB-CD2 3.84Å; C107-Y167 HydrophobicContact CB-CE1 3.85Å; C107-Y167 HydrophobicContact CB-CE2 4.1Å; C107-Y167 HydrophobicContact CB-CG 3.57Å; I110-Y167 HydrophobicContact CD1-CD1 3.47Å; I110-Y167 VanDerWaalsContact CD1-CD1 3.47Å; I110-Y167 HydrophobicContact CD1-CE1 4.22Å; I110-Y167 HydrophobicContact CD1-CG 4.24Å; S163-Y167 WeakPolarHBondContact O-CB 3.48Å; S163-Y167 PolarHBondContact O-N 2.94Å; A164-Y167 PolarHBondContact O-N 2.99Å; Y167-K169 PolarHBondContact O-N 3.16Å; Y167-T170 PolarHBondContact O-N 3Å; Y167-A171 HydrophobicContact CD1-CB 4.23Å; Y167-A171 HydrophobicContact CD2-CB 4Å; Y167-A171 HydrophobicContact CE1-CB 3.95Å; Y167-A171 HydrophobicContact CE2-CB 3.7Å; Y167-A171 HydrophobicContact CG-CB 4.25Å; Y167-A171 VanDerWaalsContact O-CB 3.32Å; Y167-A171 WeakPolarHBondContact O-CB 3.49Å; Y167-A171 PolarHBondContact O-N 3.28Å; Y167-L172 HydrophobicContact CD1-CD1 4.48Å; Y167-L172 HydrophobicContact CD1-CG 4.34Å; Y167-L172 HydrophobicContact CE1-CD1 4.12Å; Y167-L172 HydrophobicContact CE1-CD2 4.19Å; Y167-L172 HydrophobicContact CE1-CG 3.93Å; Y167-L172 PolarHBondContact O-N 2.96Å
168	L	91.1	Very high	92.4	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-53.6	-44.1	174.8	-72.9	178.3	0	0	0	110.9	I110 A164 L165 D166 L172 K173 V174 H176 L194 F197	I110-L168 HydrophobicContact CD1-CD2 3.67Å; I110-L168 HydrophobicContact CD1-CG 3.83Å; A164-L168 VanDerWaalsContact O-CG 3.31Å; A164-L168 WeakPolarHBondContact O-CG 3.39Å; A164-L168 PolarHBondContact O-N 3.46Å; L165-L168 PolarHBondContact O-N 2.88Å; D166-L168 PolarHBondContact O-N 3.05Å; L168-L172 HydrophobicContact CD2-CD1 3.87Å; L168-L172 CarbonylContact O-C 3.56Å; L168-L172 WeakPolarHBondContact O-CA 3.43Å; L168-L172 WeakPolarHBondContact O-CB 3.16Å; L168-L172 PolarHBondContact O-N 3.49Å; L168-K173 PolarHBondContact O-N 3.23Å; L168-V174 CarbonylContact C-O 3.52Å; L168-V174 PolarHBondContact O-N 3.19Å; L168-V174 VanDerWaalsContact O-O 3.14Å; L168-H176 HydrophobicContact CD1-CB 4.21Å; L168-L194 HydrophobicContact CD1-CD2 3.96Å; L168-F197 HydrophobicContact CD1-CB 3.74Å; L168-F197 HydrophobicContact CD1-CD1 4.33Å; L168-F197 HydrophobicContact CD1-CD2 4.34Å; L168-F197 HydrophobicContact CD1-CG 3.89Å; L168-F197 HydrophobicContact CD2-CB 4.26Å; L168-F197 HydrophobicContact CD2-CD1 4.17Å; L168-F197 HydrophobicContact CD2-CD2 3.27Å; L168-F197 HydrophobicContact CD2-CE1 4.38Å; L168-F197 HydrophobicContact CD2-CE2 3.49Å; L168-F197 VanDerWaalsContact CD2-CE2 3.49Å; L168-F197 HydrophobicContact CD2-CG 3.63Å; L168-F197 HydrophobicContact CD2-CZ 4.06Å; L168-F197 HydrophobicContact CG-CD2 4.44Å; L168-F197 HydrophobicContact CG-CG 4.43Å
169	K	90.7	Very high	92.2	Very high	79 Å²	79	32.3 Å²	32.3	34%	0.343	17%	0.165	S	C	.	.	H	α-helix	trans	-73.4	-47.8	-178.8	174	57.8	-177.5	159.9	0	113	L165 D166 Y167 K173 V174 I235 Y340	L165-K169 PolarHBondContact O-N 3.35Å; L165-K169 VanDerWaalsContact O-N 3.13Å; D166-K169 CarbonylContact O-C 3.55Å; D166-K169 PolarHBondContact O-N 3.17Å; D166-K169 VanDerWaalsContact O-N 3.09Å; Y167-K169 PolarHBondContact O-N 3.16Å; K169-K173 WeakPolarHBondContact O-CA 3.47Å; K169-K173 WeakPolarHBondContact O-CD 3.28Å; K169-K173 PolarHBondContact O-N 3.35Å; K169-V174 WeakPolarHBondContact CA-O 3.37Å; K169-V174 PolarHBondContact N-O 2.95Å; K169-I235 HydrophobicContact CB-CG2 4.19Å; K169-I235 HydrophobicContact CD-CG2 3.64Å; K169-I235 HydrophobicContact CG-CG2 3.84Å; K169-Y340 HydrophobicContact CB-CD2 4.28Å; K169-Y340 HydrophobicContact CB-CE2 3.86Å; K169-Y340 HydrophobicContact CG-CE2 4.39Å
170	T	92.2	Very high	92	Very high	66 Å²	66	33.4 Å²	33.4	41%	0.405	17%	0.169	S	C	.	.	H	α-helix	trans	-81.8	-45.6	-169.1	58.3	0	0	0	0	111.3	D166 Y167 K173	D166-T170 WeakPolarHBondContact O-CB 3.42Å; D166-T170 WeakPolarHBondContact O-CG2 3.49Å; D166-T170 PolarHBondContact O-N 3.41Å; D166-T170 PolarHBondContact O-OG1 2.95Å; D166-T170 WeakPolarHBondContact OD2-CG2 3.41Å; D166-T170 PolarHBondContact OD2-OG1 3.43Å; Y167-T170 PolarHBondContact O-N 3Å; T170-K173 PolarHBondContact O-NZ 2.94Å
171	A	89.8	Confident	91.9	Very high	51 Å²	51	33 Å²	33	42%	0.421	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-48.3	-179.1	0	0	0	0	0	112.4	Y167	Y167-A171 HydrophobicContact CD1-CB 4.23Å; Y167-A171 HydrophobicContact CD2-CB 4Å; Y167-A171 HydrophobicContact CE1-CB 3.95Å; Y167-A171 HydrophobicContact CE2-CB 3.7Å; Y167-A171 HydrophobicContact CG-CB 4.25Å; Y167-A171 VanDerWaalsContact O-CB 3.32Å; Y167-A171 WeakPolarHBondContact O-CB 3.49Å; Y167-A171 PolarHBondContact O-N 3.28Å
172	L	85.7	Confident	91.6	Very high	26 Å²	26	35 Å²	35	14%	0.136	18%	0.179	C	C	.	.	S	Bend	trans	-96.8	-8.8	-171.8	-51.9	-174	0	0	0	114.4	V101 A105 Y167 L168 V174 F197	V101-L172 HydrophobicContact CG1-CD1 4.13Å; A105-L172 HydrophobicContact CB-CD1 4.16Å; Y167-L172 HydrophobicContact CD1-CD1 4.48Å; Y167-L172 HydrophobicContact CD1-CG 4.34Å; Y167-L172 HydrophobicContact CE1-CD1 4.12Å; Y167-L172 HydrophobicContact CE1-CD2 4.19Å; Y167-L172 HydrophobicContact CE1-CG 3.93Å; Y167-L172 PolarHBondContact O-N 2.96Å; L168-L172 HydrophobicContact CD2-CD1 3.87Å; L168-L172 CarbonylContact O-C 3.56Å; L168-L172 WeakPolarHBondContact O-CA 3.43Å; L168-L172 WeakPolarHBondContact O-CB 3.16Å; L168-L172 PolarHBondContact O-N 3.49Å; L172-V174 HydrophobicContact CB-CB 4.35Å; L172-V174 HydrophobicContact CB-CG2 4.11Å; L172-V174 PolarHBondContact O-N 3.09Å; L172-V174 VanDerWaalsContact O-N 3.15Å; L172-F197 HydrophobicContact CD1-CE2 4.33Å
173	K	85.9	Confident	91.4	Very high	156 Å²	156	35.4 Å²	35.4	68%	0.678	18%	0.181	S	C	*	.			trans	55.6	24.9	-172.9	-49	-51.1	-175.2	-161.9	0	113.6	L168 K169 T170	L168-K173 PolarHBondContact O-N 3.23Å; K169-K173 WeakPolarHBondContact O-CA 3.47Å; K169-K173 WeakPolarHBondContact O-CD 3.28Å; K169-K173 PolarHBondContact O-N 3.35Å; T170-K173 PolarHBondContact O-NZ 2.94Å
174	V	84.5	Confident	91.4	Very high	21 Å²	21	33.8 Å²	33.8	13%	0.127	17%	0.17	C	C	.	.			trans	-98.2	149	177.1	172.5	0	0	0	0	109.3	V101 L168 K169 L172 F197	V101-V174 HydrophobicContact CG1-CG2 4.47Å; L168-V174 CarbonylContact C-O 3.52Å; L168-V174 PolarHBondContact O-N 3.19Å; L168-V174 VanDerWaalsContact O-O 3.14Å; K169-V174 WeakPolarHBondContact CA-O 3.37Å; K169-V174 PolarHBondContact N-O 2.95Å; L172-V174 HydrophobicContact CB-CB 4.35Å; L172-V174 HydrophobicContact CB-CG2 4.11Å; L172-V174 PolarHBondContact O-N 3.09Å; L172-V174 VanDerWaalsContact O-N 3.15Å; V174-F197 HydrophobicContact CG1-CD2 4.41Å
175	I	86.4	Confident	91.4	Very high	29 Å²	29	35 Å²	35	15%	0.149	18%	0.177	C	C	.	.			trans	-119.4	140.2	168.7	-53.7	172.1	0	0	0	106.5	Y233 I235 D238	I175-Y233 HydrophobicContact CB-CD1 4.37Å; I175-Y233 HydrophobicContact CB-CE1 3.51Å; I175-Y233 HydrophobicContact CD1-CD1 3.59Å; I175-Y233 HydrophobicContact CD1-CE1 3.59Å; I175-Y233 HydrophobicContact CG1-CE1 4.14Å; I175-Y233 HydrophobicContact CG2-CD1 4.31Å; I175-Y233 HydrophobicContact CG2-CE1 3.27Å; I175-Y233 VanDerWaalsContact CG2-CZ 3.49Å; I175-Y233 WeakPolarHBondContact CG2-OH 3.45Å; I175-I235 HydrophobicContact CD1-CG2 4.12Å; I175-I235 HydrophobicContact CG1-CG2 3.82Å; I175-I235 HydrophobicContact CG2-CG2 4.12Å; I175-D238 WeakPolarHBondContact CG2-OD2 3.39Å
176	H	88.8	Confident	91.4	Very high	3 Å²	3	35 Å²	35	1%	0.014	18%	0.177	C	C	.	.			trans	-70.8	-45.5	-164.6	-171.4	-80.8	0	0	0	113.5	L165 L168 D178 V179 L194 C195 D238	L165-H176 HydrophobicContact CD2-CB 3.58Å; L168-H176 HydrophobicContact CD1-CB 4.21Å; H176-D178 VanDerWaalsContact CE1-C 3.42Å; H176-D178 PolarHBondContact CE1-O 2.73Å; H176-D178 VanDerWaalsContact CE1-O 3.23Å; H176-D178 PolarHBondContact ND1-N 2.96Å; H176-D178 VanDerWaalsContact ND1-N 3.17Å; H176-D178 PolarHBondContact O-N 3.03Å; H176-D178 VanDerWaalsContact O-N 3.12Å; H176-V179 HydrophobicContact CB-CG2 3.93Å; H176-V179 PolarHBondContact ND1-N 3.27Å; H176-L194 WeakPolarHBondContact CD2-CD2 3.21Å; H176-L194 WeakPolarHBondContact NE2-CG 3.34Å; H176-C195 PolarHBondContact NE2-O 3.29Å; H176-D238 WeakPolarHBondContact CA-OD2 3.32Å; H176-D238 VanDerWaalsContact CB-OD2 3.26Å; H176-D238 WeakPolarHBondContact CB-OD2 3.34Å; H176-D238 PolarHBondContact N-OD2 3.41Å
177	R	87.4	Confident	91.4	Very high	96 Å²	96	34.8 Å²	34.8	36%	0.362	18%	0.176	S	C	.	.	S	Bend	trans	71	-13.6	178.2	-62.8	167.4	177.2	-160.6	2.4	117.3	R223 Y233 D238	R177-R223 PolarHBondContact O-NH1 3.1Å; R177-Y233 VanDerWaalsContact CA-OH 3.25Å; R177-Y233 WeakPolarHBondContact CA-OH 3.46Å; R177-Y233 HydrophobicContact CG-CE1 3.5Å; R177-Y233 HydrophobicContact CG-CE2 4.12Å; R177-Y233 WeakPolarHBondContact CG-OH 3.32Å; R177-Y233 PolarHBondContact N-OH 2.97Å; R177-D238 WeakPolarHBondContact CA-OD1 3.44Å; R177-D238 PolarHBondContact N-OD1 2.81Å; R177-D238 PolarHBondContact N-OD2 2.91Å
178	D	87	Confident	91.3	Very high	20 Å²	20	35 Å²	35	11%	0.107	18%	0.184	C	C	.	.			trans	-142.9	46	-176.7	-155.8	8.6	0	0	0	113.2	H176 K180 N183 K216	H176-D178 VanDerWaalsContact CE1-C 3.42Å; H176-D178 PolarHBondContact CE1-O 2.73Å; H176-D178 VanDerWaalsContact CE1-O 3.23Å; H176-D178 PolarHBondContact ND1-N 2.96Å; H176-D178 VanDerWaalsContact ND1-N 3.17Å; H176-D178 PolarHBondContact O-N 3.03Å; H176-D178 VanDerWaalsContact O-N 3.12Å; D178-K180 PolarHBondContact O-N 2.85Å; D178-K180 WeakPolarHBondContact OD1-CE 3.48Å; D178-K180 IonicContact OD1-NZ 3.48Å; D178-K180 PolarHBondContact OD1-NZ 2.9Å; D178-K180 IonicContact OD2-NZ 3.02Å; D178-K180 PolarHBondContact OD2-NZ 3.31Å; D178-N183 PolarHBondContact O-ND2 3.35Å; D178-K216 WeakPolarHBondContact OD1-CD 3.39Å; D178-K216 IonicContact OD1-NZ 3.03Å; D178-K216 IonicContact OD2-NZ 3.18Å; D178-K216 PolarHBondContact OD2-NZ 2.98Å
179	V	94	Very high	91.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.218	C	C	.	.			trans	-69.7	125.2	176.6	-178.9	0	0	0	0	109.2	T161 L165 H176 D238 S241 L242	T161-V179 HydrophobicContact CG2-CG1 4.45Å; L165-V179 HydrophobicContact CD1-CG2 4.24Å; L165-V179 HydrophobicContact CD2-CG2 3.73Å; H176-V179 HydrophobicContact CB-CG2 3.93Å; H176-V179 PolarHBondContact ND1-N 3.27Å; V179-D238 HydrophobicContact CG2-CB 3.98Å; V179-S241 WeakPolarHBondContact O-CB 3.41Å; V179-L242 HydrophobicContact CG1-CB 4.41Å
180	K	94.6	Very high	91.7	Very high	37 Å²	37	38.4 Å²	38.4	16%	0.161	21%	0.209	C	C	.	.	S	Bend	trans	-169.3	163.1	180	58.6	-171.8	177.2	-152.9	0	110.2	D178 S182 N183 I184 Y218 T245	D178-K180 PolarHBondContact O-N 2.85Å; D178-K180 WeakPolarHBondContact OD1-CE 3.48Å; D178-K180 IonicContact OD1-NZ 3.48Å; D178-K180 PolarHBondContact OD1-NZ 2.9Å; D178-K180 IonicContact OD2-NZ 3.02Å; D178-K180 PolarHBondContact OD2-NZ 3.31Å; K180-S182 WeakPolarHBondContact CD-OG 3.41Å; K180-S182 VanDerWaalsContact CE-OG 3.27Å; K180-S182 WeakPolarHBondContact CE-OG 3.12Å; K180-S182 WeakPolarHBondContact CG-OG 3.44Å; K180-S182 PolarHBondContact O-N 3.43Å; K180-S182 VanDerWaalsContact O-N 3.08Å; K180-N183 HydrophobicContact CG-CB 4.24Å; K180-N183 PolarHBondContact O-N 3.12Å; K180-I184 PolarHBondContact O-N 2.85Å; K180-Y218 HydrophobicContact CB-CD1 3.97Å; K180-Y218 HydrophobicContact CB-CD2 3.57Å; K180-Y218 HydrophobicContact CB-CE1 3.98Å; K180-Y218 HydrophobicContact CB-CE2 3.58Å; K180-Y218 HydrophobicContact CB-CG 3.79Å; K180-Y218 HydrophobicContact CD-CD2 4.09Å; K180-Y218 HydrophobicContact CD-CE2 4.1Å; K180-Y218 HydrophobicContact CG-CD2 4.49Å; K180-Y218 HydrophobicContact CG-CE2 4.47Å; K180-T245 WeakPolarHBondContact CA-OG1 3.2Å
181	P	96	Very high	91.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-52.1	-34	179.5	-27.8	33.9	0	0	0	114.8	L134 D135 Y138 N183 I184 Y218 T245 L249	L134-P181 HydrophobicContact CB-CB 4.42Å; L134-P181 PolarHBondContact N-O 3.49Å; D135-P181 HydrophobicContact CB-CB 3.93Å; D135-P181 PolarHBondContact N-O 3.13Å; D135-P181 VanDerWaalsContact N-O 3.11Å; Y138-P181 HydrophobicContact CD1-CB 4.33Å; Y138-P181 HydrophobicContact CE1-CB 4.19Å; Y138-P181 HydrophobicContact CE1-CG 4.35Å; P181-N183 VanDerWaalsContact C-N 3.28Å; P181-N183 PolarHBondContact O-N 3.37Å; P181-I184 PolarHBondContact O-N 2.82Å; P181-Y218 HydrophobicContact CG-CE1 4.43Å; P181-T245 HydrophobicContact CG-CG2 3.98Å; P181-L249 HydrophobicContact CB-CD2 4.16Å; P181-L249 HydrophobicContact CG-CD2 4.29Å; P181-L249 HydrophobicContact CG-CG 4.47Å
182	S	92.4	Very high	92.3	Very high	43 Å²	43	36.2 Å²	36.2	30%	0.301	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-73.4	-17.3	-179.1	43.1	0	0	0	0	114.3	K180	K180-S182 WeakPolarHBondContact CD-OG 3.41Å; K180-S182 VanDerWaalsContact CE-OG 3.27Å; K180-S182 WeakPolarHBondContact CE-OG 3.12Å; K180-S182 WeakPolarHBondContact CG-OG 3.44Å; K180-S182 PolarHBondContact O-N 3.43Å; K180-S182 VanDerWaalsContact O-N 3.08Å
183	N	93.7	Very high	92.8	Very high	9 Å²	9	35.9 Å²	35.9	5%	0.048	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-103.6	5.5	178.3	-72.7	-4.1	0	0	0	113	D178 K180 P181 C195	D178-N183 PolarHBondContact O-ND2 3.35Å; K180-N183 HydrophobicContact CG-CB 4.24Å; K180-N183 PolarHBondContact O-N 3.12Å; P181-N183 VanDerWaalsContact C-N 3.28Å; P181-N183 PolarHBondContact O-N 3.37Å; N183-C195 PolarHBondContact O-N 3.32Å; N183-C195 PolarHBondContact O-SG 2.89Å; N183-C195 VanDerWaalsContact O-SG 3.39Å
184	I	96.8	Very high	93.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	120.3	171.7	-54.6	169.3	0	0	0	106.7	S133 L134 T161 K180 P181 V192 L194 T245	S133-I184 CarbonylContact C-O 3.52Å; S133-I184 WeakPolarHBondContact CA-O 3.31Å; L134-I184 HydrophobicContact CD1-CB 3.8Å; L134-I184 HydrophobicContact CD1-CD1 4.45Å; L134-I184 HydrophobicContact CD1-CG2 3.4Å; L134-I184 VanDerWaalsContact CD1-CG2 3.4Å; L134-I184 HydrophobicContact CG-CB 4.06Å; L134-I184 HydrophobicContact CG-CG2 3.88Å; L134-I184 PolarHBondContact N-O 2.79Å; T161-I184 HydrophobicContact CG2-CD1 4.05Å; K180-I184 PolarHBondContact O-N 2.85Å; P181-I184 PolarHBondContact O-N 2.82Å; I184-V192 HydrophobicContact CG2-CG1 3.56Å; I184-L194 HydrophobicContact CG1-CD1 3.97Å; I184-T245 HydrophobicContact CD1-CG2 3.86Å
185	L	96.3	Very high	93.6	Very high	27 Å²	27	27.9 Å²	27.9	14%	0.141	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	152.3	-174.4	-51.8	-171.6	0	0	0	110.7	V111 M130 T132 V192 K193 C195	V111-L185 HydrophobicContact CG2-CD1 3.93Å; V111-L185 HydrophobicContact CG2-CG 4.48Å; M130-L185 HydrophobicContact CB-CB 3.79Å; M130-L185 HydrophobicContact CB-CD1 3.93Å; M130-L185 HydrophobicContact CB-CG 4.48Å; M130-L185 HydrophobicContact CE-CB 4.19Å; M130-L185 HydrophobicContact CG-CB 3.71Å; M130-L185 HydrophobicContact CG-CD1 3.67Å; M130-L185 HydrophobicContact CG-CG 4.35Å; T132-L185 WeakPolarHBondContact O-CA 3.23Å; L185-V192 WeakPolarHBondContact O-CA 3.44Å; L185-K193 PolarHBondContact N-O 2.57Å; L185-K193 PolarHBondContact O-N 2.57Å; L185-C195 HydrophobicContact CD1-CB 3.99Å; L185-C195 HydrophobicContact CG-CB 4.25Å
186	I	96.8	Very high	93.5	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	146.7	178	-171.6	166.4	0	0	0	110.8	S131 T132 L134 N191 V192 V359 F363	S131-I186 WeakPolarHBondContact CB-O 3.28Å; S131-I186 PolarHBondContact N-O 3.42Å; T132-I186 HydrophobicContact CG2-CG2 3.88Å; T132-I186 PolarHBondContact N-O 3.49Å; T132-I186 VanDerWaalsContact N-O 3.14Å; T132-I186 PolarHBondContact O-N 2.82Å; L134-I186 HydrophobicContact CD2-CB 4.12Å; L134-I186 HydrophobicContact CD2-CG2 3.95Å; I186-N191 VanDerWaalsContact CA-O 3.31Å; I186-N191 WeakPolarHBondContact CA-O 3.24Å; I186-V192 HydrophobicContact CD1-CG2 4.34Å; I186-V192 HydrophobicContact CG1-CG2 4.41Å; I186-V359 HydrophobicContact CD1-CG1 3.86Å; I186-F363 HydrophobicContact CD1-CB 4.16Å; I186-F363 HydrophobicContact CD1-CD2 3.84Å; I186-F363 HydrophobicContact CD1-CE2 4.44Å; I186-F363 HydrophobicContact CD1-CG 4Å; I186-F363 HydrophobicContact CG1-CD1 4.48Å; I186-F363 HydrophobicContact CG1-CD2 4.23Å; I186-F363 HydrophobicContact CG1-CE2 4.47Å; I186-F363 HydrophobicContact CG1-CG 4.25Å; I186-F363 HydrophobicContact CG2-CD2 4.05Å; I186-F363 HydrophobicContact CG2-CE2 3.54Å; I186-F363 HydrophobicContact CG2-CZ 3.82Å
187	D	94.5	Very high	92.9	Very high	17 Å²	17	27.6 Å²	27.6	9%	0.091	15%	0.149	C	C	.	.			trans	-122.9	175.6	174.4	67.8	23.5	0	0	0	113.6	M130 S131 D189 G190 N191 F363	M130-D187 HydrophobicContact CE-CB 3.87Å; M130-D187 HydrophobicContact SD-CB 4.44Å; S131-D187 WeakPolarHBondContact OG-CA 3.48Å; D187-D189 PolarHBondContact O-N 3.11Å; D187-D189 PolarHBondContact OD1-N 3.34Å; D187-D189 VanDerWaalsContact OD1-N 3.1Å; D187-G190 PolarHBondContact O-N 3.08Å; D187-G190 VanDerWaalsContact O-N 3.11Å; D187-G190 PolarHBondContact OD1-N 2.85Å; D187-G190 VanDerWaalsContact OD1-N 3.13Å; D187-N191 PolarHBondContact N-O 2.89Å; D187-N191 WeakPolarHBondContact OD1-CB 3.46Å; D187-N191 PolarHBondContact OD1-N 2.95Å; D187-N191 PolarHBondContact OD1-ND2 2.82Å; D187-N191 WeakPolarHBondContact OD2-CB 3.41Å; D187-N191 PolarHBondContact OD2-ND2 2.78Å; D187-F363 VanDerWaalsContact O-CD1 3.23Å; D187-F363 WeakPolarHBondContact O-CD1 3.14Å
188	C	93	Very high	92	Very high	54 Å²	54	23.5 Å²	23.5	37%	0.365	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.4	-177.8	-58.3	0	0	0	0	113.8	S131 G190	S131-C188 PolarHBondContact OG-N 3.39Å; S131-C188 PolarHBondContact OG-SG 3.21Å; C188-G190 PolarHBondContact O-N 3.39Å
189	D	94.7	Very high	90.9	Very high	135 Å²	135	23 Å²	23	72%	0.722	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-4.1	176	-61.7	-40.4	0	0	0	111.6	D187	D187-D189 PolarHBondContact O-N 3.11Å; D187-D189 PolarHBondContact OD1-N 3.34Å; D187-D189 VanDerWaalsContact OD1-N 3.1Å
190	G	95.2	Very high	89.6	Confident	15 Å²	15	23 Å²	23	16%	0.155	13%	0.134	C	C	.	.			trans	84.2	12.5	-179.8	0	0	0	0	0	113.8	D187 C188 V192 G360	D187-G190 PolarHBondContact O-N 3.08Å; D187-G190 VanDerWaalsContact O-N 3.11Å; D187-G190 PolarHBondContact OD1-N 2.85Å; D187-G190 VanDerWaalsContact OD1-N 3.13Å; C188-G190 PolarHBondContact O-N 3.39Å; G190-V192 PolarHBondContact O-N 2.91Å; G190-G360 VanDerWaalsContact CA-CA 3.46Å
191	N	97.1	Very high	88.1	Confident	65 Å²	65	22.1 Å²	22.1	35%	0.348	14%	0.135	S	C	.	.			trans	-71.3	132.2	174.7	-54.8	-61.4	0	0	0	109.4	I186 D187 K193	I186-N191 VanDerWaalsContact CA-O 3.31Å; I186-N191 WeakPolarHBondContact CA-O 3.24Å; D187-N191 PolarHBondContact N-O 2.89Å; D187-N191 WeakPolarHBondContact OD1-CB 3.46Å; D187-N191 PolarHBondContact OD1-N 2.95Å; D187-N191 PolarHBondContact OD1-ND2 2.82Å; D187-N191 WeakPolarHBondContact OD2-CB 3.41Å; D187-N191 PolarHBondContact OD2-ND2 2.78Å; N191-K193 HydrophobicContact CB-CG 4.41Å
192	V	98	Very high	86.7	Confident	7 Å²	7	27 Å²	27	4%	0.042	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121.3	172	179.4	0	0	0	0	108.3	N109 I157 A160 I184 L185 I186 G190	N109-V192 PolarHBondContact ND2-O 2.88Å; I157-V192 HydrophobicContact CG1-CG1 4.39Å; I157-V192 HydrophobicContact CG1-CG2 4.08Å; I157-V192 HydrophobicContact CG2-CG1 4.42Å; A160-V192 HydrophobicContact CB-CB 3.71Å; A160-V192 HydrophobicContact CB-CG1 3.89Å; I184-V192 HydrophobicContact CG2-CG1 3.56Å; L185-V192 WeakPolarHBondContact O-CA 3.44Å; I186-V192 HydrophobicContact CD1-CG2 4.34Å; I186-V192 HydrophobicContact CG1-CG2 4.41Å; G190-V192 PolarHBondContact O-N 2.91Å
193	K	96.7	Very high	85.5	Confident	18 Å²	18	25.5 Å²	25.5	8%	0.078	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	138.9	-171.9	-57.6	-168.9	-178.7	-176.9	0	112.8	P108 N109 V111 E128 M130 L185 N191	P108-K193 VanDerWaalsContact O-CE 3.25Å; P108-K193 WeakPolarHBondContact O-CE 3.43Å; P108-K193 WeakPolarHBondContact O-CG 3.3Å; N109-K193 CarbonylContact O-C 3.59Å; N109-K193 VanDerWaalsContact O-CA 3.31Å; N109-K193 WeakPolarHBondContact O-CA 3.45Å; V111-K193 HydrophobicContact CG2-CB 3.72Å; E128-K193 WeakPolarHBondContact OE1-CD 3.46Å; E128-K193 IonicContact OE1-NZ 2.73Å; E128-K193 PolarHBondContact OE1-NZ 3.38Å; E128-K193 IonicContact OE2-NZ 3.12Å; E128-K193 PolarHBondContact OE2-NZ 3.33Å; M130-K193 HydrophobicContact CE-CB 4.1Å; M130-K193 HydrophobicContact CE-CD 4Å; M130-K193 HydrophobicContact CE-CG 3.91Å; M130-K193 HydrophobicContact SD-CD 3.94Å; M130-K193 HydrophobicContact SD-CG 4.47Å; L185-K193 PolarHBondContact N-O 2.57Å; L185-K193 PolarHBondContact O-N 2.57Å; N191-K193 HydrophobicContact CB-CG 4.41Å
194	L	95.2	Very high	84.1	Confident	2 Å²	2	25.4 Å²	25.4	1%	0.01	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	134.5	176.1	-167.7	64.8	0	0	0	110.1	N109 V111 T161 A164 L165 L168 H176 I184	N109-L194 PolarHBondContact O-N 2.83Å; V111-L194 PolarHBondContact N-O 3.04Å; T161-L194 HydrophobicContact CG2-CD1 4.5Å; A164-L194 HydrophobicContact CB-CB 3.76Å; A164-L194 HydrophobicContact CB-CD2 3.87Å; L165-L194 HydrophobicContact CD2-CD2 3.76Å; L165-L194 HydrophobicContact CG-CD2 4.03Å; L168-L194 HydrophobicContact CD1-CD2 3.96Å; H176-L194 WeakPolarHBondContact CD2-CD2 3.21Å; H176-L194 WeakPolarHBondContact NE2-CG 3.34Å; I184-L194 HydrophobicContact CG1-CD1 3.97Å
195	C	91.2	Very high	82.6	Confident	7 Å²	7	26.9 Å²	26.9	5%	0.047	15%	0.154	C	C	.	.			trans	-123.4	176.1	178.9	77.8	0	0	0	0	111.7	V111 H176 N183 L185 F197	V111-C195 HydrophobicContact CB-CB 4.07Å; V111-C195 HydrophobicContact CG2-CB 3.65Å; H176-C195 PolarHBondContact NE2-O 3.29Å; N183-C195 PolarHBondContact O-N 3.32Å; N183-C195 PolarHBondContact O-SG 2.89Å; N183-C195 VanDerWaalsContact O-SG 3.39Å; L185-C195 HydrophobicContact CD1-CB 3.99Å; L185-C195 HydrophobicContact CG-CB 4.25Å; C195-F197 PolarHBondContact O-N 2.86Å
196	D	83.5	Confident	81.1	Confident	27 Å²	27	27.4 Å²	27.4	14%	0.144	16%	0.16	C	C	.	.	S	Bend	trans	61.9	30.8	171.5	-81.9	-19.6	0	0	0	117.4	K80 S200	K80-D196 IonicContact NZ-OD1 2.69Å; K80-D196 PolarHBondContact NZ-OD1 2.84Å; K80-D196 IonicContact NZ-OD2 2.64Å; K80-D196 PolarHBondContact NZ-OD2 2.86Å; D196-S200 PolarHBondContact OD1-OG 2.82Å; D196-S200 VanDerWaalsContact OD1-OG 3.04Å
197	F	77.6	Confident	79.2	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.164	C	C	.	.			trans	-90.8	171.4	173.1	59	-86.6	0	0	0	113.7	V101 I110 F113 L168 L172 V174 C195 I199 S200	V101-F197 HydrophobicContact CG1-CE2 4.05Å; I110-F197 HydrophobicContact CG2-CD1 4.32Å; I110-F197 HydrophobicContact CG2-CE1 3.24Å; I110-F197 HydrophobicContact CG2-CE2 4.45Å; I110-F197 HydrophobicContact CG2-CZ 3.3Å; F113-F197 HydrophobicContact CD2-CZ 4.13Å; F113-F197 AromaticContact CE2-CE1 3.49Å; F113-F197 HydrophobicContact CE2-CE1 3.49Å; F113-F197 VanDerWaalsContact CE2-CE1 3.49Å; F113-F197 HydrophobicContact CE2-CE2 4.36Å; F113-F197 AromaticContact CE2-CZ 3.41Å; F113-F197 HydrophobicContact CE2-CZ 3.41Å; F113-F197 VanDerWaalsContact CE2-CZ 3.41Å; F113-F197 HydrophobicContact CZ-CE1 4.1Å; F113-F197 HydrophobicContact CZ-CZ 4.28Å; L168-F197 HydrophobicContact CD1-CB 3.74Å; L168-F197 HydrophobicContact CD1-CD1 4.33Å; L168-F197 HydrophobicContact CD1-CD2 4.34Å; L168-F197 HydrophobicContact CD1-CG 3.89Å; L168-F197 HydrophobicContact CD2-CB 4.26Å; L168-F197 HydrophobicContact CD2-CD1 4.17Å; L168-F197 HydrophobicContact CD2-CD2 3.27Å; L168-F197 HydrophobicContact CD2-CE1 4.38Å; L168-F197 HydrophobicContact CD2-CE2 3.49Å; L168-F197 VanDerWaalsContact CD2-CE2 3.49Å; L168-F197 HydrophobicContact CD2-CG 3.63Å; L168-F197 HydrophobicContact CD2-CZ 4.06Å; L168-F197 HydrophobicContact CG-CD2 4.44Å; L168-F197 HydrophobicContact CG-CG 4.43Å; L172-F197 HydrophobicContact CD1-CE2 4.33Å; V174-F197 HydrophobicContact CG1-CD2 4.41Å; C195-F197 PolarHBondContact O-N 2.86Å; F197-I199 PolarHBondContact O-N 2.83Å; F197-S200 PolarHBondContact O-N 2.71Å
198	G	68	Low	77.5	Confident	10 Å²	10	28.1 Å²	28.1	10%	0.103	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	-119.1	167	0	0	0	0	0	112.7	G201 Q202	G198-G201 CarbonylContact O-C 3.59Å; G198-G201 WeakPolarHBondContact O-CA 3.11Å; G198-G201 PolarHBondContact O-N 2.83Å; G198-Q202 PolarHBondContact O-N 3.27Å
199	I	62.7	Low	75.8	Confident	9 Å²	9	34.5 Å²	34.5	5%	0.046	18%	0.182	C	C	.	.	H	α-helix	trans	-79.1	-28.3	-168.8	-60	153.7	0	0	0	112.1	T94 D97 L98 V101 F197 G201 Q202 L203	T94-I199 HydrophobicContact CG2-CG2 3.76Å; D97-I199 HydrophobicContact CB-CD1 3.45Å; D97-I199 VanDerWaalsContact CB-CD1 3.45Å; D97-I199 HydrophobicContact CB-CG1 4.32Å; D97-I199 WeakPolarHBondContact O-CD1 3.42Å; L98-I199 HydrophobicContact CB-CD1 4.47Å; L98-I199 HydrophobicContact CD1-CG2 4.4Å; L98-I199 HydrophobicContact CD2-CB 3.61Å; L98-I199 HydrophobicContact CD2-CD1 4.23Å; L98-I199 HydrophobicContact CD2-CG2 3.7Å; L98-I199 HydrophobicContact CG-CB 4.08Å; L98-I199 HydrophobicContact CG-CD1 4.2Å; L98-I199 HydrophobicContact CG-CG2 3.71Å; V101-I199 HydrophobicContact CB-CD1 4.18Å; V101-I199 HydrophobicContact CG2-CD1 3.72Å; F197-I199 PolarHBondContact O-N 2.83Å; I199-G201 PolarHBondContact O-N 2.8Å; I199-Q202 PolarHBondContact O-N 2.94Å; I199-Q202 VanDerWaalsContact O-N 3.11Å; I199-L203 HydrophobicContact CG2-CG 4.49Å; I199-L203 WeakPolarHBondContact O-CB 3.31Å; I199-L203 WeakPolarHBondContact O-CG 3.46Å; I199-L203 PolarHBondContact O-N 2.93Å
200	S	67.1	Low	73.8	Confident	1 Å²	1	32 Å²	32	1%	0.007	18%	0.175	C	C	.	.	H	α-helix	trans	-55.5	-46.1	165.8	-179.3	0	0	0	0	109.3	D196 F197 L203 V204	D196-S200 PolarHBondContact OD1-OG 2.82Å; D196-S200 VanDerWaalsContact OD1-OG 3.04Å; F197-S200 PolarHBondContact O-N 2.71Å; S200-L203 PolarHBondContact O-N 3.49Å; S200-V204 WeakPolarHBondContact O-CB 3.46Å; S200-V204 VanDerWaalsContact O-CG2 3.27Å; S200-V204 WeakPolarHBondContact O-CG2 3.46Å; S200-V204 PolarHBondContact O-N 3.31Å
201	G	64.1	Low	71.7	Confident	17 Å²	17	38.6 Å²	38.6	18%	0.175	20%	0.195	C	C	.	.	H	α-helix	trans	-61.4	-40.7	172.7	0	0	0	0	0	113.7	G198 I199 V204 D205	G198-G201 CarbonylContact O-C 3.59Å; G198-G201 WeakPolarHBondContact O-CA 3.11Å; G198-G201 PolarHBondContact O-N 2.83Å; I199-G201 PolarHBondContact O-N 2.8Å; G201-V204 WeakPolarHBondContact O-CB 3.37Å; G201-V204 PolarHBondContact O-N 3.3Å; G201-D205 VanDerWaalsContact O-CB 3.29Å; G201-D205 WeakPolarHBondContact O-CB 3.47Å; G201-D205 PolarHBondContact O-N 2.97Å
202	Q	66.9	Low	69.3	Low	104 Å²	104	44 Å²	44	49%	0.486	22%	0.224	S	C	.	.	H	α-helix	trans	-69.2	-38.5	177.9	-67.4	178.3	11.5	0	0	113.4	G198 I199 D205 S206	G198-Q202 PolarHBondContact O-N 3.27Å; I199-Q202 PolarHBondContact O-N 2.94Å; I199-Q202 VanDerWaalsContact O-N 3.11Å; Q202-D205 PolarHBondContact O-N 3.2Å; Q202-S206 WeakPolarHBondContact O-CB 3.14Å; Q202-S206 PolarHBondContact O-N 3.07Å
203	L	66.6	Low	66.8	Low	11 Å²	11	45.7 Å²	45.7	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-47.1	173.3	-79.1	171.9	0	0	0	110.2	I82 L86 T94 C123 I199 S200 S206 I207	I82-L203 HydrophobicContact CG2-CB 4.49Å; L86-L203 HydrophobicContact CD1-CD2 3.65Å; T94-L203 HydrophobicContact CG2-CD1 3.95Å; T94-L203 HydrophobicContact CG2-CD2 3.98Å; T94-L203 HydrophobicContact CG2-CG 4.08Å; C123-L203 HydrophobicContact CB-CD1 4.3Å; I199-L203 HydrophobicContact CG2-CG 4.49Å; I199-L203 WeakPolarHBondContact O-CB 3.31Å; I199-L203 WeakPolarHBondContact O-CG 3.46Å; I199-L203 PolarHBondContact O-N 2.93Å; S200-L203 PolarHBondContact O-N 3.49Å; L203-S206 WeakPolarHBondContact O-CB 3.41Å; L203-S206 PolarHBondContact O-N 3.18Å; L203-I207 WeakPolarHBondContact O-CD1 3.32Å; L203-I207 WeakPolarHBondContact O-CG1 3.35Å; L203-I207 PolarHBondContact O-N 2.86Å; L203-I207 VanDerWaalsContact O-N 3.13Å
204	V	64.3	Low	64.6	Low	7 Å²	7	47.2 Å²	47.2	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-58.1	-49	172.6	163.8	0	0	0	0	111.3	Y62 I82 S200 G201 S206 I207 A208	Y62-V204 HydrophobicContact CD1-CG1 3.98Å; Y62-V204 HydrophobicContact CD2-CB 4.19Å; Y62-V204 HydrophobicContact CD2-CG1 3.3Å; Y62-V204 HydrophobicContact CD2-CG2 3.87Å; Y62-V204 HydrophobicContact CE1-CG1 3.88Å; Y62-V204 HydrophobicContact CE2-CB 4.47Å; Y62-V204 HydrophobicContact CE2-CG1 3.18Å; Y62-V204 HydrophobicContact CG-CB 4.3Å; Y62-V204 HydrophobicContact CG-CG1 3.7Å; Y62-V204 HydrophobicContact CG-CG2 3.96Å; Y62-V204 VanDerWaalsContact CZ-CG1 3.48Å; I82-V204 HydrophobicContact CD1-CG2 4.41Å; S200-V204 WeakPolarHBondContact O-CB 3.46Å; S200-V204 VanDerWaalsContact O-CG2 3.27Å; S200-V204 WeakPolarHBondContact O-CG2 3.46Å; S200-V204 PolarHBondContact O-N 3.31Å; G201-V204 WeakPolarHBondContact O-CB 3.37Å; G201-V204 PolarHBondContact O-N 3.3Å; V204-S206 VanDerWaalsContact C-N 3.26Å; V204-S206 PolarHBondContact O-N 3.27Å; V204-I207 PolarHBondContact O-N 2.87Å; V204-I207 VanDerWaalsContact O-N 3.17Å; V204-A208 WeakPolarHBondContact O-CB 3.45Å; V204-A208 PolarHBondContact O-N 3.49Å
205	D	65	Low	62.6	Low	30 Å²	30	48.5 Å²	48.5	16%	0.16	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-33.7	179.7	-74.4	-14.2	0	0	0	111.4	G201 Q202 A208 R209	G201-D205 VanDerWaalsContact O-CB 3.29Å; G201-D205 WeakPolarHBondContact O-CB 3.47Å; G201-D205 PolarHBondContact O-N 2.97Å; Q202-D205 PolarHBondContact O-N 3.2Å; D205-A208 PolarHBondContact O-N 2.91Å; D205-R209 WeakPolarHBondContact O-CG 3.29Å; D205-R209 PolarHBondContact O-N 3.34Å
206	S	63.9	Low	61.7	Low	38 Å²	38	49.6 Å²	49.6	27%	0.266	27%	0.272	S	S	.	.	H	α-helix	trans	-65.7	-41.8	175.3	-167.3	0	0	0	0	112	Q202 L203 V204	Q202-S206 WeakPolarHBondContact O-CB 3.14Å; Q202-S206 PolarHBondContact O-N 3.07Å; L203-S206 WeakPolarHBondContact O-CB 3.41Å; L203-S206 PolarHBondContact O-N 3.18Å; V204-S206 VanDerWaalsContact C-N 3.26Å; V204-S206 PolarHBondContact O-N 3.27Å
207	I	58.6	Low	61.7	Low	17 Å²	17	50 Å²	50	9%	0.087	28%	0.277	C	S	.	.	H	α-helix	trans	-69	-42.6	174.9	-60.5	157.3	0	0	0	109.8	Y62 I82 R83 L203 V204 R209 S210 R211	Y62-I207 HydrophobicContact CD1-CG2 4.3Å; I82-I207 HydrophobicContact CG2-CD1 3.37Å; R83-I207 WeakPolarHBondContact O-CD1 3.26Å; L203-I207 WeakPolarHBondContact O-CD1 3.32Å; L203-I207 WeakPolarHBondContact O-CG1 3.35Å; L203-I207 PolarHBondContact O-N 2.86Å; L203-I207 VanDerWaalsContact O-N 3.13Å; V204-I207 PolarHBondContact O-N 2.87Å; V204-I207 VanDerWaalsContact O-N 3.17Å; I207-R209 PolarHBondContact O-N 3.26Å; I207-S210 WeakPolarHBondContact O-CB 3.37Å; I207-S210 PolarHBondContact O-N 2.95Å; I207-S210 PolarHBondContact O-OG 3.3Å; I207-R211 PolarHBondContact O-N 3.43Å
208	A	57.6	Low	62.4	Low	17 Å²	17	51 Å²	51	14%	0.14	28%	0.281	C	S	.	.	H	α-helix	trans	-62.4	-38.5	-179.7	0	0	0	0	0	113.2	Y62 V204 D205 S210 R211 A213	Y62-A208 HydrophobicContact CE1-CB 3.98Å; V204-A208 WeakPolarHBondContact O-CB 3.45Å; V204-A208 PolarHBondContact O-N 3.49Å; D205-A208 PolarHBondContact O-N 2.91Å; A208-S210 PolarHBondContact O-N 3.4Å; A208-R211 CarbonylContact O-C 3.57Å; A208-R211 VanDerWaalsContact O-C 3.28Å; A208-R211 PolarHBondContact O-N 3.43Å; A208-A213 VanDerWaalsContact CA-CB 3.48Å; A208-A213 HydrophobicContact CB-CB 3.23Å
209	R	57.7	Low	63.3	Low	188 Å²	188	52 Å²	52	71%	0.709	28%	0.283	S	S	*	.	H	α-helix	trans	-63	-25.3	172.9	-76.6	-174.6	-63.7	-91.5	3	113	D205 I207	D205-R209 WeakPolarHBondContact O-CG 3.29Å; D205-R209 PolarHBondContact O-N 3.34Å; I207-R209 PolarHBondContact O-N 3.26Å
210	S	53.6	Low	64.5	Low	82 Å²	82	51.6 Å²	51.6	57%	0.573	28%	0.281	S	S	*	.	H	α-helix	trans	-88.8	-13.9	178.2	75.4	0	0	0	0	114	I207 A208	I207-S210 WeakPolarHBondContact O-CB 3.37Å; I207-S210 PolarHBondContact O-N 2.95Å; I207-S210 PolarHBondContact O-OG 3.3Å; A208-S210 PolarHBondContact O-N 3.4Å
211	R	49.4	Very low	65.4	Low	153 Å²	153	51.8 Å²	51.8	58%	0.577	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.3	104.7	-175.7	-69.9	-179.9	176.3	-177.3	-2.9	107.9	I207 A208 A213	I207-R211 PolarHBondContact O-N 3.43Å; A208-R211 CarbonylContact O-C 3.57Å; A208-R211 VanDerWaalsContact O-C 3.28Å; A208-R211 PolarHBondContact O-N 3.43Å; R211-A213 WeakPolarHBondContact O-CA 3.36Å; R211-A213 VanDerWaalsContact O-CB 3.31Å; R211-A213 WeakPolarHBondContact O-CB 3.38Å; R211-A213 PolarHBondContact O-N 3.34Å
212	D	47.7	Very low	66.4	Low	179 Å²	179	51.5 Å²	51.5	96%	0.957	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-20.1	75.5	175.8	-86.1	-27.7	0	0	0	114	G214	D212-G214 PolarHBondContact O-N 2.9Å
213	A	45.8	Very low	67	Low	43 Å²	43	49.6 Å²	49.6	36%	0.355	27%	0.265	S	S	.	.			trans	-85.8	106.3	-165.5	0	0	0	0	0	106.5	Y62 A208 R211	Y62-A213 HydrophobicContact CE1-CB 4.5Å; A208-A213 VanDerWaalsContact CA-CB 3.48Å; A208-A213 HydrophobicContact CB-CB 3.23Å; R211-A213 WeakPolarHBondContact O-CA 3.36Å; R211-A213 VanDerWaalsContact O-CB 3.31Å; R211-A213 WeakPolarHBondContact O-CB 3.38Å; R211-A213 PolarHBondContact O-N 3.34Å
214	G	50.5	Low	67.4	Low	49 Å²	49	50.5 Å²	50.5	51%	0.505	27%	0.269	S	S	.	.			trans	-42.6	150.4	-171.9	0	0	0	0	0	114.6	D212 K216	D212-G214 PolarHBondContact O-N 2.9Å; G214-K216 PolarHBondContact O-N 2.95Å
215	C	53.7	Low	67.8	Low	29 Å²	29	54.6 Å²	54.6	20%	0.196	29%	0.287	C	S	.	.			trans	-46.9	127.7	171.9	172.4	0	0	0	0	111	P217 V262 Q265 L266	C215-P217 WeakPolarHBondContact O-CD 3.17Å; C215-V262 HydrophobicContact CB-CB 4.18Å; C215-V262 HydrophobicContact CB-CG1 3.3Å; C215-V262 HydrophobicContact CB-CG2 4.04Å; C215-Q265 PolarHBondContact SG-OE1 3.16Å; C215-L266 HydrophobicContact CB-CD2 4.31Å; C215-L266 WeakPolarHBondContact SG-CD2 3.41Å
216	K	71.8	Confident	67.9	Low	30 Å²	30	57.5 Å²	57.5	13%	0.13	31%	0.308	C	S	.	.			trans	-83.3	120.5	175.4	-62.1	-171	178.7	-167.8	0	107.5	D178 G214 Y218 M219	D178-K216 WeakPolarHBondContact OD1-CD 3.39Å; D178-K216 IonicContact OD1-NZ 3.03Å; D178-K216 IonicContact OD2-NZ 3.18Å; D178-K216 PolarHBondContact OD2-NZ 2.98Å; G214-K216 PolarHBondContact O-N 2.95Å; K216-Y218 PolarHBondContact O-N 3.34Å; K216-M219 HydrophobicContact CB-CB 4.49Å; K216-M219 HydrophobicContact CB-CE 4.11Å; K216-M219 HydrophobicContact CG-CE 4.4Å; K216-M219 WeakPolarHBondContact O-CB 3.46Å; K216-M219 PolarHBondContact O-N 3.1Å
217	P	83.7	Confident	68.1	Low	37 Å²	37	64.6 Å²	64.6	24%	0.24	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-27	-175.6	-13.1	11.4	0	0	0	115.6	C215 M219 F254 W259	C215-P217 WeakPolarHBondContact O-CD 3.17Å; P217-M219 VanDerWaalsContact C-N 3.28Å; P217-M219 PolarHBondContact O-N 3.06Å; P217-F254 HydrophobicContact CB-CE1 3.92Å; P217-F254 HydrophobicContact CB-CE2 3.63Å; P217-F254 HydrophobicContact CB-CZ 3.21Å; P217-F254 HydrophobicContact CG-CZ 4.49Å; P217-W259 HydrophobicContact CB-CH2 4.25Å; P217-W259 HydrophobicContact CG-CZ2 4.48Å
218	Y	91	Very high	68.2	Low	20 Å²	20	68.5 Å²	68.5	8%	0.078	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	3.1	-176.8	-53.1	-91.4	0	0	0	112.6	K180 P181 K216 S241 I244 E248 F254	K180-Y218 HydrophobicContact CB-CD1 3.97Å; K180-Y218 HydrophobicContact CB-CD2 3.57Å; K180-Y218 HydrophobicContact CB-CE1 3.98Å; K180-Y218 HydrophobicContact CB-CE2 3.58Å; K180-Y218 HydrophobicContact CB-CG 3.79Å; K180-Y218 HydrophobicContact CD-CD2 4.09Å; K180-Y218 HydrophobicContact CD-CE2 4.1Å; K180-Y218 HydrophobicContact CG-CD2 4.49Å; K180-Y218 HydrophobicContact CG-CE2 4.47Å; P181-Y218 HydrophobicContact CG-CE1 4.43Å; K216-Y218 PolarHBondContact O-N 3.34Å; Y218-S241 WeakPolarHBondContact O-CA 3.28Å; Y218-S241 WeakPolarHBondContact O-CB 3.07Å; Y218-S241 PolarHBondContact O-OG 2.83Å; Y218-I244 HydrophobicContact CD1-CB 4.04Å; Y218-I244 HydrophobicContact CD1-CG2 3.49Å; Y218-I244 VanDerWaalsContact CD1-CG2 3.49Å; Y218-I244 HydrophobicContact CE1-CG2 3.86Å; Y218-I244 HydrophobicContact CG-CG2 4.4Å; Y218-E248 WeakPolarHBondContact CE1-OE2 3.36Å; Y218-E248 VanDerWaalsContact CZ-OE2 3.25Å; Y218-E248 PolarHBondContact OH-OE1 3.13Å; Y218-E248 PolarHBondContact OH-OE2 3.45Å; Y218-F254 HydrophobicContact CD1-CE2 4.28Å; Y218-F254 HydrophobicContact CE1-CD2 4.29Å; Y218-F254 AromaticContact CE1-CE2 3.85Å; Y218-F254 HydrophobicContact CE1-CE2 3.85Å; Y218-F254 HydrophobicContact CE2-CE2 4.41Å; Y218-F254 AromaticContact CZ-CE2 3.91Å
219	M	87.5	Confident	68.3	Low	32 Å²	32	68.7 Å²	68.7	16%	0.158	36%	0.358	C	S	.	.			trans	-69	131.9	-174.1	-171.4	175.1	-53.2	0	0	111.4	K216 P217 R223 I224 W240	K216-M219 HydrophobicContact CB-CB 4.49Å; K216-M219 HydrophobicContact CB-CE 4.11Å; K216-M219 HydrophobicContact CG-CE 4.4Å; K216-M219 WeakPolarHBondContact O-CB 3.46Å; K216-M219 PolarHBondContact O-N 3.1Å; P217-M219 VanDerWaalsContact C-N 3.28Å; P217-M219 PolarHBondContact O-N 3.06Å; M219-R223 HydrophobicContact CG-CB 3.48Å; M219-R223 VanDerWaalsContact CG-CB 3.48Å; M219-R223 HydrophobicContact CG-CG 4.33Å; M219-R223 HydrophobicContact SD-CB 3.78Å; M219-I224 HydrophobicContact CG-CG1 4.03Å; M219-I224 HydrophobicContact SD-CG1 3.86Å; M219-W240 PolarHBondContact O-NE1 2.96Å
220	A	88.4	Confident	68.2	Low	0 Å²	0	64.6 Å²	64.6	0%	0	37%	0.365	C	S	.	.			trans	-70	150.6	178.1	0	0	0	0	0	112.5	E222 R223 W240	A220-E222 VanDerWaalsContact C-N 3.25Å; A220-E222 VanDerWaalsContact CB-CD 3.46Å; A220-E222 WeakPolarHBondContact CB-OE1 3.27Å; A220-E222 WeakPolarHBondContact CB-OE2 3.35Å; A220-E222 PolarHBondContact O-N 3.42Å; A220-R223 HydrophobicContact CB-CG 4.48Å; A220-R223 WeakPolarHBondContact O-CB 3.3Å; A220-R223 PolarHBondContact O-N 3.21Å; A220-W240 VanDerWaalsContact CA-CD1 3.43Å; A220-W240 HydrophobicContact CB-CB 3.67Å; A220-W240 HydrophobicContact CB-CD2 4.3Å; A220-W240 HydrophobicContact CB-CG 3.65Å
221	P	86.5	Confident	68.2	Low	4 Å²	4	68.3 Å²	68.3	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-51.7	-42.3	-178.2	-26.1	32.3	0	0	0	113.3	R223 I224 H225 L228 W240 V269 L270	P221-R223 PolarHBondContact O-N 3.29Å; P221-I224 WeakPolarHBondContact O-CB 3.4Å; P221-I224 PolarHBondContact O-N 3.48Å; P221-H225 PolarHBondContact O-N 2.99Å; P221-H225 VanDerWaalsContact O-N 3.16Å; P221-L228 HydrophobicContact CB-CD1 4.33Å; P221-W240 HydrophobicContact CG-CD2 4.45Å; P221-W240 HydrophobicContact CG-CE3 4.23Å; P221-W240 HydrophobicContact CG-CH2 3.59Å; P221-W240 HydrophobicContact CG-CZ2 3.83Å; P221-W240 HydrophobicContact CG-CZ3 3.8Å; P221-V269 HydrophobicContact CB-CG1 4.29Å; P221-V269 HydrophobicContact CG-CG1 3.81Å; P221-L270 HydrophobicContact CB-CD2 4.15Å
222	E	84.6	Confident	68.6	Low	12 Å²	12	63.1 Å²	63.1	6%	0.056	37%	0.372	C	S	.	.	H	α-helix	trans	-70.4	-16.6	-178	72.8	-79.5	-178.8	0	0	114.5	A220 H225 L228 S237 V334 R337	A220-E222 VanDerWaalsContact C-N 3.25Å; A220-E222 VanDerWaalsContact CB-CD 3.46Å; A220-E222 WeakPolarHBondContact CB-OE1 3.27Å; A220-E222 WeakPolarHBondContact CB-OE2 3.35Å; A220-E222 PolarHBondContact O-N 3.42Å; E222-H225 CarbonylContact O-C 3.5Å; E222-L228 HydrophobicContact CB-CB 4.16Å; E222-S237 VanDerWaalsContact OE1-CA 3.27Å; E222-S237 WeakPolarHBondContact OE1-CA 3.45Å; E222-S237 WeakPolarHBondContact OE1-CB 3.5Å; E222-S237 PolarHBondContact OE1-OG 3.39Å; E222-V334 HydrophobicContact CG-CB 4.29Å; E222-V334 HydrophobicContact CG-CG2 4.1Å; E222-R337 IonicContact OE1-CZ 2.8Å; E222-R337 IonicContact OE1-NH1 3.05Å; E222-R337 PolarHBondContact OE1-NH1 2.75Å; E222-R337 IonicContact OE2-CZ 2.78Å; E222-R337 IonicContact OE2-NH1 3.62Å; E222-R337 PolarHBondContact OE2-NH1 3.44Å; E222-R337 IonicContact OE2-NH2 3.73Å; E222-R337 PolarHBondContact OE2-NH2 3Å
223	R	79.2	Confident	69.3	Low	64 Å²	64	58.1 Å²	58.1	24%	0.242	34%	0.34	C	S	.	.	H	α-helix	trans	-82.3	-21.1	172.2	-68	-177.7	63.9	178.5	2.9	112.4	R177 M219 A220 P221 Y233	R177-R223 PolarHBondContact O-NH1 3.1Å; M219-R223 HydrophobicContact CG-CB 3.48Å; M219-R223 VanDerWaalsContact CG-CB 3.48Å; M219-R223 HydrophobicContact CG-CG 4.33Å; M219-R223 HydrophobicContact SD-CB 3.78Å; A220-R223 HydrophobicContact CB-CG 4.48Å; A220-R223 WeakPolarHBondContact O-CB 3.3Å; A220-R223 PolarHBondContact O-N 3.21Å; P221-R223 PolarHBondContact O-N 3.29Å; R223-Y233 HydrophobicContact CG-CE2 4.44Å
224	I	75.2	Confident	71	Confident	29 Å²	29	57.5 Å²	57.5	15%	0.149	33%	0.331	C	S	.	.	H	α-helix	trans	-84.7	-46.7	-179.4	-58.3	168.5	0	0	0	109.7	M219 P221 P226 L266 V269 L270	M219-I224 HydrophobicContact CG-CG1 4.03Å; M219-I224 HydrophobicContact SD-CG1 3.86Å; P221-I224 WeakPolarHBondContact O-CB 3.4Å; P221-I224 PolarHBondContact O-N 3.48Å; I224-P226 WeakPolarHBondContact O-CD 3.45Å; I224-L266 HydrophobicContact CB-CD2 4.19Å; I224-L266 HydrophobicContact CD1-CD2 3.41Å; I224-L266 VanDerWaalsContact CD1-CD2 3.41Å; I224-L266 HydrophobicContact CG1-CD2 3.53Å; I224-L266 HydrophobicContact CG2-CB 4.07Å; I224-L266 HydrophobicContact CG2-CD1 4.17Å; I224-L266 HydrophobicContact CG2-CD2 3.63Å; I224-L266 HydrophobicContact CG2-CG 4.17Å; I224-V269 HydrophobicContact CD1-CB 3.85Å; I224-V269 HydrophobicContact CD1-CG1 3.54Å; I224-V269 HydrophobicContact CD1-CG2 4.43Å; I224-L270 HydrophobicContact CB-CD2 4.21Å; I224-L270 HydrophobicContact CG2-CD1 3.75Å; I224-L270 HydrophobicContact CG2-CD2 4.29Å; I224-L270 HydrophobicContact CG2-CG 4.2Å
225	H	72.4	Confident	72.9	Confident	93 Å²	93	55.7 Å²	55.7	43%	0.431	31%	0.31	S	S	.	.			trans	-115.7	98	170.8	-77.4	-69.4	0	0	0	109.7	P221 E222 E227 L228 L270	P221-H225 PolarHBondContact O-N 2.99Å; P221-H225 VanDerWaalsContact O-N 3.16Å; E222-H225 CarbonylContact O-C 3.5Å; H225-E227 PolarHBondContact O-N 3.4Å; H225-L228 HydrophobicContact CB-CD1 3.86Å; H225-L228 HydrophobicContact CB-CG 3.93Å; H225-L228 VanDerWaalsContact O-CB 3.28Å; H225-L228 WeakPolarHBondContact O-CB 3.03Å; H225-L228 WeakPolarHBondContact O-CG 3.17Å; H225-L228 PolarHBondContact O-N 2.89Å; H225-L270 WeakPolarHBondContact CD2-CD1 3.14Å; H225-L270 VanDerWaalsContact NE2-CD1 3.29Å; H225-L270 WeakPolarHBondContact NE2-CD1 3.4Å
226	P	67.5	Low	74.8	Confident	92 Å²	92	56.5 Å²	56.5	60%	0.597	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-55.1	-24.4	178	-27.1	35	0	0	0	113.9	I224 L228 S229	I224-P226 WeakPolarHBondContact O-CD 3.45Å; P226-L228 PolarHBondContact O-N 3.48Å; P226-S229 CarbonylContact O-C 3.37Å; P226-S229 PolarHBondContact O-N 2.87Å
227	E	67.2	Low	75.8	Confident	187 Å²	187	55.1 Å²	55.1	87%	0.874	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-59.9	-23	173.9	-60.5	-172.3	177.8	0	0	113.1	H225 S229	H225-E227 PolarHBondContact O-N 3.4Å; E227-S229 PolarHBondContact O-N 3.33Å
228	L	61.7	Low	76.3	Confident	99 Å²	99	53.3 Å²	53.3	52%	0.518	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-75.2	-10.7	174.2	-59.4	173.4	0	0	0	113	P221 E222 H225 P226 L270	P221-L228 HydrophobicContact CB-CD1 4.33Å; E222-L228 HydrophobicContact CB-CB 4.16Å; H225-L228 HydrophobicContact CB-CD1 3.86Å; H225-L228 HydrophobicContact CB-CG 3.93Å; H225-L228 VanDerWaalsContact O-CB 3.28Å; H225-L228 WeakPolarHBondContact O-CB 3.03Å; H225-L228 WeakPolarHBondContact O-CG 3.17Å; H225-L228 PolarHBondContact O-N 2.89Å; P226-L228 PolarHBondContact O-N 3.48Å; L228-L270 HydrophobicContact CD1-CD2 3.91Å
229	S	58.9	Low	76.6	Confident	20 Å²	20	52.4 Å²	52.4	14%	0.14	29%	0.287	C	S	.	.			trans	-132.9	98.1	173.7	-177.9	0	0	0	0	111	P226 E227 N231 G232	P226-S229 CarbonylContact O-C 3.37Å; P226-S229 PolarHBondContact O-N 2.87Å; E227-S229 PolarHBondContact O-N 3.33Å; S229-N231 PolarHBondContact O-N 2.87Å; S229-G232 PolarHBondContact O-N 3.03Å; S229-G232 PolarHBondContact OG-O 2.97Å
230	A	54.9	Low	77	Confident	103 Å²	103	50.9 Å²	50.9	85%	0.851	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-21.4	178.3	0	0	0	0	0	114.3
231	N	55.5	Low	77.4	Confident	160 Å²	160	51 Å²	51	86%	0.856	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	15.5	-173.4	-73.3	-11.9	0	0	0	114	S229	S229-N231 PolarHBondContact O-N 2.87Å
232	G	56.3	Low	78	Confident	44 Å²	44	50.8 Å²	50.8	45%	0.454	28%	0.279	S	S	.	.			trans	70	-157.4	178.7	0	0	0	0	0	113.3	S229	S229-G232 PolarHBondContact O-N 3.03Å; S229-G232 PolarHBondContact OG-O 2.97Å
233	Y	63	Low	78.6	Confident	74 Å²	74	50.2 Å²	50.2	29%	0.29	28%	0.277	S	S	.	.			trans	-66.7	131.7	-164.7	-173.1	-115.8	0	0	0	113.6	I175 R177 R223 D238	I175-Y233 HydrophobicContact CB-CD1 4.37Å; I175-Y233 HydrophobicContact CB-CE1 3.51Å; I175-Y233 HydrophobicContact CD1-CD1 3.59Å; I175-Y233 HydrophobicContact CD1-CE1 3.59Å; I175-Y233 HydrophobicContact CG1-CE1 4.14Å; I175-Y233 HydrophobicContact CG2-CD1 4.31Å; I175-Y233 HydrophobicContact CG2-CE1 3.27Å; I175-Y233 VanDerWaalsContact CG2-CZ 3.49Å; I175-Y233 WeakPolarHBondContact CG2-OH 3.45Å; R177-Y233 VanDerWaalsContact CA-OH 3.25Å; R177-Y233 WeakPolarHBondContact CA-OH 3.46Å; R177-Y233 HydrophobicContact CG-CE1 3.5Å; R177-Y233 HydrophobicContact CG-CE2 4.12Å; R177-Y233 WeakPolarHBondContact CG-OH 3.32Å; R177-Y233 PolarHBondContact N-OH 2.97Å; R223-Y233 HydrophobicContact CG-CE2 4.44Å; Y233-D238 PolarHBondContact OH-OD1 3.08Å; Y233-D238 VanDerWaalsContact OH-OD1 3.14Å
234	D	80.9	Confident	79.5	Confident	30 Å²	30	47.1 Å²	47.1	16%	0.16	27%	0.265	C	S	.	.			trans	-133	153.2	-177.8	-160.5	-13.3	0	0	0	112	R236 S237	D234-R236 PolarHBondContact O-N 2.89Å; D234-R236 VanDerWaalsContact O-N 3.09Å; D234-R236 IonicContact OD2-CZ 3.88Å; D234-R236 IonicContact OD2-NE 2.79Å; D234-R236 PolarHBondContact OD2-NE 3.42Å; D234-R236 IonicContact OD2-NH2 3.68Å; D234-R236 PolarHBondContact OD2-NH2 2.82Å; D234-S237 WeakPolarHBondContact O-CB 3.39Å; D234-S237 PolarHBondContact O-N 3.27Å; D234-S237 PolarHBondContact O-OG 3.03Å
235	I	90.6	Very high	80.6	Confident	11 Å²	11	45.8 Å²	45.8	6%	0.056	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-23.4	174.4	53.8	158.6	0	0	0	113.3	K169 I175 S237 D238 V239 K339 Y340	K169-I235 HydrophobicContact CB-CG2 4.19Å; K169-I235 HydrophobicContact CD-CG2 3.64Å; K169-I235 HydrophobicContact CG-CG2 3.84Å; I175-I235 HydrophobicContact CD1-CG2 4.12Å; I175-I235 HydrophobicContact CG1-CG2 3.82Å; I175-I235 HydrophobicContact CG2-CG2 4.12Å; I235-S237 PolarHBondContact O-N 2.73Å; I235-D238 WeakPolarHBondContact O-CB 3.32Å; I235-D238 PolarHBondContact O-N 3.3Å; I235-V239 PolarHBondContact O-N 3.11Å; I235-K339 HydrophobicContact CD1-CB 3.86Å; I235-K339 HydrophobicContact CD1-CD 4.13Å; I235-K339 HydrophobicContact CD1-CG 3.86Å; I235-K339 HydrophobicContact CG1-CG 4.38Å; I235-Y340 HydrophobicContact CB-CE1 4.43Å; I235-Y340 HydrophobicContact CB-CE2 3.64Å; I235-Y340 WeakPolarHBondContact CB-OH 3.49Å; I235-Y340 HydrophobicContact CD1-CD2 3.77Å; I235-Y340 HydrophobicContact CD1-CE2 3.76Å; I235-Y340 HydrophobicContact CD1-CG 4.34Å; I235-Y340 HydrophobicContact CG1-CE2 4.32Å; I235-Y340 HydrophobicContact CG2-CE2 3.71Å; I235-Y340 PolarHBondContact O-OH 2.86Å
236	R	94.3	Very high	81.8	Confident	45 Å²	45	41.4 Å²	41.4	17%	0.17	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-23.7	175.9	-68.1	-179.9	-72.8	-176.9	-0.3	112.1	D234 D238 V239 W240 V334 R335 R337 K339	D234-R236 PolarHBondContact O-N 2.89Å; D234-R236 VanDerWaalsContact O-N 3.09Å; D234-R236 IonicContact OD2-CZ 3.88Å; D234-R236 IonicContact OD2-NE 2.79Å; D234-R236 PolarHBondContact OD2-NE 3.42Å; D234-R236 IonicContact OD2-NH2 3.68Å; D234-R236 PolarHBondContact OD2-NH2 2.82Å; R236-D238 VanDerWaalsContact C-N 3.34Å; R236-V239 WeakPolarHBondContact O-CB 3.43Å; R236-V239 PolarHBondContact O-N 3.26Å; R236-W240 PolarHBondContact O-N 3.15Å; R236-W240 VanDerWaalsContact O-N 3.16Å; R236-V334 HydrophobicContact CB-CG2 3.83Å; R236-V334 WeakPolarHBondContact CD-O 3.44Å; R236-V334 PolarHBondContact NE-O 3.26Å; R236-V334 PolarHBondContact NH1-O 2.77Å; R236-R335 VanDerWaalsContact NH1-CA 3.35Å; R236-R337 WeakPolarHBondContact CD-O 3.27Å; R236-R337 WeakPolarHBondContact O-CD 3.39Å; R236-R337 PolarHBondContact O-NH1 3.44Å; R236-K339 HydrophobicContact CG-CG 4.06Å
237	S	92.2	Very high	83.3	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.007	21%	0.211	C	C	.	.	H	α-helix	trans	-67	-35.7	171	-56.8	0	0	0	0	112.5	E222 D234 I235 V239 W240 S241	E222-S237 VanDerWaalsContact OE1-CA 3.27Å; E222-S237 WeakPolarHBondContact OE1-CA 3.45Å; E222-S237 WeakPolarHBondContact OE1-CB 3.5Å; E222-S237 PolarHBondContact OE1-OG 3.39Å; D234-S237 WeakPolarHBondContact O-CB 3.39Å; D234-S237 PolarHBondContact O-N 3.27Å; D234-S237 PolarHBondContact O-OG 3.03Å; I235-S237 PolarHBondContact O-N 2.73Å; S237-V239 VanDerWaalsContact C-N 3.31Å; S237-W240 PolarHBondContact O-N 3.37Å; S237-S241 PolarHBondContact O-N 2.82Å; S237-S241 PolarHBondContact O-OG 3.44Å
238	D	94.4	Very high	84.7	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-71.5	-30.2	175.1	-67.3	-15.8	0	0	0	111.4	L165 I175 H176 R177 V179 Y233 I235 R236 S241 L242 Y340	L165-D238 HydrophobicContact CD2-CB 4.21Å; I175-D238 WeakPolarHBondContact CG2-OD2 3.39Å; H176-D238 WeakPolarHBondContact CA-OD2 3.32Å; H176-D238 VanDerWaalsContact CB-OD2 3.26Å; H176-D238 WeakPolarHBondContact CB-OD2 3.34Å; H176-D238 PolarHBondContact N-OD2 3.41Å; R177-D238 WeakPolarHBondContact CA-OD1 3.44Å; R177-D238 PolarHBondContact N-OD1 2.81Å; R177-D238 PolarHBondContact N-OD2 2.91Å; V179-D238 HydrophobicContact CG2-CB 3.98Å; Y233-D238 PolarHBondContact OH-OD1 3.08Å; Y233-D238 VanDerWaalsContact OH-OD1 3.14Å; I235-D238 WeakPolarHBondContact O-CB 3.32Å; I235-D238 PolarHBondContact O-N 3.3Å; R236-D238 VanDerWaalsContact C-N 3.34Å; D238-S241 PolarHBondContact O-N 2.95Å; D238-L242 WeakPolarHBondContact O-CB 3.48Å; D238-L242 PolarHBondContact O-N 2.97Å; D238-Y340 PolarHBondContact OD2-OH 2.9Å
239	V	97.7	Very high	86.4	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.2	-41.1	173	172.2	0	0	0	0	111.4	I235 R236 S237 L242 G243 C329 R337 P338 Y340 L343	I235-V239 PolarHBondContact O-N 3.11Å; R236-V239 WeakPolarHBondContact O-CB 3.43Å; R236-V239 PolarHBondContact O-N 3.26Å; S237-V239 VanDerWaalsContact C-N 3.31Å; V239-L242 WeakPolarHBondContact O-CB 3.15Å; V239-L242 PolarHBondContact O-N 2.82Å; V239-G243 PolarHBondContact O-N 2.83Å; V239-C329 HydrophobicContact CG1-CB 3.97Å; V239-R337 HydrophobicContact CG1-CG 3.96Å; V239-P338 HydrophobicContact CG1-CG 4.48Å; V239-Y340 HydrophobicContact CG2-CD1 3.81Å; V239-Y340 HydrophobicContact CG2-CE1 3.63Å; V239-L343 HydrophobicContact CG1-CD1 3.88Å; V239-L343 HydrophobicContact CG2-CD1 3.93Å
240	W	96.6	Very high	88.3	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.4	-49.4	172.3	173.8	-79.7	0	0	0	111.7	M219 A220 P221 R236 S237 L242 G243 I244 Y256 V269 P274 C329 L330 K332	M219-W240 PolarHBondContact O-NE1 2.96Å; A220-W240 VanDerWaalsContact CA-CD1 3.43Å; A220-W240 HydrophobicContact CB-CB 3.67Å; A220-W240 HydrophobicContact CB-CD2 4.3Å; A220-W240 HydrophobicContact CB-CG 3.65Å; P221-W240 HydrophobicContact CG-CD2 4.45Å; P221-W240 HydrophobicContact CG-CE3 4.23Å; P221-W240 HydrophobicContact CG-CH2 3.59Å; P221-W240 HydrophobicContact CG-CZ2 3.83Å; P221-W240 HydrophobicContact CG-CZ3 3.8Å; R236-W240 PolarHBondContact O-N 3.15Å; R236-W240 VanDerWaalsContact O-N 3.16Å; S237-W240 PolarHBondContact O-N 3.37Å; W240-L242 PolarHBondContact O-N 2.58Å; W240-G243 WeakPolarHBondContact O-CA 3.45Å; W240-G243 PolarHBondContact O-N 3.14Å; W240-I244 PolarHBondContact O-N 3.27Å; W240-Y256 WeakPolarHBondContact CZ2-OH 3.25Å; W240-V269 HydrophobicContact CZ2-CG1 3.98Å; W240-P274 HydrophobicContact CH2-CB 4.34Å; W240-C329 WeakPolarHBondContact CA-O 3.02Å; W240-L330 HydrophobicContact CD2-CD2 3.92Å; W240-L330 HydrophobicContact CE3-CD2 4.08Å; W240-L330 HydrophobicContact CG-CD2 4.31Å; W240-L330 HydrophobicContact CZ3-CB 4.46Å; W240-L330 HydrophobicContact CZ3-CD2 4.46Å; W240-L330 VanDerWaalsContact CZ3-O 3.22Å; W240-L330 WeakPolarHBondContact CZ3-O 3.25Å; W240-K332 HydrophobicContact CH2-CG 4.14Å; W240-K332 HydrophobicContact CZ3-CG 4.03Å
241	S	96	Very high	90.2	Very high	2 Å²	2	19 Å²	19	1%	0.014	10%	0.104	C	C	.	.	H	α-helix	trans	-58.3	-36.1	178.4	-59.5	0	0	0	0	111.9	V179 Y218 S237 D238 T245	V179-S241 WeakPolarHBondContact O-CB 3.41Å; Y218-S241 WeakPolarHBondContact O-CA 3.28Å; Y218-S241 WeakPolarHBondContact O-CB 3.07Å; Y218-S241 PolarHBondContact O-OG 2.83Å; S237-S241 PolarHBondContact O-N 2.82Å; S237-S241 PolarHBondContact O-OG 3.44Å; D238-S241 PolarHBondContact O-N 2.95Å; S241-T245 WeakPolarHBondContact O-CB 3.26Å; S241-T245 PolarHBondContact O-N 2.77Å; S241-T245 PolarHBondContact O-OG1 2.91Å
242	L	98.3	Very high	92	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.3	-47.8	170.1	174.9	64.9	0	0	0	111.6	T161 V162 V179 D238 V239 W240 I244 T245 L246 F325	T161-L242 HydrophobicContact CG2-CD1 3.89Å; V162-L242 HydrophobicContact CG2-CD2 3.47Å; V162-L242 VanDerWaalsContact CG2-CD2 3.47Å; V179-L242 HydrophobicContact CG1-CB 4.41Å; D238-L242 WeakPolarHBondContact O-CB 3.48Å; D238-L242 PolarHBondContact O-N 2.97Å; V239-L242 WeakPolarHBondContact O-CB 3.15Å; V239-L242 PolarHBondContact O-N 2.82Å; W240-L242 PolarHBondContact O-N 2.58Å; L242-I244 VanDerWaalsContact C-N 3.34Å; L242-I244 PolarHBondContact O-N 2.67Å; L242-T245 WeakPolarHBondContact O-CA 3.45Å; L242-T245 VanDerWaalsContact O-CB 3.31Å; L242-T245 WeakPolarHBondContact O-CB 3.12Å; L242-T245 PolarHBondContact O-N 3.13Å; L242-T245 VanDerWaalsContact O-N 3.12Å; L242-L246 HydrophobicContact CD1-CD1 4.05Å; L242-L246 HydrophobicContact CD1-CD2 4.17Å; L242-L246 HydrophobicContact CD1-CG 3.91Å; L242-L246 HydrophobicContact CG-CD1 3.97Å; L242-L246 HydrophobicContact CG-CG 4.23Å; L242-L246 VanDerWaalsContact O-CG 3.3Å; L242-L246 WeakPolarHBondContact O-CG 3.13Å; L242-L246 PolarHBondContact O-N 3.39Å; L242-F325 HydrophobicContact CD2-CE1 4.49Å
243	G	98.4	Very high	93.8	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-55.3	-45.9	177.1	0	0	0	0	0	113.2	V239 W240 T245 L246 I247	V239-G243 PolarHBondContact O-N 2.83Å; W240-G243 WeakPolarHBondContact O-CA 3.45Å; W240-G243 PolarHBondContact O-N 3.14Å; G243-T245 PolarHBondContact O-N 2.88Å; G243-L246 PolarHBondContact O-N 2.9Å; G243-I247 PolarHBondContact O-N 2.76Å; G243-I247 VanDerWaalsContact O-N 3.13Å
244	I	97.6	Very high	95.3	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-61.9	-45.1	175.8	-61.3	-60.3	0	0	0	110.8	Y218 W240 L242 L246 I247 E248 F254 P255 Y256 P275 L330	Y218-I244 HydrophobicContact CD1-CB 4.04Å; Y218-I244 HydrophobicContact CD1-CG2 3.49Å; Y218-I244 VanDerWaalsContact CD1-CG2 3.49Å; Y218-I244 HydrophobicContact CE1-CG2 3.86Å; Y218-I244 HydrophobicContact CG-CG2 4.4Å; W240-I244 PolarHBondContact O-N 3.27Å; L242-I244 VanDerWaalsContact C-N 3.34Å; L242-I244 PolarHBondContact O-N 2.67Å; I244-L246 VanDerWaalsContact C-N 3.33Å; I244-L246 PolarHBondContact O-N 2.88Å; I244-I247 PolarHBondContact O-N 2.77Å; I244-E248 PolarHBondContact O-N 3.43Å; I244-E248 VanDerWaalsContact O-N 3.08Å; I244-F254 HydrophobicContact CG2-CD2 4.41Å; I244-F254 HydrophobicContact CG2-CE2 3.6Å; I244-F254 HydrophobicContact CG2-CZ 4.13Å; I244-P255 HydrophobicContact CD1-CG 4.05Å; I244-P255 HydrophobicContact CG2-CG 3.83Å; I244-Y256 HydrophobicContact CD1-CE2 3.82Å; I244-P275 HydrophobicContact CD1-CG 3.5Å; I244-L330 HydrophobicContact CD1-CD1 4.44Å; I244-L330 HydrophobicContact CD1-CD2 3.59Å; I244-L330 HydrophobicContact CG1-CD2 3.82Å
245	T	98.2	Very high	95.8	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-58.3	-43.9	177.2	-61.8	0	0	0	0	111.6	K180 P181 I184 S241 L242 G243 E248 L249	K180-T245 WeakPolarHBondContact CA-OG1 3.2Å; P181-T245 HydrophobicContact CG-CG2 3.98Å; I184-T245 HydrophobicContact CD1-CG2 3.86Å; S241-T245 WeakPolarHBondContact O-CB 3.26Å; S241-T245 PolarHBondContact O-N 2.77Å; S241-T245 PolarHBondContact O-OG1 2.91Å; L242-T245 WeakPolarHBondContact O-CA 3.45Å; L242-T245 VanDerWaalsContact O-CB 3.31Å; L242-T245 WeakPolarHBondContact O-CB 3.12Å; L242-T245 PolarHBondContact O-N 3.13Å; L242-T245 VanDerWaalsContact O-N 3.12Å; G243-T245 PolarHBondContact O-N 2.88Å; T245-E248 PolarHBondContact O-N 3.27Å; T245-L249 HydrophobicContact CG2-CD1 3.84Å; T245-L249 HydrophobicContact CG2-CG 4.29Å; T245-L249 WeakPolarHBondContact O-CB 3.38Å; T245-L249 VanDerWaalsContact O-CG 3.26Å; T245-L249 WeakPolarHBondContact O-CG 3.39Å; T245-L249 PolarHBondContact O-N 3.14Å
246	L	98.6	Very high	95.8	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-68.3	-37.8	-178.5	-67.2	177.2	0	0	0	112.3	I154 T158 L242 G243 I244 S250 F322 F325 V326	I154-L246 HydrophobicContact CG2-CD2 3.98Å; T158-L246 HydrophobicContact CG2-CD1 4.14Å; T158-L246 WeakPolarHBondContact OG1-CD2 3.31Å; L242-L246 HydrophobicContact CD1-CD1 4.05Å; L242-L246 HydrophobicContact CD1-CD2 4.17Å; L242-L246 HydrophobicContact CD1-CG 3.91Å; L242-L246 HydrophobicContact CG-CD1 3.97Å; L242-L246 HydrophobicContact CG-CG 4.23Å; L242-L246 VanDerWaalsContact O-CG 3.3Å; L242-L246 WeakPolarHBondContact O-CG 3.13Å; L242-L246 PolarHBondContact O-N 3.39Å; G243-L246 PolarHBondContact O-N 2.9Å; I244-L246 VanDerWaalsContact C-N 3.33Å; I244-L246 PolarHBondContact O-N 2.88Å; L246-S250 VanDerWaalsContact O-CB 3.24Å; L246-S250 WeakPolarHBondContact O-CB 3.22Å; L246-S250 PolarHBondContact O-N 3.4Å; L246-S250 VanDerWaalsContact O-N 3.12Å; L246-S250 PolarHBondContact O-OG 3.47Å; L246-F322 HydrophobicContact CB-CE2 4.39Å; L246-F322 HydrophobicContact CB-CZ 4.41Å; L246-F322 HydrophobicContact CD1-CE2 4.44Å; L246-F325 HydrophobicContact CD1-CD1 3.97Å; L246-F325 HydrophobicContact CD1-CE1 3.72Å; L246-V326 HydrophobicContact CB-CG2 4.09Å; L246-V326 HydrophobicContact CD1-CG2 4.36Å
247	I	97.7	Very high	95.3	Very high	5 Å²	5	17.4 Å²	17.4	3%	0.026	10%	0.095	C	C	.	.	H	α-helix	trans	-61.1	-51.2	172.2	-65	177.6	0	0	0	109.7	G243 I244 L249 S250 T251 P255 P275 L277 V326 L330	G243-I247 PolarHBondContact O-N 2.76Å; G243-I247 VanDerWaalsContact O-N 3.13Å; I244-I247 PolarHBondContact O-N 2.77Å; I247-L249 PolarHBondContact O-N 2.68Å; I247-S250 PolarHBondContact O-N 3.42Å; I247-S250 VanDerWaalsContact O-N 3.07Å; I247-T251 HydrophobicContact CG2-CG2 3.95Å; I247-T251 WeakPolarHBondContact O-CG2 3.44Å; I247-T251 PolarHBondContact O-N 2.86Å; I247-T251 PolarHBondContact O-OG1 3.49Å; I247-P255 HydrophobicContact CB-CB 4.4Å; I247-P255 HydrophobicContact CB-CG 4.46Å; I247-P255 HydrophobicContact CD1-CB 4.44Å; I247-P255 HydrophobicContact CG2-CB 3.85Å; I247-P255 HydrophobicContact CG2-CG 4.37Å; I247-P275 HydrophobicContact CD1-CB 3.95Å; I247-P275 HydrophobicContact CD1-CG 4.31Å; I247-L277 HydrophobicContact CB-CD2 4.42Å; I247-L277 HydrophobicContact CG1-CD2 4.08Å; I247-L277 HydrophobicContact CG1-CG 4.27Å; I247-L277 HydrophobicContact CG2-CD2 4.42Å; I247-V326 HydrophobicContact CD1-CG1 3.8Å; I247-V326 HydrophobicContact CG1-CG1 3.57Å; I247-L330 HydrophobicContact CD1-CD1 3.44Å; I247-L330 VanDerWaalsContact CD1-CD1 3.44Å; I247-L330 HydrophobicContact CG1-CD1 4.36Å
248	E	97.5	Very high	94.9	Very high	6 Å²	6	21.8 Å²	21.8	3%	0.028	13%	0.131	C	C	.	.	H	α-helix	trans	-58.6	-45.4	-177.6	-176.5	177.8	177.8	0	0	112.6	Y138 Y218 I244 T245 S250 G252 Q253	Y138-E248 HydrophobicContact CE1-CG 4.13Å; Y138-E248 WeakPolarHBondContact CE1-OE1 3.42Å; Y138-E248 HydrophobicContact CE2-CG 4.37Å; Y138-E248 VanDerWaalsContact CZ-OE1 3.26Å; Y138-E248 PolarHBondContact OH-OE1 3.3Å; Y218-E248 WeakPolarHBondContact CE1-OE2 3.36Å; Y218-E248 VanDerWaalsContact CZ-OE2 3.25Å; Y218-E248 PolarHBondContact OH-OE1 3.13Å; Y218-E248 PolarHBondContact OH-OE2 3.45Å; I244-E248 PolarHBondContact O-N 3.43Å; I244-E248 VanDerWaalsContact O-N 3.08Å; T245-E248 PolarHBondContact O-N 3.27Å; E248-S250 VanDerWaalsContact C-N 3.27Å; E248-S250 PolarHBondContact O-N 2.94Å; E248-G252 VanDerWaalsContact O-CA 3.27Å; E248-G252 WeakPolarHBondContact O-CA 3.4Å; E248-G252 PolarHBondContact O-N 3.09Å; E248-Q253 WeakPolarHBondContact CA-O 3.09Å
249	L	97.8	Very high	94.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.8	-29.3	177.6	-67.3	175.9	0	0	0	113.1	L134 Y138 Y142 I154 I157 P181 T245 I247	L134-L249 HydrophobicContact CB-CD2 3.92Å; L134-L249 HydrophobicContact CD1-CD1 3.82Å; L134-L249 HydrophobicContact CD1-CD2 4.5Å; Y138-L249 HydrophobicContact CD1-CD2 3.7Å; Y138-L249 HydrophobicContact CG-CD2 4.07Å; Y142-L249 WeakPolarHBondContact CE2-O 3.33Å; Y142-L249 PolarHBondContact OH-O 3.04Å; I154-L249 HydrophobicContact CD1-CB 3.71Å; I157-L249 HydrophobicContact CG2-CD1 4.21Å; P181-L249 HydrophobicContact CB-CD2 4.16Å; P181-L249 HydrophobicContact CG-CD2 4.29Å; P181-L249 HydrophobicContact CG-CG 4.47Å; T245-L249 HydrophobicContact CG2-CD1 3.84Å; T245-L249 HydrophobicContact CG2-CG 4.29Å; T245-L249 WeakPolarHBondContact O-CB 3.38Å; T245-L249 VanDerWaalsContact O-CG 3.26Å; T245-L249 WeakPolarHBondContact O-CG 3.39Å; T245-L249 PolarHBondContact O-N 3.14Å; I247-L249 PolarHBondContact O-N 2.68Å
250	S	97.1	Very high	93.4	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.007	19%	0.187	C	C	.	.	H	α-helix	trans	-87.9	-31.6	-175.8	-56.2	0	0	0	0	113	Y142 L246 I247 E248 F322	Y142-S250 PolarHBondContact OH-O 2.96Å; L246-S250 VanDerWaalsContact O-CB 3.24Å; L246-S250 WeakPolarHBondContact O-CB 3.22Å; L246-S250 PolarHBondContact O-N 3.4Å; L246-S250 VanDerWaalsContact O-N 3.12Å; L246-S250 PolarHBondContact O-OG 3.47Å; I247-S250 PolarHBondContact O-N 3.42Å; I247-S250 VanDerWaalsContact O-N 3.07Å; E248-S250 VanDerWaalsContact C-N 3.27Å; E248-S250 PolarHBondContact O-N 2.94Å; S250-F322 WeakPolarHBondContact OG-CE1 3.23Å; S250-F322 VanDerWaalsContact OG-CZ 3.23Å; S250-F322 WeakPolarHBondContact OG-CZ 3.5Å
251	T	95.1	Very high	92.6	Very high	18 Å²	18	35.7 Å²	35.7	11%	0.11	20%	0.203	C	C	.	.	H	α-helix	trans	-99.5	-20.2	-178.6	66.7	0	0	0	0	112.7	Y142 I247 Q253 L277 P278 L281	Y142-T251 WeakPolarHBondContact CE1-O 3.45Å; I247-T251 HydrophobicContact CG2-CG2 3.95Å; I247-T251 WeakPolarHBondContact O-CG2 3.44Å; I247-T251 PolarHBondContact O-N 2.86Å; I247-T251 PolarHBondContact O-OG1 3.49Å; T251-Q253 PolarHBondContact OG1-N 3.5Å; T251-Q253 VanDerWaalsContact OG1-N 3.1Å; T251-Q253 PolarHBondContact OG1-O 2.84Å; T251-L277 HydrophobicContact CG2-CD2 4.3Å; T251-P278 HydrophobicContact CG2-CG 4.09Å; T251-L281 HydrophobicContact CG2-CD2 4.03Å
252	G	94.7	Very high	91.7	Very high	11 Å²	11	38.9 Å²	38.9	11%	0.113	22%	0.223	C	C	.	.	S	Bend	trans	75.6	8	-169.5	0	0	0	0	0	113.6	E248	E248-G252 VanDerWaalsContact O-CA 3.27Å; E248-G252 WeakPolarHBondContact O-CA 3.4Å; E248-G252 PolarHBondContact O-N 3.09Å
253	Q	93.5	Very high	90.8	Very high	137 Å²	137	46.4 Å²	46.4	64%	0.64	26%	0.256	S	S	*	.	S	Bend	trans	-134.2	133.9	-175.2	-64.4	-172.6	-2.5	0	0	111.1	E248 T251	E248-Q253 WeakPolarHBondContact CA-O 3.09Å; T251-Q253 PolarHBondContact OG1-N 3.5Å; T251-Q253 VanDerWaalsContact OG1-N 3.1Å; T251-Q253 PolarHBondContact OG1-O 2.84Å
254	F	93.7	Very high	90	Very high	48 Å²	48	49.9 Å²	49.9	21%	0.211	27%	0.272	C	S	.	.			trans	-60.1	133	170.7	-171.7	-105	0	0	0	109.9	P217 Y218 I244 Y256 W259	P217-F254 HydrophobicContact CB-CE1 3.92Å; P217-F254 HydrophobicContact CB-CE2 3.63Å; P217-F254 HydrophobicContact CB-CZ 3.21Å; P217-F254 HydrophobicContact CG-CZ 4.49Å; Y218-F254 HydrophobicContact CD1-CE2 4.28Å; Y218-F254 HydrophobicContact CE1-CD2 4.29Å; Y218-F254 AromaticContact CE1-CE2 3.85Å; Y218-F254 HydrophobicContact CE1-CE2 3.85Å; Y218-F254 HydrophobicContact CE2-CE2 4.41Å; Y218-F254 AromaticContact CZ-CE2 3.91Å; I244-F254 HydrophobicContact CG2-CD2 4.41Å; I244-F254 HydrophobicContact CG2-CE2 3.6Å; I244-F254 HydrophobicContact CG2-CZ 4.13Å; F254-Y256 VanDerWaalsContact C-N 3.35Å; F254-Y256 AromaticContact CE1-CD2 3.74Å; F254-Y256 HydrophobicContact CE1-CD2 3.74Å; F254-Y256 HydrophobicContact CE1-CG 4.23Å; F254-Y256 AromaticContact CZ-CD2 3.89Å; F254-Y256 HydrophobicContact CZ-CD2 3.89Å; F254-Y256 PolarHBondContact O-N 3.39Å; F254-W259 AromaticContact CD1-CH2 3.83Å; F254-W259 HydrophobicContact CD1-CH2 3.83Å; F254-W259 AromaticContact CD1-CZ3 3.7Å; F254-W259 HydrophobicContact CD1-CZ3 3.7Å; F254-W259 AromaticContact CE1-CH2 3.53Å; F254-W259 HydrophobicContact CE1-CH2 3.53Å; F254-W259 AromaticContact CE1-CZ3 3.44Å; F254-W259 HydrophobicContact CE1-CZ3 3.44Å; F254-W259 VanDerWaalsContact CE1-CZ3 3.44Å; F254-W259 HydrophobicContact CZ-CH2 4.39Å
255	P	92.7	Very high	89.2	Confident	35 Å²	35	50 Å²	50	23%	0.227	27%	0.273	C	S	.	.	S	Bend	trans	-75.3	-16.2	-165.3	25	-34.5	0	0	0	115.7	I244 I247 P275	I244-P255 HydrophobicContact CD1-CG 4.05Å; I244-P255 HydrophobicContact CG2-CG 3.83Å; I247-P255 HydrophobicContact CB-CB 4.4Å; I247-P255 HydrophobicContact CB-CG 4.46Å; I247-P255 HydrophobicContact CD1-CB 4.44Å; I247-P255 HydrophobicContact CG2-CB 3.85Å; I247-P255 HydrophobicContact CG2-CG 4.37Å; P255-P275 HydrophobicContact CB-CB 3.61Å; P255-P275 HydrophobicContact CB-CG 4.06Å; P255-P275 HydrophobicContact CG-CB 4.33Å; P255-P275 HydrophobicContact CG-CG 4.24Å
256	Y	89.3	Confident	88.4	Confident	18 Å²	18	51.8 Å²	51.8	7%	0.071	28%	0.282	C	S	.	.	S	Bend	trans	-94	147.4	175.9	-67.5	-70.4	0	0	0	111.2	W240 I244 F254 C268 V269 P275	W240-Y256 WeakPolarHBondContact CZ2-OH 3.25Å; I244-Y256 HydrophobicContact CD1-CE2 3.82Å; F254-Y256 VanDerWaalsContact C-N 3.35Å; F254-Y256 AromaticContact CE1-CD2 3.74Å; F254-Y256 HydrophobicContact CE1-CD2 3.74Å; F254-Y256 HydrophobicContact CE1-CG 4.23Å; F254-Y256 AromaticContact CZ-CD2 3.89Å; F254-Y256 HydrophobicContact CZ-CD2 3.89Å; F254-Y256 PolarHBondContact O-N 3.39Å; Y256-C268 HydrophobicContact CD1-CB 4.03Å; Y256-C268 HydrophobicContact CE1-CB 4.37Å; Y256-V269 HydrophobicContact CD2-CG2 4.39Å; Y256-V269 HydrophobicContact CE1-CG2 4.32Å; Y256-V269 HydrophobicContact CE2-CG2 3.75Å; Y256-P275 HydrophobicContact CE1-CG 4.32Å; Y256-P275 HydrophobicContact CE2-CG 4.3Å; Y256-P275 WeakPolarHBondContact OH-CD 3.22Å
257	P	83.8	Confident	87.7	Confident	82 Å²	82	53.9 Å²	53.9	53%	0.532	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-59.4	154.5	174.9	27.9	-35.9	0	0	0	110.5	W259	P257-W259 PolarHBondContact O-N 3.42Å
258	A	83.6	Confident	87	Confident	93 Å²	93	54.4 Å²	54.4	77%	0.769	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-55	138.4	171.7	0	0	0	0	0	110.5
259	W	81.6	Confident	86.3	Confident	83 Å²	83	54.2 Å²	54.2	31%	0.314	30%	0.298	S	S	.	.			trans	-120.1	142.7	-178.7	55.4	84.9	0	0	0	110.4	P217 F254 P257 E264 Q265	P217-W259 HydrophobicContact CB-CH2 4.25Å; P217-W259 HydrophobicContact CG-CZ2 4.48Å; F254-W259 AromaticContact CD1-CH2 3.83Å; F254-W259 HydrophobicContact CD1-CH2 3.83Å; F254-W259 AromaticContact CD1-CZ3 3.7Å; F254-W259 HydrophobicContact CD1-CZ3 3.7Å; F254-W259 AromaticContact CE1-CH2 3.53Å; F254-W259 HydrophobicContact CE1-CH2 3.53Å; F254-W259 AromaticContact CE1-CZ3 3.44Å; F254-W259 HydrophobicContact CE1-CZ3 3.44Å; F254-W259 VanDerWaalsContact CE1-CZ3 3.44Å; F254-W259 HydrophobicContact CZ-CH2 4.39Å; P257-W259 PolarHBondContact O-N 3.42Å; W259-E264 HydrophobicContact CB-CB 4.13Å; W259-E264 HydrophobicContact CB-CG 4.03Å; W259-Q265 HydrophobicContact CB-CB 4.18Å; W259-Q265 HydrophobicContact CD2-CB 3.67Å; W259-Q265 HydrophobicContact CD2-CG 3.77Å; W259-Q265 VanDerWaalsContact CE2-NE2 3.32Å; W259-Q265 HydrophobicContact CE3-CB 4.15Å; W259-Q265 HydrophobicContact CE3-CG 3.87Å; W259-Q265 HydrophobicContact CG-CB 3.63Å; W259-Q265 HydrophobicContact CG-CG 4.27Å; W259-Q265 HydrophobicContact CZ2-CG 4.41Å; W259-Q265 HydrophobicContact CZ3-CG 4.31Å
260	N	79.1	Confident	85.5	Confident	159 Å²	159	55.5 Å²	55.5	85%	0.85	31%	0.305	S	S	*	.	S	Bend	trans	-86.9	-18.5	175.8	-61.7	-66.1	0	0	0	112.1	E264	N260-E264 PolarHBondContact N-OE2 2.79Å
261	S	81.1	Confident	85	Confident	50 Å²	50	62.1 Å²	62.1	35%	0.35	34%	0.335	S	S	.	.	S	Bend	trans	-140.6	153.1	179.4	72.8	0	0	0	0	112.1	F263 E264 Q265	S261-F263 PolarHBondContact O-N 3.26Å; S261-E264 WeakPolarHBondContact O-CB 3.48Å; S261-E264 PolarHBondContact O-N 3.32Å; S261-E264 WeakPolarHBondContact OG-CB 3.36Å; S261-E264 PolarHBondContact OG-N 2.83Å; S261-E264 VanDerWaalsContact OG-N 3.08Å; S261-Q265 PolarHBondContact O-N 3.18Å
262	V	76.4	Confident	84.6	Confident	70 Å²	70	65.1 Å²	65.1	42%	0.424	35%	0.351	S	S	.	.	H	α-helix	trans	-54.2	-40.8	170.3	165	0	0	0	0	110.9	C215 E264 Q265 L266	C215-V262 HydrophobicContact CB-CB 4.18Å; C215-V262 HydrophobicContact CB-CG1 3.3Å; C215-V262 HydrophobicContact CB-CG2 4.04Å; V262-E264 VanDerWaalsContact C-N 3.34Å; V262-E264 PolarHBondContact O-N 3.01Å; V262-Q265 WeakPolarHBondContact O-CB 3.49Å; V262-Q265 PolarHBondContact O-N 3.09Å; V262-L266 HydrophobicContact CG1-CD1 3.77Å; V262-L266 HydrophobicContact CG1-CG 4.18Å; V262-L266 VanDerWaalsContact O-CG 3.23Å; V262-L266 WeakPolarHBondContact O-CG 3.47Å; V262-L266 PolarHBondContact O-N 3.41Å
263	F	79.5	Confident	84.4	Confident	157 Å²	157	71.6 Å²	71.6	69%	0.689	38%	0.383	S	S	*	.	H	α-helix	trans	-62.1	-40.5	179.8	-177.1	-97.1	0	0	0	112.5	S261 L266 T267	S261-F263 PolarHBondContact O-N 3.26Å; F263-L266 PolarHBondContact O-N 2.92Å; F263-T267 WeakPolarHBondContact CE1-OG1 3.47Å; F263-T267 WeakPolarHBondContact O-CB 3.47Å; F263-T267 PolarHBondContact O-N 3.22Å; F263-T267 PolarHBondContact O-OG1 3.26Å
264	E	81.6	Confident	84.3	Confident	73 Å²	73	67.4 Å²	67.4	34%	0.341	37%	0.367	S	S	.	.	H	α-helix	trans	-62.3	-45.4	176.8	-179.6	177	-164.6	0	0	111.4	W259 N260 S261 V262 L266 T267 C268	W259-E264 HydrophobicContact CB-CB 4.13Å; W259-E264 HydrophobicContact CB-CG 4.03Å; N260-E264 PolarHBondContact N-OE2 2.79Å; S261-E264 WeakPolarHBondContact O-CB 3.48Å; S261-E264 PolarHBondContact O-N 3.32Å; S261-E264 WeakPolarHBondContact OG-CB 3.36Å; S261-E264 PolarHBondContact OG-N 2.83Å; S261-E264 VanDerWaalsContact OG-N 3.08Å; V262-E264 VanDerWaalsContact C-N 3.34Å; V262-E264 PolarHBondContact O-N 3.01Å; E264-L266 PolarHBondContact O-N 3.02Å; E264-T267 WeakPolarHBondContact O-CB 3.32Å; E264-T267 PolarHBondContact O-N 2.71Å; E264-C268 PolarHBondContact O-N 2.87Å; E264-C268 PolarHBondContact O-SG 3.31Å; E264-C268 VanDerWaalsContact O-SG 3.39Å
265	Q	81.6	Confident	84.3	Confident	4 Å²	4	66 Å²	66	2%	0.019	36%	0.363	C	S	.	.	H	α-helix	trans	-58.2	-49.4	174.7	-174.4	178.1	34.5	0	0	112.5	C215 W259 S261 V262 T267 C268 V269	C215-Q265 PolarHBondContact SG-OE1 3.16Å; W259-Q265 HydrophobicContact CB-CB 4.18Å; W259-Q265 HydrophobicContact CD2-CB 3.67Å; W259-Q265 HydrophobicContact CD2-CG 3.77Å; W259-Q265 VanDerWaalsContact CE2-NE2 3.32Å; W259-Q265 HydrophobicContact CE3-CB 4.15Å; W259-Q265 HydrophobicContact CE3-CG 3.87Å; W259-Q265 HydrophobicContact CG-CB 3.63Å; W259-Q265 HydrophobicContact CG-CG 4.27Å; W259-Q265 HydrophobicContact CZ2-CG 4.41Å; W259-Q265 HydrophobicContact CZ3-CG 4.31Å; S261-Q265 PolarHBondContact O-N 3.18Å; V262-Q265 WeakPolarHBondContact O-CB 3.49Å; V262-Q265 PolarHBondContact O-N 3.09Å; Q265-T267 VanDerWaalsContact C-N 3.28Å; Q265-T267 PolarHBondContact O-N 3.28Å; Q265-C268 WeakPolarHBondContact O-CB 3.44Å; Q265-C268 PolarHBondContact O-N 3.38Å; Q265-V269 WeakPolarHBondContact O-CG2 3.13Å; Q265-V269 PolarHBondContact O-N 2.92Å; Q265-V269 VanDerWaalsContact O-N 3.11Å
266	L	81.1	Confident	84.4	Confident	36 Å²	36	68.5 Å²	68.5	19%	0.188	38%	0.381	C	S	.	.	H	α-helix	trans	-61.1	-41.3	179.3	-66.4	176.3	0	0	0	110.7	C215 I224 V262 F263 E264 C268 V269 L270	C215-L266 HydrophobicContact CB-CD2 4.31Å; C215-L266 WeakPolarHBondContact SG-CD2 3.41Å; I224-L266 HydrophobicContact CB-CD2 4.19Å; I224-L266 HydrophobicContact CD1-CD2 3.41Å; I224-L266 VanDerWaalsContact CD1-CD2 3.41Å; I224-L266 HydrophobicContact CG1-CD2 3.53Å; I224-L266 HydrophobicContact CG2-CB 4.07Å; I224-L266 HydrophobicContact CG2-CD1 4.17Å; I224-L266 HydrophobicContact CG2-CD2 3.63Å; I224-L266 HydrophobicContact CG2-CG 4.17Å; V262-L266 HydrophobicContact CG1-CD1 3.77Å; V262-L266 HydrophobicContact CG1-CG 4.18Å; V262-L266 VanDerWaalsContact O-CG 3.23Å; V262-L266 WeakPolarHBondContact O-CG 3.47Å; V262-L266 PolarHBondContact O-N 3.41Å; F263-L266 PolarHBondContact O-N 2.92Å; E264-L266 PolarHBondContact O-N 3.02Å; L266-C268 VanDerWaalsContact C-N 3.34Å; L266-C268 PolarHBondContact O-N 2.85Å; L266-V269 PolarHBondContact O-N 3.23Å; L266-L270 WeakPolarHBondContact O-CB 3.4Å; L266-L270 WeakPolarHBondContact O-CD1 3.31Å; L266-L270 WeakPolarHBondContact O-CG 3.17Å; L266-L270 PolarHBondContact O-N 3.23Å
267	T	82.4	Confident	84.7	Confident	45 Å²	45	67.9 Å²	67.9	28%	0.276	38%	0.379	S	S	.	.	H	α-helix	trans	-59	-44.5	176	-58.6	0	0	0	0	111	F263 E264 Q265 V269 L270 H271	F263-T267 WeakPolarHBondContact CE1-OG1 3.47Å; F263-T267 WeakPolarHBondContact O-CB 3.47Å; F263-T267 PolarHBondContact O-N 3.22Å; F263-T267 PolarHBondContact O-OG1 3.26Å; E264-T267 WeakPolarHBondContact O-CB 3.32Å; E264-T267 PolarHBondContact O-N 2.71Å; Q265-T267 VanDerWaalsContact C-N 3.28Å; Q265-T267 PolarHBondContact O-N 3.28Å; T267-V269 PolarHBondContact O-N 3.17Å; T267-L270 PolarHBondContact O-N 3.12Å; T267-H271 WeakPolarHBondContact O-CB 3.18Å; T267-H271 PolarHBondContact O-CD2 3.49Å; T267-H271 PolarHBondContact O-N 3.14Å
268	C	83.1	Confident	85	Confident	16 Å²	16	66.2 Å²	66.2	11%	0.108	37%	0.368	C	S	.	.	H	α-helix	trans	-59.3	-47.6	175.5	-68.7	0	0	0	0	112	Y256 E264 Q265 L266 L270 N272	Y256-C268 HydrophobicContact CD1-CB 4.03Å; Y256-C268 HydrophobicContact CE1-CB 4.37Å; E264-C268 PolarHBondContact O-N 2.87Å; E264-C268 PolarHBondContact O-SG 3.31Å; E264-C268 VanDerWaalsContact O-SG 3.39Å; Q265-C268 WeakPolarHBondContact O-CB 3.44Å; Q265-C268 PolarHBondContact O-N 3.38Å; L266-C268 VanDerWaalsContact C-N 3.34Å; L266-C268 PolarHBondContact O-N 2.85Å; C268-L270 VanDerWaalsContact C-N 3.28Å; C268-L270 PolarHBondContact O-N 3.21Å; C268-N272 VanDerWaalsContact O-CB 3.31Å; C268-N272 WeakPolarHBondContact O-CB 3.48Å; C268-N272 PolarHBondContact O-N 3.47Å; C268-N272 VanDerWaalsContact O-N 3.13Å
269	V	83.3	Confident	85.2	Confident	3 Å²	3	67 Å²	67	2%	0.018	36%	0.356	C	S	.	.	H	α-helix	trans	-60.5	-39.6	179	174.4	0	0	0	0	111.2	P221 I224 W240 Y256 Q265 L266 T267 K332	P221-V269 HydrophobicContact CB-CG1 4.29Å; P221-V269 HydrophobicContact CG-CG1 3.81Å; I224-V269 HydrophobicContact CD1-CB 3.85Å; I224-V269 HydrophobicContact CD1-CG1 3.54Å; I224-V269 HydrophobicContact CD1-CG2 4.43Å; W240-V269 HydrophobicContact CZ2-CG1 3.98Å; Y256-V269 HydrophobicContact CD2-CG2 4.39Å; Y256-V269 HydrophobicContact CE1-CG2 4.32Å; Y256-V269 HydrophobicContact CE2-CG2 3.75Å; Q265-V269 WeakPolarHBondContact O-CG2 3.13Å; Q265-V269 PolarHBondContact O-N 2.92Å; Q265-V269 VanDerWaalsContact O-N 3.11Å; L266-V269 PolarHBondContact O-N 3.23Å; T267-V269 PolarHBondContact O-N 3.17Å; V269-K332 WeakPolarHBondContact O-CE 3.47Å; V269-K332 PolarHBondContact O-NZ 2.89Å
270	L	82.6	Confident	85.5	Confident	27 Å²	27	68.7 Å²	68.7	14%	0.141	36%	0.363	C	S	.	.	H	α-helix	trans	-82	-40.1	-174.3	-68.1	165.9	0	0	0	114.2	P221 I224 H225 L228 L266 T267 C268 K332	P221-L270 HydrophobicContact CB-CD2 4.15Å; I224-L270 HydrophobicContact CB-CD2 4.21Å; I224-L270 HydrophobicContact CG2-CD1 3.75Å; I224-L270 HydrophobicContact CG2-CD2 4.29Å; I224-L270 HydrophobicContact CG2-CG 4.2Å; H225-L270 WeakPolarHBondContact CD2-CD1 3.14Å; H225-L270 VanDerWaalsContact NE2-CD1 3.29Å; H225-L270 WeakPolarHBondContact NE2-CD1 3.4Å; L228-L270 HydrophobicContact CD1-CD2 3.91Å; L266-L270 WeakPolarHBondContact O-CB 3.4Å; L266-L270 WeakPolarHBondContact O-CD1 3.31Å; L266-L270 WeakPolarHBondContact O-CG 3.17Å; L266-L270 PolarHBondContact O-N 3.23Å; T267-L270 PolarHBondContact O-N 3.12Å; C268-L270 VanDerWaalsContact C-N 3.28Å; C268-L270 PolarHBondContact O-N 3.21Å; L270-K332 PolarHBondContact O-NZ 2.94Å
271	H	84.8	Confident	85.6	Confident	139 Å²	139	62 Å²	62	64%	0.644	33%	0.327	S	S	*	.	H	α-helix	trans	-110.4	-25.2	-166.8	-61.5	-65.2	0	0	0	114.7	T267	T267-H271 WeakPolarHBondContact O-CB 3.18Å; T267-H271 PolarHBondContact O-CD2 3.49Å; T267-H271 PolarHBondContact O-N 3.14Å
272	N	87.7	Confident	85.4	Confident	82 Å²	82	63.6 Å²	63.6	44%	0.439	34%	0.337	S	S	.	.	S	Bend	trans	-83.6	164	177.9	-61.9	-2.9	0	0	0	111.1	C268 K332	C268-N272 VanDerWaalsContact O-CB 3.31Å; C268-N272 WeakPolarHBondContact O-CB 3.48Å; C268-N272 PolarHBondContact O-N 3.47Å; C268-N272 VanDerWaalsContact O-N 3.13Å; N272-K332 PolarHBondContact O-NZ 3.17Å
273	D	89.8	Confident	85	Confident	147 Å²	147	70 Å²	70	79%	0.786	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-56.5	147.4	169.4	-68.5	-30.8	0	0	0	110.9
274	P	92.4	Very high	84.1	Confident	48 Å²	48	67 Å²	67	31%	0.312	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-61.9	144.4	176.1	28.6	-32.2	0	0	0	109.7	W240 L330 K332	W240-P274 HydrophobicContact CH2-CB 4.34Å; P274-L330 HydrophobicContact CB-CB 4.23Å; P274-L330 WeakPolarHBondContact CB-O 3.37Å; P274-K332 HydrophobicContact CB-CD 4.45Å; P274-K332 HydrophobicContact CB-CG 4Å; P274-K332 HydrophobicContact CG-CD 4.49Å; P274-K332 HydrophobicContact CG-CG 4.14Å
275	P	93.9	Very high	83	Confident	20 Å²	20	64.8 Å²	64.8	13%	0.13	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-63.9	152.2	177.6	23.7	-28.1	0	0	0	110.7	I244 I247 P255 Y256 L330	I244-P275 HydrophobicContact CD1-CG 3.5Å; I247-P275 HydrophobicContact CD1-CB 3.95Å; I247-P275 HydrophobicContact CD1-CG 4.31Å; P255-P275 HydrophobicContact CB-CB 3.61Å; P255-P275 HydrophobicContact CB-CG 4.06Å; P255-P275 HydrophobicContact CG-CB 4.33Å; P255-P275 HydrophobicContact CG-CG 4.24Å; Y256-P275 HydrophobicContact CE1-CG 4.32Å; Y256-P275 HydrophobicContact CE2-CG 4.3Å; Y256-P275 WeakPolarHBondContact OH-CD 3.22Å; P275-L330 HydrophobicContact CG-CD1 4.05Å; P275-L330 WeakPolarHBondContact O-CD1 3.48Å
276	S	94.6	Very high	81.3	Confident	87 Å²	87	72.4 Å²	72.4	61%	0.608	38%	0.383	S	S	*	.			trans	-136.1	158.6	179.4	57.5	0	0	0	0	110.6
277	L	93.9	Very high	79.7	Confident	5 Å²	5	75.7 Å²	75.7	3%	0.026	41%	0.405	C	S	.	.			trans	-65.7	131	172.4	-75.7	171	0	0	0	109.8	I247 T251 F318 F322 R323 V326	I247-L277 HydrophobicContact CB-CD2 4.42Å; I247-L277 HydrophobicContact CG1-CD2 4.08Å; I247-L277 HydrophobicContact CG1-CG 4.27Å; I247-L277 HydrophobicContact CG2-CD2 4.42Å; T251-L277 HydrophobicContact CG2-CD2 4.3Å; L277-F318 HydrophobicContact CB-CD2 4.05Å; L277-F318 HydrophobicContact CB-CE2 4.39Å; L277-F318 HydrophobicContact CD1-CB 4.42Å; L277-F318 HydrophobicContact CD1-CD2 4.32Å; L277-F318 HydrophobicContact CD1-CG 4.21Å; L277-F318 HydrophobicContact CD2-CD2 4.22Å; L277-F318 HydrophobicContact CD2-CE2 3.94Å; L277-F318 HydrophobicContact CD2-CZ 4.17Å; L277-F318 HydrophobicContact CG-CD2 4.43Å; L277-F322 HydrophobicContact CD1-CD1 3.56Å; L277-F322 HydrophobicContact CD1-CD2 4.42Å; L277-F322 HydrophobicContact CD1-CE1 3.46Å; L277-F322 VanDerWaalsContact CD1-CE1 3.46Å; L277-F322 HydrophobicContact CD1-CE2 4.34Å; L277-F322 HydrophobicContact CD1-CG 4.04Å; L277-F322 HydrophobicContact CD1-CZ 3.86Å; L277-F322 HydrophobicContact CD2-CE1 4.34Å; L277-R323 HydrophobicContact CB-CG 4.39Å; L277-R323 HydrophobicContact CD1-CG 4.36Å; L277-R323 PolarHBondContact O-NH1 2.97Å; L277-V326 HydrophobicContact CD1-CB 4.19Å; L277-V326 HydrophobicContact CD1-CG2 3.85Å; L277-V326 HydrophobicContact CG-CB 4.44Å; L277-V326 HydrophobicContact CG-CG1 4.3Å; L277-V326 HydrophobicContact CG-CG2 4.35Å
278	P	92.1	Very high	77.9	Confident	47 Å²	47	76.7 Å²	76.7	31%	0.305	41%	0.414	S	S	.	.			trans	-63.3	147.9	176.7	28.5	-35	0	0	0	110.5	T251 Y280 L281 F318 R323	T251-P278 HydrophobicContact CG2-CG 4.09Å; P278-Y280 VanDerWaalsContact C-N 3.3Å; P278-L281 HydrophobicContact CG-CD2 3.52Å; P278-L281 HydrophobicContact CG-CG 4.37Å; P278-F318 HydrophobicContact CG-CE2 4.33Å; P278-R323 VanDerWaalsContact C-NH1 3.27Å; P278-R323 PolarHBondContact O-NH1 2.64Å
279	E	87.4	Confident	75.8	Confident	110 Å²	110	81 Å²	81	51%	0.514	44%	0.444	S	S	.	.	S	Bend	trans	-64.9	-38	174.4	-74.7	179.9	173.4	0	0	112.1	T316 D317 R323	E279-T316 HydrophobicContact CB-CG2 4.28Å; E279-T316 HydrophobicContact CG-CG2 4.43Å; E279-D317 PolarHBondContact O-N 2.96Å; E279-D317 VanDerWaalsContact O-N 3.13Å; E279-R323 VanDerWaalsContact CA-NH1 3.33Å; E279-R323 VanDerWaalsContact CG-NH2 3.3Å
280	Y	86.6	Confident	73.6	Confident	118 Å²	118	85.8 Å²	85.8	46%	0.463	48%	0.477	S	S	.	.	S	Bend	trans	-136.1	134.6	179.3	-50.5	-78.3	0	0	0	109.3	P278 S314 D317	P278-Y280 VanDerWaalsContact C-N 3.3Å; Y280-S314 PolarHBondContact OH-OG 3.13Å; Y280-D317 WeakPolarHBondContact CA-OD2 3.06Å
281	L	82.7	Confident	71.3	Confident	18 Å²	18	89.9 Å²	89.9	9%	0.094	50%	0.503	C	S	.	.			trans	-88.5	151.4	174.8	-60.2	160.9	0	0	0	109.3	R148 T251 P278 K283 D317 F318	R148-L281 VanDerWaalsContact CZ-CD1 3.44Å; T251-L281 HydrophobicContact CG2-CD2 4.03Å; P278-L281 HydrophobicContact CG-CD2 3.52Å; P278-L281 HydrophobicContact CG-CG 4.37Å; L281-K283 PolarHBondContact O-N 2.64Å; L281-D317 WeakPolarHBondContact CB-OD2 3.43Å; L281-D317 HydrophobicContact CD1-CB 3.91Å; L281-D317 HydrophobicContact CG-CB 4.18Å; L281-D317 PolarHBondContact N-OD2 2.87Å; L281-F318 HydrophobicContact CD1-CE1 4.35Å; L281-F318 HydrophobicContact CD1-CE2 3.81Å; L281-F318 HydrophobicContact CD1-CZ 3.53Å; L281-F318 HydrophobicContact CD2-CE2 3.94Å; L281-F318 HydrophobicContact CD2-CZ 4.1Å; L281-F318 HydrophobicContact CG-CE2 3.99Å; L281-F318 HydrophobicContact CG-CZ 4.17Å
282	P	76.2	Confident	68.9	Low	84 Å²	84	89 Å²	89	55%	0.545	51%	0.508	S	S	.	.			trans	-55.7	131.7	176	-25.2	33.8	0	0	0	111.5	R148 S284	R148-P282 PolarHBondContact NH2-O 3.18Å; P282-S284 PolarHBondContact O-N 3.4Å
283	K	66.7	Low	66.2	Low	205 Å²	205	90.4 Å²	90.4	89%	0.891	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-5.1	-176.8	-68.4	-175.5	178.9	179.9	0	114.9	L281 I285	L281-K283 PolarHBondContact O-N 2.64Å; K283-I285 PolarHBondContact O-N 2.67Å; K283-I285 VanDerWaalsContact O-N 3.14Å
284	S	61.9	Low	63.5	Low	92 Å²	92	89.2 Å²	89.2	64%	0.643	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-5.2	-178	54.6	0	0	0	0	114.4	P282	P282-S284 PolarHBondContact O-N 3.4Å
285	I	57.7	Low	60.6	Low	27 Å²	27	92.3 Å²	92.3	14%	0.138	53%	0.53	C	S	.	.	S	Bend	trans	-118.8	103.7	-179.2	-49.4	-178.6	0	0	0	108	Y142 Q146 S147 R148 K283 T287	Y142-I285 HydrophobicContact CD1-CD1 3.95Å; Y142-I285 HydrophobicContact CE1-CD1 4.46Å; Q146-I285 VanDerWaalsContact O-CG2 3.29Å; Q146-I285 WeakPolarHBondContact O-CG2 3.35Å; S147-I285 VanDerWaalsContact C-CG2 3.43Å; S147-I285 WeakPolarHBondContact O-CG2 3.38Å; R148-I285 HydrophobicContact CG-CB 4.34Å; R148-I285 HydrophobicContact CG-CG2 3.49Å; R148-I285 VanDerWaalsContact CG-CG2 3.49Å; K283-I285 PolarHBondContact O-N 2.67Å; K283-I285 VanDerWaalsContact O-N 3.14Å; I285-T287 PolarHBondContact O-N 3.29Å
286	Q	46.9	Very low	57.6	Low	164 Å²	164	98.9 Å²	98.9	77%	0.766	57%	0.565	S	S	*	*			trans	-73	122.7	178.9	-66.4	-178.8	10.2	0	0	109.2	S288	Q286-S288 PolarHBondContact O-N 2.79Å; Q286-S288 VanDerWaalsContact O-N 3.17Å
287	T	48.1	Very low	54.8	Low	106 Å²	106	101.1 Å²	101.1	65%	0.65	57%	0.569	S	S	*	*			trans	-63	115.4	162.3	40	0	0	0	0	106.9	I285 S289	I285-T287 PolarHBondContact O-N 3.29Å; T287-S289 PolarHBondContact O-N 3.45Å
288	S	42.8	Very low	51.7	Low	66 Å²	66	109 Å²	109	46%	0.462	61%	0.605	S	S	.	*			trans	-65.5	104.6	172.5	37.5	0	0	0	0	107.3	Q286 S290	Q286-S288 PolarHBondContact O-N 2.79Å; Q286-S288 VanDerWaalsContact O-N 3.17Å; S288-S290 PolarHBondContact O-N 2.81Å
289	S	39.6	Very low	49	Very low	107 Å²	107	117 Å²	117	75%	0.748	63%	0.631	S	S	*	*			trans	-70.9	42.2	175.3	43.8	0	0	0	0	112	T287	T287-S289 PolarHBondContact O-N 3.45Å
290	S	36.5	Very low	46.3	Very low	103 Å²	103	116.1 Å²	116.1	72%	0.72	64%	0.637	S	S	*	*			trans	-142.9	55.9	-178.1	-62	0	0	0	0	111.4	S288	S288-S290 PolarHBondContact O-N 2.81Å
291	T	35	Very low	43.8	Very low	112 Å²	112	117.4 Å²	117.4	69%	0.687	65%	0.652	S	S	*	*			trans	-133.3	57.4	150.2	-39.8	0	0	0	0	108.6	T293	T291-T293 PolarHBondContact O-N 3.04Å
292	T	33.7	Very low	41.7	Very low	122 Å²	122	124.4 Å²	124.4	75%	0.748	68%	0.683	S	S	*	*			trans	-90.7	88.3	168.9	-39.5	0	0	0	0	108.4
293	T	31.1	Very low	39.8	Very low	110 Å²	110	124.5 Å²	124.5	68%	0.675	69%	0.686	S	S	*	*			trans	-159.2	135.3	147.9	-27.4	0	0	0	0	106.8	T291	T291-T293 PolarHBondContact O-N 3.04Å
294	L	33.4	Very low	38.5	Very low	122 Å²	122	122.3 Å²	122.3	64%	0.639	68%	0.683	S	S	*	*	S	Bend	trans	86.2	81.6	-163.7	-47.7	169.8	0	0	0	109.6
295	V	32.5	Very low	37.3	Very low	113 Å²	113	122.7 Å²	122.7	69%	0.685	69%	0.685	S	S	*	*				-156.6	113	54.8	-176.5	0	0	0	0	108.4	I297	V295-I297 HydrophobicContact CG1-CD1 4.31Å; V295-I297 HydrophobicContact CG1-CG1 4.09Å
296	N	30.1	Very low	36.2	Very low	159 Å²	159	128.3 Å²	128.3	85%	0.85	72%	0.715	S	S	*	*			trans	-113.7	90.7	158.9	-84.4	-5.4	0	0	0	106.3
297	I	35.6	Very low	35.7	Very low	134 Å²	134	127.6 Å²	127.6	69%	0.687	72%	0.717	S	S	*	*			trans	-96	105.5	159.5	-65.7	175.6	0	0	0	105.1	V295 Y299	V295-I297 HydrophobicContact CG1-CD1 4.31Å; V295-I297 HydrophobicContact CG1-CG1 4.09Å; I297-Y299 HydrophobicContact CG2-CD2 4.45Å; I297-Y299 HydrophobicContact CG2-CE2 4.18Å; I297-Y299 PolarHBondContact O-N 2.79Å
298	E	29.1	Very low	35	Very low	169 Å²	169	127.3 Å²	127.3	79%	0.79	72%	0.719	S	S	*	*			trans	-58.6	122.4	175.2	-66.3	172.9	151.8	0	0	110.3
299	Y	35.4	Very low	34.5	Very low	216 Å²	216	131.4 Å²	131.4	85%	0.847	74%	0.736	S	S	*	*			trans	-116.7	99.4	150.7	-84.5	-81.5	0	0	0	107.7	I297	I297-Y299 HydrophobicContact CG2-CD2 4.45Å; I297-Y299 HydrophobicContact CG2-CE2 4.18Å; I297-Y299 PolarHBondContact O-N 2.79Å
300	S	30.1	Very low	34.3	Very low	92 Å²	92	136 Å²	136	64%	0.643	75%	0.745	S	S	*	*			trans	-67	124.9	162.6	-29	0	0	0	0	108.1
301	N	35.4	Very low	34.3	Very low	145 Å²	145	136 Å²	136	78%	0.775	75%	0.745	S	S	*	*				173.6	132.3	126.6	-86.3	-25.4	0	0	0	113.1
302	H	38	Very low	34	Very low	164 Å²	164	136.8 Å²	136.8	76%	0.759	76%	0.755	S	S	*	*			trans	80.1	92.1	149.1	-78.3	-59.4	0	0	0	121.9
303	S	37.3	Very low	34.5	Very low	86 Å²	86	135.5 Å²	135.5	60%	0.601	75%	0.75	S	S	*	*				56.3	111.5	115.6	55.3	0	0	0	0	122.1
304	I	37.5	Very low	35.4	Very low	160 Å²	160	134 Å²	134	82%	0.821	75%	0.745	S	S	*	*				73.5	125.2	123.9	-60.3	169.9	0	0	0	119.8
305	S	37.7	Very low	37.1	Very low	99 Å²	99	133.8 Å²	133.8	69%	0.692	75%	0.748	S	S	*	*			trans	101.3	106.3	145.2	64.5	0	0	0	0	120.6
306	N	33.8	Very low	39.4	Very low	145 Å²	145	130.9 Å²	130.9	78%	0.775	73%	0.731	S	S	*	*				40	109.4	129.1	-60	-10.5	0	0	0	118.9
307	N	37.2	Very low	42.2	Very low	150 Å²	150	127.4 Å²	127.4	80%	0.802	71%	0.712	S	S	*	*				161.4	146.5	101.1	-98.1	-26.3	0	0	0	112
308	S	32.8	Very low	45	Very low	100 Å²	100	121.6 Å²	121.6	70%	0.699	68%	0.682	S	S	*	*			trans	72.6	123.4	148.2	58.2	0	0	0	0	120.3
309	N	33.5	Very low	48.1	Very low	152 Å²	152	114.9 Å²	114.9	81%	0.813	65%	0.654	S	S	*	*			trans	81.3	71.2	153.6	-54.5	-19	0	0	0	117.8	S311	N309-S311 PolarHBondContact O-N 3.49Å
310	E	34.4	Very low	51	Low	202 Å²	202	108.6 Å²	108.6	94%	0.944	64%	0.642	S	S	*	*			trans	-79.6	94.6	155.1	-82.7	-178.8	160.9	0	0	109.5	C312	E310-C312 PolarHBondContact O-N 2.81Å
311	S	36.2	Very low	54.2	Low	103 Å²	103	107.1 Å²	107.1	72%	0.72	63%	0.625	S	S	*	*			trans	-58.4	117	158.2	53.2	0	0	0	0	108.4	N309 S313	N309-S311 PolarHBondContact O-N 3.49Å; S311-S313 VanDerWaalsContact C-N 3.29Å; S311-S313 PolarHBondContact O-N 2.95Å
312	C	30	Very low	57.2	Low	130 Å²	130	100.2 Å²	100.2	88%	0.878	59%	0.588	S	S	*	*			trans	-64.4	88.3	173.9	-165.7	0	0	0	0	109.2	E310 S314	E310-C312 PolarHBondContact O-N 2.81Å; C312-S314 PolarHBondContact O-N 3.01Å
313	S	42.5	Very low	60	Low	94 Å²	94	95.4 Å²	95.4	66%	0.657	56%	0.563	S	S	*	*			trans	-73.8	101.7	167.4	59.1	0	0	0	0	107	S311 T315	S311-S313 VanDerWaalsContact C-N 3.29Å; S311-S313 PolarHBondContact O-N 2.95Å; S313-T315 VanDerWaalsContact C-N 3.34Å; S313-T315 PolarHBondContact O-N 3.35Å
314	S	51.5	Low	62.9	Low	80 Å²	80	94.8 Å²	94.8	56%	0.559	55%	0.553	S	S	*	*			trans	-62.1	94.8	173.4	56	0	0	0	0	109.2	Y280 C312 T316	Y280-S314 PolarHBondContact OH-OG 3.13Å; C312-S314 PolarHBondContact O-N 3.01Å; S314-T316 PolarHBondContact O-N 2.9Å
315	T	67.6	Low	65.8	Low	116 Å²	116	87.1 Å²	87.1	71%	0.712	51%	0.514	S	S	*	.			trans	-67.3	121.8	176.3	53.3	0	0	0	0	108.5	S313	S313-T315 VanDerWaalsContact C-N 3.34Å; S313-T315 PolarHBondContact O-N 3.35Å
316	T	80.8	Confident	68.7	Low	52 Å²	52	82.5 Å²	82.5	32%	0.319	48%	0.481	S	S	.	.			trans	-62.1	157.6	172.8	48.9	0	0	0	0	110.8	E279 S314 F318	E279-T316 HydrophobicContact CB-CG2 4.28Å; E279-T316 HydrophobicContact CG-CG2 4.43Å; S314-T316 PolarHBondContact O-N 2.9Å; T316-F318 PolarHBondContact O-N 3.06Å; T316-F318 PolarHBondContact OG1-O 2.66Å
317	D	89.2	Confident	71.7	Confident	86 Å²	86	78.7 Å²	78.7	46%	0.46	47%	0.466	S	S	.	.	S	Bend	trans	-68.8	-17.6	-179.4	-77.8	-36.2	0	0	0	113.8	E279 Y280 L281	E279-D317 PolarHBondContact O-N 2.96Å; E279-D317 VanDerWaalsContact O-N 3.13Å; Y280-D317 WeakPolarHBondContact CA-OD2 3.06Å; L281-D317 WeakPolarHBondContact CB-OD2 3.43Å; L281-D317 HydrophobicContact CD1-CB 3.91Å; L281-D317 HydrophobicContact CG-CB 4.18Å; L281-D317 PolarHBondContact N-OD2 2.87Å
318	F	94.8	Very high	74.6	Confident	12 Å²	12	74.6 Å²	74.6	5%	0.053	44%	0.442	C	S	.	.	S	Bend	trans	-123.6	146	177.2	-59	-67.3	0	0	0	110.5	E151 L277 P278 L281 T316 F322 R323	E151-F318 WeakPolarHBondContact OE2-CA 3.26Å; L277-F318 HydrophobicContact CB-CD2 4.05Å; L277-F318 HydrophobicContact CB-CE2 4.39Å; L277-F318 HydrophobicContact CD1-CB 4.42Å; L277-F318 HydrophobicContact CD1-CD2 4.32Å; L277-F318 HydrophobicContact CD1-CG 4.21Å; L277-F318 HydrophobicContact CD2-CD2 4.22Å; L277-F318 HydrophobicContact CD2-CE2 3.94Å; L277-F318 HydrophobicContact CD2-CZ 4.17Å; L277-F318 HydrophobicContact CG-CD2 4.43Å; P278-F318 HydrophobicContact CG-CE2 4.33Å; L281-F318 HydrophobicContact CD1-CE1 4.35Å; L281-F318 HydrophobicContact CD1-CE2 3.81Å; L281-F318 HydrophobicContact CD1-CZ 3.53Å; L281-F318 HydrophobicContact CD2-CE2 3.94Å; L281-F318 HydrophobicContact CD2-CZ 4.1Å; L281-F318 HydrophobicContact CG-CE2 3.99Å; L281-F318 HydrophobicContact CG-CZ 4.17Å; T316-F318 PolarHBondContact O-N 3.06Å; T316-F318 PolarHBondContact OG1-O 2.66Å; F318-F322 HydrophobicContact CB-CD1 4.06Å; F318-F322 AromaticContact CD1-CD1 3.71Å; F318-F322 HydrophobicContact CD1-CD1 3.71Å; F318-F322 AromaticContact CD1-CE1 3.78Å; F318-F322 HydrophobicContact CD1-CE1 3.78Å; F318-F322 HydrophobicContact CE1-CE1 4.14Å; F318-F322 HydrophobicContact CG-CD1 4.11Å; F318-F322 HydrophobicContact CG-CE1 4.41Å; F318-R323 HydrophobicContact CB-CG 4.03Å
319	S	95.6	Very high	77.8	Confident	28 Å²	28	69.9 Å²	69.9	20%	0.196	41%	0.409	C	S	.	.			trans	-63.7	152.6	176.3	72.8	0	0	0	0	111.8	E151 E321 F322 R323 R351	E151-S319 VanDerWaalsContact OE1-CB 3.23Å; E151-S319 WeakPolarHBondContact OE1-CB 3.27Å; E151-S319 PolarHBondContact OE1-OG 3.39Å; E151-S319 PolarHBondContact OE2-N 2.67Å; S319-E321 PolarHBondContact O-N 2.84Å; S319-F322 PolarHBondContact O-N 2.88Å; S319-F322 WeakPolarHBondContact OG-CB 3.18Å; S319-F322 PolarHBondContact OG-N 3.26Å; S319-R323 WeakPolarHBondContact O-CG 3.36Å; S319-R323 PolarHBondContact O-N 3.13Å; S319-R351 PolarHBondContact OG-NH1 2.77Å; S319-R351 PolarHBondContact OG-NH2 3.42Å
320	S	95.8	Very high	80.8	Confident	85 Å²	85	62.7 Å²	62.7	59%	0.594	37%	0.37	S	S	*	.	H	α-helix	trans	-54.5	-39.8	174.3	37	0	0	0	0	112.2	R323 D324	S320-R323 PolarHBondContact O-N 3.29Å; S320-D324 WeakPolarHBondContact O-CB 3.32Å; S320-D324 PolarHBondContact O-N 2.77Å
321	E	97.1	Very high	83.7	Confident	61 Å²	61	56.8 Å²	56.8	29%	0.285	34%	0.343	S	S	.	.	H	α-helix	trans	-69	-37.3	-178.5	-55.6	94.7	116	0	0	111.2	S319 F325 H346 P347 F348 R351	S319-E321 PolarHBondContact O-N 2.84Å; E321-F325 WeakPolarHBondContact O-CB 3.32Å; E321-F325 PolarHBondContact O-N 3.17Å; E321-H346 PolarHBondContact O-CE1 2.92Å; E321-H346 VanDerWaalsContact O-CE1 3.26Å; E321-P347 HydrophobicContact CB-CB 4.46Å; E321-P347 HydrophobicContact CG-CB 4.1Å; E321-F348 HydrophobicContact CB-CB 4.02Å; E321-R351 IonicContact OE1-NH1 3.8Å; E321-R351 PolarHBondContact OE1-NH1 3.08Å; E321-R351 VanDerWaalsContact OE1-NH1 3.12Å; E321-R351 IonicContact OE2-NH1 3.01Å
322	F	98	Very high	86.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-69.8	-41.8	176.6	-176.8	-144.1	0	0	0	111.7	E151 I154 L246 S250 L277 F318 S319 D324 F325 V326 F348	E151-F322 HydrophobicContact CG-CB 4.28Å; E151-F322 HydrophobicContact CG-CD1 3.73Å; E151-F322 HydrophobicContact CG-CE1 4.35Å; E151-F322 HydrophobicContact CG-CG 4.12Å; E151-F322 WeakPolarHBondContact OE1-CB 3.48Å; I154-F322 HydrophobicContact CG2-CE1 4.31Å; I154-F322 HydrophobicContact CG2-CE2 4.01Å; I154-F322 HydrophobicContact CG2-CZ 3.62Å; L246-F322 HydrophobicContact CB-CE2 4.39Å; L246-F322 HydrophobicContact CB-CZ 4.41Å; L246-F322 HydrophobicContact CD1-CE2 4.44Å; S250-F322 WeakPolarHBondContact OG-CE1 3.23Å; S250-F322 VanDerWaalsContact OG-CZ 3.23Å; S250-F322 WeakPolarHBondContact OG-CZ 3.5Å; L277-F322 HydrophobicContact CD1-CD1 3.56Å; L277-F322 HydrophobicContact CD1-CD2 4.42Å; L277-F322 HydrophobicContact CD1-CE1 3.46Å; L277-F322 VanDerWaalsContact CD1-CE1 3.46Å; L277-F322 HydrophobicContact CD1-CE2 4.34Å; L277-F322 HydrophobicContact CD1-CG 4.04Å; L277-F322 HydrophobicContact CD1-CZ 3.86Å; L277-F322 HydrophobicContact CD2-CE1 4.34Å; F318-F322 HydrophobicContact CB-CD1 4.06Å; F318-F322 AromaticContact CD1-CD1 3.71Å; F318-F322 HydrophobicContact CD1-CD1 3.71Å; F318-F322 AromaticContact CD1-CE1 3.78Å; F318-F322 HydrophobicContact CD1-CE1 3.78Å; F318-F322 HydrophobicContact CE1-CE1 4.14Å; F318-F322 HydrophobicContact CG-CD1 4.11Å; F318-F322 HydrophobicContact CG-CE1 4.41Å; S319-F322 PolarHBondContact O-N 2.88Å; S319-F322 WeakPolarHBondContact OG-CB 3.18Å; S319-F322 PolarHBondContact OG-N 3.26Å; F322-D324 VanDerWaalsContact C-N 3.34Å; F322-D324 PolarHBondContact O-N 2.69Å; F322-F325 PolarHBondContact O-N 3Å; F322-V326 HydrophobicContact CD2-CG2 3.96Å; F322-V326 HydrophobicContact CE2-CG2 3.49Å; F322-V326 VanDerWaalsContact CE2-CG2 3.49Å; F322-V326 HydrophobicContact CZ-CG2 3.98Å; F322-V326 PolarHBondContact O-N 3.48Å; F322-F348 HydrophobicContact CB-CD2 3.68Å; F322-F348 HydrophobicContact CB-CE2 3.59Å; F322-F348 HydrophobicContact CB-CG 4.37Å; F322-F348 HydrophobicContact CB-CZ 4.21Å; F322-F348 HydrophobicContact CD2-CD1 4.05Å; F322-F348 HydrophobicContact CD2-CD2 4.14Å; F322-F348 AromaticContact CD2-CE1 3.54Å; F322-F348 HydrophobicContact CD2-CE1 3.54Å; F322-F348 AromaticContact CD2-CE2 3.66Å; F322-F348 HydrophobicContact CD2-CE2 3.66Å; F322-F348 HydrophobicContact CD2-CG 4.32Å; F322-F348 AromaticContact CD2-CZ 3.33Å; F322-F348 HydrophobicContact CD2-CZ 3.33Å; F322-F348 AromaticContact CE2-CE1 3.97Å; F322-F348 HydrophobicContact CE2-CE1 3.97Å; F322-F348 AromaticContact CE2-CZ 3.85Å; F322-F348 HydrophobicContact CE2-CZ 3.85Å; F322-F348 HydrophobicContact CG-CD2 4.23Å; F322-F348 HydrophobicContact CG-CE1 4.45Å; F322-F348 AromaticContact CG-CE2 3.74Å; F322-F348 HydrophobicContact CG-CE2 3.74Å; F322-F348 AromaticContact CG-CZ 3.86Å; F322-F348 HydrophobicContact CG-CZ 3.86Å
323	R	97.6	Very high	89.2	Confident	62 Å²	62	50.8 Å²	50.8	23%	0.234	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-45.5	174.6	-66.2	170.9	67.4	81.1	2.7	111.5	L277 P278 E279 F318 S319 S320 V326 S327	L277-R323 HydrophobicContact CB-CG 4.39Å; L277-R323 HydrophobicContact CD1-CG 4.36Å; L277-R323 PolarHBondContact O-NH1 2.97Å; P278-R323 VanDerWaalsContact C-NH1 3.27Å; P278-R323 PolarHBondContact O-NH1 2.64Å; E279-R323 VanDerWaalsContact CA-NH1 3.33Å; E279-R323 VanDerWaalsContact CG-NH2 3.3Å; F318-R323 HydrophobicContact CB-CG 4.03Å; S319-R323 WeakPolarHBondContact O-CG 3.36Å; S319-R323 PolarHBondContact O-N 3.13Å; S320-R323 PolarHBondContact O-N 3.29Å; R323-V326 PolarHBondContact O-N 3.16Å; R323-S327 WeakPolarHBondContact O-CB 3.25Å; R323-S327 PolarHBondContact O-N 3.03Å
324	D	97.8	Very high	91.4	Very high	73 Å²	73	46.7 Å²	46.7	39%	0.39	26%	0.262	S	S	.	.	H	α-helix	trans	-63.5	-45.2	176.5	-177.6	39.6	0	0	0	112	S320 F322 V326 S327 Q328 H346	S320-D324 WeakPolarHBondContact O-CB 3.32Å; S320-D324 PolarHBondContact O-N 2.77Å; F322-D324 VanDerWaalsContact C-N 3.34Å; F322-D324 PolarHBondContact O-N 2.69Å; D324-V326 VanDerWaalsContact C-N 3.34Å; D324-V326 PolarHBondContact O-N 3.31Å; D324-S327 WeakPolarHBondContact O-CB 3.1Å; D324-S327 PolarHBondContact O-N 2.93Å; D324-Q328 WeakPolarHBondContact O-CG 3.4Å; D324-Q328 PolarHBondContact O-N 2.87Å; D324-Q328 PolarHBondContact OD1-NE2 2.6Å; D324-Q328 PolarHBondContact OD2-NE2 3.08Å; D324-H346 IonicContact OD2-CE1 3.14Å; D324-H346 IonicContact OD2-NE2 2.89Å; D324-H346 PolarHBondContact OD2-NE2 2.87Å
325	F	98.5	Very high	93.3	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-56.9	-47.1	177.6	-173.7	-83.6	0	0	0	112	T158 V162 L242 L246 E321 F322 C329 L343 H346 F348	T158-F325 HydrophobicContact CG2-CD1 4.39Å; T158-F325 HydrophobicContact CG2-CE1 3.54Å; T158-F325 HydrophobicContact CG2-CE2 4.33Å; T158-F325 HydrophobicContact CG2-CZ 3.51Å; V162-F325 HydrophobicContact CG2-CZ 4.32Å; L242-F325 HydrophobicContact CD2-CE1 4.49Å; L246-F325 HydrophobicContact CD1-CD1 3.97Å; L246-F325 HydrophobicContact CD1-CE1 3.72Å; E321-F325 WeakPolarHBondContact O-CB 3.32Å; E321-F325 PolarHBondContact O-N 3.17Å; F322-F325 PolarHBondContact O-N 3Å; F325-C329 PolarHBondContact O-N 3.02Å; F325-C329 VanDerWaalsContact O-N 3.09Å; F325-C329 PolarHBondContact O-SG 2.69Å; F325-L343 HydrophobicContact CD2-CD2 4.41Å; F325-L343 HydrophobicContact CE2-CB 4Å; F325-L343 HydrophobicContact CE2-CD2 3.86Å; F325-L343 HydrophobicContact CE2-CG 4.45Å; F325-L343 HydrophobicContact CZ-CB 4.13Å; F325-L343 HydrophobicContact CZ-CD1 4.31Å; F325-L343 HydrophobicContact CZ-CD2 3.91Å; F325-L343 HydrophobicContact CZ-CG 4.35Å; F325-H346 HydrophobicContact CD2-CB 3.81Å; F325-H346 AromaticContact CD2-CG 3.55Å; F325-H346 AromaticContact CD2-ND1 3.56Å; F325-H346 HydrophobicContact CE2-CB 4.11Å; F325-H346 PolarHBondContact N-NE2 3.23Å; F325-F348 HydrophobicContact CB-CB 3.98Å; F325-F348 HydrophobicContact CB-CD1 3.96Å; F325-F348 HydrophobicContact CB-CG 4.2Å; F325-F348 HydrophobicContact CD1-CD1 4.16Å; F325-F348 HydrophobicContact CD2-CB 4.18Å; F325-F348 AromaticContact CD2-CD1 3.91Å; F325-F348 HydrophobicContact CD2-CD1 3.91Å; F325-F348 HydrophobicContact CE2-CD1 4.48Å; F325-F348 HydrophobicContact CG-CB 4.33Å; F325-F348 AromaticContact CG-CD1 3.74Å; F325-F348 HydrophobicContact CG-CD1 3.74Å; F325-F348 HydrophobicContact CG-CG 4.4Å
326	V	98.4	Very high	94.6	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-67.3	-41.9	179	170.7	0	0	0	0	110.8	L246 I247 L277 F322 R323 D324 Q328 C329 L330	L246-V326 HydrophobicContact CB-CG2 4.09Å; L246-V326 HydrophobicContact CD1-CG2 4.36Å; I247-V326 HydrophobicContact CD1-CG1 3.8Å; I247-V326 HydrophobicContact CG1-CG1 3.57Å; L277-V326 HydrophobicContact CD1-CB 4.19Å; L277-V326 HydrophobicContact CD1-CG2 3.85Å; L277-V326 HydrophobicContact CG-CB 4.44Å; L277-V326 HydrophobicContact CG-CG1 4.3Å; L277-V326 HydrophobicContact CG-CG2 4.35Å; F322-V326 HydrophobicContact CD2-CG2 3.96Å; F322-V326 HydrophobicContact CE2-CG2 3.49Å; F322-V326 VanDerWaalsContact CE2-CG2 3.49Å; F322-V326 HydrophobicContact CZ-CG2 3.98Å; F322-V326 PolarHBondContact O-N 3.48Å; R323-V326 PolarHBondContact O-N 3.16Å; D324-V326 VanDerWaalsContact C-N 3.34Å; D324-V326 PolarHBondContact O-N 3.31Å; V326-Q328 PolarHBondContact O-N 3.15Å; V326-C329 WeakPolarHBondContact O-CB 3.4Å; V326-C329 PolarHBondContact O-N 2.94Å; V326-L330 HydrophobicContact CG1-CD1 3.8Å; V326-L330 WeakPolarHBondContact O-CG 2.91Å; V326-L330 PolarHBondContact O-N 3.37Å
327	S	97.5	Very high	95.3	Very high	65 Å²	65	48.2 Å²	48.2	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-58.5	-47.6	176.9	-170.2	0	0	0	0	111.5	R323 D324 C329 L330 E331	R323-S327 WeakPolarHBondContact O-CB 3.25Å; R323-S327 PolarHBondContact O-N 3.03Å; D324-S327 WeakPolarHBondContact O-CB 3.1Å; D324-S327 PolarHBondContact O-N 2.93Å; S327-C329 VanDerWaalsContact C-N 3.33Å; S327-C329 PolarHBondContact O-N 3.38Å; S327-L330 CarbonylContact O-C 3.58Å; S327-L330 PolarHBondContact O-N 3.02Å; S327-L330 VanDerWaalsContact O-N 3.1Å; S327-E331 PolarHBondContact O-N 3.28Å
328	Q	98	Very high	95.7	Very high	65 Å²	65	44.9 Å²	44.9	30%	0.304	23%	0.232	S	C	.	.	H	α-helix	trans	-62.8	-39	177.2	-69.7	178.9	40.4	0	0	111.9	D324 V326 L330 E331 P338 H346	D324-Q328 WeakPolarHBondContact O-CG 3.4Å; D324-Q328 PolarHBondContact O-N 2.87Å; D324-Q328 PolarHBondContact OD1-NE2 2.6Å; D324-Q328 PolarHBondContact OD2-NE2 3.08Å; V326-Q328 PolarHBondContact O-N 3.15Å; Q328-L330 PolarHBondContact O-N 3.39Å; Q328-E331 PolarHBondContact O-N 2.99Å; Q328-P338 HydrophobicContact CB-CG 4.13Å; Q328-P338 WeakPolarHBondContact O-CD 3.11Å; Q328-H346 PolarHBondContact NE2-CD2 3.26Å; Q328-H346 PolarHBondContact NE2-NE2 2.7Å; Q328-H346 VanDerWaalsContact NE2-NE2 3.15Å
329	C	98.2	Very high	95.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.1	-33.4	174.6	-70.3	0	0	0	0	112.8	V239 W240 F325 V326 S327 R337	V239-C329 HydrophobicContact CG1-CB 3.97Å; W240-C329 WeakPolarHBondContact CA-O 3.02Å; F325-C329 PolarHBondContact O-N 3.02Å; F325-C329 VanDerWaalsContact O-N 3.09Å; F325-C329 PolarHBondContact O-SG 2.69Å; V326-C329 WeakPolarHBondContact O-CB 3.4Å; V326-C329 PolarHBondContact O-N 2.94Å; S327-C329 VanDerWaalsContact C-N 3.33Å; S327-C329 PolarHBondContact O-N 3.38Å; C329-R337 VanDerWaalsContact O-CD 3.24Å; C329-R337 WeakPolarHBondContact O-CD 3.49Å
330	L	97.1	Very high	95.8	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.01	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	20.7	-175.1	-64	175	0	0	0	113.7	W240 I244 I247 P274 P275 V326 S327 Q328 K332	W240-L330 HydrophobicContact CD2-CD2 3.92Å; W240-L330 HydrophobicContact CE3-CD2 4.08Å; W240-L330 HydrophobicContact CG-CD2 4.31Å; W240-L330 HydrophobicContact CZ3-CB 4.46Å; W240-L330 HydrophobicContact CZ3-CD2 4.46Å; W240-L330 VanDerWaalsContact CZ3-O 3.22Å; W240-L330 WeakPolarHBondContact CZ3-O 3.25Å; I244-L330 HydrophobicContact CD1-CD1 4.44Å; I244-L330 HydrophobicContact CD1-CD2 3.59Å; I244-L330 HydrophobicContact CG1-CD2 3.82Å; I247-L330 HydrophobicContact CD1-CD1 3.44Å; I247-L330 VanDerWaalsContact CD1-CD1 3.44Å; I247-L330 HydrophobicContact CG1-CD1 4.36Å; P274-L330 HydrophobicContact CB-CB 4.23Å; P274-L330 WeakPolarHBondContact CB-O 3.37Å; P275-L330 HydrophobicContact CG-CD1 4.05Å; P275-L330 WeakPolarHBondContact O-CD1 3.48Å; V326-L330 HydrophobicContact CG1-CD1 3.8Å; V326-L330 WeakPolarHBondContact O-CG 2.91Å; V326-L330 PolarHBondContact O-N 3.37Å; S327-L330 CarbonylContact O-C 3.58Å; S327-L330 PolarHBondContact O-N 3.02Å; S327-L330 VanDerWaalsContact O-N 3.1Å; Q328-L330 PolarHBondContact O-N 3.39Å; L330-K332 PolarHBondContact O-N 3.38Å
331	E	95.3	Very high	95.9	Very high	78 Å²	78	48.8 Å²	48.8	36%	0.364	24%	0.236	S	C	.	.			trans	-62.9	120.3	171.5	-163.7	56.6	-128.3	0	0	110	S327 Q328 C336 R337	S327-E331 PolarHBondContact O-N 3.28Å; Q328-E331 PolarHBondContact O-N 2.99Å; E331-C336 HydrophobicContact CG-CB 3.5Å; E331-R337 HydrophobicContact CB-CB 4.1Å; E331-R337 HydrophobicContact CB-CG 4.35Å; E331-R337 VanDerWaalsContact O-CZ 3.3Å; E331-R337 PolarHBondContact O-NE 3.41Å; E331-R337 PolarHBondContact O-NH2 2.88Å
332	K	90.9	Very high	95.9	Very high	54 Å²	54	48.5 Å²	48.5	24%	0.235	24%	0.244	C	C	.	.	S	Bend	trans	-69.7	-39.4	-175.1	-60.5	-166.3	83.1	172.8	0	111.6	W240 V269 L270 N272 P274 L330 V334	W240-K332 HydrophobicContact CH2-CG 4.14Å; W240-K332 HydrophobicContact CZ3-CG 4.03Å; V269-K332 WeakPolarHBondContact O-CE 3.47Å; V269-K332 PolarHBondContact O-NZ 2.89Å; L270-K332 PolarHBondContact O-NZ 2.94Å; N272-K332 PolarHBondContact O-NZ 3.17Å; P274-K332 HydrophobicContact CB-CD 4.45Å; P274-K332 HydrophobicContact CB-CG 4Å; P274-K332 HydrophobicContact CG-CD 4.49Å; P274-K332 HydrophobicContact CG-CG 4.14Å; L330-K332 PolarHBondContact O-N 3.38Å; K332-V334 PolarHBondContact O-N 3.17Å; K332-V334 VanDerWaalsContact O-N 3.08Å
333	D	89.9	Confident	96	Very high	52 Å²	52	48.5 Å²	48.5	28%	0.278	24%	0.244	S	C	.	.	S	Bend	trans	-69.9	106.7	171.2	-171.6	-16	0	0	0	109	R335 C336 R337	D333-R335 PolarHBondContact O-N 2.75Å; D333-R335 VanDerWaalsContact OD1-CB 3.22Å; D333-R335 WeakPolarHBondContact OD1-CB 3.49Å; D333-R335 WeakPolarHBondContact OD1-CG 3.29Å; D333-R335 IonicContact OD1-CZ 3.86Å; D333-R335 PolarHBondContact OD1-N 2.83Å; D333-R335 IonicContact OD1-NE 3.89Å; D333-R335 PolarHBondContact OD1-NE 3.19Å; D333-R335 IonicContact OD1-NH2 3.34Å; D333-R335 IonicContact OD2-CZ 2.69Å; D333-R335 IonicContact OD2-NE 2.88Å; D333-R335 PolarHBondContact OD2-NE 2.76Å; D333-R335 VanDerWaalsContact OD2-NE 3.16Å; D333-R335 IonicContact OD2-NH2 3.16Å; D333-R335 PolarHBondContact OD2-NH2 2.96Å; D333-C336 HydrophobicContact CB-CB 4.32Å; D333-C336 PolarHBondContact O-N 2.84Å; D333-R337 PolarHBondContact O-N 3.11Å; D333-R337 VanDerWaalsContact O-N 3.14Å
334	V	90.6	Very high	96	Very high	8 Å²	8	47 Å²	47	5%	0.048	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-27.4	178.4	69.4	0	0	0	0	111.9	E222 R236 K332 C336	E222-V334 HydrophobicContact CG-CB 4.29Å; E222-V334 HydrophobicContact CG-CG2 4.1Å; R236-V334 HydrophobicContact CB-CG2 3.83Å; R236-V334 WeakPolarHBondContact CD-O 3.44Å; R236-V334 PolarHBondContact NE-O 3.26Å; R236-V334 PolarHBondContact NH1-O 2.77Å; K332-V334 PolarHBondContact O-N 3.17Å; K332-V334 VanDerWaalsContact O-N 3.08Å; V334-C336 VanDerWaalsContact C-N 3.34Å
335	R	90.3	Very high	96	Very high	192 Å²	192	49.9 Å²	49.9	73%	0.725	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-32.7	178.5	-59.2	172.6	-62.1	175.4	5.2	112.9	R236 D333	R236-R335 VanDerWaalsContact NH1-CA 3.35Å; D333-R335 PolarHBondContact O-N 2.75Å; D333-R335 VanDerWaalsContact OD1-CB 3.22Å; D333-R335 WeakPolarHBondContact OD1-CB 3.49Å; D333-R335 WeakPolarHBondContact OD1-CG 3.29Å; D333-R335 IonicContact OD1-CZ 3.86Å; D333-R335 PolarHBondContact OD1-N 2.83Å; D333-R335 IonicContact OD1-NE 3.89Å; D333-R335 PolarHBondContact OD1-NE 3.19Å; D333-R335 IonicContact OD1-NH2 3.34Å; D333-R335 IonicContact OD2-CZ 2.69Å; D333-R335 IonicContact OD2-NE 2.88Å; D333-R335 PolarHBondContact OD2-NE 2.76Å; D333-R335 VanDerWaalsContact OD2-NE 3.16Å; D333-R335 IonicContact OD2-NH2 3.16Å; D333-R335 PolarHBondContact OD2-NH2 2.96Å
336	C	94.3	Very high	96	Very high	85 Å²	85	50.2 Å²	50.2	57%	0.574	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-21.9	179.7	-61.6	0	0	0	0	112.3	E331 D333 V334	E331-C336 HydrophobicContact CG-CB 3.5Å; D333-C336 HydrophobicContact CB-CB 4.32Å; D333-C336 PolarHBondContact O-N 2.84Å; V334-C336 VanDerWaalsContact C-N 3.34Å
337	R	96.1	Very high	96	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.015	28%	0.276	C	S	.	.	S	Bend	trans	-64.7	129.9	176.9	-160	-176.4	-58.2	145.6	7.8	111.6	E222 R236 V239 C329 E331 D333	E222-R337 IonicContact OE1-CZ 2.8Å; E222-R337 IonicContact OE1-NH1 3.05Å; E222-R337 PolarHBondContact OE1-NH1 2.75Å; E222-R337 IonicContact OE2-CZ 2.78Å; E222-R337 IonicContact OE2-NH1 3.62Å; E222-R337 PolarHBondContact OE2-NH1 3.44Å; E222-R337 IonicContact OE2-NH2 3.73Å; E222-R337 PolarHBondContact OE2-NH2 3Å; R236-R337 WeakPolarHBondContact CD-O 3.27Å; R236-R337 WeakPolarHBondContact O-CD 3.39Å; R236-R337 PolarHBondContact O-NH1 3.44Å; V239-R337 HydrophobicContact CG1-CG 3.96Å; C329-R337 VanDerWaalsContact O-CD 3.24Å; C329-R337 WeakPolarHBondContact O-CD 3.49Å; E331-R337 HydrophobicContact CB-CB 4.1Å; E331-R337 HydrophobicContact CB-CG 4.35Å; E331-R337 VanDerWaalsContact O-CZ 3.3Å; E331-R337 PolarHBondContact O-NE 3.41Å; E331-R337 PolarHBondContact O-NH2 2.88Å; D333-R337 PolarHBondContact O-N 3.11Å; D333-R337 VanDerWaalsContact O-N 3.14Å
338	P	97.1	Very high	96.1	Very high	16 Å²	16	50.8 Å²	50.8	10%	0.104	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-67	156	-177.4	28.4	-35.8	0	0	0	112.3	V239 Q328 A342 L343	V239-P338 HydrophobicContact CG1-CG 4.48Å; Q328-P338 HydrophobicContact CB-CG 4.13Å; Q328-P338 WeakPolarHBondContact O-CD 3.11Å; P338-A342 HydrophobicContact CB-CB 3.83Å; P338-L343 HydrophobicContact CB-CD2 4.11Å; P338-L343 HydrophobicContact CB-CG 4.3Å; P338-L343 HydrophobicContact CG-CD2 3.5Å; P338-L343 VanDerWaalsContact CG-CD2 3.5Å; P338-L343 HydrophobicContact CG-CG 4.08Å
339	K	96.5	Very high	96.1	Very high	108 Å²	108	48.5 Å²	48.5	47%	0.47	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-90.2	167.9	165.6	-66.2	-178.8	176.6	179.5	0	109.8	I235 R236 Q341 A342 L343	I235-K339 HydrophobicContact CD1-CB 3.86Å; I235-K339 HydrophobicContact CD1-CD 4.13Å; I235-K339 HydrophobicContact CD1-CG 3.86Å; I235-K339 HydrophobicContact CG1-CG 4.38Å; R236-K339 HydrophobicContact CG-CG 4.06Å; K339-Q341 VanDerWaalsContact C-N 3.3Å; K339-Q341 PolarHBondContact O-N 3.28Å; K339-A342 WeakPolarHBondContact O-CB 3.42Å; K339-A342 PolarHBondContact O-N 3.23Å; K339-L343 PolarHBondContact O-N 3.45Å
340	Y	97.6	Very high	96.1	Very high	3 Å²	3	52.5 Å²	52.5	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-52.9	-43.5	-176.3	-49.8	-46.4	0	0	0	113.9	L165 D166 K169 I235 D238 V239 A342 L343 M344	L165-Y340 HydrophobicContact CB-CD1 4.11Å; L165-Y340 HydrophobicContact CB-CE1 3.67Å; L165-Y340 HydrophobicContact CB-CE2 4.09Å; L165-Y340 HydrophobicContact CD1-CE1 3.97Å; L165-Y340 HydrophobicContact CG-CE1 4.35Å; L165-Y340 WeakPolarHBondContact O-CE2 3.17Å; D166-Y340 HydrophobicContact CB-CD2 4.19Å; D166-Y340 HydrophobicContact CB-CG 4.34Å; K169-Y340 HydrophobicContact CB-CD2 4.28Å; K169-Y340 HydrophobicContact CB-CE2 3.86Å; K169-Y340 HydrophobicContact CG-CE2 4.39Å; I235-Y340 HydrophobicContact CB-CE1 4.43Å; I235-Y340 HydrophobicContact CB-CE2 3.64Å; I235-Y340 WeakPolarHBondContact CB-OH 3.49Å; I235-Y340 HydrophobicContact CD1-CD2 3.77Å; I235-Y340 HydrophobicContact CD1-CE2 3.76Å; I235-Y340 HydrophobicContact CD1-CG 4.34Å; I235-Y340 HydrophobicContact CG1-CE2 4.32Å; I235-Y340 HydrophobicContact CG2-CE2 3.71Å; I235-Y340 PolarHBondContact O-OH 2.86Å; D238-Y340 PolarHBondContact OD2-OH 2.9Å; V239-Y340 HydrophobicContact CG2-CD1 3.81Å; V239-Y340 HydrophobicContact CG2-CE1 3.63Å; Y340-A342 VanDerWaalsContact C-N 3.29Å; Y340-A342 PolarHBondContact O-N 3.11Å; Y340-L343 WeakPolarHBondContact O-CB 3.42Å; Y340-L343 PolarHBondContact O-N 3.44Å; Y340-M344 WeakPolarHBondContact O-CG 3.23Å; Y340-M344 PolarHBondContact O-N 3.1Å
341	Q	97.1	Very high	96.1	Very high	96 Å²	96	55.3 Å²	55.3	45%	0.449	27%	0.274	S	S	.	.	H	α-helix	trans	-58.3	-39.3	177.8	-67.6	-62.7	-46.4	0	0	112.5	D166 K339 M344 H345	D166-Q341 VanDerWaalsContact CG-NE2 3.27Å; D166-Q341 PolarHBondContact OD1-NE2 2.97Å; D166-Q341 PolarHBondContact OD2-NE2 3.49Å; K339-Q341 VanDerWaalsContact C-N 3.3Å; K339-Q341 PolarHBondContact O-N 3.28Å; Q341-M344 PolarHBondContact O-N 2.82Å; Q341-H345 PolarHBondContact O-N 3.01Å; Q341-H345 PolarHBondContact O-ND1 3.42Å
342	A	97.8	Very high	96.2	Very high	54 Å²	54	51.6 Å²	51.6	45%	0.446	26%	0.257	S	S	.	.	H	α-helix	trans	-68.4	-40.2	175.6	0	0	0	0	0	111.6	P338 K339 Y340 M344 H345 H346	P338-A342 HydrophobicContact CB-CB 3.83Å; K339-A342 WeakPolarHBondContact O-CB 3.42Å; K339-A342 PolarHBondContact O-N 3.23Å; Y340-A342 VanDerWaalsContact C-N 3.29Å; Y340-A342 PolarHBondContact O-N 3.11Å; A342-M344 VanDerWaalsContact C-N 3.31Å; A342-M344 PolarHBondContact O-N 3.29Å; A342-H345 PolarHBondContact O-N 3.47Å; A342-H345 VanDerWaalsContact O-N 3.15Å; A342-H346 PolarHBondContact O-N 3.3Å
343	L	98.3	Very high	96.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-38.1	174.5	-64.1	178.1	0	0	0	112.5	V162 V239 F325 P338 K339 Y340 H345 H346 Y349	V162-L343 HydrophobicContact CG1-CB 4.26Å; V162-L343 HydrophobicContact CG2-CD1 4.37Å; V239-L343 HydrophobicContact CG1-CD1 3.88Å; V239-L343 HydrophobicContact CG2-CD1 3.93Å; F325-L343 HydrophobicContact CD2-CD2 4.41Å; F325-L343 HydrophobicContact CE2-CB 4Å; F325-L343 HydrophobicContact CE2-CD2 3.86Å; F325-L343 HydrophobicContact CE2-CG 4.45Å; F325-L343 HydrophobicContact CZ-CB 4.13Å; F325-L343 HydrophobicContact CZ-CD1 4.31Å; F325-L343 HydrophobicContact CZ-CD2 3.91Å; F325-L343 HydrophobicContact CZ-CG 4.35Å; P338-L343 HydrophobicContact CB-CD2 4.11Å; P338-L343 HydrophobicContact CB-CG 4.3Å; P338-L343 HydrophobicContact CG-CD2 3.5Å; P338-L343 VanDerWaalsContact CG-CD2 3.5Å; P338-L343 HydrophobicContact CG-CG 4.08Å; K339-L343 PolarHBondContact O-N 3.45Å; Y340-L343 WeakPolarHBondContact O-CB 3.42Å; Y340-L343 PolarHBondContact O-N 3.44Å; L343-H345 PolarHBondContact O-N 3.37Å; L343-H346 WeakPolarHBondContact O-CB 3.36Å; L343-H346 PolarHBondContact O-N 3.21Å; L343-Y349 WeakPolarHBondContact O-CB 3.38Å
344	M	98.3	Very high	96.6	Very high	32 Å²	32	56.2 Å²	56.2	16%	0.158	29%	0.288	C	S	.	.	H	α-helix	trans	-66.3	-19.2	177.5	-71.2	176.6	163.1	0	0	113.6	V162 D166 Y340 Q341 A342 Y349 L350	V162-M344 HydrophobicContact CG1-CE 4.02Å; V162-M344 HydrophobicContact CG1-CG 3.73Å; D166-M344 HydrophobicContact CB-CE 3.38Å; D166-M344 HydrophobicContact CB-SD 4.28Å; Y340-M344 WeakPolarHBondContact O-CG 3.23Å; Y340-M344 PolarHBondContact O-N 3.1Å; Q341-M344 PolarHBondContact O-N 2.82Å; A342-M344 VanDerWaalsContact C-N 3.31Å; A342-M344 PolarHBondContact O-N 3.29Å; M344-Y349 HydrophobicContact CB-CD1 4.3Å; M344-Y349 HydrophobicContact CB-CE1 4.01Å; M344-Y349 HydrophobicContact CG-CE1 4.04Å; M344-Y349 HydrophobicContact CG-CE2 4.15Å; M344-Y349 WeakPolarHBondContact O-CD1 3.29Å; M344-L350 WeakPolarHBondContact O-CD2 3.38Å
345	H	98.2	Very high	96.7	Very high	132 Å²	132	58.2 Å²	58.2	61%	0.611	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	0.3	174.3	-66.6	82.5	0	0	0	112.7	Q341 A342 L343 L350	Q341-H345 PolarHBondContact O-N 3.01Å; Q341-H345 PolarHBondContact O-ND1 3.42Å; A342-H345 PolarHBondContact O-N 3.47Å; A342-H345 VanDerWaalsContact O-N 3.15Å; L343-H345 PolarHBondContact O-N 3.37Å; H345-L350 WeakPolarHBondContact O-CD1 3.4Å
346	H	98.6	Very high	96.9	Very high	8 Å²	8	54.8 Å²	54.8	4%	0.037	30%	0.297	C	S	.	.	S	Bend	trans	-69.1	140.6	-179.6	-169.1	-79.3	0	0	0	111.1	E321 D324 F325 Q328 A342 L343 F348 Y349 L350	E321-H346 PolarHBondContact O-CE1 2.92Å; E321-H346 VanDerWaalsContact O-CE1 3.26Å; D324-H346 IonicContact OD2-CE1 3.14Å; D324-H346 IonicContact OD2-NE2 2.89Å; D324-H346 PolarHBondContact OD2-NE2 2.87Å; F325-H346 HydrophobicContact CD2-CB 3.81Å; F325-H346 AromaticContact CD2-CG 3.55Å; F325-H346 AromaticContact CD2-ND1 3.56Å; F325-H346 HydrophobicContact CE2-CB 4.11Å; F325-H346 PolarHBondContact N-NE2 3.23Å; Q328-H346 PolarHBondContact NE2-CD2 3.26Å; Q328-H346 PolarHBondContact NE2-NE2 2.7Å; Q328-H346 VanDerWaalsContact NE2-NE2 3.15Å; A342-H346 PolarHBondContact O-N 3.3Å; L343-H346 WeakPolarHBondContact O-CB 3.36Å; L343-H346 PolarHBondContact O-N 3.21Å; H346-F348 VanDerWaalsContact C-N 3.33Å; H346-F348 WeakPolarHBondContact ND1-CB 3.34Å; H346-F348 PolarHBondContact ND1-N 2.76Å; H346-F348 VanDerWaalsContact ND1-N 3.15Å; H346-F348 PolarHBondContact O-N 2.98Å; H346-Y349 WeakPolarHBondContact O-CB 3.46Å; H346-Y349 PolarHBondContact O-N 3.42Å; H346-L350 PolarHBondContact O-N 3.5Å
347	P	98.3	Very high	96.8	Very high	76 Å²	76	53.3 Å²	53.3	49%	0.494	28%	0.283	S	S	.	.	H	α-helix	trans	-49.6	-46.5	179.6	-31.3	36.2	0	0	0	114.5	E321 Y349 L350 R351	E321-P347 HydrophobicContact CB-CB 4.46Å; E321-P347 HydrophobicContact CG-CB 4.1Å; P347-Y349 PolarHBondContact O-N 2.94Å; P347-L350 PolarHBondContact O-N 2.98Å; P347-R351 VanDerWaalsContact O-CB 3.3Å; P347-R351 WeakPolarHBondContact O-CB 3.41Å; P347-R351 PolarHBondContact O-N 3.17Å
348	F	98.4	Very high	96.7	Very high	1 Å²	1	57.2 Å²	57.2	0%	0.004	30%	0.304	C	S	.	.	H	α-helix	trans	-55.9	-43.8	174.5	180	-110.8	0	0	0	113.8	E151 T158 E321 F322 F325 H346 S352	E151-F348 HydrophobicContact CG-CE2 4.03Å; T158-F348 HydrophobicContact CG2-CD1 4.48Å; T158-F348 HydrophobicContact CG2-CE1 4.08Å; E321-F348 HydrophobicContact CB-CB 4.02Å; F322-F348 HydrophobicContact CB-CD2 3.68Å; F322-F348 HydrophobicContact CB-CE2 3.59Å; F322-F348 HydrophobicContact CB-CG 4.37Å; F322-F348 HydrophobicContact CB-CZ 4.21Å; F322-F348 HydrophobicContact CD2-CD1 4.05Å; F322-F348 HydrophobicContact CD2-CD2 4.14Å; F322-F348 AromaticContact CD2-CE1 3.54Å; F322-F348 HydrophobicContact CD2-CE1 3.54Å; F322-F348 AromaticContact CD2-CE2 3.66Å; F322-F348 HydrophobicContact CD2-CE2 3.66Å; F322-F348 HydrophobicContact CD2-CG 4.32Å; F322-F348 AromaticContact CD2-CZ 3.33Å; F322-F348 HydrophobicContact CD2-CZ 3.33Å; F322-F348 AromaticContact CE2-CE1 3.97Å; F322-F348 HydrophobicContact CE2-CE1 3.97Å; F322-F348 AromaticContact CE2-CZ 3.85Å; F322-F348 HydrophobicContact CE2-CZ 3.85Å; F322-F348 HydrophobicContact CG-CD2 4.23Å; F322-F348 HydrophobicContact CG-CE1 4.45Å; F322-F348 AromaticContact CG-CE2 3.74Å; F322-F348 HydrophobicContact CG-CE2 3.74Å; F322-F348 AromaticContact CG-CZ 3.86Å; F322-F348 HydrophobicContact CG-CZ 3.86Å; F325-F348 HydrophobicContact CB-CB 3.98Å; F325-F348 HydrophobicContact CB-CD1 3.96Å; F325-F348 HydrophobicContact CB-CG 4.2Å; F325-F348 HydrophobicContact CD1-CD1 4.16Å; F325-F348 HydrophobicContact CD2-CB 4.18Å; F325-F348 AromaticContact CD2-CD1 3.91Å; F325-F348 HydrophobicContact CD2-CD1 3.91Å; F325-F348 HydrophobicContact CE2-CD1 4.48Å; F325-F348 HydrophobicContact CG-CB 4.33Å; F325-F348 AromaticContact CG-CD1 3.74Å; F325-F348 HydrophobicContact CG-CD1 3.74Å; F325-F348 HydrophobicContact CG-CG 4.4Å; H346-F348 VanDerWaalsContact C-N 3.33Å; H346-F348 WeakPolarHBondContact ND1-CB 3.34Å; H346-F348 PolarHBondContact ND1-N 2.76Å; H346-F348 VanDerWaalsContact ND1-N 3.15Å; H346-F348 PolarHBondContact O-N 2.98Å; F348-S352 VanDerWaalsContact O-CB 3.26Å; F348-S352 WeakPolarHBondContact O-CB 3.46Å; F348-S352 PolarHBondContact O-N 2.94Å; F348-S352 PolarHBondContact O-OG 3.48Å
349	Y	98.5	Very high	96.6	Very high	17 Å²	17	57 Å²	57	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-66.5	-47.5	179.5	-174.6	-83.6	0	0	0	110.8	T159 V162 L343 M344 H346 P347 S352 L353	T159-Y349 VanDerWaalsContact CA-CE2 3.5Å; T159-Y349 HydrophobicContact CG2-CD2 3.95Å; T159-Y349 HydrophobicContact CG2-CE2 3.91Å; T159-Y349 HydrophobicContact CG2-CG 4.25Å; T159-Y349 PolarHBondContact O-OH 2.81Å; V162-Y349 HydrophobicContact CB-CD2 4.42Å; V162-Y349 HydrophobicContact CB-CE2 3.83Å; V162-Y349 HydrophobicContact CG1-CD2 4.42Å; V162-Y349 HydrophobicContact CG1-CE2 3.88Å; L343-Y349 WeakPolarHBondContact O-CB 3.38Å; M344-Y349 HydrophobicContact CB-CD1 4.3Å; M344-Y349 HydrophobicContact CB-CE1 4.01Å; M344-Y349 HydrophobicContact CG-CE1 4.04Å; M344-Y349 HydrophobicContact CG-CE2 4.15Å; M344-Y349 WeakPolarHBondContact O-CD1 3.29Å; H346-Y349 WeakPolarHBondContact O-CB 3.46Å; H346-Y349 PolarHBondContact O-N 3.42Å; P347-Y349 PolarHBondContact O-N 2.94Å; Y349-S352 PolarHBondContact O-N 3.19Å; Y349-L353 HydrophobicContact CD1-CD1 3.89Å; Y349-L353 HydrophobicContact CD1-CG 4.13Å; Y349-L353 HydrophobicContact CE1-CD1 3.49Å; Y349-L353 VanDerWaalsContact CE1-CD1 3.49Å; Y349-L353 HydrophobicContact CE1-CD2 4.28Å; Y349-L353 HydrophobicContact CE1-CG 3.85Å; Y349-L353 PolarHBondContact O-N 3.15Å
350	L	98.3	Very high	96.5	Very high	85 Å²	85	52.1 Å²	52.1	45%	0.445	28%	0.283	S	S	.	.	H	α-helix	trans	-62.5	-44.3	179.2	-64.4	176.6	0	0	0	111.8	M344 H345 H346 P347 S352 L353 T354	M344-L350 WeakPolarHBondContact O-CD2 3.38Å; H345-L350 WeakPolarHBondContact O-CD1 3.4Å; H346-L350 PolarHBondContact O-N 3.5Å; P347-L350 PolarHBondContact O-N 2.98Å; L350-S352 PolarHBondContact O-N 3.24Å; L350-L353 WeakPolarHBondContact O-CB 3.49Å; L350-L353 PolarHBondContact O-N 3.06Å; L350-T354 PolarHBondContact O-N 3.3Å; L350-T354 PolarHBondContact O-OG1 3.25Å
351	R	97.5	Very high	96.4	Very high	60 Å²	60	58 Å²	58	23%	0.226	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-49.8	174.5	-166.3	-174.8	76.6	-153.5	-2.7	110.6	E151 S319 E321 P347 L353 T354 E355	E151-R351 IonicContact OE1-CZ 4Å; E151-R351 IonicContact OE1-NH2 3.57Å; E151-R351 PolarHBondContact OE1-NH2 2.94Å; S319-R351 PolarHBondContact OG-NH1 2.77Å; S319-R351 PolarHBondContact OG-NH2 3.42Å; E321-R351 IonicContact OE1-NH1 3.8Å; E321-R351 PolarHBondContact OE1-NH1 3.08Å; E321-R351 VanDerWaalsContact OE1-NH1 3.12Å; E321-R351 IonicContact OE2-NH1 3.01Å; P347-R351 VanDerWaalsContact O-CB 3.3Å; P347-R351 WeakPolarHBondContact O-CB 3.41Å; P347-R351 PolarHBondContact O-N 3.17Å; R351-L353 VanDerWaalsContact C-N 3.27Å; R351-L353 PolarHBondContact O-N 2.9Å; R351-T354 PolarHBondContact O-N 3.41Å; R351-T354 PolarHBondContact O-OG1 3.04Å; R351-E355 WeakPolarHBondContact CD-OE1 3.41Å; R351-E355 HydrophobicContact CG-CG 4.39Å; R351-E355 WeakPolarHBondContact CG-OE1 3.46Å; R351-E355 IonicContact CZ-OE1 3.57Å; R351-E355 IonicContact NE-OE1 3.85Å; R351-E355 PolarHBondContact NE-OE1 3.14Å; R351-E355 WeakPolarHBondContact O-CG 3.48Å; R351-E355 PolarHBondContact O-N 3.16Å
352	S	97.2	Very high	96.4	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.007	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-30.1	179.4	-60.7	0	0	0	0	113.6	G155 K156 F348 Y349 L350	G155-S352 WeakPolarHBondContact CA-OG 3.28Å; K156-S352 VanDerWaalsContact CE-O 3.3Å; K156-S352 WeakPolarHBondContact CE-O 3.4Å; K156-S352 PolarHBondContact NZ-O 2.89Å; F348-S352 VanDerWaalsContact O-CB 3.26Å; F348-S352 WeakPolarHBondContact O-CB 3.46Å; F348-S352 PolarHBondContact O-N 2.94Å; F348-S352 PolarHBondContact O-OG 3.48Å; Y349-S352 PolarHBondContact O-N 3.19Å; L350-S352 PolarHBondContact O-N 3.24Å
353	L	95.3	Very high	96.3	Very high	91 Å²	91	52.1 Å²	52.1	48%	0.476	27%	0.271	S	S	.	.	H	α-helix	trans	-66.7	-43.1	172.2	-76.6	179.6	0	0	0	111.7	K156 T159 Y349 L350 R351	K156-L353 PolarHBondContact NZ-O 3.37Å; T159-L353 HydrophobicContact CG2-CD2 3.95Å; T159-L353 HydrophobicContact CG2-CG 4.07Å; Y349-L353 HydrophobicContact CD1-CD1 3.89Å; Y349-L353 HydrophobicContact CD1-CG 4.13Å; Y349-L353 HydrophobicContact CE1-CD1 3.49Å; Y349-L353 VanDerWaalsContact CE1-CD1 3.49Å; Y349-L353 HydrophobicContact CE1-CD2 4.28Å; Y349-L353 HydrophobicContact CE1-CG 3.85Å; Y349-L353 PolarHBondContact O-N 3.15Å; L350-L353 WeakPolarHBondContact O-CB 3.49Å; L350-L353 PolarHBondContact O-N 3.06Å; R351-L353 VanDerWaalsContact C-N 3.27Å; R351-L353 PolarHBondContact O-N 2.9Å
354	T	94.8	Very high	95.9	Very high	111 Å²	111	55.6 Å²	55.6	68%	0.681	29%	0.287	S	S	*	.	H	α-helix	trans	-80.7	-26.2	-174.9	59.5	0	0	0	0	114.6	L350 R351 V356	L350-T354 PolarHBondContact O-N 3.3Å; L350-T354 PolarHBondContact O-OG1 3.25Å; R351-T354 PolarHBondContact O-N 3.41Å; R351-T354 PolarHBondContact O-OG1 3.04Å; T354-V356 PolarHBondContact O-N 3.4Å
355	E	92.6	Very high	95.7	Very high	51 Å²	51	56 Å²	56	24%	0.238	29%	0.293	C	S	.	.	S	Bend	trans	-63.8	129.2	178.5	-77	177.6	-164.2	0	0	111.1	S152 K156 R351 I357	S152-E355 WeakPolarHBondContact CB-OE2 3.32Å; K156-E355 WeakPolarHBondContact CE-O 3.35Å; K156-E355 PolarHBondContact NZ-O 3.05Å; R351-E355 WeakPolarHBondContact CD-OE1 3.41Å; R351-E355 HydrophobicContact CG-CG 4.39Å; R351-E355 WeakPolarHBondContact CG-OE1 3.46Å; R351-E355 IonicContact CZ-OE1 3.57Å; R351-E355 IonicContact NE-OE1 3.85Å; R351-E355 PolarHBondContact NE-OE1 3.14Å; R351-E355 WeakPolarHBondContact O-CG 3.48Å; R351-E355 PolarHBondContact O-N 3.16Å; E355-I357 HydrophobicContact CB-CG1 4.05Å; E355-I357 PolarHBondContact O-N 3.11Å
356	V	93.2	Very high	95.5	Very high	120 Å²	120	50 Å²	50	73%	0.727	27%	0.265	S	S	*	.			trans	-85.4	94.1	177.2	-177.3	0	0	0	0	108.7	T354	T354-V356 PolarHBondContact O-N 3.4Å
357	I	93.2	Very high	95	Very high	54 Å²	54	51.1 Å²	51.1	28%	0.277	27%	0.271	S	S	.	.			trans	-120.9	123.1	-180	-55.3	-63.9	0	0	0	109	V153 K156 E355 V359	V153-I357 HydrophobicContact CG2-CG2 4.21Å; K156-I357 HydrophobicContact CG-CB 4.13Å; K156-I357 HydrophobicContact CG-CG2 4.44Å; E355-I357 HydrophobicContact CB-CG1 4.05Å; E355-I357 PolarHBondContact O-N 3.11Å; I357-V359 HydrophobicContact CG2-CG2 4.27Å; I357-V359 PolarHBondContact O-N 3.45Å
358	D	94.6	Very high	94.6	Very high	85 Å²	85	53 Å²	53	46%	0.455	28%	0.277	S	S	.	.			trans	-87	89.1	173.9	-170.6	-18.8	0	0	0	109.6	G360 K361 Y362	D358-G360 VanDerWaalsContact C-N 3.29Å; D358-G360 PolarHBondContact O-N 3.41Å; D358-G360 PolarHBondContact OD1-N 2.9Å; D358-K361 HydrophobicContact CB-CB 3.91Å; D358-K361 PolarHBondContact O-N 2.84Å; D358-K361 WeakPolarHBondContact OD1-CB 3.39Å; D358-K361 PolarHBondContact OD1-N 3.35Å; D358-K361 VanDerWaalsContact OD2-CB 3.29Å; D358-K361 WeakPolarHBondContact OD2-CB 3.43Å; D358-Y362 PolarHBondContact O-N 3.19Å
359	V	95	Very high	94.1	Very high	12 Å²	12	57.9 Å²	57.9	7%	0.073	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-37.5	179.8	179	0	0	0	0	110.9	K156 I186 I357 Y362 F363	K156-V359 HydrophobicContact CB-CG2 3.61Å; K156-V359 HydrophobicContact CG-CG2 3.7Å; I186-V359 HydrophobicContact CD1-CG1 3.86Å; I357-V359 HydrophobicContact CG2-CG2 4.27Å; I357-V359 PolarHBondContact O-N 3.45Å; V359-Y362 PolarHBondContact O-N 3.17Å; V359-F363 VanDerWaalsContact O-CB 3.25Å; V359-F363 WeakPolarHBondContact O-CB 3.34Å; V359-F363 PolarHBondContact O-N 2.9Å
360	G	94.7	Very high	93.4	Very high	5 Å²	5	58.5 Å²	58.5	5%	0.052	30%	0.304	C	S	.	.	H	α-helix	trans	-63.8	-47.1	178.9	0	0	0	0	0	111.3	G190 D358 Y362 F363 Q364	G190-G360 VanDerWaalsContact CA-CA 3.46Å; D358-G360 VanDerWaalsContact C-N 3.29Å; D358-G360 PolarHBondContact O-N 3.41Å; D358-G360 PolarHBondContact OD1-N 2.9Å; G360-Y362 PolarHBondContact O-N 3.05Å; G360-F363 PolarHBondContact O-N 3.26Å; G360-Q364 WeakPolarHBondContact O-CB 3.37Å; G360-Q364 PolarHBondContact O-N 2.83Å
361	K	95.5	Very high	92.6	Very high	126 Å²	126	55.4 Å²	55.4	55%	0.548	29%	0.289	S	S	.	.	H	α-helix	trans	-63.2	-41.8	175	-175.7	179.1	-178.4	-178.7	0	112.7	D358 S365	D358-K361 HydrophobicContact CB-CB 3.91Å; D358-K361 PolarHBondContact O-N 2.84Å; D358-K361 WeakPolarHBondContact OD1-CB 3.39Å; D358-K361 PolarHBondContact OD1-N 3.35Å; D358-K361 VanDerWaalsContact OD2-CB 3.29Å; D358-K361 WeakPolarHBondContact OD2-CB 3.43Å; K361-S365 WeakPolarHBondContact O-CB 3.29Å; K361-S365 PolarHBondContact O-N 3.13Å
362	Y	96	Very high	91.6	Very high	28 Å²	28	59.3 Å²	59.3	11%	0.11	32%	0.322	C	S	.	.	H	α-helix	trans	-60	-50.3	173.6	168.5	-105.7	0	0	0	110.7	F137 I149 P150 V153 D358 V359 G360 Q364 S365 I366	F137-Y362 AromaticContact CE1-CE1 3.96Å; F137-Y362 HydrophobicContact CE1-CE1 3.96Å; F137-Y362 HydrophobicContact CZ-CD1 4.38Å; F137-Y362 AromaticContact CZ-CE1 3.64Å; F137-Y362 HydrophobicContact CZ-CE1 3.64Å; I149-Y362 HydrophobicContact CG2-CE1 4.4Å; P150-Y362 WeakPolarHBondContact CD-OH 3.29Å; P150-Y362 HydrophobicContact CG-CE2 4.09Å; V153-Y362 HydrophobicContact CB-CD1 4.37Å; V153-Y362 HydrophobicContact CB-CE1 4.41Å; V153-Y362 HydrophobicContact CG1-CD1 3.85Å; V153-Y362 HydrophobicContact CG1-CE1 3.91Å; V153-Y362 HydrophobicContact CG2-CD1 3.72Å; V153-Y362 HydrophobicContact CG2-CD2 4.49Å; V153-Y362 HydrophobicContact CG2-CE1 4.08Å; V153-Y362 HydrophobicContact CG2-CG 3.94Å; D358-Y362 PolarHBondContact O-N 3.19Å; V359-Y362 PolarHBondContact O-N 3.17Å; G360-Y362 PolarHBondContact O-N 3.05Å; Y362-Q364 PolarHBondContact O-N 3.45Å; Y362-S365 WeakPolarHBondContact O-CB 3.46Å; Y362-S365 PolarHBondContact O-N 3.27Å; Y362-S365 VanDerWaalsContact O-N 3.15Å; Y362-S365 PolarHBondContact O-OG 2.81Å; Y362-I366 HydrophobicContact CE1-CG1 4.32Å; Y362-I366 HydrophobicContact CE2-CD1 4.1Å; Y362-I366 HydrophobicContact CE2-CG1 4.02Å; Y362-I366 PolarHBondContact O-N 3.34Å; Y362-I366 VanDerWaalsContact O-N 3.17Å
363	F	94.8	Very high	90.7	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-59.1	-48.1	179.8	-177.9	-114.3	0	0	0	111.3	T132 F137 I186 D187 V359 G360 S365 I366 L367 M376	T132-F363 HydrophobicContact CG2-CE2 3.98Å; T132-F363 HydrophobicContact CG2-CZ 3.92Å; F137-F363 AromaticContact CD2-CD2 3.69Å; F137-F363 HydrophobicContact CD2-CD2 3.69Å; F137-F363 AromaticContact CD2-CE2 3.45Å; F137-F363 HydrophobicContact CD2-CE2 3.45Å; F137-F363 VanDerWaalsContact CD2-CE2 3.45Å; F137-F363 AromaticContact CE2-CD2 3.33Å; F137-F363 HydrophobicContact CE2-CD2 3.33Å; F137-F363 AromaticContact CE2-CE2 3.61Å; F137-F363 HydrophobicContact CE2-CE2 3.61Å; F137-F363 HydrophobicContact CG-CD2 4.45Å; F137-F363 HydrophobicContact CG-CE2 4.2Å; F137-F363 AromaticContact CZ-CD2 3.85Å; F137-F363 HydrophobicContact CZ-CD2 3.85Å; F137-F363 HydrophobicContact CZ-CE2 4.46Å; I186-F363 HydrophobicContact CD1-CB 4.16Å; I186-F363 HydrophobicContact CD1-CD2 3.84Å; I186-F363 HydrophobicContact CD1-CE2 4.44Å; I186-F363 HydrophobicContact CD1-CG 4Å; I186-F363 HydrophobicContact CG1-CD1 4.48Å; I186-F363 HydrophobicContact CG1-CD2 4.23Å; I186-F363 HydrophobicContact CG1-CE2 4.47Å; I186-F363 HydrophobicContact CG1-CG 4.25Å; I186-F363 HydrophobicContact CG2-CD2 4.05Å; I186-F363 HydrophobicContact CG2-CE2 3.54Å; I186-F363 HydrophobicContact CG2-CZ 3.82Å; D187-F363 VanDerWaalsContact O-CD1 3.23Å; D187-F363 WeakPolarHBondContact O-CD1 3.14Å; V359-F363 VanDerWaalsContact O-CB 3.25Å; V359-F363 WeakPolarHBondContact O-CB 3.34Å; V359-F363 PolarHBondContact O-N 2.9Å; G360-F363 PolarHBondContact O-N 3.26Å; F363-S365 VanDerWaalsContact C-N 3.31Å; F363-S365 PolarHBondContact O-N 2.8Å; F363-I366 WeakPolarHBondContact O-CA 3.33Å; F363-I366 WeakPolarHBondContact O-CB 3.2Å; F363-I366 PolarHBondContact O-N 2.89Å; F363-L367 HydrophobicContact CD1-CD1 3.95Å; F363-L367 HydrophobicContact CD1-CG 4.23Å; F363-L367 HydrophobicContact CE1-CD1 3.58Å; F363-L367 HydrophobicContact CE1-CD2 4.18Å; F363-L367 HydrophobicContact CE1-CG 4.01Å; F363-L367 HydrophobicContact CE2-CD2 4.18Å; F363-L367 HydrophobicContact CZ-CD1 4.09Å; F363-L367 HydrophobicContact CZ-CD2 3.83Å; F363-L367 HydrophobicContact CZ-CG 4.15Å; F363-L367 WeakPolarHBondContact O-CG 3.48Å; F363-L367 PolarHBondContact O-N 2.6Å; F363-M376 HydrophobicContact CZ-CE 4.49Å
364	Q	92	Very high	89.5	Confident	72 Å²	72	63.9 Å²	63.9	34%	0.336	34%	0.341	S	S	.	.	H	α-helix	trans	-58.6	-41.1	175.5	-169.7	61	53	0	0	112	G360 Y362 I366 L367 D368	G360-Q364 WeakPolarHBondContact O-CB 3.37Å; G360-Q364 PolarHBondContact O-N 2.83Å; Y362-Q364 PolarHBondContact O-N 3.45Å; Q364-I366 PolarHBondContact O-N 3.21Å; Q364-L367 WeakPolarHBondContact O-CB 3.32Å; Q364-L367 PolarHBondContact O-N 3.21Å; Q364-D368 PolarHBondContact NE2-OD1 3.21Å; Q364-D368 PolarHBondContact O-N 3.43Å
365	S	93.7	Very high	88.3	Confident	40 Å²	40	61.8 Å²	61.8	28%	0.28	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-23.2	176.6	81.3	0	0	0	0	114	K361 Y362 F363 K369	K361-S365 WeakPolarHBondContact O-CB 3.29Å; K361-S365 PolarHBondContact O-N 3.13Å; Y362-S365 WeakPolarHBondContact O-CB 3.46Å; Y362-S365 PolarHBondContact O-N 3.27Å; Y362-S365 VanDerWaalsContact O-N 3.15Å; Y362-S365 PolarHBondContact O-OG 2.81Å; F363-S365 VanDerWaalsContact C-N 3.31Å; F363-S365 PolarHBondContact O-N 2.8Å; S365-K369 WeakPolarHBondContact O-CE 3.42Å
366	I	92.9	Very high	87.2	Confident	6 Å²	6	60.3 Å²	60.3	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-82	-42.9	171.2	-62.1	-59.8	0	0	0	110.1	F137 F140 V141 L145 Y362 F363 Q364 D368 K369	F137-I366 HydrophobicContact CD2-CG2 4.35Å; F137-I366 HydrophobicContact CE2-CB 3.86Å; F137-I366 HydrophobicContact CE2-CG1 4.15Å; F137-I366 HydrophobicContact CE2-CG2 3.55Å; F137-I366 HydrophobicContact CZ-CB 4.3Å; F137-I366 HydrophobicContact CZ-CG1 4.07Å; F137-I366 HydrophobicContact CZ-CG2 4.24Å; F140-I366 HydrophobicContact CD1-CG2 3.69Å; F140-I366 HydrophobicContact CE1-CG2 3.77Å; V141-I366 HydrophobicContact CG2-CD1 4.35Å; V141-I366 HydrophobicContact CG2-CG1 4.38Å; V141-I366 HydrophobicContact CG2-CG2 3.89Å; L145-I366 HydrophobicContact CD1-CD1 3.83Å; L145-I366 HydrophobicContact CD1-CG2 3.84Å; Y362-I366 HydrophobicContact CE1-CG1 4.32Å; Y362-I366 HydrophobicContact CE2-CD1 4.1Å; Y362-I366 HydrophobicContact CE2-CG1 4.02Å; Y362-I366 PolarHBondContact O-N 3.34Å; Y362-I366 VanDerWaalsContact O-N 3.17Å; F363-I366 WeakPolarHBondContact O-CA 3.33Å; F363-I366 WeakPolarHBondContact O-CB 3.2Å; F363-I366 PolarHBondContact O-N 2.89Å; Q364-I366 PolarHBondContact O-N 3.21Å; I366-D368 VanDerWaalsContact C-N 3.31Å; I366-D368 PolarHBondContact O-N 3.26Å; I366-K369 WeakPolarHBondContact O-CB 3.46Å; I366-K369 PolarHBondContact O-N 3.02Å; I366-K369 VanDerWaalsContact O-N 3.11Å
367	L	88.1	Confident	85.8	Confident	32 Å²	32	56.3 Å²	56.3	17%	0.168	29%	0.294	C	S	.	.	H	α-helix	trans	-58.6	-40.3	176.3	-65.4	-171.3	0	0	0	112.7	F363 Q364 K369 V370 M376	F363-L367 HydrophobicContact CD1-CD1 3.95Å; F363-L367 HydrophobicContact CD1-CG 4.23Å; F363-L367 HydrophobicContact CE1-CD1 3.58Å; F363-L367 HydrophobicContact CE1-CD2 4.18Å; F363-L367 HydrophobicContact CE1-CG 4.01Å; F363-L367 HydrophobicContact CE2-CD2 4.18Å; F363-L367 HydrophobicContact CZ-CD1 4.09Å; F363-L367 HydrophobicContact CZ-CD2 3.83Å; F363-L367 HydrophobicContact CZ-CG 4.15Å; F363-L367 WeakPolarHBondContact O-CG 3.48Å; F363-L367 PolarHBondContact O-N 2.6Å; Q364-L367 WeakPolarHBondContact O-CB 3.32Å; Q364-L367 PolarHBondContact O-N 3.21Å; L367-K369 PolarHBondContact O-N 2.62Å; L367-K369 VanDerWaalsContact O-N 3.08Å; L367-V370 VanDerWaalsContact O-CB 3.23Å; L367-V370 WeakPolarHBondContact O-CB 3.01Å; L367-V370 VanDerWaalsContact O-CG2 3.3Å; L367-V370 WeakPolarHBondContact O-CG2 3.2Å; L367-V370 PolarHBondContact O-N 3.02Å; L367-M376 HydrophobicContact CD2-CE 3.08Å; L367-M376 HydrophobicContact CD2-SD 3.67Å
368	D	89.4	Confident	84.2	Confident	117 Å²	117	60.1 Å²	60.1	63%	0.626	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-16.2	179.5	-65.6	-17.6	0	0	0	112.8	Q364 I366	Q364-D368 PolarHBondContact NE2-OD1 3.21Å; Q364-D368 PolarHBondContact O-N 3.43Å; I366-D368 VanDerWaalsContact C-N 3.31Å; I366-D368 PolarHBondContact O-N 3.26Å
369	K	89	Confident	82.4	Confident	103 Å²	103	58.2 Å²	58.2	45%	0.448	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-5.3	175.1	-60.3	172.7	-175.7	172.5	0	112.9	L145 S365 I366 L367 P371	L145-K369 HydrophobicContact CD1-CB 4.32Å; L145-K369 HydrophobicContact CD1-CD 4Å; L145-K369 HydrophobicContact CD2-CB 3.77Å; L145-K369 HydrophobicContact CD2-CD 4.15Å; S365-K369 WeakPolarHBondContact O-CE 3.42Å; I366-K369 WeakPolarHBondContact O-CB 3.46Å; I366-K369 PolarHBondContact O-N 3.02Å; I366-K369 VanDerWaalsContact O-N 3.11Å; L367-K369 PolarHBondContact O-N 2.62Å; L367-K369 VanDerWaalsContact O-N 3.08Å; K369-P371 VanDerWaalsContact O-CD 3.31Å; K369-P371 WeakPolarHBondContact O-CD 3.43Å
370	V	83.6	Confident	80.1	Confident	30 Å²	30	60 Å²	60	18%	0.182	31%	0.313	C	S	.	.	S	Bend	trans	-71	118.6	175.4	-177.9	0	0	0	0	108	F140 L367 I374 M376	F140-V370 HydrophobicContact CD1-CG2 4.34Å; F140-V370 HydrophobicContact CE1-CG2 3.58Å; F140-V370 HydrophobicContact CE2-CG2 4.05Å; F140-V370 HydrophobicContact CZ-CB 4.08Å; F140-V370 HydrophobicContact CZ-CG2 3.44Å; F140-V370 VanDerWaalsContact CZ-CG2 3.44Å; L367-V370 VanDerWaalsContact O-CB 3.23Å; L367-V370 WeakPolarHBondContact O-CB 3.01Å; L367-V370 VanDerWaalsContact O-CG2 3.3Å; L367-V370 WeakPolarHBondContact O-CG2 3.2Å; L367-V370 PolarHBondContact O-N 3.02Å; V370-I374 HydrophobicContact CG1-CB 4.05Å; V370-I374 HydrophobicContact CG1-CG2 4.22Å; V370-I374 WeakPolarHBondContact CG1-O 3.31Å; V370-M376 HydrophobicContact CG1-CG 3.99Å; V370-M376 HydrophobicContact CG2-CG 3.72Å; V370-M376 HydrophobicContact CG2-SD 3.7Å
371	P	82.1	Confident	77.4	Confident	20 Å²	20	67.7 Å²	67.7	13%	0.13	35%	0.347	C	S	.	.			trans	-59.5	146.4	175.3	-19.3	29.4	0	0	0	110.8	Y144 K369 H373 I374	Y144-P371 HydrophobicContact CE1-CG 3.96Å; Y144-P371 WeakPolarHBondContact OH-CG 3.47Å; K369-P371 VanDerWaalsContact O-CD 3.31Å; K369-P371 WeakPolarHBondContact O-CD 3.43Å; P371-H373 WeakPolarHBondContact CB-CE1 3.48Å; P371-H373 WeakPolarHBondContact CB-ND1 3.47Å; P371-H373 PolarHBondContact O-N 3.28Å; P371-I374 HydrophobicContact CB-CD1 4.41Å; P371-I374 HydrophobicContact CB-CG1 4.19Å; P371-I374 HydrophobicContact CG-CD1 3.75Å; P371-I374 HydrophobicContact CG-CG1 4.06Å; P371-I374 PolarHBondContact O-N 3.18Å
372	P	77	Confident	74.3	Confident	142 Å²	142	66.6 Å²	66.6	92%	0.922	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-15	-175.7	23.5	-34	0	0	0	114.4
373	H	76.9	Confident	71	Confident	152 Å²	152	72.1 Å²	72.1	70%	0.704	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-9.7	176.5	61.4	-89.3	0	0	0	113.6	P371	P371-H373 WeakPolarHBondContact CB-CE1 3.48Å; P371-H373 WeakPolarHBondContact CB-ND1 3.47Å; P371-H373 PolarHBondContact O-N 3.28Å
374	I	71.5	Confident	67.9	Low	36 Å²	36	81.5 Å²	81.5	19%	0.185	45%	0.449	C	S	.	.			trans	-96.9	111.6	178	-61	-170.6	0	0	0	108.1	Y144 V370 P371 M376 L379	Y144-I374 HydrophobicContact CD2-CD1 4.05Å; Y144-I374 HydrophobicContact CE2-CD1 3.52Å; V370-I374 HydrophobicContact CG1-CB 4.05Å; V370-I374 HydrophobicContact CG1-CG2 4.22Å; V370-I374 WeakPolarHBondContact CG1-O 3.31Å; P371-I374 HydrophobicContact CB-CD1 4.41Å; P371-I374 HydrophobicContact CB-CG1 4.19Å; P371-I374 HydrophobicContact CG-CD1 3.75Å; P371-I374 HydrophobicContact CG-CG1 4.06Å; P371-I374 PolarHBondContact O-N 3.18Å; I374-M376 PolarHBondContact O-N 2.9Å; I374-L379 HydrophobicContact CG2-CD1 4.16Å; I374-L379 HydrophobicContact CG2-CD2 4.01Å; I374-L379 HydrophobicContact CG2-CG 4.13Å
375	N	69.4	Low	66.7	Low	67 Å²	67	82 Å²	82	36%	0.358	45%	0.454	S	S	.	.			trans	-80.9	112.4	163.4	-175.6	-6.5	0	0	0	107.9	N377 E378	N375-N377 PolarHBondContact O-N 2.98Å; N375-N377 VanDerWaalsContact OD1-CB 3.32Å; N375-N377 WeakPolarHBondContact OD1-CB 3.39Å; N375-N377 PolarHBondContact OD1-N 3.09Å; N375-E378 HydrophobicContact CB-CB 4.25Å; N375-E378 HydrophobicContact CB-CG 3.9Å; N375-E378 WeakPolarHBondContact CB-OE1 3.39Å; N375-E378 PolarHBondContact ND2-OE1 3.19Å; N375-E378 WeakPolarHBondContact O-CB 3.34Å; N375-E378 PolarHBondContact O-N 2.91Å
376	M	68.3	Low	65.3	Low	19 Å²	19	84.2 Å²	84.2	9%	0.094	46%	0.464	C	S	.	.	G	3₁₀ helix	trans	-55.9	-25	177.3	-72.8	-158.7	-47.1	0	0	112.4	T132 K136 F140 F363 L367 V370 I374 E378 L379	T132-M376 HydrophobicContact CG2-CE 4.08Å; K136-M376 WeakPolarHBondContact CD-O 3.49Å; F140-M376 HydrophobicContact CD1-SD 4.37Å; F140-M376 HydrophobicContact CG-SD 4.47Å; F363-M376 HydrophobicContact CZ-CE 4.49Å; L367-M376 HydrophobicContact CD2-CE 3.08Å; L367-M376 HydrophobicContact CD2-SD 3.67Å; V370-M376 HydrophobicContact CG1-CG 3.99Å; V370-M376 HydrophobicContact CG2-CG 3.72Å; V370-M376 HydrophobicContact CG2-SD 3.7Å; I374-M376 PolarHBondContact O-N 2.9Å; M376-E378 PolarHBondContact O-N 2.96Å; M376-L379 HydrophobicContact CB-CD1 4.31Å; M376-L379 HydrophobicContact CG-CD1 4.29Å; M376-L379 PolarHBondContact O-N 3.04Å
377	N	63.4	Low	63.7	Low	36 Å²	36	88.6 Å²	88.6	19%	0.193	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-70.4	-16.5	176.3	-71.2	-38.6	0	0	0	114.2	K136 N375	K136-N377 VanDerWaalsContact NZ-CA 3.28Å; K136-N377 PolarHBondContact NZ-O 2.75Å; K136-N377 PolarHBondContact NZ-OD1 2.84Å; N375-N377 PolarHBondContact O-N 2.98Å; N375-N377 VanDerWaalsContact OD1-CB 3.32Å; N375-N377 WeakPolarHBondContact OD1-CB 3.39Å; N375-N377 PolarHBondContact OD1-N 3.09Å
378	E	60.7	Low	62.3	Low	134 Å²	134	91.9 Å²	91.9	63%	0.626	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-93.7	-10.2	178.9	-69	169.4	-154.1	0	0	113.4	N375 M376 S380	N375-E378 HydrophobicContact CB-CB 4.25Å; N375-E378 HydrophobicContact CB-CG 3.9Å; N375-E378 WeakPolarHBondContact CB-OE1 3.39Å; N375-E378 PolarHBondContact ND2-OE1 3.19Å; N375-E378 WeakPolarHBondContact O-CB 3.34Å; N375-E378 PolarHBondContact O-N 2.91Å; M376-E378 PolarHBondContact O-N 2.96Å; E378-S380 PolarHBondContact O-N 3.04Å
379	L	56.1	Low	60.6	Low	46 Å²	46	90.3 Å²	90.3	24%	0.241	50%	0.499	C	S	.	.			trans	-65.5	-2.6	-178.3	-70.6	169.1	0	0	0	114.4	F140 I374 M376 Q381	F140-L379 HydrophobicContact CB-CD1 3.95Å; F140-L379 HydrophobicContact CD2-CD1 3.63Å; F140-L379 HydrophobicContact CG-CD1 4.17Å; I374-L379 HydrophobicContact CG2-CD1 4.16Å; I374-L379 HydrophobicContact CG2-CD2 4.01Å; I374-L379 HydrophobicContact CG2-CG 4.13Å; M376-L379 HydrophobicContact CB-CD1 4.31Å; M376-L379 HydrophobicContact CG-CD1 4.29Å; M376-L379 PolarHBondContact O-N 3.04Å; L379-Q381 VanDerWaalsContact C-N 3.32Å; L379-Q381 PolarHBondContact O-N 3.03Å
380	S	46.8	Very low	58.7	Low	49 Å²	49	89.5 Å²	89.5	34%	0.343	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	25.7	-172.9	63.8	0	0	0	0	115.5	E378	E378-S380 PolarHBondContact O-N 3.04Å
381	Q	38	Very low	56.9	Low	166 Å²	166	93.7 Å²	93.7	78%	0.776	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.3	5.9	-177.3	-65.3	-167.4	17.7	0	0	116.4	L379	L379-Q381 VanDerWaalsContact C-N 3.32Å; L379-Q381 PolarHBondContact O-N 3.03Å
382	T	29.9	Very low	55	Low	104 Å²	104	99.4 Å²	99.4	64%	0.638	56%	0.556	S	S	*	*	S	Bend	trans	-118.9	115.8	178.5	55.1	0	0	0	0	110.6
383	N	28.1	Very low	53.1	Low	144 Å²	144	95.8 Å²	95.8	77%	0.77	53%	0.525	S	S	*	.			trans	86.9	82.3	176.1	-49.1	-24.1	0	0	0	115.5
384	S	28.9	Very low	51	Low	197 Å²	197	90.7 Å²	90.7	100%	1.378	51%	0.509	S	S	*	.			trans	-105.9	0	141.2	-57.4	0	0	0	0	107.9

Retrieved 384 of 384 residues in 864.1 ms (Link to these results)

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