C1M0Q3_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession C1M0Q3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 418 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	32.2	Very low	27.1	Very low	239 Å²	239	159.1 Å²	159.1	100%	1.177	76%	0.764	S	S	*	*				0	88.6	0	-76.3	178.8	173.3	0	0	106.8	V3	M1-V3 PolarHBondContact O-N 3.28Å
2	E	26.7	Very low	27.2	Very low	193 Å²	193	157.7 Å²	157.7	90%	0.902	76%	0.761	S	S	*	*			trans	-76.9	114.2	176.1	-87.3	-177.6	144.5	0	0	109.1	V4	E2-V4 PolarHBondContact O-N 3.17Å
3	V	24.5	Very low	27.7	Very low	136 Å²	136	153.8 Å²	153.8	82%	0.824	75%	0.745	S	S	*	*			trans	-78.9	105	174.7	179.1	0	0	0	0	107.4	M1	M1-V3 PolarHBondContact O-N 3.28Å
4	V	25.3	Very low	27.8	Very low	123 Å²	123	150.1 Å²	150.1	75%	0.745	74%	0.739	S	S	*	*			trans	-74.8	126	169.8	-173.9	0	0	0	0	107.9	E2 R6	E2-V4 PolarHBondContact O-N 3.17Å; V4-R6 PolarHBondContact O-N 3.31Å
5	P	25	Very low	28	Very low	79 Å²	79	148.3 Å²	148.3	51%	0.513	74%	0.743	S	S	.	*			trans	-70.6	126.5	-178.3	27.2	-30.5	0	0	0	110.2	Y7	P5-Y7 HydrophobicContact CB-CE2 4.5Å; P5-Y7 HydrophobicContact CG-CE2 3.96Å; P5-Y7 PolarHBondContact O-N 3.19Å
6	R	24.2	Very low	28.4	Very low	221 Å²	221	151.8 Å²	151.8	83%	0.834	76%	0.756	S	S	*	*			trans	-71.1	112.6	164.5	-80.7	-174.1	-179.1	-170.3	1.8	108	V4 E8	V4-R6 PolarHBondContact O-N 3.31Å; R6-E8 PolarHBondContact O-N 2.88Å
7	Y	26.6	Very low	28.5	Very low	171 Å²	171	147.6 Å²	147.6	67%	0.671	76%	0.76	S	S	*	*			trans	-81.7	99	164.4	-67.2	-79.7	0	0	0	108.2	P5 Y9	P5-Y7 HydrophobicContact CB-CE2 4.5Å; P5-Y7 HydrophobicContact CG-CE2 3.96Å; P5-Y7 PolarHBondContact O-N 3.19Å; Y7-Y9 PolarHBondContact O-N 3.38Å
8	E	23.3	Very low	28.5	Very low	167 Å²	167	143.2 Å²	143.2	78%	0.78	76%	0.758	S	S	*	*			trans	-78.7	111.2	166	-75.1	-178.7	169.3	0	0	108.2	R6	R6-E8 PolarHBondContact O-N 2.88Å
9	Y	31.3	Very low	28.3	Very low	170 Å²	170	143.2 Å²	143.2	67%	0.667	77%	0.768	S	S	*	*			trans	-92.3	98.2	166.2	-66.4	-82.8	0	0	0	107.4	Y7	Y7-Y9 PolarHBondContact O-N 3.38Å
10	E	27.3	Very low	28.2	Very low	170 Å²	170	141.8 Å²	141.8	79%	0.794	77%	0.765	S	S	*	*			trans	-69.5	125.6	170.9	-121.3	179.5	171.4	0	0	109.4	I12	E10-I12 PolarHBondContact O-N 3.11Å; E10-I12 VanDerWaalsContact O-N 3.11Å
11	V	31.7	Very low	28	Very low	81 Å²	81	140.7 Å²	140.7	49%	0.491	77%	0.768	S	S	.	*			trans	-77.3	95.5	169.6	178.5	0	0	0	0	107	I13	V11-I13 HydrophobicContact CG1-CG1 4.39Å; V11-I13 PolarHBondContact O-N 2.79Å
12	I	27.7	Very low	27.7	Very low	142 Å²	142	136 Å²	136	73%	0.728	75%	0.747	S	S	*	*			trans	-76.4	106.7	175.3	-56.4	176.4	0	0	0	108	E10	E10-I12 PolarHBondContact O-N 3.11Å; E10-I12 VanDerWaalsContact O-N 3.11Å
13	I	34.1	Very low	27.6	Very low	108 Å²	108	136.8 Å²	136.8	55%	0.554	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-85.1	116.5	167.1	-55.6	175.9	0	0	0	106.6	V11 I176	V11-I13 HydrophobicContact CG1-CG1 4.39Å; V11-I13 PolarHBondContact O-N 2.79Å; I13-I176 HydrophobicContact CD1-CD1 4.4Å
14	P	28.7	Very low	27.7	Very low	102 Å²	102	134.4 Å²	134.4	66%	0.662	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-69.7	142.6	178.9	27.7	-31.1	0	0	0	110.3
15	P	31.7	Very low	27.9	Very low	123 Å²	123	135.5 Å²	135.5	80%	0.799	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-66.7	146.1	177.1	27.5	-31.3	0	0	0	110.6	G17	P15-G17 PolarHBondContact O-N 3.18Å
16	E	33.7	Very low	28.2	Very low	203 Å²	203	136.8 Å²	136.8	95%	0.949	75%	0.748	S	S	*	*	S	Bend	trans	-55.7	126	-177.2	-65.5	-175	168.9	0	0	112
17	G	30.8	Very low	29.2	Very low	81 Å²	81	134 Å²	134	84%	0.835	74%	0.739	S	S	*	*			trans	118.9	91.1	168.1	0	0	0	0	0	114.2	P15	P15-G17 PolarHBondContact O-N 3.18Å
18	G	27.4	Very low	29.8	Very low	69 Å²	69	129.2 Å²	129.2	71%	0.711	73%	0.725	S	S	*	*			trans	175.6	88.9	168.9	0	0	0	0	0	112.3	V20	G18-V20 PolarHBondContact O-N 3.14Å; G18-V20 VanDerWaalsContact O-N 3.16Å
19	C	25.3	Very low	30.8	Very low	142 Å²	142	122.5 Å²	122.5	96%	0.959	69%	0.694	S	S	*	*			trans	-62.7	111.6	163	-83.9	0	0	0	0	108.7
20	V	27.3	Very low	31.4	Very low	116 Å²	116	121 Å²	121	70%	0.703	70%	0.697	S	S	*	*			trans	-116.8	105.7	162.3	-169.7	0	0	0	0	107.1	G18 L22	G18-V20 PolarHBondContact O-N 3.14Å; G18-V20 VanDerWaalsContact O-N 3.16Å; V20-L22 HydrophobicContact CG1-CD1 4.28Å; V20-L22 HydrophobicContact CG1-CG 4.22Å; V20-L22 PolarHBondContact O-N 2.77Å; V20-L22 VanDerWaalsContact O-N 3.09Å
21	S	24	Very low	31.9	Very low	119 Å²	119	118.9 Å²	118.9	83%	0.832	69%	0.692	S	S	*	*			trans	-65.1	99.4	166.9	50.2	0	0	0	0	108.8
22	L	25.8	Very low	32.5	Very low	141 Å²	141	117.9 Å²	117.9	74%	0.738	68%	0.683	S	S	*	*			trans	-115.4	126.5	160.3	-79.5	163.3	0	0	0	106.8	V20 S24	V20-L22 HydrophobicContact CG1-CD1 4.28Å; V20-L22 HydrophobicContact CG1-CG 4.22Å; V20-L22 PolarHBondContact O-N 2.77Å; V20-L22 VanDerWaalsContact O-N 3.09Å; L22-S24 VanDerWaalsContact C-N 3.31Å; L22-S24 PolarHBondContact O-N 3.42Å
23	E	24.1	Very low	32.8	Very low	208 Å²	208	119 Å²	119	97%	0.972	69%	0.685	S	S	*	*			trans	-48.7	96.1	170.8	-70.7	176.3	151.5	0	0	108.9
24	S	27.3	Very low	32.7	Very low	87 Å²	87	123.1 Å²	123.1	61%	0.608	70%	0.699	S	S	*	*			trans	-89.9	112.9	174.5	38.7	0	0	0	0	106.2	L22 V26	L22-S24 VanDerWaalsContact C-N 3.31Å; L22-S24 PolarHBondContact O-N 3.42Å; S24-V26 PolarHBondContact O-N 3.49Å
25	N	27.8	Very low	32.8	Very low	145 Å²	145	128.7 Å²	128.7	78%	0.775	71%	0.707	S	S	*	*			trans	-56.7	96.3	151.9	-83.4	-32.7	0	0	0	106	Y27	N25-Y27 VanDerWaalsContact C-N 3.32Å; N25-Y27 WeakPolarHBondContact O-CD2 3.42Å; N25-Y27 PolarHBondContact O-N 3.15Å
26	V	33.2	Very low	32.6	Very low	107 Å²	107	129.3 Å²	129.3	65%	0.648	70%	0.703	S	S	*	*			trans	-63.1	97.7	178	-179.2	0	0	0	0	106.3	S24 N28	S24-V26 PolarHBondContact O-N 3.49Å; V26-N28 HydrophobicContact CG1-CB 4.08Å; V26-N28 PolarHBondContact O-N 3.27Å
27	Y	43.6	Very low	32.6	Very low	161 Å²	161	124.4 Å²	124.4	63%	0.631	69%	0.687	S	S	*	*			trans	-66.9	83.2	164.8	-79.6	-86	0	0	0	106.8	N25 L29 R127	N25-Y27 VanDerWaalsContact C-N 3.32Å; N25-Y27 WeakPolarHBondContact O-CD2 3.42Å; N25-Y27 PolarHBondContact O-N 3.15Å; Y27-L29 PolarHBondContact O-N 3.08Å; Y27-L29 VanDerWaalsContact O-N 3.14Å; Y27-R127 HydrophobicContact CE2-CB 4.46Å
28	N	39.7	Very low	32.5	Very low	71 Å²	71	126.3 Å²	126.3	38%	0.38	68%	0.678	S	S	.	*			trans	-75.4	103.9	-173.5	-160.3	-13.3	0	0	0	108.2	V26 N30 N31	V26-N28 HydrophobicContact CG1-CB 4.08Å; V26-N28 PolarHBondContact O-N 3.27Å; N28-N30 PolarHBondContact O-N 2.93Å; N28-N30 VanDerWaalsContact OD1-CB 3.26Å; N28-N30 WeakPolarHBondContact OD1-CB 3.4Å; N28-N30 PolarHBondContact OD1-N 2.79Å; N28-N30 PolarHBondContact OD1-ND2 2.95Å; N28-N31 PolarHBondContact O-N 3.33Å
29	L	45.6	Very low	32.9	Very low	26 Å²	26	127.1 Å²	127.1	14%	0.136	67%	0.666	C	S	.	*	T	Hydrogen-bonded Turn	trans	-51.6	-18.5	171.8	-79.9	160.4	0	0	0	112.6	Y27 N31 L131 Y144 E202	Y27-L29 PolarHBondContact O-N 3.08Å; Y27-L29 VanDerWaalsContact O-N 3.14Å; L29-N31 VanDerWaalsContact C-N 3.33Å; L29-L131 HydrophobicContact CD2-CD1 3.4Å; L29-L131 VanDerWaalsContact CD2-CD1 3.4Å; L29-Y144 HydrophobicContact CD2-CE2 4.12Å; L29-E202 WeakPolarHBondContact CD1-OE2 3.35Å
30	N	41.9	Very low	33.5	Very low	138 Å²	138	129.4 Å²	129.4	74%	0.738	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-10.6	177.2	-58.2	-49.1	0	0	0	114.3	N28 I32	N28-N30 PolarHBondContact O-N 2.93Å; N28-N30 VanDerWaalsContact OD1-CB 3.26Å; N28-N30 WeakPolarHBondContact OD1-CB 3.4Å; N28-N30 PolarHBondContact OD1-N 2.79Å; N28-N30 PolarHBondContact OD1-ND2 2.95Å; N30-I32 VanDerWaalsContact C-N 3.35Å; N30-I32 PolarHBondContact O-N 2.88Å
31	N	39.1	Very low	34.6	Very low	126 Å²	126	128.3 Å²	128.3	67%	0.674	65%	0.647	S	S	*	*			trans	-96.1	40.2	179	-84.6	-11.1	0	0	0	113.2	N28 L29 H33	N28-N31 PolarHBondContact O-N 3.33Å; L29-N31 VanDerWaalsContact C-N 3.33Å; N31-H33 PolarHBondContact O-N 3.22Å; N31-H33 VanDerWaalsContact O-N 3.08Å
32	I	44.7	Very low	36.1	Very low	61 Å²	61	124.9 Å²	124.9	31%	0.313	63%	0.631	S	S	.	*			trans	-77.9	94.7	167.4	-60.6	170.3	0	0	0	107	N30 K34 Y144	N30-I32 VanDerWaalsContact C-N 3.35Å; N30-I32 PolarHBondContact O-N 2.88Å; I32-K34 PolarHBondContact O-N 2.8Å; I32-K34 VanDerWaalsContact O-N 3.16Å; I32-Y144 HydrophobicContact CD1-CD1 3.7Å; I32-Y144 HydrophobicContact CD1-CE1 3.33Å
33	H	33.8	Very low	37.6	Very low	166 Å²	166	120.4 Å²	120.4	77%	0.769	61%	0.609	S	S	*	*			trans	-58.2	120.4	160.2	-81.9	-5	0	0	0	107.7	N31 R35	N31-H33 PolarHBondContact O-N 3.22Å; N31-H33 VanDerWaalsContact O-N 3.08Å; H33-R35 PolarHBondContact O-N 2.98Å
34	K	32.5	Very low	39.9	Very low	194 Å²	194	111.3 Å²	111.3	84%	0.843	57%	0.566	S	S	*	*			trans	-55.4	88.5	162.8	-78.5	-176.1	176.4	-178.6	0	107.2	I32 N36	I32-K34 PolarHBondContact O-N 2.8Å; I32-K34 VanDerWaalsContact O-N 3.16Å; K34-N36 VanDerWaalsContact C-N 3.29Å; K34-N36 PolarHBondContact O-N 3.12Å; K34-N36 VanDerWaalsContact O-N 3.09Å
35	R	29.5	Very low	42.3	Very low	219 Å²	219	107.4 Å²	107.4	83%	0.826	54%	0.538	S	S	*	.			trans	-66.3	105.7	150.8	-77.2	-172.7	-175.3	175.8	3.1	103.7	H33 T37	H33-R35 PolarHBondContact O-N 2.98Å; R35-T37 HydrophobicContact CB-CG2 4.28Å; R35-T37 PolarHBondContact O-N 2.74Å
36	N	28.1	Very low	44.8	Very low	135 Å²	135	103.6 Å²	103.6	72%	0.722	52%	0.517	S	S	*	.			trans	-57.6	82.9	153.6	-91	-1.9	0	0	0	105.9	K34 D38	K34-N36 VanDerWaalsContact C-N 3.29Å; K34-N36 PolarHBondContact O-N 3.12Å; K34-N36 VanDerWaalsContact O-N 3.09Å; N36-D38 PolarHBondContact O-N 2.93Å
37	T	32.4	Very low	47.3	Very low	101 Å²	101	98.7 Å²	98.7	62%	0.62	49%	0.487	S	S	*	.			trans	-82.2	81.7	150.6	56.6	0	0	0	0	104.3	R35 D39	R35-T37 HydrophobicContact CB-CG2 4.28Å; R35-T37 PolarHBondContact O-N 2.74Å; T37-D39 PolarHBondContact O-N 3.38Å
38	D	29.8	Very low	49.1	Very low	121 Å²	121	93.6 Å²	93.6	65%	0.647	47%	0.474	S	S	*	.			trans	-47.6	123.7	147	-76	-33.1	0	0	0	106.3	N36	N36-D38 PolarHBondContact O-N 2.93Å
39	D	35.8	Very low	51.2	Low	86 Å²	86	93.2 Å²	93.2	46%	0.46	47%	0.474	S	S	.	.			trans	71.2	84.7	142.6	-54.7	-24.8	0	0	0	119	T37 H57	T37-D39 PolarHBondContact O-N 3.38Å; D39-H57 VanDerWaalsContact CB-NE2 3.3Å; D39-H57 WeakPolarHBondContact CB-NE2 3.33Å; D39-H57 IonicContact OD1-CE1 3.05Å; D39-H57 PolarHBondContact OD1-CE1 2.92Å; D39-H57 IonicContact OD1-NE2 3.44Å; D39-H57 PolarHBondContact OD1-NE2 3.37Å; D39-H57 IonicContact OD2-CE1 2.9Å; D39-H57 PolarHBondContact OD2-CE1 3.16Å; D39-H57 IonicContact OD2-NE2 3.95Å; D39-H57 PolarHBondContact OD2-NE2 3.01Å
40	Q	38.6	Very low	53.3	Low	189 Å²	189	95.3 Å²	95.3	88%	0.883	49%	0.488	S	S	*	.			trans	-159.1	53.2	137.6	-113.6	178.8	29.4	0	0	111.3	G42	Q40-G42 PolarHBondContact O-N 3.32Å
41	Y	49.1	Very low	55.2	Low	93 Å²	93	94.8 Å²	94.8	37%	0.365	49%	0.485	S	S	.	.			trans	-85.5	109.2	167.5	-72.2	-76.9	0	0	0	108.7	S56 R145	Y41-S56 WeakPolarHBondContact O-CB 3.47Å; Y41-S56 PolarHBondContact O-OG 3.23Å; Y41-R145 PolarHBondContact OH-NH1 3.24Å
42	G	55.7	Low	57.4	Low	48 Å²	48	93.3 Å²	93.3	50%	0.495	48%	0.478	S	S	.	.			trans	-65.4	-176.6	-170.2	0	0	0	0	0	113.9	Q40 F44	Q40-G42 PolarHBondContact O-N 3.32Å; G42-F44 PolarHBondContact O-N 2.88Å
43	V	57.9	Low	59.2	Low	46 Å²	46	93.8 Å²	93.8	28%	0.279	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-43.1	125.9	172.3	-178.6	0	0	0	0	110.4	T53 N55 V267	V43-T53 HydrophobicContact CB-CG2 3.74Å; V43-T53 HydrophobicContact CG1-CG2 3.26Å; V43-T53 HydrophobicContact CG2-CG2 3.2Å; V43-N55 WeakPolarHBondContact CA-OD1 3.28Å; V43-N55 WeakPolarHBondContact CG2-OD1 3.35Å; V43-N55 PolarHBondContact N-OD1 3.18Å; V43-V267 HydrophobicContact CB-CG1 3.57Å; V43-V267 HydrophobicContact CG1-CB 4.16Å; V43-V267 HydrophobicContact CG1-CG1 3.48Å; V43-V267 VanDerWaalsContact CG1-CG1 3.48Å; V43-V267 WeakPolarHBondContact O-CG1 3.04Å
44	F	72.1	Confident	61.3	Low	18 Å²	18	85.9 Å²	85.9	8%	0.079	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-61.9	176.2	-64.4	-51.4	0	0	0	111.1	G42 V54 S56 L59 A212 N266 V267	G42-F44 PolarHBondContact O-N 2.88Å; F44-V54 PolarHBondContact N-O 2.89Å; F44-S56 VanDerWaalsContact CZ-CA 3.46Å; F44-L59 HydrophobicContact CD2-CD1 4.18Å; F44-L59 HydrophobicContact CE2-CD1 4.18Å; F44-A212 CarbonylContact C-O 3.49Å; F44-A212 WeakPolarHBondContact CA-O 2.94Å; F44-N266 CarbonylContact O-C 3.55Å; F44-V267 PolarHBondContact O-N 2.99Å
45	F	76.7	Confident	63.3	Low	5 Å²	5	79.7 Å²	79.7	2%	0.022	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	167.9	-176.7	63.3	-89.8	0	0	0	110.2	V54 M218 H221 F222	F45-V54 HydrophobicContact CD1-CB 4.41Å; F45-V54 HydrophobicContact CD2-CB 4.37Å; F45-V54 HydrophobicContact CD2-CG2 4.12Å; F45-V54 HydrophobicContact CE1-CB 4.04Å; F45-V54 HydrophobicContact CE1-CG1 3.93Å; F45-V54 HydrophobicContact CE1-CG2 4.45Å; F45-V54 HydrophobicContact CE2-CB 4.01Å; F45-V54 HydrophobicContact CE2-CG1 4.46Å; F45-V54 HydrophobicContact CE2-CG2 3.56Å; F45-V54 HydrophobicContact CZ-CB 3.81Å; F45-V54 HydrophobicContact CZ-CG1 3.79Å; F45-V54 HydrophobicContact CZ-CG2 3.73Å; F45-V54 PolarHBondContact O-N 2.81Å; F45-M218 HydrophobicContact CB-CE 3.98Å; F45-M218 HydrophobicContact CD1-CB 4.23Å; F45-M218 HydrophobicContact CD1-CE 4.28Å; F45-M218 HydrophobicContact CD2-CE 3.33Å; F45-M218 HydrophobicContact CE1-CB 3.92Å; F45-M218 HydrophobicContact CE2-CE 3.85Å; F45-M218 HydrophobicContact CE2-CG 4.23Å; F45-M218 HydrophobicContact CG-CE 3.6Å; F45-M218 HydrophobicContact CZ-CB 4.07Å; F45-M218 HydrophobicContact CZ-CG 4.21Å; F45-H221 AromaticContact CE2-CD2 3.96Å; F45-H221 HydrophobicContact CZ-CB 3.76Å; F45-H221 AromaticContact CZ-CD2 3.79Å; F45-H221 AromaticContact CZ-CG 3.81Å; F45-F222 HydrophobicContact CE2-CE2 4.48Å
46	I	81.9	Confident	64.9	Low	65 Å²	65	69.7 Å²	69.7	33%	0.333	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	123.6	172.4	-59.3	174	0	0	0	107.5	P48 N51 D52	I46-P48 VanDerWaalsContact O-CD 3.25Å; I46-P48 WeakPolarHBondContact O-CD 3.4Å; I46-P48 VanDerWaalsContact O-N 3.14Å; I46-N51 WeakPolarHBondContact CG2-OD1 3.3Å; I46-D52 CarbonylContact C-O 3.59Å; I46-D52 WeakPolarHBondContact CA-O 3.39Å
47	D	84.5	Confident	66.3	Low	4 Å²	4	66.3 Å²	66.3	2%	0.021	37%	0.366	C	S	.	.			trans	-62.1	113.6	171.6	-175.6	-40.9	0	0	0	107.9	T49 T50 N51 D52 V54 H221 R227	D47-T49 PolarHBondContact O-N 3.39Å; D47-T49 PolarHBondContact OD1-N 3.48Å; D47-T49 PolarHBondContact OD1-OG1 3.11Å; D47-T50 PolarHBondContact O-N 3.49Å; D47-N51 WeakPolarHBondContact O-CA 3.44Å; D47-N51 PolarHBondContact O-N 3.09Å; D47-D52 PolarHBondContact N-O 3.13Å; D47-V54 HydrophobicContact CB-CG2 4.21Å; D47-H221 IonicContact OD2-CD2 3.35Å; D47-H221 IonicContact OD2-NE2 2.99Å; D47-H221 PolarHBondContact OD2-NE2 2.87Å; D47-R227 VanDerWaalsContact CG-NH2 3.28Å; D47-R227 IonicContact OD1-CZ 3.15Å; D47-R227 IonicContact OD1-NH2 3.73Å; D47-R227 PolarHBondContact OD1-NH2 3.1Å; D47-R227 IonicContact OD2-NH2 3.97Å; D47-R227 PolarHBondContact OD2-NH2 2.83Å
48	P	82.7	Confident	67.4	Low	53 Å²	53	66.8 Å²	66.8	34%	0.344	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-6	-173.1	29.2	-41.9	0	0	0	114.8	I46 F222 P230 T233	I46-P48 VanDerWaalsContact O-CD 3.25Å; I46-P48 WeakPolarHBondContact O-CD 3.4Å; I46-P48 VanDerWaalsContact O-N 3.14Å; P48-F222 HydrophobicContact CG-CE2 4.49Å; P48-F222 HydrophobicContact CG-CZ 3.76Å; P48-P230 HydrophobicContact CG-CG 4.45Å; P48-T233 HydrophobicContact CB-CG2 4.23Å; P48-T233 VanDerWaalsContact CB-OG1 3.26Å; P48-T233 WeakPolarHBondContact CB-OG1 3.28Å; P48-T233 HydrophobicContact CG-CG2 3.88Å; P48-T233 WeakPolarHBondContact CG-OG1 3.25Å
49	T	83.5	Confident	68.5	Low	64 Å²	64	62 Å²	62	39%	0.393	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-27.6	-175.5	66.1	0	0	0	0	114.6	D47 R227 P230	D47-T49 PolarHBondContact O-N 3.39Å; D47-T49 PolarHBondContact OD1-N 3.48Å; D47-T49 PolarHBondContact OD1-OG1 3.11Å; T49-R227 PolarHBondContact OG1-NH1 3.47Å; T49-R227 PolarHBondContact OG1-NH2 3.44Å; T49-P230 HydrophobicContact CG2-CG 3.39Å
50	T	88.2	Confident	69	Low	70 Å²	70	62.7 Å²	62.7	43%	0.429	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-14.9	172.1	66.8	0	0	0	0	111	D47 D52	D47-T50 PolarHBondContact O-N 3.49Å; T50-D52 WeakPolarHBondContact CB-OD2 3.22Å; T50-D52 PolarHBondContact O-N 2.78Å; T50-D52 WeakPolarHBondContact OG1-CB 3.48Å; T50-D52 PolarHBondContact OG1-N 2.73Å; T50-D52 PolarHBondContact OG1-OD2 3.19Å
51	N	83.4	Confident	69.4	Low	126 Å²	126	63.5 Å²	63.5	67%	0.674	33%	0.334	S	S	*	.			trans	61.2	18.1	-171.6	-153.6	48.9	0	0	0	113	I46 D47	I46-N51 WeakPolarHBondContact CG2-OD1 3.3Å; D47-N51 WeakPolarHBondContact O-CA 3.44Å; D47-N51 PolarHBondContact O-N 3.09Å
52	D	84.1	Confident	69	Low	96 Å²	96	61.1 Å²	61.1	51%	0.513	34%	0.338	S	S	.	.			trans	-80.1	143.2	177.9	-64	-40.9	0	0	0	111.2	I46 D47 T50 V54	I46-D52 CarbonylContact C-O 3.59Å; I46-D52 WeakPolarHBondContact CA-O 3.39Å; D47-D52 PolarHBondContact N-O 3.13Å; T50-D52 WeakPolarHBondContact CB-OD2 3.22Å; T50-D52 PolarHBondContact O-N 2.78Å; T50-D52 WeakPolarHBondContact OG1-CB 3.48Å; T50-D52 PolarHBondContact OG1-N 2.73Å; T50-D52 PolarHBondContact OG1-OD2 3.19Å; D52-V54 PolarHBondContact O-N 3.25Å
53	T	81.8	Confident	68.1	Low	70 Å²	70	65.6 Å²	65.6	43%	0.429	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	112.1	172.4	-64	0	0	0	0	109.4	V43	V43-T53 HydrophobicContact CB-CG2 3.74Å; V43-T53 HydrophobicContact CG1-CG2 3.26Å; V43-T53 HydrophobicContact CG2-CG2 3.2Å
54	V	79.4	Confident	66.8	Low	1 Å²	1	68.4 Å²	68.4	1%	0.006	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	117.5	178.5	-176.5	0	0	0	0	109.7	F44 F45 D47 D52 L59	F44-V54 PolarHBondContact N-O 2.89Å; F45-V54 HydrophobicContact CD1-CB 4.41Å; F45-V54 HydrophobicContact CD2-CB 4.37Å; F45-V54 HydrophobicContact CD2-CG2 4.12Å; F45-V54 HydrophobicContact CE1-CB 4.04Å; F45-V54 HydrophobicContact CE1-CG1 3.93Å; F45-V54 HydrophobicContact CE1-CG2 4.45Å; F45-V54 HydrophobicContact CE2-CB 4.01Å; F45-V54 HydrophobicContact CE2-CG1 4.46Å; F45-V54 HydrophobicContact CE2-CG2 3.56Å; F45-V54 HydrophobicContact CZ-CB 3.81Å; F45-V54 HydrophobicContact CZ-CG1 3.79Å; F45-V54 HydrophobicContact CZ-CG2 3.73Å; F45-V54 PolarHBondContact O-N 2.81Å; D47-V54 HydrophobicContact CB-CG2 4.21Å; D52-V54 PolarHBondContact O-N 3.25Å; V54-L59 HydrophobicContact CG1-CD1 3.65Å
55	N	75	Confident	64.7	Low	64 Å²	64	73.9 Å²	73.9	34%	0.342	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	158	-178.3	-72.8	-33.2	0	0	0	112.7	V43 H57 E58	V43-N55 WeakPolarHBondContact CA-OD1 3.28Å; V43-N55 WeakPolarHBondContact CG2-OD1 3.35Å; V43-N55 PolarHBondContact N-OD1 3.18Å; N55-H57 PolarHBondContact O-N 3.03Å; N55-H57 VanDerWaalsContact O-N 3.14Å; N55-E58 PolarHBondContact O-N 3.11Å
56	S	61.7	Low	62.3	Low	9 Å²	9	82.2 Å²	82.2	6%	0.063	44%	0.435	C	S	.	.	H	α-helix	trans	-46.5	-40.6	173.5	62.1	0	0	0	0	115	Y41 F44 E58 L60	Y41-S56 WeakPolarHBondContact O-CB 3.47Å; Y41-S56 PolarHBondContact O-OG 3.23Å; F44-S56 VanDerWaalsContact CZ-CA 3.46Å; S56-E58 PolarHBondContact O-N 3.26Å; S56-L60 PolarHBondContact O-N 3.1Å
57	H	57.1	Low	59.6	Low	64 Å²	64	88 Å²	88	30%	0.296	46%	0.46	S	S	.	.	H	α-helix	trans	-68.4	-31.3	-176.9	-87.4	-68.7	0	0	0	115.9	D39 N55 R61	D39-H57 VanDerWaalsContact CB-NE2 3.3Å; D39-H57 WeakPolarHBondContact CB-NE2 3.33Å; D39-H57 IonicContact OD1-CE1 3.05Å; D39-H57 PolarHBondContact OD1-CE1 2.92Å; D39-H57 IonicContact OD1-NE2 3.44Å; D39-H57 PolarHBondContact OD1-NE2 3.37Å; D39-H57 IonicContact OD2-CE1 2.9Å; D39-H57 PolarHBondContact OD2-CE1 3.16Å; D39-H57 IonicContact OD2-NE2 3.95Å; D39-H57 PolarHBondContact OD2-NE2 3.01Å; N55-H57 PolarHBondContact O-N 3.03Å; N55-H57 VanDerWaalsContact O-N 3.14Å; H57-R61 WeakPolarHBondContact O-CB 3.48Å; H57-R61 VanDerWaalsContact O-CG 3.29Å; H57-R61 WeakPolarHBondContact O-CG 3.05Å; H57-R61 PolarHBondContact O-N 3.44Å
58	E	57	Low	56.7	Low	110 Å²	110	94.8 Å²	94.8	51%	0.514	50%	0.502	S	S	.	.	H	α-helix	trans	-76	-27.6	-174.8	-77.6	-165.6	137.7	0	0	113.2	N55 S56 K224	N55-E58 PolarHBondContact O-N 3.11Å; S56-E58 PolarHBondContact O-N 3.26Å; E58-K224 PolarHBondContact O-NZ 3.28Å
59	L	51.6	Low	54	Low	20 Å²	20	98.4 Å²	98.4	11%	0.105	52%	0.524	C	S	.	.	H	α-helix	trans	-77.7	-47.3	175.9	-86.8	128.1	0	0	0	111	F44 V54 R61 G62 K220 H221	F44-L59 HydrophobicContact CD2-CD1 4.18Å; F44-L59 HydrophobicContact CE2-CD1 4.18Å; V54-L59 HydrophobicContact CG1-CD1 3.65Å; L59-R61 PolarHBondContact O-N 3.08Å; L59-G62 PolarHBondContact O-N 3.49Å; L59-K220 HydrophobicContact CD2-CB 4.08Å; L59-H221 HydrophobicContact CD1-CB 4.44Å; L59-H221 HydrophobicContact CD2-CB 4.24Å
60	L	47.2	Very low	51.2	Low	102 Å²	102	103.4 Å²	103.4	53%	0.534	55%	0.548	S	S	.	.	H	α-helix	trans	-68.5	-31.9	-176.9	-67.8	171.1	0	0	0	113.7	S56 G62 E63	S56-L60 PolarHBondContact O-N 3.1Å; L60-G62 PolarHBondContact O-N 3.1Å; L60-E63 PolarHBondContact O-N 3.08Å; L60-E63 VanDerWaalsContact O-N 3.13Å
61	R	47.1	Very low	48.2	Very low	206 Å²	206	104.8 Å²	104.8	78%	0.777	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-5.7	176.7	-80	-176.5	-177.5	-150.5	2.3	114.6	H57 L59	H57-R61 WeakPolarHBondContact O-CB 3.48Å; H57-R61 VanDerWaalsContact O-CG 3.29Å; H57-R61 WeakPolarHBondContact O-CG 3.05Å; H57-R61 PolarHBondContact O-N 3.44Å; L59-R61 PolarHBondContact O-N 3.08Å
62	G	39.3	Very low	45.4	Very low	43 Å²	43	106.3 Å²	106.3	44%	0.443	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.2	-8.2	175.6	0	0	0	0	0	115.8	L59 L60	L59-G62 PolarHBondContact O-N 3.49Å; L60-G62 PolarHBondContact O-N 3.1Å
63	E	38.5	Very low	42.4	Very low	141 Å²	141	113.6 Å²	113.6	66%	0.659	59%	0.591	S	S	*	*	S	Bend	trans	-99.5	2.7	-168.9	-68.6	-173.5	163.2	0	0	114.3	L60	L60-E63 PolarHBondContact O-N 3.08Å; L60-E63 VanDerWaalsContact O-N 3.13Å
64	S	29	Very low	39.8	Very low	105 Å²	105	116.3 Å²	116.3	73%	0.734	60%	0.602	S	S	*	*	S	Bend	trans	-92.9	10.9	-177.8	87.6	0	0	0	0	115.8
65	I	28.7	Very low	37.3	Very low	133 Å²	133	121.9 Å²	121.9	68%	0.682	64%	0.636	S	S	*	*	S	Bend	trans	-143.6	114.4	-179	-40	175.3	0	0	0	108.5
66	H	26.3	Very low	35	Very low	180 Å²	180	126.4 Å²	126.4	83%	0.833	66%	0.661	S	S	*	*	S	Bend	trans	88.8	66.2	-176.5	-60.7	-71.5	0	0	0	117.4
67	E	24.8	Very low	33.3	Very low	187 Å²	187	134.2 Å²	134.2	87%	0.874	70%	0.696	S	S	*	*	S	Bend	trans	-172.1	81.4	142.5	-107.4	168.1	-161.9	0	0	108.6
68	T	25.1	Very low	32	Very low	147 Å²	147	137.5 Å²	137.5	90%	0.902	72%	0.72	S	S	*	*			trans	177.3	64.3	157.6	28.3	0	0	0	0	109
69	T	24.9	Very low	30.6	Very low	129 Å²	129	137.3 Å²	137.3	79%	0.791	73%	0.731	S	S	*	*			trans	-128.9	90.4	155.8	50.1	0	0	0	0	105.4
70	D	24.6	Very low	29.4	Very low	169 Å²	169	144.8 Å²	144.8	90%	0.904	77%	0.77	S	S	*	*	S	Bend	trans	158.3	67.1	154.2	-78.6	-18	0	0	0	110.2
71	A	25	Very low	28.4	Very low	98 Å²	98	151.2 Å²	151.2	81%	0.81	79%	0.787	S	S	*	*	S	Bend	trans	-159.4	126.1	152.6	0	0	0	0	0	110.4
72	M	25.2	Very low	27.3	Very low	159 Å²	159	150 Å²	150	78%	0.783	79%	0.79	S	S	*	*			trans	71.2	83.4	169.2	-74.6	166.7	79.5	0	0	117.7	I74	M72-I74 HydrophobicContact CE-CD1 3.43Å; M72-I74 VanDerWaalsContact CE-CD1 3.43Å; M72-I74 HydrophobicContact CE-CG1 4.13Å; M72-I74 PolarHBondContact O-N 3.28Å; M72-I74 VanDerWaalsContact O-N 3.16Å
73	R	21.8	Very low	26.8	Very low	248 Å²	248	156.9 Å²	156.9	94%	0.936	81%	0.811	S	S	*	*			trans	-56	103.3	131.8	-83.5	179.1	174.1	169.7	-1.7	108.6
74	I	27.3	Very low	26	Very low	127 Å²	127	154.1 Å²	154.1	65%	0.651	81%	0.812	S	S	*	*			trans	-125.2	105.3	145.3	-63.4	-174.3	0	0	0	105.6	M72	M72-I74 HydrophobicContact CE-CD1 3.43Å; M72-I74 VanDerWaalsContact CE-CD1 3.43Å; M72-I74 HydrophobicContact CE-CG1 4.13Å; M72-I74 PolarHBondContact O-N 3.28Å; M72-I74 VanDerWaalsContact O-N 3.16Å
75	T	25.1	Very low	25.8	Very low	118 Å²	118	156.3 Å²	156.3	72%	0.724	82%	0.815	S	S	*	*			trans	-65.9	120.1	161.7	44.3	0	0	0	0	108
76	D	27.7	Very low	25.7	Very low	160 Å²	160	158 Å²	158	86%	0.856	82%	0.824	S	S	*	*			trans	-156.8	120.5	133.1	-101.9	-24.5	0	0	0	110.6
77	H	26.7	Very low	25.5	Very low	173 Å²	173	156 Å²	156	80%	0.801	83%	0.829	S	S	*	*			trans	-75.5	126.7	168.2	-77.4	-87.4	0	0	0	108.5
78	T	28.9	Very low	25.6	Very low	133 Å²	133	152 Å²	152	82%	0.816	82%	0.821	S	S	*	*				171.4	133.5	117.1	32.3	0	0	0	0	112.1
79	S	27.3	Very low	25.6	Very low	105 Å²	105	152.4 Å²	152.4	73%	0.734	82%	0.816	S	S	*	*			trans	57.1	101.2	155.7	61.8	0	0	0	0	119.9
80	L	27.3	Very low	25.6	Very low	178 Å²	178	150.4 Å²	150.4	93%	0.932	81%	0.813	S	S	*	*				-158.7	114.6	112.5	-104.1	147.6	0	0	0	110
81	R	24.8	Very low	25.6	Very low	236 Å²	236	147.4 Å²	147.4	89%	0.891	81%	0.805	S	S	*	*			trans	-72	149.8	167.9	-74.2	173.9	168.9	177.2	-4.3	109
82	Q	25.5	Very low	25.7	Very low	180 Å²	180	150.4 Å²	150.4	84%	0.841	81%	0.806	S	S	*	*			trans	113.7	84.6	163.2	-66.2	178.6	-16.1	0	0	114
83	H	27.5	Very low	25.9	Very low	189 Å²	189	148.7 Å²	148.7	88%	0.875	81%	0.805	S	S	*	*				-177.8	92.8	116.7	-101.5	-74.1	0	0	0	107.7
84	A	22.4	Very low	26	Very low	82 Å²	82	144.7 Å²	144.7	68%	0.678	80%	0.801	S	S	*	*			trans	-89.2	162.3	154.4	0	0	0	0	0	107.5
85	D	24.9	Very low	26.1	Very low	151 Å²	151	144.6 Å²	144.6	81%	0.807	81%	0.809	S	S	*	*			trans	92.5	95.7	-179.1	-52.3	-24.9	0	0	0	114.6
86	I	26.4	Very low	26	Very low	170 Å²	170	143.5 Å²	143.5	87%	0.872	81%	0.812	S	S	*	*				-170.5	94.2	113.3	-80.6	147.2	0	0	0	107
87	C	22.1	Very low	26	Very low	137 Å²	137	143.2 Å²	143.2	93%	0.926	81%	0.805	S	S	*	*			trans	-141.5	92.3	154	-105	0	0	0	0	105.7
88	S	26.4	Very low	26	Very low	103 Å²	103	143.6 Å²	143.6	72%	0.72	81%	0.812	S	S	*	*			trans	-152.4	107.8	165.7	-138.1	0	0	0	0	109.9
89	I	25.1	Very low	25.9	Very low	155 Å²	155	144.4 Å²	144.4	80%	0.795	81%	0.807	S	S	*	*			trans	32.7	108.2	133.6	-48.4	173.1	0	0	0	115.7
90	A	26	Very low	25.7	Very low	87 Å²	87	150.8 Å²	150.8	72%	0.719	82%	0.816	S	S	*	*			trans	-137.3	100.3	150.2	0	0	0	0	0	109.4	I92	A90-I92 PolarHBondContact O-N 3.29Å
91	S	23.4	Very low	25.8	Very low	107 Å²	107	150.6 Å²	150.6	75%	0.748	82%	0.815	S	S	*	*			trans	-59.9	117.4	157.7	-58.1	0	0	0	0	108.4
92	I	28.5	Very low	25.8	Very low	160 Å²	160	147.5 Å²	147.5	82%	0.821	81%	0.811	S	S	*	*			trans	-102.7	102.9	168	-62.2	177.8	0	0	0	107.6	A90	A90-I92 PolarHBondContact O-N 3.29Å
93	T	27.7	Very low	25.9	Very low	124 Å²	124	145 Å²	145	76%	0.761	81%	0.81	S	S	*	*			trans	-67.9	131	167.7	-22.7	0	0	0	0	109.2
94	L	24	Very low	25.8	Very low	164 Å²	164	141.8 Å²	141.8	86%	0.859	80%	0.804	S	S	*	*			trans	-60.7	134.4	170.2	-76.7	149.9	0	0	0	110.9
95	P	29.5	Very low	26.1	Very low	124 Å²	124	146.4 Å²	146.4	81%	0.805	81%	0.811	S	S	*	*			trans	-83	113.9	159.1	0.8	17.1	0	0	0	109.4	H97	P95-H97 PolarHBondContact O-N 3.41Å
96	A	24.7	Very low	26.2	Very low	96 Å²	96	148.1 Å²	148.1	79%	0.793	82%	0.815	S	S	*	*			trans	-72.9	101.3	160.2	0	0	0	0	0	108.9
97	H	26.6	Very low	26.1	Very low	154 Å²	154	146.3 Å²	146.3	71%	0.713	82%	0.816	S	S	*	*			trans	-174.2	86.4	150.7	-113.9	-72.9	0	0	0	110	P95	P95-H97 PolarHBondContact O-N 3.41Å
98	L	27.1	Very low	26.4	Very low	180 Å²	180	149.6 Å²	149.6	94%	0.942	81%	0.808	S	S	*	*			trans	-131.9	97.9	150.5	-93.6	167.5	0	0	0	106.8
99	Q	27.7	Very low	26.5	Very low	151 Å²	151	149.6 Å²	149.6	71%	0.706	81%	0.806	S	S	*	*			trans	-60.6	140.9	170	-80.7	165.8	-36.5	0	0	109.7	L101	Q99-L101 PolarHBondContact O-N 3.46Å
100	Y	23.1	Very low	26.7	Very low	238 Å²	238	146.9 Å²	146.9	93%	0.933	80%	0.801	S	S	*	*			trans	-27.6	116.6	160.3	-76.7	-102.7	0	0	0	113
101	L	27.8	Very low	27	Very low	175 Å²	175	149.6 Å²	149.6	92%	0.916	80%	0.797	S	S	*	*			trans	-120.7	120.7	156.4	-86.6	163.6	0	0	0	107.7	Q99	Q99-L101 PolarHBondContact O-N 3.46Å
102	E	26.5	Very low	27.8	Very low	171 Å²	171	152.1 Å²	152.1	80%	0.799	80%	0.796	S	S	*	*			trans	-64.8	156.4	-177.8	-70.5	-149.7	150.8	0	0	113.5	T104	E102-T104 PolarHBondContact O-N 2.91Å
103	P	27	Very low	28.3	Very low	126 Å²	126	152 Å²	152	82%	0.818	79%	0.792	S	S	*	*			trans	-83.5	105.7	-175.7	33	-29.9	0	0	0	110.4
104	T	25.7	Very low	28.8	Very low	122 Å²	122	154.2 Å²	154.2	75%	0.748	79%	0.793	S	S	*	*			trans	-136.9	139.1	161.6	54	0	0	0	0	111.7	E102	E102-T104 PolarHBondContact O-N 2.91Å
105	Q	28.4	Very low	29.6	Very low	179 Å²	179	148.5 Å²	148.5	84%	0.836	77%	0.766	S	S	*	*	S	Bend	trans	94.5	84.2	170.8	-53	-168	-7.1	0	0	117.6
106	Q	27.1	Very low	30.7	Very low	188 Å²	188	143.6 Å²	143.6	88%	0.879	73%	0.734	S	S	*	*			trans	48	82.7	135.3	-71.1	175	-11.8	0	0	117.1	R108	Q106-R108 PolarHBondContact O-N 3.11Å; Q106-R108 VanDerWaalsContact O-N 3.12Å
107	C	24.8	Very low	32.2	Very low	132 Å²	132	143.4 Å²	143.4	89%	0.892	72%	0.724	S	S	*	*			trans	-61.9	108.4	150.8	-75.5	0	0	0	0	109
108	R	27.3	Very low	33.3	Very low	205 Å²	205	140.9 Å²	140.9	77%	0.774	72%	0.715	S	S	*	*			trans	-60.1	128.6	164.4	-75.8	-174.2	177.6	-166	0.3	108.9	Q106	Q106-R108 PolarHBondContact O-N 3.11Å; Q106-R108 VanDerWaalsContact O-N 3.12Å
109	P	28.3	Very low	34.8	Very low	104 Å²	104	133.1 Å²	133.1	68%	0.675	67%	0.674	S	S	*	*			trans	-78.7	140	174.8	32	-30	0	0	0	110.2
110	S	30.7	Very low	36.7	Very low	97 Å²	97	129 Å²	129	68%	0.678	66%	0.657	S	S	*	*			trans	51.2	80.1	151	54.4	0	0	0	0	118.7
111	F	32.2	Very low	39	Very low	144 Å²	144	123.7 Å²	123.7	63%	0.632	64%	0.639	S	S	*	*			trans	-99.7	-3.2	164.3	-98	-88.3	0	0	0	114.7
112	H	40	Very low	41.4	Very low	161 Å²	161	120 Å²	120	75%	0.745	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-21.7	-170	-76.2	-63.7	0	0	0	115.8
113	H	38.3	Very low	44.3	Very low	157 Å²	157	112.1 Å²	112.1	73%	0.727	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-25.4	-175.2	-73.7	-66.8	0	0	0	114.6
114	H	37.8	Very low	47.2	Very low	171 Å²	171	111 Å²	111	79%	0.792	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-14.6	-176.5	-72	-62.8	0	0	0	115.1
115	C	42.3	Very low	50.4	Low	43 Å²	43	105.7 Å²	105.7	29%	0.291	53%	0.528	S	S	.	.	S	Bend	trans	-87.2	-15.6	179	-108.6	0	0	0	0	114.2	P117 L118 Q119	C115-P117 VanDerWaalsContact C-CD 3.5Å; C115-L118 PolarHBondContact O-N 2.54Å; C115-Q119 WeakPolarHBondContact O-CG 3.42Å; C115-Q119 PolarHBondContact O-N 2.84Å; C115-Q119 VanDerWaalsContact O-N 3.11Å
116	L	52.5	Low	53.4	Low	22 Å²	22	97.9 Å²	97.9	12%	0.115	49%	0.492	C	S	.	.	H	α-helix	trans	-56.5	-42.8	-174.8	-108.1	145.8	0	0	0	115	L118 Q119 L120 R192 L194	L116-L118 PolarHBondContact O-N 2.84Å; L116-Q119 WeakPolarHBondContact O-CB 3.35Å; L116-Q119 PolarHBondContact O-N 3.41Å; L116-Q119 VanDerWaalsContact O-N 3.15Å; L116-L120 WeakPolarHBondContact O-CG 3.16Å; L116-L120 PolarHBondContact O-N 3.39Å; L116-R192 VanDerWaalsContact CD2-NH2 3.31Å; L116-L194 HydrophobicContact CD2-CD2 4.23Å
117	P	54.6	Low	56.5	Low	91 Å²	91	96.1 Å²	96.1	59%	0.591	48%	0.477	S	S	*	.	H	α-helix	trans	-61.1	-32.4	176.8	-22	32.8	0	0	0	113.3	C115	C115-P117 VanDerWaalsContact C-CD 3.5Å
118	L	50.3	Low	59.7	Low	102 Å²	102	91.1 Å²	91.1	53%	0.534	44%	0.441	S	S	.	.	H	α-helix	trans	-76.1	-32.9	177.3	-68.3	169.9	0	0	0	111.9	C115 L116 K121	C115-L118 PolarHBondContact O-N 2.54Å; L116-L118 PolarHBondContact O-N 2.84Å; L118-K121 PolarHBondContact O-N 3.12Å
119	Q	59.3	Low	62.8	Low	16 Å²	16	82 Å²	82	8%	0.075	41%	0.407	C	S	.	.	H	α-helix	trans	-66.5	-34.8	177.8	-69.5	-178.7	-45.3	0	0	112.7	C115 L116 K121 Y122 P151	C115-Q119 WeakPolarHBondContact O-CG 3.42Å; C115-Q119 PolarHBondContact O-N 2.84Å; C115-Q119 VanDerWaalsContact O-N 3.11Å; L116-Q119 WeakPolarHBondContact O-CB 3.35Å; L116-Q119 PolarHBondContact O-N 3.41Å; L116-Q119 VanDerWaalsContact O-N 3.15Å; Q119-K121 PolarHBondContact O-N 3.33Å; Q119-K121 VanDerWaalsContact O-N 3.11Å; Q119-Y122 WeakPolarHBondContact O-CD2 3.46Å; Q119-Y122 PolarHBondContact O-N 3.45Å; Q119-Y122 VanDerWaalsContact O-N 3.1Å; Q119-P151 HydrophobicContact CG-CG 3.67Å; Q119-P151 PolarHBondContact NE2-O 3.19Å; Q119-P151 VanDerWaalsContact NE2-O 3.13Å
120	L	67.3	Low	65.9	Low	66 Å²	66	80 Å²	80	35%	0.346	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-61.8	-21.8	-178.9	-66.2	179.5	0	0	0	113.4	L116 Y122 F123 L194	L116-L120 WeakPolarHBondContact O-CG 3.16Å; L116-L120 PolarHBondContact O-N 3.39Å; L120-Y122 PolarHBondContact O-N 3.08Å; L120-Y122 VanDerWaalsContact O-N 3.08Å; L120-F123 HydrophobicContact CD2-CD2 3.6Å; L120-F123 HydrophobicContact CD2-CE2 3.8Å; L120-F123 HydrophobicContact CD2-CG 4.45Å; L120-F123 PolarHBondContact O-N 2.95Å; L120-L194 HydrophobicContact CD2-CB 4.04Å; L120-L194 WeakPolarHBondContact CD2-O 3.36Å
121	K	72	Confident	68.9	Low	126 Å²	126	78.3 Å²	78.3	55%	0.548	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-60.7	-15.7	174.9	-71.1	-172.2	177.1	-176.6	0	114	L118 Q119 H124	L118-K121 PolarHBondContact O-N 3.12Å; Q119-K121 PolarHBondContact O-N 3.33Å; Q119-K121 VanDerWaalsContact O-N 3.11Å; K121-H124 PolarHBondContact O-CD2 3.31Å
122	Y	78	Confident	71.8	Confident	96 Å²	96	75.1 Å²	75.1	38%	0.376	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-101.1	-3.3	179.1	-58.3	-84.7	0	0	0	112.5	Q119 L120 H124 N128 Q150 P151	Q119-Y122 WeakPolarHBondContact O-CD2 3.46Å; Q119-Y122 PolarHBondContact O-N 3.45Å; Q119-Y122 VanDerWaalsContact O-N 3.1Å; L120-Y122 PolarHBondContact O-N 3.08Å; L120-Y122 VanDerWaalsContact O-N 3.08Å; Y122-H124 VanDerWaalsContact C-N 3.31Å; Y122-H124 PolarHBondContact O-N 3.27Å; Y122-H124 VanDerWaalsContact O-N 3.15Å; Y122-N128 WeakPolarHBondContact O-CB 3.15Å; Y122-N128 PolarHBondContact O-ND2 3.26Å; Y122-Q150 WeakPolarHBondContact CB-O 2.9Å; Y122-Q150 HydrophobicContact CD1-CB 4.24Å; Y122-Q150 HydrophobicContact CE1-CB 4.3Å; Y122-P151 HydrophobicContact CE2-CG 4.32Å
123	F	86.7	Confident	74.3	Confident	7 Å²	7	69 Å²	69	3%	0.031	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	53.8	-172.1	-64.4	5.4	0	0	0	112.1	L120 F129 C148 L154 L194 A195 F197 V206	L120-F123 HydrophobicContact CD2-CD2 3.6Å; L120-F123 HydrophobicContact CD2-CE2 3.8Å; L120-F123 HydrophobicContact CD2-CG 4.45Å; L120-F123 PolarHBondContact O-N 2.95Å; F123-F129 HydrophobicContact CB-CZ 4.11Å; F123-F129 HydrophobicContact CD1-CE1 4.03Å; F123-F129 AromaticContact CD1-CZ 3.67Å; F123-F129 HydrophobicContact CD1-CZ 3.67Å; F123-F129 HydrophobicContact CE1-CE1 4.21Å; F123-F129 HydrophobicContact CE1-CZ 4.32Å; F123-F129 HydrophobicContact CG-CE1 4.49Å; F123-F129 AromaticContact CG-CZ 3.89Å; F123-F129 HydrophobicContact CG-CZ 3.89Å; F123-C148 HydrophobicContact CE1-CB 4.09Å; F123-C148 WeakPolarHBondContact CE1-SG 3.48Å; F123-L154 HydrophobicContact CZ-CD2 4.3Å; F123-L194 HydrophobicContact CD2-CB 3.85Å; F123-L194 HydrophobicContact CE2-CB 3.73Å; F123-L194 HydrophobicContact CE2-CD1 3.89Å; F123-L194 HydrophobicContact CE2-CG 4.35Å; F123-A195 HydrophobicContact CB-CB 3.43Å; F123-A195 VanDerWaalsContact CB-CB 3.43Å; F123-A195 HydrophobicContact CD2-CB 4Å; F123-A195 HydrophobicContact CG-CB 4.26Å; F123-F197 VanDerWaalsContact O-CD1 3.29Å; F123-F197 WeakPolarHBondContact O-CD1 3.45Å; F123-V206 HydrophobicContact CB-CG2 4.37Å; F123-V206 HydrophobicContact CD2-CB 4.28Å; F123-V206 HydrophobicContact CD2-CG1 3.81Å; F123-V206 HydrophobicContact CE2-CG1 4.03Å; F123-V206 HydrophobicContact CG-CG1 4.39Å
124	H	88	Confident	76.7	Confident	101 Å²	101	65.5 Å²	65.5	47%	0.468	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133	3.7	-174.2	67.9	79.9	0	0	0	114.4	K121 Y122	K121-H124 PolarHBondContact O-CD2 3.31Å; Y122-H124 VanDerWaalsContact C-N 3.31Å; Y122-H124 PolarHBondContact O-N 3.27Å; Y122-H124 VanDerWaalsContact O-N 3.15Å
125	S	91.7	Very high	79.1	Confident	11 Å²	11	61.4 Å²	61.4	8%	0.077	31%	0.308	C	S	.	.			trans	-160.2	143.8	175.9	173.3	0	0	0	0	110.1	R127 N128 F129 E199	S125-R127 PolarHBondContact O-N 3.15Å; S125-R127 WeakPolarHBondContact OG-CG 3.33Å; S125-R127 PolarHBondContact OG-N 3.27Å; S125-N128 WeakPolarHBondContact O-CB 3.48Å; S125-N128 PolarHBondContact O-N 3.49Å; S125-N128 VanDerWaalsContact O-N 3.15Å; S125-F129 WeakPolarHBondContact O-CD2 3.5Å; S125-F129 WeakPolarHBondContact O-CE2 3.35Å; S125-E199 WeakPolarHBondContact CB-OE1 3.16Å; S125-E199 PolarHBondContact OG-OE1 3.22Å
126	L	91.8	Very high	80.8	Confident	16 Å²	16	60.6 Å²	60.6	8%	0.084	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-59.7	-27.5	177.5	-72.6	168.2	0	0	0	112.3	N128 F129 L158 F197 E199 I204	L126-N128 PolarHBondContact O-N 3.1Å; L126-F129 PolarHBondContact O-N 2.94Å; L126-L158 HydrophobicContact CD2-CD1 4.03Å; L126-F197 HydrophobicContact CD2-CZ 4.31Å; L126-F197 HydrophobicContact CG-CE2 4.08Å; L126-F197 HydrophobicContact CG-CZ 4.23Å; L126-E199 WeakPolarHBondContact CA-OE2 3.47Å; L126-E199 WeakPolarHBondContact CB-OE2 3.41Å; L126-E199 WeakPolarHBondContact CD1-OE2 3.43Å; L126-E199 WeakPolarHBondContact CG-OE2 3.4Å; L126-E199 PolarHBondContact N-OE2 3.05Å; L126-I204 HydrophobicContact CD1-CD1 4.45Å; L126-I204 HydrophobicContact CD1-CG1 4.29Å; L126-I204 HydrophobicContact CD2-CG1 4Å; L126-I204 HydrophobicContact CD2-CG2 4.26Å; L126-I204 HydrophobicContact CG-CG1 4.17Å
127	R	91.6	Very high	82	Confident	151 Å²	151	64.8 Å²	64.8	57%	0.57	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-59.6	-20.3	177.7	80.3	-170.3	-176.5	176.6	-3	113.6	Y27 S125 F129 N149	Y27-R127 HydrophobicContact CE2-CB 4.46Å; S125-R127 PolarHBondContact O-N 3.15Å; S125-R127 WeakPolarHBondContact OG-CG 3.33Å; S125-R127 PolarHBondContact OG-N 3.27Å; R127-F129 VanDerWaalsContact C-N 3.25Å; R127-N149 PolarHBondContact O-ND2 3.32Å
128	N	92.1	Very high	82.7	Confident	26 Å²	26	62.2 Å²	62.2	14%	0.139	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-86.7	2.7	178.8	-62.6	-21.2	0	0	0	112.5	Y122 S125 L126 N149	Y122-N128 WeakPolarHBondContact O-CB 3.15Å; Y122-N128 PolarHBondContact O-ND2 3.26Å; S125-N128 WeakPolarHBondContact O-CB 3.48Å; S125-N128 PolarHBondContact O-N 3.49Å; S125-N128 VanDerWaalsContact O-N 3.15Å; L126-N128 PolarHBondContact O-N 3.1Å; N128-N149 VanDerWaalsContact C-ND2 3.34Å; N128-N149 WeakPolarHBondContact O-CB 3.33Å; N128-N149 PolarHBondContact O-N 3.33Å
129	F	93.4	Very high	83.5	Confident	13 Å²	13	63.2 Å²	63.2	6%	0.057	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	141.1	179.3	-57.7	-85.5	0	0	0	110.8	F123 S125 L126 R127 A146 E147 C148 V156 L158 F197 V206	F123-F129 HydrophobicContact CB-CZ 4.11Å; F123-F129 HydrophobicContact CD1-CE1 4.03Å; F123-F129 AromaticContact CD1-CZ 3.67Å; F123-F129 HydrophobicContact CD1-CZ 3.67Å; F123-F129 HydrophobicContact CE1-CE1 4.21Å; F123-F129 HydrophobicContact CE1-CZ 4.32Å; F123-F129 HydrophobicContact CG-CE1 4.49Å; F123-F129 AromaticContact CG-CZ 3.89Å; F123-F129 HydrophobicContact CG-CZ 3.89Å; S125-F129 WeakPolarHBondContact O-CD2 3.5Å; S125-F129 WeakPolarHBondContact O-CE2 3.35Å; L126-F129 PolarHBondContact O-N 2.94Å; R127-F129 VanDerWaalsContact C-N 3.25Å; F129-A146 HydrophobicContact CB-CB 4.22Å; F129-E147 CarbonylContact C-O 3.59Å; F129-E147 VanDerWaalsContact CA-O 3.29Å; F129-E147 WeakPolarHBondContact CA-O 3.4Å; F129-C148 HydrophobicContact CD1-CB 4.05Å; F129-C148 HydrophobicContact CE1-CB 4.01Å; F129-V156 HydrophobicContact CD1-CG2 3.81Å; F129-V156 HydrophobicContact CE1-CG2 3.83Å; F129-L158 HydrophobicContact CB-CD1 4.02Å; F129-L158 HydrophobicContact CD1-CD2 4.23Å; F129-L158 HydrophobicContact CD2-CD1 4.45Å; F129-L158 HydrophobicContact CE1-CD2 4.24Å; F129-L158 HydrophobicContact CG-CD1 4.09Å; F129-L158 HydrophobicContact CG-CD2 4.39Å; F129-L158 HydrophobicContact CZ-CD2 4.39Å; F129-F197 HydrophobicContact CE2-CE1 4.06Å; F129-F197 HydrophobicContact CE2-CZ 4.2Å; F129-V206 HydrophobicContact CE1-CG1 4.1Å; F129-V206 HydrophobicContact CE2-CG2 4.43Å; F129-V206 HydrophobicContact CZ-CG1 4.11Å; F129-V206 HydrophobicContact CZ-CG2 3.93Å
130	T	94.1	Very high	84.1	Confident	64 Å²	64	64.9 Å²	64.9	39%	0.393	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	114.5	166.4	-65.1	0	0	0	0	108.2	L132 A146 E147 N149	T130-L132 HydrophobicContact CG2-CD2 4.24Å; T130-L132 PolarHBondContact O-N 3.26Å; T130-A146 CarbonylContact O-C 3.58Å; T130-A146 VanDerWaalsContact O-CA 3.23Å; T130-A146 WeakPolarHBondContact O-CA 3.29Å; T130-A146 WeakPolarHBondContact O-CB 3.39Å; T130-E147 PolarHBondContact N-O 3.04Å; T130-E147 PolarHBondContact O-N 3.47Å; T130-N149 PolarHBondContact N-OD1 3.15Å; T130-N149 PolarHBondContact OG1-OD1 3.34Å
131	L	92.9	Very high	84.8	Confident	60 Å²	60	62.5 Å²	62.5	31%	0.314	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	129	175.6	-66.7	167.7	0	0	0	109.9	L29 Y144 A146 L158	L29-L131 HydrophobicContact CD2-CD1 3.4Å; L29-L131 VanDerWaalsContact CD2-CD1 3.4Å; L131-Y144 HydrophobicContact CD2-CD1 4.46Å; L131-Y144 HydrophobicContact CD2-CG 4.02Å; L131-A146 HydrophobicContact CD2-CB 4.25Å; L131-L158 HydrophobicContact CD2-CD1 3.85Å
132	L	92.6	Very high	85.6	Confident	78 Å²	78	57.5 Å²	57.5	41%	0.408	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	-52.5	-177.6	-59.7	180	0	0	0	111.3	T130 R145 E147	T130-L132 HydrophobicContact CG2-CD2 4.24Å; T130-L132 PolarHBondContact O-N 3.26Å; L132-R145 HydrophobicContact CB-CB 4.47Å; L132-R145 HydrophobicContact CB-CG 4.3Å; L132-R145 HydrophobicContact CD1-CG 4.13Å; L132-R145 PolarHBondContact N-O 3.24Å; L132-E147 HydrophobicContact CD1-CB 4.24Å
133	S	92.4	Very high	86.2	Confident	31 Å²	31	54.5 Å²	54.5	22%	0.217	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	155.9	-178.9	61.3	0	0	0	0	111.8	Y144 R145	S133-Y144 CarbonylContact O-C 3.37Å; S133-Y144 VanDerWaalsContact O-CA 3.27Å; S133-Y144 WeakPolarHBondContact O-CA 3.25Å; S133-R145 PolarHBondContact N-O 3Å; S133-R145 PolarHBondContact O-N 3.28Å
134	Q	90	Very high	86.5	Confident	85 Å²	85	55 Å²	55	40%	0.397	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	122.3	168.2	-166.4	171.7	27.6	0	0	108.6	V137 S142 Y144	Q134-V137 VanDerWaalsContact CD-CG2 3.5Å; Q134-V137 HydrophobicContact CG-CG2 3.97Å; Q134-S142 PolarHBondContact NE2-OG 3.31Å; Q134-Y144 HydrophobicContact CB-CD1 3.79Å; Q134-Y144 HydrophobicContact CB-CE1 3.75Å; Q134-Y144 HydrophobicContact CG-CD1 3.92Å; Q134-Y144 HydrophobicContact CG-CE1 3.61Å; Q134-Y144 PolarHBondContact NE2-OH 3.27Å
135	I	86.6	Confident	86.8	Confident	85 Å²	85	52.4 Å²	52.4	44%	0.436	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-12.9	-175.1	60.5	175.3	0	0	0	113.2	V143 R145 A157 L209	I135-V143 HydrophobicContact CD1-CG1 3.77Å; I135-V143 HydrophobicContact CG1-CB 3.96Å; I135-V143 HydrophobicContact CG1-CG1 3.65Å; I135-V143 WeakPolarHBondContact CG1-O 3.5Å; I135-V143 PolarHBondContact N-O 2.97Å; I135-R145 HydrophobicContact CG2-CB 3.91Å; I135-A157 HydrophobicContact CD1-CB 4.48Å; I135-L209 HydrophobicContact CD1-CD1 4.05Å
136	G	78.6	Confident	87	Confident	25 Å²	25	51.9 Å²	51.9	26%	0.258	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	145.2	175	0	0	0	0	0	112.1	S142 V143	G136-S142 WeakPolarHBondContact O-CA 3.17Å; G136-V143 PolarHBondContact N-O 2.94Å; G136-V143 VanDerWaalsContact N-O 3.15Å; G136-V143 PolarHBondContact O-N 3.04Å
137	V	78.9	Confident	87	Confident	111 Å²	111	54.6 Å²	54.6	67%	0.673	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.8	127.6	176.9	-171.7	0	0	0	0	108.8	Q134	Q134-V137 VanDerWaalsContact CD-CG2 3.5Å; Q134-V137 HydrophobicContact CG-CG2 3.97Å
138	G	69	Low	87	Confident	37 Å²	37	47.4 Å²	47.4	38%	0.381	26%	0.263	S	S	.	.			trans	-128.2	177.9	169	0	0	0	0	0	110.3	F140 S141	G138-F140 VanDerWaalsContact C-N 3.34Å; G138-F140 PolarHBondContact O-N 2.96Å; G138-S141 WeakPolarHBondContact CA-O 3.5Å; G138-S141 PolarHBondContact N-O 3.39Å
139	Q	66.5	Low	86.8	Confident	122 Å²	122	49.1 Å²	49.1	57%	0.57	27%	0.272	S	S	*	.	S	Bend	trans	-59	-43	-175.8	-174.1	178	7.9	0	0	113.1	S284	Q139-S284 PolarHBondContact OE1-OG 2.66Å
140	F	72.9	Confident	86.2	Confident	51 Å²	51	54.1 Å²	54.1	22%	0.224	30%	0.295	C	S	.	.	S	Bend	trans	-119.4	6.3	-175.4	-60.4	-71.3	0	0	0	113.4	G138 K162 F282	G138-F140 VanDerWaalsContact C-N 3.34Å; G138-F140 PolarHBondContact O-N 2.96Å; F140-K162 PolarHBondContact O-N 2.96Å; F140-K162 VanDerWaalsContact O-N 3.1Å; F140-F282 HydrophobicContact CB-CD1 3.74Å; F140-F282 HydrophobicContact CB-CE1 4.42Å; F140-F282 HydrophobicContact CB-CG 4.46Å
141	S	81.5	Confident	84.6	Confident	17 Å²	17	52.2 Å²	52.2	12%	0.119	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	141.4	-177.7	67.2	0	0	0	0	112.8	G138 V160	G138-S141 WeakPolarHBondContact CA-O 3.5Å; G138-S141 PolarHBondContact N-O 3.39Å; S141-V160 CarbonylContact C-O 3.58Å; S141-V160 WeakPolarHBondContact CA-O 3.41Å; S141-V160 WeakPolarHBondContact CB-O 3.38Å
142	S	88.2	Confident	83.6	Confident	21 Å²	21	57.1 Å²	57.1	15%	0.147	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	146.6	169.8	-70.1	0	0	0	0	109.5	Q134 G136 Y144 K159 V160	Q134-S142 PolarHBondContact NE2-OG 3.31Å; G136-S142 WeakPolarHBondContact O-CA 3.17Å; S142-Y144 VanDerWaalsContact CB-CE2 3.42Å; S142-K159 CarbonylContact O-C 3.36Å; S142-K159 WeakPolarHBondContact O-CA 3.46Å; S142-V160 PolarHBondContact N-O 3.18Å; S142-V160 PolarHBondContact O-N 3.02Å
143	V	90	Very high	83.1	Confident	32 Å²	32	54.6 Å²	54.6	19%	0.194	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.5	174.2	-168.7	0	0	0	0	108.5	I135 G136 A157 L158 K159	I135-V143 HydrophobicContact CD1-CG1 3.77Å; I135-V143 HydrophobicContact CG1-CB 3.96Å; I135-V143 HydrophobicContact CG1-CG1 3.65Å; I135-V143 WeakPolarHBondContact CG1-O 3.5Å; I135-V143 PolarHBondContact N-O 2.97Å; G136-V143 PolarHBondContact N-O 2.94Å; G136-V143 VanDerWaalsContact N-O 3.15Å; G136-V143 PolarHBondContact O-N 3.04Å; V143-A157 HydrophobicContact CG1-CB 4.29Å; V143-L158 CarbonylContact C-O 3.52Å; V143-L158 WeakPolarHBondContact CA-O 3.39Å; V143-K159 HydrophobicContact CG2-CB 4.41Å; V143-K159 HydrophobicContact CG2-CD 4.47Å; V143-K159 HydrophobicContact CG2-CG 4.15Å
144	Y	93.8	Very high	83	Confident	17 Å²	17	55.9 Å²	55.9	7%	0.067	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.2	178.1	-58	-88.3	0	0	0	110.5	L29 I32 L131 S133 Q134 S142 A157 L158 V160	L29-Y144 HydrophobicContact CD2-CE2 4.12Å; I32-Y144 HydrophobicContact CD1-CD1 3.7Å; I32-Y144 HydrophobicContact CD1-CE1 3.33Å; L131-Y144 HydrophobicContact CD2-CD1 4.46Å; L131-Y144 HydrophobicContact CD2-CG 4.02Å; S133-Y144 CarbonylContact O-C 3.37Å; S133-Y144 VanDerWaalsContact O-CA 3.27Å; S133-Y144 WeakPolarHBondContact O-CA 3.25Å; Q134-Y144 HydrophobicContact CB-CD1 3.79Å; Q134-Y144 HydrophobicContact CB-CE1 3.75Å; Q134-Y144 HydrophobicContact CG-CD1 3.92Å; Q134-Y144 HydrophobicContact CG-CE1 3.61Å; Q134-Y144 PolarHBondContact NE2-OH 3.27Å; S142-Y144 VanDerWaalsContact CB-CE2 3.42Å; Y144-A157 CarbonylContact O-C 3.51Å; Y144-A157 WeakPolarHBondContact O-CA 3.36Å; Y144-L158 PolarHBondContact N-O 2.68Å; Y144-L158 PolarHBondContact O-N 3.41Å; Y144-V160 HydrophobicContact CD2-CG2 3.79Å; Y144-V160 HydrophobicContact CE2-CB 4.26Å; Y144-V160 HydrophobicContact CE2-CG2 3.79Å
145	R	94.3	Very high	83.1	Confident	47 Å²	47	54.6 Å²	54.6	18%	0.177	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	131	159.1	-175.7	-176.3	178.7	164.1	6.9	107.9	Y41 L132 S133 I135 L209 D211	Y41-R145 PolarHBondContact OH-NH1 3.24Å; L132-R145 HydrophobicContact CB-CB 4.47Å; L132-R145 HydrophobicContact CB-CG 4.3Å; L132-R145 HydrophobicContact CD1-CG 4.13Å; L132-R145 PolarHBondContact N-O 3.24Å; S133-R145 PolarHBondContact N-O 3Å; S133-R145 PolarHBondContact O-N 3.28Å; I135-R145 HydrophobicContact CG2-CB 3.91Å; R145-L209 HydrophobicContact CG-CD1 4.37Å; R145-L209 HydrophobicContact CG-CD2 3.83Å; R145-D211 IonicContact NH2-OD2 3.84Å
146	A	95.1	Very high	83.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	158.8	176.4	0	0	0	0	0	111.3	F129 T130 L131 N155 V156 L158	F129-A146 HydrophobicContact CB-CB 4.22Å; T130-A146 CarbonylContact O-C 3.58Å; T130-A146 VanDerWaalsContact O-CA 3.23Å; T130-A146 WeakPolarHBondContact O-CA 3.29Å; T130-A146 WeakPolarHBondContact O-CB 3.39Å; L131-A146 HydrophobicContact CD2-CB 4.25Å; A146-N155 WeakPolarHBondContact O-CA 3.15Å; A146-V156 HydrophobicContact CB-CG2 4.1Å; A146-V156 PolarHBondContact N-O 3.31Å; A146-V156 PolarHBondContact O-N 3.4Å; A146-L158 HydrophobicContact CB-CD1 3.58Å; A146-L158 HydrophobicContact CB-CG 3.79Å
147	E	93.4	Very high	84.1	Confident	73 Å²	73	49.8 Å²	49.8	34%	0.341	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	132.2	170.5	-175.6	177.4	-136.7	0	0	108.9	F129 T130 L132 N149 G153	F129-E147 CarbonylContact C-O 3.59Å; F129-E147 VanDerWaalsContact CA-O 3.29Å; F129-E147 WeakPolarHBondContact CA-O 3.4Å; T130-E147 PolarHBondContact N-O 3.04Å; T130-E147 PolarHBondContact O-N 3.47Å; L132-E147 HydrophobicContact CD1-CB 4.24Å; E147-N149 PolarHBondContact O-N 3.23Å; E147-G153 VanDerWaalsContact CG-C 3.44Å; E147-G153 VanDerWaalsContact CG-CA 3.47Å; E147-G153 WeakPolarHBondContact CG-O 3.14Å; E147-G153 VanDerWaalsContact OE1-CA 3.3Å; E147-G153 WeakPolarHBondContact OE1-CA 3.38Å
148	C	91.3	Very high	84.9	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.007	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	123.8	172.3	-171.8	0	0	0	0	110.7	F123 F129 Q150 G153 L154	F123-C148 HydrophobicContact CE1-CB 4.09Å; F123-C148 WeakPolarHBondContact CE1-SG 3.48Å; F129-C148 HydrophobicContact CD1-CB 4.05Å; F129-C148 HydrophobicContact CE1-CB 4.01Å; C148-Q150 VanDerWaalsContact C-N 3.26Å; C148-Q150 PolarHBondContact O-N 3.1Å; C148-Q150 PolarHBondContact SG-O 3.09Å; C148-G153 VanDerWaalsContact O-CA 3.24Å; C148-G153 WeakPolarHBondContact O-CA 3.41Å; C148-G153 PolarHBondContact O-N 3.42Å; C148-L154 HydrophobicContact CB-CB 4.36Å; C148-L154 PolarHBondContact N-O 3.45Å
149	N	87.5	Confident	85.9	Confident	61 Å²	61	43.3 Å²	43.3	33%	0.326	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-32.5	-175.9	-62.7	-17.9	0	0	0	112.2	R127 N128 T130 E147	R127-N149 PolarHBondContact O-ND2 3.32Å; N128-N149 VanDerWaalsContact C-ND2 3.34Å; N128-N149 WeakPolarHBondContact O-CB 3.33Å; N128-N149 PolarHBondContact O-N 3.33Å; T130-N149 PolarHBondContact N-OD1 3.15Å; T130-N149 PolarHBondContact OG1-OD1 3.34Å; E147-N149 PolarHBondContact O-N 3.23Å
150	Q	80.5	Confident	87.1	Confident	118 Å²	118	37.7 Å²	37.7	55%	0.551	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-151.2	140.2	-179.7	-69.9	-69.4	-52.8	0	0	112.1	Y122 C148	Y122-Q150 WeakPolarHBondContact CB-O 2.9Å; Y122-Q150 HydrophobicContact CD1-CB 4.24Å; Y122-Q150 HydrophobicContact CE1-CB 4.3Å; C148-Q150 VanDerWaalsContact C-N 3.26Å; C148-Q150 PolarHBondContact O-N 3.1Å; C148-Q150 PolarHBondContact SG-O 3.09Å
151	P	59.6	Low	87.8	Confident	24 Å²	24	35.2 Å²	35.2	16%	0.156	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93.7	140	-15.8	37.7	-30	0	0	0	109.6	Q119 Y122	Q119-P151 HydrophobicContact CG-CG 3.67Å; Q119-P151 PolarHBondContact NE2-O 3.19Å; Q119-P151 VanDerWaalsContact NE2-O 3.13Å; Y122-P151 HydrophobicContact CE2-CG 4.32Å
152	F	72.2	Confident	88	Confident	164 Å²	164	37.7 Å²	37.7	72%	0.719	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.1	28.1	166.4	-46	-72.6	0	0	0	119.3	L154	F152-L154 PolarHBondContact O-N 3.23Å
153	G	83.1	Confident	87.6	Confident	24 Å²	24	36.9 Å²	36.9	25%	0.247	18%	0.184	C	C	.	.			trans	56.5	33.9	168	0	0	0	0	0	112.9	E147 C148 N155	E147-G153 VanDerWaalsContact CG-C 3.44Å; E147-G153 VanDerWaalsContact CG-CA 3.47Å; E147-G153 WeakPolarHBondContact CG-O 3.14Å; E147-G153 VanDerWaalsContact OE1-CA 3.3Å; E147-G153 WeakPolarHBondContact OE1-CA 3.38Å; C148-G153 VanDerWaalsContact O-CA 3.24Å; C148-G153 WeakPolarHBondContact O-CA 3.41Å; C148-G153 PolarHBondContact O-N 3.42Å; G153-N155 PolarHBondContact O-N 2.6Å
154	L	89.7	Confident	87	Confident	58 Å²	58	39.9 Å²	39.9	30%	0.304	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	120.8	-172.8	179.3	65.1	0	0	0	108.9	F123 C148 F152 V156	F123-L154 HydrophobicContact CZ-CD2 4.3Å; C148-L154 HydrophobicContact CB-CB 4.36Å; C148-L154 PolarHBondContact N-O 3.45Å; F152-L154 PolarHBondContact O-N 3.23Å; L154-V156 HydrophobicContact CD2-CG1 4.34Å; L154-V156 HydrophobicContact CG-CG1 4.24Å; L154-V156 PolarHBondContact O-N 3.4Å
155	N	91.9	Very high	86.2	Confident	59 Å²	59	44.1 Å²	44.1	32%	0.316	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	129.8	172.3	-77.9	-70.4	0	0	0	110.8	A146 G153 L209	A146-N155 WeakPolarHBondContact O-CA 3.15Å; G153-N155 PolarHBondContact O-N 2.6Å; N155-L209 HydrophobicContact CB-CD2 3.84Å
156	V	93.8	Very high	85.2	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	161.4	-179.7	-63.8	0	0	0	0	110.7	F129 A146 L154 L158 L194 V206 L207	F129-V156 HydrophobicContact CD1-CG2 3.81Å; F129-V156 HydrophobicContact CE1-CG2 3.83Å; A146-V156 HydrophobicContact CB-CG2 4.1Å; A146-V156 PolarHBondContact N-O 3.31Å; A146-V156 PolarHBondContact O-N 3.4Å; L154-V156 HydrophobicContact CD2-CG1 4.34Å; L154-V156 HydrophobicContact CG-CG1 4.24Å; L154-V156 PolarHBondContact O-N 3.4Å; V156-L158 HydrophobicContact CG2-CD2 4.02Å; V156-L158 HydrophobicContact CG2-CG 4.4Å; V156-L194 HydrophobicContact CG1-CD1 3.83Å; V156-V206 HydrophobicContact CB-CG1 4.02Å; V156-V206 HydrophobicContact CG1-CG1 4.08Å; V156-V206 HydrophobicContact CG2-CG1 4.16Å; V156-L207 WeakPolarHBondContact CA-O 3.17Å; V156-L207 WeakPolarHBondContact CB-O 3.35Å
157	A	93.6	Very high	84	Confident	9 Å²	9	50 Å²	50	7%	0.074	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	127.6	165.3	0	0	0	0	0	109.4	I135 V143 Y144 L207 L209	I135-A157 HydrophobicContact CD1-CB 4.48Å; V143-A157 HydrophobicContact CG1-CB 4.29Å; Y144-A157 CarbonylContact O-C 3.51Å; Y144-A157 WeakPolarHBondContact O-CA 3.36Å; A157-L207 HydrophobicContact CB-CB 4.31Å; A157-L207 PolarHBondContact N-O 3.45Å; A157-L207 PolarHBondContact O-N 3.46Å; A157-L209 HydrophobicContact CB-CD1 4.03Å
158	L	94.2	Very high	83.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	108.5	173.6	-58.1	-177.3	0	0	0	108.7	L126 F129 L131 V143 Y144 A146 V156 I204 I205 V206	L126-L158 HydrophobicContact CD2-CD1 4.03Å; F129-L158 HydrophobicContact CB-CD1 4.02Å; F129-L158 HydrophobicContact CD1-CD2 4.23Å; F129-L158 HydrophobicContact CD2-CD1 4.45Å; F129-L158 HydrophobicContact CE1-CD2 4.24Å; F129-L158 HydrophobicContact CG-CD1 4.09Å; F129-L158 HydrophobicContact CG-CD2 4.39Å; F129-L158 HydrophobicContact CZ-CD2 4.39Å; L131-L158 HydrophobicContact CD2-CD1 3.85Å; V143-L158 CarbonylContact C-O 3.52Å; V143-L158 WeakPolarHBondContact CA-O 3.39Å; Y144-L158 PolarHBondContact N-O 2.68Å; Y144-L158 PolarHBondContact O-N 3.41Å; A146-L158 HydrophobicContact CB-CD1 3.58Å; A146-L158 HydrophobicContact CB-CG 3.79Å; V156-L158 HydrophobicContact CG2-CD2 4.02Å; V156-L158 HydrophobicContact CG2-CG 4.4Å; L158-I204 HydrophobicContact CB-CG2 4.46Å; L158-I204 HydrophobicContact CD2-CG2 4.27Å; L158-I205 WeakPolarHBondContact CA-O 3.45Å; L158-V206 HydrophobicContact CD2-CB 4.24Å; L158-V206 HydrophobicContact CD2-CG1 3.99Å; L158-V206 HydrophobicContact CD2-CG2 3.85Å
159	K	91.8	Very high	82.5	Confident	11 Å²	11	53.2 Å²	53.2	5%	0.048	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	107.2	171.3	-174.4	167.1	-173.5	176.4	0	108.6	S142 V143 I161 I205 D275	S142-K159 CarbonylContact O-C 3.36Å; S142-K159 WeakPolarHBondContact O-CA 3.46Å; V143-K159 HydrophobicContact CG2-CB 4.41Å; V143-K159 HydrophobicContact CG2-CD 4.47Å; V143-K159 HydrophobicContact CG2-CG 4.15Å; K159-I161 HydrophobicContact CG-CD1 4.47Å; K159-I161 HydrophobicContact CG-CG1 4.3Å; K159-I205 HydrophobicContact CB-CB 4.35Å; K159-I205 PolarHBondContact N-O 2.75Å; K159-I205 PolarHBondContact O-N 3.42Å; K159-D275 IonicContact NZ-OD1 3.03Å; K159-D275 PolarHBondContact NZ-OD1 3.14Å
160	V	91.5	Very high	82.1	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.024	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.1	-179.5	-176.4	0	0	0	0	108.4	S141 S142 Y144 E202 L203 I204	S141-V160 CarbonylContact C-O 3.58Å; S141-V160 WeakPolarHBondContact CA-O 3.41Å; S141-V160 WeakPolarHBondContact CB-O 3.38Å; S142-V160 PolarHBondContact N-O 3.18Å; S142-V160 PolarHBondContact O-N 3.02Å; Y144-V160 HydrophobicContact CD2-CG2 3.79Å; Y144-V160 HydrophobicContact CE2-CB 4.26Å; Y144-V160 HydrophobicContact CE2-CG2 3.79Å; V160-E202 HydrophobicContact CG1-CB 3.9Å; V160-E202 HydrophobicContact CG1-CG 4.23Å; V160-E202 VanDerWaalsContact CG1-OE2 3.23Å; V160-E202 WeakPolarHBondContact CG1-OE2 3.49Å; V160-L203 CarbonylContact C-O 3.53Å; V160-I204 HydrophobicContact CG2-CG1 4.44Å
161	I	86.8	Confident	81.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128	-175.1	-61	162.1	0	0	0	108.9	K159 I163 E202 L203 I205 L278 F282	K159-I161 HydrophobicContact CG-CD1 4.47Å; K159-I161 HydrophobicContact CG-CG1 4.3Å; I161-I163 HydrophobicContact CB-CG2 4.19Å; I161-I163 HydrophobicContact CG2-CG2 3.5Å; I161-I163 PolarHBondContact O-N 3.39Å; I161-E202 CarbonylContact O-C 3.51Å; I161-E202 WeakPolarHBondContact O-CA 3.37Å; I161-L203 HydrophobicContact CB-CB 4.22Å; I161-L203 HydrophobicContact CB-CD2 4.25Å; I161-L203 HydrophobicContact CD1-CD2 3.76Å; I161-L203 HydrophobicContact CD1-CG 4.43Å; I161-L203 PolarHBondContact N-O 2.86Å; I161-L203 PolarHBondContact O-N 3.33Å; I161-I205 HydrophobicContact CD1-CD1 3.62Å; I161-I205 HydrophobicContact CD1-CG1 4.26Å; I161-L278 HydrophobicContact CD1-CD1 3.83Å; I161-F282 HydrophobicContact CB-CZ 4.19Å; I161-F282 HydrophobicContact CD1-CE2 3.85Å; I161-F282 HydrophobicContact CD1-CZ 3.72Å; I161-F282 HydrophobicContact CG1-CE2 4.03Å; I161-F282 HydrophobicContact CG1-CZ 3.85Å; I161-F282 HydrophobicContact CG2-CE1 3.41Å; I161-F282 VanDerWaalsContact CG2-CE1 3.41Å; I161-F282 HydrophobicContact CG2-CE2 4.22Å; I161-F282 HydrophobicContact CG2-CZ 3.25Å
162	K	85.4	Confident	82.6	Confident	69 Å²	69	55.1 Å²	55.1	30%	0.3	29%	0.285	S	S	.	.			trans	-80.8	61.5	-179.1	-66.6	163.4	150.4	-121.8	0	111.8	F140 F164 E165	F140-K162 PolarHBondContact O-N 2.96Å; F140-K162 VanDerWaalsContact O-N 3.1Å; K162-F164 PolarHBondContact O-N 3.44Å; K162-F164 VanDerWaalsContact O-N 3.16Å; K162-E165 HydrophobicContact CB-CB 4.19Å; K162-E165 HydrophobicContact CB-CG 4.08Å; K162-E165 IonicContact NZ-OE1 2.99Å; K162-E165 PolarHBondContact NZ-OE1 2.78Å; K162-E165 IonicContact NZ-OE2 3.21Å; K162-E165 PolarHBondContact NZ-OE2 3Å; K162-E165 PolarHBondContact O-N 3.02Å; K162-E165 VanDerWaalsContact O-N 3.1Å
163	I	79.5	Confident	83	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.015	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-22	-172	57.1	158.9	0	0	0	114.1	I161 M166 R172 V198 L203	I161-I163 HydrophobicContact CB-CG2 4.19Å; I161-I163 HydrophobicContact CG2-CG2 3.5Å; I161-I163 PolarHBondContact O-N 3.39Å; I163-M166 HydrophobicContact CG2-SD 4.46Å; I163-M166 WeakPolarHBondContact O-CB 3.38Å; I163-R172 WeakPolarHBondContact O-CD 3.11Å; I163-V198 HydrophobicContact CD1-CG2 4.14Å; I163-L203 HydrophobicContact CB-CB 4.37Å; I163-L203 HydrophobicContact CD1-CB 3.86Å; I163-L203 HydrophobicContact CG1-CB 3.86Å; I163-L203 HydrophobicContact CG2-CB 3.59Å; I163-L203 HydrophobicContact CG2-CD2 3.75Å; I163-L203 HydrophobicContact CG2-CG 4.37Å
164	F	77.9	Confident	82.8	Confident	96 Å²	96	52.2 Å²	52.2	42%	0.421	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-15.5	178.1	-71	-95.4	0	0	0	113.2	K162 M166 V198 N201	K162-F164 PolarHBondContact O-N 3.44Å; K162-F164 VanDerWaalsContact O-N 3.16Å; F164-M166 PolarHBondContact O-N 2.84Å; F164-V198 HydrophobicContact CE2-CG1 3.8Å; F164-V198 HydrophobicContact CZ-CG1 4.35Å; F164-N201 HydrophobicContact CB-CB 4.01Å; F164-N201 VanDerWaalsContact CD2-CA 3.42Å; F164-N201 HydrophobicContact CD2-CB 3.65Å; F164-N201 WeakPolarHBondContact CD2-O 3.22Å; F164-N201 HydrophobicContact CE2-CB 4.21Å; F164-N201 HydrophobicContact CG-CB 3.83Å
165	E	78.1	Confident	82.3	Confident	106 Å²	106	49.5 Å²	49.5	50%	0.495	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-11.5	167.8	-63.5	-178.9	-164.1	0	0	111.4	K162 V167	K162-E165 HydrophobicContact CB-CB 4.19Å; K162-E165 HydrophobicContact CB-CG 4.08Å; K162-E165 IonicContact NZ-OE1 2.99Å; K162-E165 PolarHBondContact NZ-OE1 2.78Å; K162-E165 IonicContact NZ-OE2 3.21Å; K162-E165 PolarHBondContact NZ-OE2 3Å; K162-E165 PolarHBondContact O-N 3.02Å; K162-E165 VanDerWaalsContact O-N 3.1Å; E165-V167 PolarHBondContact O-N 2.83Å; E165-V167 VanDerWaalsContact O-N 3.16Å
166	M	71.9	Confident	81.7	Confident	22 Å²	22	48.1 Å²	48.1	11%	0.108	25%	0.247	C	C	.	.			trans	-72.5	106.4	173.5	-59.5	178.5	69	0	0	110.2	I163 F164 D168 A171 Y281	I163-M166 HydrophobicContact CG2-SD 4.46Å; I163-M166 WeakPolarHBondContact O-CB 3.38Å; F164-M166 PolarHBondContact O-N 2.84Å; M166-D168 VanDerWaalsContact C-N 3.28Å; M166-D168 PolarHBondContact O-N 3.38Å; M166-A171 HydrophobicContact CE-CB 3.68Å; M166-Y281 HydrophobicContact CE-CD1 4.45Å
167	V	70.4	Confident	81.1	Confident	148 Å²	148	53.8 Å²	53.8	90%	0.897	27%	0.271	S	S	*	.			trans	-62.2	-35.3	-179.9	-176	0	0	0	0	112.2	E165 A169	E165-V167 PolarHBondContact O-N 2.83Å; E165-V167 VanDerWaalsContact O-N 3.16Å; V167-A169 PolarHBondContact O-N 3.21Å
168	D	75.2	Confident	80.5	Confident	84 Å²	84	53.8 Å²	53.8	45%	0.449	27%	0.27	S	S	.	.			trans	-82.1	106.7	-178.4	-178.6	-2.6	0	0	0	111.2	M166 K170 A171 R172	M166-D168 VanDerWaalsContact C-N 3.28Å; M166-D168 PolarHBondContact O-N 3.38Å; D168-K170 PolarHBondContact O-N 3.2Å; D168-K170 WeakPolarHBondContact OD1-CA 3.43Å; D168-K170 VanDerWaalsContact OD1-CB 3.23Å; D168-K170 WeakPolarHBondContact OD1-CB 3.47Å; D168-K170 PolarHBondContact OD1-N 3.5Å; D168-A171 HydrophobicContact CB-CB 3.76Å; D168-A171 WeakPolarHBondContact O-CB 3.37Å; D168-A171 PolarHBondContact O-N 3.47Å; D168-A171 PolarHBondContact OD1-N 3.07Å; D168-R172 PolarHBondContact O-N 2.89Å
169	A	78.3	Confident	80	Confident	57 Å²	57	54.1 Å²	54.1	47%	0.471	27%	0.271	S	S	.	.	H	α-helix	trans	-57.9	-32.4	176.8	0	0	0	0	0	113	V167 Q173	V167-A169 PolarHBondContact O-N 3.21Å; A169-Q173 WeakPolarHBondContact O-CB 3.48Å; A169-Q173 PolarHBondContact O-N 3.15Å
170	K	79	Confident	79.7	Confident	146 Å²	146	56.8 Å²	56.8	64%	0.635	29%	0.286	S	S	*	.	H	α-helix	trans	-68.9	-44.2	175	-175.7	179.1	178.8	177.4	0	110.5	D168 R172 Q173 D174	D168-K170 PolarHBondContact O-N 3.2Å; D168-K170 WeakPolarHBondContact OD1-CA 3.43Å; D168-K170 VanDerWaalsContact OD1-CB 3.23Å; D168-K170 WeakPolarHBondContact OD1-CB 3.47Å; D168-K170 PolarHBondContact OD1-N 3.5Å; K170-R172 VanDerWaalsContact C-N 3.3Å; K170-R172 PolarHBondContact O-N 3.29Å; K170-Q173 PolarHBondContact O-N 3.33Å; K170-D174 WeakPolarHBondContact O-CB 3.2Å; K170-D174 VanDerWaalsContact O-CG 3.32Å; K170-D174 PolarHBondContact O-N 3.01Å
171	A	73.8	Confident	79.5	Confident	20 Å²	20	59 Å²	59	17%	0.165	30%	0.298	C	S	.	.	H	α-helix	trans	-61.1	-39.8	176.1	0	0	0	0	0	111.9	M166 D168 D174 C175	M166-A171 HydrophobicContact CE-CB 3.68Å; D168-A171 HydrophobicContact CB-CB 3.76Å; D168-A171 WeakPolarHBondContact O-CB 3.37Å; D168-A171 PolarHBondContact O-N 3.47Å; D168-A171 PolarHBondContact OD1-N 3.07Å; A171-D174 PolarHBondContact O-N 3.36Å; A171-C175 WeakPolarHBondContact O-CB 3.47Å; A171-C175 PolarHBondContact O-N 3.22Å
172	R	77	Confident	79.5	Confident	78 Å²	78	59.4 Å²	59.4	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-61.6	-47	173.1	-177	173.3	63.4	-138.9	4.6	111.8	I163 D168 K170 D174 C175 I176	I163-R172 WeakPolarHBondContact O-CD 3.11Å; D168-R172 PolarHBondContact O-N 2.89Å; K170-R172 VanDerWaalsContact C-N 3.3Å; K170-R172 PolarHBondContact O-N 3.29Å; R172-D174 PolarHBondContact O-N 2.95Å; R172-C175 WeakPolarHBondContact O-CB 3.49Å; R172-C175 PolarHBondContact O-N 3.18Å; R172-I176 HydrophobicContact CG-CD1 4.44Å; R172-I176 WeakPolarHBondContact O-CG1 3.45Å; R172-I176 PolarHBondContact O-N 2.94Å
173	Q	80.4	Confident	79.7	Confident	88 Å²	88	60 Å²	60	41%	0.411	30%	0.302	S	S	.	.	H	α-helix	trans	-64.6	-39.6	178.6	-171.7	61.9	51.9	0	0	112.5	A169 K170 C175 I176 K177	A169-Q173 WeakPolarHBondContact O-CB 3.48Å; A169-Q173 PolarHBondContact O-N 3.15Å; K170-Q173 PolarHBondContact O-N 3.33Å; Q173-C175 VanDerWaalsContact C-N 3.34Å; Q173-I176 PolarHBondContact O-N 3.49Å; Q173-K177 WeakPolarHBondContact O-CG 3.38Å; Q173-K177 PolarHBondContact O-N 3.36Å
174	D	78.1	Confident	80.2	Confident	39 Å²	39	67.3 Å²	67.3	21%	0.209	33%	0.33	C	S	.	.	H	α-helix	trans	-67.2	-37	176.7	-73.9	-13	0	0	0	111.2	K170 A171 R172 K177 E178 R280 Y281	K170-D174 WeakPolarHBondContact O-CB 3.2Å; K170-D174 VanDerWaalsContact O-CG 3.32Å; K170-D174 PolarHBondContact O-N 3.01Å; A171-D174 PolarHBondContact O-N 3.36Å; R172-D174 PolarHBondContact O-N 2.95Å; D174-K177 PolarHBondContact O-N 3Å; D174-E178 WeakPolarHBondContact O-CB 3.38Å; D174-E178 PolarHBondContact O-N 2.82Å; D174-R280 IonicContact OD2-NH2 2.61Å; D174-Y281 VanDerWaalsContact C-OH 3.26Å; D174-Y281 HydrophobicContact CB-CE1 3.7Å; D174-Y281 WeakPolarHBondContact CB-OH 3.41Å; D174-Y281 PolarHBondContact O-OH 3.31Å; D174-Y281 VanDerWaalsContact O-OH 3.08Å
175	C	79.1	Confident	80.9	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59.6	-47.3	171.8	-177.2	0	0	0	0	111.4	A171 R172 Q173 K177 E178 I179 Y281	A171-C175 WeakPolarHBondContact O-CB 3.47Å; A171-C175 PolarHBondContact O-N 3.22Å; R172-C175 WeakPolarHBondContact O-CB 3.49Å; R172-C175 PolarHBondContact O-N 3.18Å; Q173-C175 VanDerWaalsContact C-N 3.34Å; C175-K177 PolarHBondContact O-N 3.16Å; C175-E178 PolarHBondContact O-N 2.65Å; C175-I179 WeakPolarHBondContact O-CG1 3.38Å; C175-I179 PolarHBondContact O-N 3.31Å; C175-I179 VanDerWaalsContact O-N 3.14Å; C175-Y281 HydrophobicContact CB-CD1 4.39Å; C175-Y281 HydrophobicContact CB-CD2 4.13Å; C175-Y281 HydrophobicContact CB-CE1 4.5Å; C175-Y281 HydrophobicContact CB-CE2 4.21Å; C175-Y281 HydrophobicContact CB-CG 4.22Å
176	I	79.9	Confident	81.7	Confident	31 Å²	31	63.9 Å²	63.9	16%	0.159	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-46.6	177.2	-65.6	168.5	0	0	0	111.3	I13 R172 Q173 E178 I179 D180	I13-I176 HydrophobicContact CD1-CD1 4.4Å; R172-I176 HydrophobicContact CG-CD1 4.44Å; R172-I176 WeakPolarHBondContact O-CG1 3.45Å; R172-I176 PolarHBondContact O-N 2.94Å; Q173-I176 PolarHBondContact O-N 3.49Å; I176-E178 VanDerWaalsContact C-N 3.26Å; I176-E178 PolarHBondContact O-N 3.44Å; I176-I179 WeakPolarHBondContact O-CB 3.17Å; I176-I179 PolarHBondContact O-N 3.4Å; I176-I179 VanDerWaalsContact O-N 3.15Å; I176-D180 PolarHBondContact O-N 3.23Å
177	K	81	Confident	82.9	Confident	118 Å²	118	64.7 Å²	64.7	51%	0.513	32%	0.322	S	S	.	.	H	α-helix	trans	-59.7	-37.1	176.9	-74.1	173.7	-179.4	171.4	0	112.6	Q173 D174 C175 I179 D180 L181	Q173-K177 WeakPolarHBondContact O-CG 3.38Å; Q173-K177 PolarHBondContact O-N 3.36Å; D174-K177 PolarHBondContact O-N 3Å; C175-K177 PolarHBondContact O-N 3.16Å; K177-I179 VanDerWaalsContact C-N 3.33Å; K177-D180 PolarHBondContact O-N 3.27Å; K177-L181 PolarHBondContact O-N 3.24Å
178	E	80.3	Confident	84.1	Confident	10 Å²	10	62 Å²	62	5%	0.047	31%	0.308	C	S	.	.	H	α-helix	trans	-69.1	-33.6	179	-173	147.2	-173.6	0	0	112.1	D174 C175 I176 D180 L181 L182 R256 L278 R280 Y281	D174-E178 WeakPolarHBondContact O-CB 3.38Å; D174-E178 PolarHBondContact O-N 2.82Å; C175-E178 PolarHBondContact O-N 2.65Å; I176-E178 VanDerWaalsContact C-N 3.26Å; I176-E178 PolarHBondContact O-N 3.44Å; E178-D180 VanDerWaalsContact C-N 3.3Å; E178-D180 PolarHBondContact O-N 2.92Å; E178-L181 WeakPolarHBondContact O-CB 3.39Å; E178-L181 PolarHBondContact O-N 3.02Å; E178-L181 VanDerWaalsContact O-N 3.12Å; E178-L182 WeakPolarHBondContact O-CG 3.46Å; E178-L182 PolarHBondContact O-N 3.48Å; E178-R256 IonicContact OE1-CZ 2.78Å; E178-R256 IonicContact OE1-NE 3.81Å; E178-R256 IonicContact OE1-NH1 2.86Å; E178-R256 PolarHBondContact OE1-NH1 2.9Å; E178-R256 IonicContact OE1-NH2 3.41Å; E178-R256 PolarHBondContact OE1-NH2 2.9Å; E178-R256 IonicContact OE2-CZ 3.64Å; E178-R256 IonicContact OE2-NH1 3.82Å; E178-R256 PolarHBondContact OE2-NH1 3.31Å; E178-R256 IonicContact OE2-NH2 2.75Å; E178-R256 PolarHBondContact OE2-NH2 2.86Å; E178-L278 HydrophobicContact CG-CD2 4.36Å; E178-R280 IonicContact OE2-NE 3.65Å; E178-Y281 HydrophobicContact CB-CE2 4.05Å; E178-Y281 HydrophobicContact CG-CE2 4.38Å; E178-Y281 WeakPolarHBondContact OE2-CE2 3.26Å; E178-Y281 PolarHBondContact OE2-OH 3.07Å
179	I	84.7	Confident	85.1	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-63.7	-38.7	172.6	-61.5	157.4	0	0	0	111	C175 I176 K177 L181 L182 K183 Y193 L203 I205 L278	C175-I179 WeakPolarHBondContact O-CG1 3.38Å; C175-I179 PolarHBondContact O-N 3.31Å; C175-I179 VanDerWaalsContact O-N 3.14Å; I176-I179 WeakPolarHBondContact O-CB 3.17Å; I176-I179 PolarHBondContact O-N 3.4Å; I176-I179 VanDerWaalsContact O-N 3.15Å; K177-I179 VanDerWaalsContact C-N 3.33Å; I179-L181 PolarHBondContact O-N 3.05Å; I179-L182 WeakPolarHBondContact O-CB 3.43Å; I179-L182 PolarHBondContact O-N 3.27Å; I179-K183 WeakPolarHBondContact O-CG 3.39Å; I179-K183 PolarHBondContact O-N 2.93Å; I179-Y193 HydrophobicContact CG2-CE2 4.14Å; I179-L203 HydrophobicContact CD1-CD1 3.9Å; I179-L203 HydrophobicContact CD1-CD2 3.1Å; I179-L203 HydrophobicContact CD1-CG 4.06Å; I179-L203 HydrophobicContact CG1-CD2 4.27Å; I179-I205 HydrophobicContact CD1-CD1 4.5Å; I179-I205 HydrophobicContact CG1-CD1 4.21Å; I179-L278 HydrophobicContact CG1-CD2 4.36Å
180	D	85.9	Confident	86	Confident	67 Å²	67	56.2 Å²	56.2	36%	0.358	27%	0.269	S	S	.	.	H	α-helix	trans	-64.3	-26.9	175.4	-70.1	-30.7	0	0	0	113	I176 K177 E178 K183	I176-D180 PolarHBondContact O-N 3.23Å; K177-D180 PolarHBondContact O-N 3.27Å; E178-D180 VanDerWaalsContact C-N 3.3Å; E178-D180 PolarHBondContact O-N 2.92Å; D180-K183 IonicContact OD1-NZ 3.4Å; D180-K183 PolarHBondContact OD1-NZ 3.29Å
181	L	86.9	Confident	86.7	Confident	52 Å²	52	49.6 Å²	49.6	27%	0.272	24%	0.241	S	C	.	.	H	α-helix	trans	-74.3	-44.5	168.6	-62.7	176.9	0	0	0	111	K177 E178 I179 K183 R184 I253	K177-L181 PolarHBondContact O-N 3.24Å; E178-L181 WeakPolarHBondContact O-CB 3.39Å; E178-L181 PolarHBondContact O-N 3.02Å; E178-L181 VanDerWaalsContact O-N 3.12Å; I179-L181 PolarHBondContact O-N 3.05Å; L181-K183 PolarHBondContact O-N 3.1Å; L181-R184 VanDerWaalsContact O-CB 3.24Å; L181-R184 WeakPolarHBondContact O-CB 3.35Å; L181-R184 PolarHBondContact O-N 2.97Å; L181-I253 HydrophobicContact CB-CD1 3.8Å; L181-I253 HydrophobicContact CB-CG1 3.75Å; L181-I253 HydrophobicContact CD1-CG1 4.47Å; L181-I253 VanDerWaalsContact O-CD1 3.22Å; L181-I253 WeakPolarHBondContact O-CD1 3.48Å
182	L	87.7	Confident	87.6	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-56.3	-35.9	178.1	-68.7	176.7	0	0	0	112.6	E178 I179 R184 L185 Y193 I253 L276 L278	E178-L182 WeakPolarHBondContact O-CG 3.46Å; E178-L182 PolarHBondContact O-N 3.48Å; I179-L182 WeakPolarHBondContact O-CB 3.43Å; I179-L182 PolarHBondContact O-N 3.27Å; L182-R184 PolarHBondContact O-N 2.89Å; L182-L185 HydrophobicContact CD2-CD1 3.78Å; L182-L185 WeakPolarHBondContact O-CB 3.2Å; L182-L185 PolarHBondContact O-N 3.5Å; L182-Y193 HydrophobicContact CB-CD2 4.4Å; L182-I253 HydrophobicContact CD2-CG2 4.24Å; L182-L276 HydrophobicContact CD2-CB 3.72Å; L182-L278 HydrophobicContact CD1-CD1 3.99Å; L182-L278 HydrophobicContact CD1-CD2 4.26Å; L182-L278 HydrophobicContact CD1-CG 3.93Å
183	K	89.7	Confident	88.3	Confident	82 Å²	82	49.9 Å²	49.9	36%	0.357	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-23.5	173.1	-72.2	173.9	-171.1	164.8	0	113.8	I179 D180 L181 L185 Y193	I179-K183 WeakPolarHBondContact O-CG 3.39Å; I179-K183 PolarHBondContact O-N 2.93Å; D180-K183 IonicContact OD1-NZ 3.4Å; D180-K183 PolarHBondContact OD1-NZ 3.29Å; L181-K183 PolarHBondContact O-N 3.1Å; K183-L185 VanDerWaalsContact C-N 3.34Å; K183-Y193 HydrophobicContact CB-CE1 4.38Å; K183-Y193 VanDerWaalsContact CE-OH 3.25Å; K183-Y193 WeakPolarHBondContact CE-OH 3.47Å; K183-Y193 HydrophobicContact CG-CD1 4.11Å; K183-Y193 HydrophobicContact CG-CE1 3.52Å; K183-Y193 HydrophobicContact CG-CE2 4.18Å
184	R	90	Very high	88.8	Confident	157 Å²	157	46.3 Å²	46.3	59%	0.592	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-6.6	-178.2	-53	175.9	-175.3	-169.4	-3.2	113	L181 L182 D186	L181-R184 VanDerWaalsContact O-CB 3.24Å; L181-R184 WeakPolarHBondContact O-CB 3.35Å; L181-R184 PolarHBondContact O-N 2.97Å; L182-R184 PolarHBondContact O-N 2.89Å; R184-D186 PolarHBondContact O-N 2.87Å
185	L	92.2	Very high	89.5	Confident	6 Å²	6	45.2 Å²	45.2	3%	0.031	22%	0.217	C	C	.	.			trans	-80.6	104.4	178.4	-65.7	176	0	0	0	110.1	L182 K183 V190 M248 K251 I253 L276	L182-L185 HydrophobicContact CD2-CD1 3.78Å; L182-L185 WeakPolarHBondContact O-CB 3.2Å; L182-L185 PolarHBondContact O-N 3.5Å; K183-L185 VanDerWaalsContact C-N 3.34Å; L185-V190 HydrophobicContact CB-CG1 4.45Å; L185-V190 HydrophobicContact CD1-CG1 4.25Å; L185-M248 HydrophobicContact CD1-CE 4.3Å; L185-M248 HydrophobicContact CD1-CG 4.27Å; L185-M248 HydrophobicContact CD2-CB 4.32Å; L185-M248 HydrophobicContact CD2-CG 3.82Å; L185-K251 HydrophobicContact CD2-CB 4.45Å; L185-K251 HydrophobicContact CD2-CG 4.37Å; L185-I253 HydrophobicContact CD1-CD1 3.98Å; L185-I253 HydrophobicContact CD1-CG2 4.45Å; L185-I253 HydrophobicContact CD2-CD1 3.71Å; L185-I253 HydrophobicContact CG-CD1 3.67Å; L185-L276 HydrophobicContact CD1-CD1 3.97Å
186	D	93.7	Very high	90	Very high	124 Å²	124	46.5 Å²	46.5	66%	0.663	23%	0.227	S	C	*	.			trans	-126.7	104.7	165.9	-175.1	23.3	0	0	0	109.4	R184 H247	R184-D186 PolarHBondContact O-N 2.87Å; D186-H247 PolarHBondContact N-NE2 2.91Å; D186-H247 PolarHBondContact O-CE1 3.3Å; D186-H247 VanDerWaalsContact O-CE1 3.29Å; D186-H247 PolarHBondContact O-NE2 3.19Å; D186-H247 VanDerWaalsContact O-NE2 3.14Å
187	H	96.7	Very high	90.6	Very high	38 Å²	38	46 Å²	46	18%	0.176	22%	0.223	C	C	.	.			trans	-157.9	140.4	-177.6	-170.1	-95.7	0	0	0	111.2	N189 V190 S243 H247	H187-N189 PolarHBondContact CE1-OD1 2.96Å; H187-N189 PolarHBondContact ND1-N 3.35Å; H187-N189 PolarHBondContact O-N 2.79Å; H187-V190 HydrophobicContact CB-CB 4.26Å; H187-V190 HydrophobicContact CB-CG2 4.01Å; H187-V190 PolarHBondContact O-N 3.2Å; H187-S243 PolarHBondContact CE1-OG 3.26Å; H187-S243 PolarHBondContact NE2-OG 3.24Å; H187-H247 HydrophobicContact CB-CB 4.24Å; H187-H247 VanDerWaalsContact CB-CD2 3.44Å; H187-H247 WeakPolarHBondContact CB-CD2 3.09Å; H187-H247 AromaticContact CD2-CG 3.93Å; H187-H247 AromaticContact CG-CG 3.98Å
188	P	96.3	Very high	91	Very high	93 Å²	93	43.8 Å²	43.8	60%	0.604	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-31.3	-178.9	22	-35.2	0	0	0	114	K272	P188-K272 PolarHBondContact O-NZ 3.17Å
189	N	97.6	Very high	91.5	Very high	16 Å²	16	45.7 Å²	45.7	9%	0.086	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	17.5	-179	-54	118.8	0	0	0	115.2	H187 Q240 V271 L273	H187-N189 PolarHBondContact CE1-OD1 2.96Å; H187-N189 PolarHBondContact ND1-N 3.35Å; H187-N189 PolarHBondContact O-N 2.79Å; N189-Q240 WeakPolarHBondContact CB-O 3.32Å; N189-Q240 WeakPolarHBondContact ND2-CB 3.37Å; N189-Q240 PolarHBondContact ND2-OE1 3.03Å; N189-V271 VanDerWaalsContact CA-O 3.28Å; N189-V271 WeakPolarHBondContact CA-O 3.47Å; N189-V271 PolarHBondContact ND2-O 3.32Å; N189-L273 PolarHBondContact O-N 3.43Å
190	V	96.1	Very high	91.7	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.012	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-125.6	140.3	173.4	-177.7	0	0	0	0	108.1	L185 H187 R192 M248 L276	L185-V190 HydrophobicContact CB-CG1 4.45Å; L185-V190 HydrophobicContact CD1-CG1 4.25Å; H187-V190 HydrophobicContact CB-CB 4.26Å; H187-V190 HydrophobicContact CB-CG2 4.01Å; H187-V190 PolarHBondContact O-N 3.2Å; V190-R192 PolarHBondContact O-N 2.92Å; V190-M248 HydrophobicContact CG2-CG 4.16Å; V190-M248 HydrophobicContact CG2-SD 4.44Å; V190-L276 HydrophobicContact CG1-CD1 3.73Å; V190-L276 HydrophobicContact CG1-CD2 3.76Å; V190-L276 HydrophobicContact CG1-CG 4.41Å
191	I	93.9	Very high	91.7	Very high	7 Å²	7	52.5 Å²	52.5	4%	0.036	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-58.6	125.5	172.4	-72.8	-70.5	0	0	0	108.2	Y193 L207 E208 A210 F264 K272 L273 L276	I191-Y193 PolarHBondContact O-N 2.92Å; I191-L207 HydrophobicContact CG2-CB 4.01Å; I191-E208 HydrophobicContact CG2-CB 4.32Å; I191-A210 HydrophobicContact CD1-CB 3.52Å; I191-F264 HydrophobicContact CD1-CD2 4.21Å; I191-F264 HydrophobicContact CG1-CD2 4.22Å; I191-K272 HydrophobicContact CD1-CB 3.92Å; I191-K272 HydrophobicContact CD1-CD 4.02Å; I191-K272 HydrophobicContact CG1-CB 4.15Å; I191-L273 WeakPolarHBondContact CB-O 3.23Å; I191-L273 VanDerWaalsContact CG1-O 3.29Å; I191-L273 WeakPolarHBondContact CG1-O 3.44Å; I191-L273 PolarHBondContact N-O 3.42Å; I191-L276 WeakPolarHBondContact O-CD1 3.43Å
192	R	92.1	Very high	91.8	Very high	75 Å²	75	51.6 Å²	51.6	28%	0.283	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-74.9	127.9	-173.2	-167.5	163.7	57.1	113.2	6	110.9	L116 V190 L194 E208	L116-R192 VanDerWaalsContact CD2-NH2 3.31Å; V190-R192 PolarHBondContact O-N 2.92Å; R192-L194 HydrophobicContact CG-CD2 4.22Å; R192-L194 VanDerWaalsContact CZ-CD2 3.49Å; R192-E208 HydrophobicContact CB-CB 4.05Å; R192-E208 WeakPolarHBondContact CB-OE2 3.37Å; R192-E208 PolarHBondContact N-OE2 2.97Å; R192-E208 PolarHBondContact O-N 3.34Å
193	Y	91.8	Very high	91.9	Very high	30 Å²	30	51.6 Å²	51.6	12%	0.118	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	130.7	164.8	177.8	-79.6	0	0	0	109.3	I179 L182 K183 I191 S196 I205 L207	I179-Y193 HydrophobicContact CG2-CE2 4.14Å; L182-Y193 HydrophobicContact CB-CD2 4.4Å; K183-Y193 HydrophobicContact CB-CE1 4.38Å; K183-Y193 VanDerWaalsContact CE-OH 3.25Å; K183-Y193 WeakPolarHBondContact CE-OH 3.47Å; K183-Y193 HydrophobicContact CG-CD1 4.11Å; K183-Y193 HydrophobicContact CG-CE1 3.52Å; K183-Y193 HydrophobicContact CG-CE2 4.18Å; I191-Y193 PolarHBondContact O-N 2.92Å; Y193-S196 WeakPolarHBondContact OH-CB 3.48Å; Y193-S196 PolarHBondContact OH-N 3.29Å; Y193-S196 PolarHBondContact OH-OG 2.95Å; Y193-I205 HydrophobicContact CD2-CG2 3.92Å; Y193-I205 HydrophobicContact CE2-CG2 3.76Å; Y193-L207 HydrophobicContact CD2-CD2 4.37Å
194	L	91.3	Very high	92.1	Very high	13 Å²	13	47.7 Å²	47.7	7%	0.068	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-53.8	178.7	-54.5	175.9	0	0	0	110.8	L116 L120 F123 V156 R192 V206	L116-L194 HydrophobicContact CD2-CD2 4.23Å; L120-L194 HydrophobicContact CD2-CB 4.04Å; L120-L194 WeakPolarHBondContact CD2-O 3.36Å; F123-L194 HydrophobicContact CD2-CB 3.85Å; F123-L194 HydrophobicContact CE2-CB 3.73Å; F123-L194 HydrophobicContact CE2-CD1 3.89Å; F123-L194 HydrophobicContact CE2-CG 4.35Å; V156-L194 HydrophobicContact CG1-CD1 3.83Å; R192-L194 HydrophobicContact CG-CD2 4.22Å; R192-L194 VanDerWaalsContact CZ-CD2 3.49Å; L194-V206 WeakPolarHBondContact CA-O 3.4Å; L194-V206 HydrophobicContact CB-CB 4.3Å; L194-V206 HydrophobicContact CB-CG1 4.18Å; L194-V206 WeakPolarHBondContact CB-O 3.23Å; L194-V206 HydrophobicContact CD1-CG1 4.19Å; L194-V206 PolarHBondContact N-O 3.3Å
195	A	91.9	Very high	92.2	Very high	15 Å²	15	40.3 Å²	40.3	12%	0.124	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	171.6	-179.4	0	0	0	0	0	111.7	F123 V206	F123-A195 HydrophobicContact CB-CB 3.43Å; F123-A195 VanDerWaalsContact CB-CB 3.43Å; F123-A195 HydrophobicContact CD2-CB 4Å; F123-A195 HydrophobicContact CG-CB 4.26Å; A195-V206 HydrophobicContact CB-CB 4.27Å; A195-V206 HydrophobicContact CB-CG2 4.23Å; A195-V206 PolarHBondContact N-O 2.96Å; A195-V206 PolarHBondContact O-N 2.94Å
196	S	91.6	Very high	92.2	Very high	28 Å²	28	40 Å²	40	20%	0.196	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	147.5	166	69.1	0	0	0	0	110.2	Y193 I204	Y193-S196 WeakPolarHBondContact OH-CB 3.48Å; Y193-S196 PolarHBondContact OH-N 3.29Å; Y193-S196 PolarHBondContact OH-OG 2.95Å; S196-I204 CarbonylContact C-O 3.44Å; S196-I204 WeakPolarHBondContact CA-O 3.43Å; S196-I204 WeakPolarHBondContact CB-O 3.37Å
197	F	91.4	Very high	92.2	Very high	20 Å²	20	35.3 Å²	35.3	9%	0.088	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	161.5	174.1	56	-87.7	0	0	0	110.1	F123 L126 F129 E199 I204 V206	F123-F197 VanDerWaalsContact O-CD1 3.29Å; F123-F197 WeakPolarHBondContact O-CD1 3.45Å; L126-F197 HydrophobicContact CD2-CZ 4.31Å; L126-F197 HydrophobicContact CG-CE2 4.08Å; L126-F197 HydrophobicContact CG-CZ 4.23Å; F129-F197 HydrophobicContact CE2-CE1 4.06Å; F129-F197 HydrophobicContact CE2-CZ 4.2Å; F197-E199 HydrophobicContact CD2-CB 4.01Å; F197-E199 HydrophobicContact CE2-CB 4.07Å; F197-I204 HydrophobicContact CD1-CB 4.44Å; F197-I204 HydrophobicContact CD2-CB 4.17Å; F197-I204 HydrophobicContact CD2-CD1 4.27Å; F197-I204 HydrophobicContact CD2-CG1 4.44Å; F197-I204 HydrophobicContact CE1-CB 4.07Å; F197-I204 HydrophobicContact CE1-CG2 3.83Å; F197-I204 HydrophobicContact CE2-CB 3.77Å; F197-I204 HydrophobicContact CE2-CD1 4Å; F197-I204 HydrophobicContact CE2-CG1 3.84Å; F197-I204 HydrophobicContact CE2-CG2 4.16Å; F197-I204 HydrophobicContact CG-CB 4.49Å; F197-I204 HydrophobicContact CZ-CB 3.72Å; F197-I204 HydrophobicContact CZ-CG1 4.12Å; F197-I204 HydrophobicContact CZ-CG2 3.58Å; F197-I204 PolarHBondContact N-O 3.05Å; F197-I204 PolarHBondContact O-N 3.2Å; F197-V206 HydrophobicContact CD1-CG2 4.46Å; F197-V206 HydrophobicContact CE1-CG2 3.87Å
198	V	89.1	Confident	92	Very high	72 Å²	72	35.9 Å²	35.9	44%	0.436	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.4	173.9	176.6	0	0	0	0	107.9	I163 F164 E202 L203	I163-V198 HydrophobicContact CD1-CG2 4.14Å; F164-V198 HydrophobicContact CE2-CG1 3.8Å; F164-V198 HydrophobicContact CZ-CG1 4.35Å; V198-E202 CarbonylContact C-O 3.59Å; V198-E202 VanDerWaalsContact CA-O 3.28Å; V198-E202 WeakPolarHBondContact CA-O 3.43Å; V198-L203 HydrophobicContact CG2-CD1 4.26Å
199	E	90.6	Very high	91.7	Very high	49 Å²	49	32.6 Å²	32.6	23%	0.229	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	141.3	176.9	-166.9	171.2	-123.7	0	0	108.6	S125 L126 F197 N201 E202 I204	S125-E199 WeakPolarHBondContact CB-OE1 3.16Å; S125-E199 PolarHBondContact OG-OE1 3.22Å; L126-E199 WeakPolarHBondContact CA-OE2 3.47Å; L126-E199 WeakPolarHBondContact CB-OE2 3.41Å; L126-E199 WeakPolarHBondContact CD1-OE2 3.43Å; L126-E199 WeakPolarHBondContact CG-OE2 3.4Å; L126-E199 PolarHBondContact N-OE2 3.05Å; F197-E199 HydrophobicContact CD2-CB 4.01Å; F197-E199 HydrophobicContact CE2-CB 4.07Å; E199-N201 VanDerWaalsContact C-N 3.25Å; E199-N201 PolarHBondContact O-N 3.48Å; E199-E202 PolarHBondContact N-O 3.09Å; E199-E202 PolarHBondContact O-N 3.06Å; E199-E202 VanDerWaalsContact O-O 3.1Å; E199-I204 HydrophobicContact CB-CD1 4.06Å
200	N	88.7	Confident	91.3	Very high	108 Å²	108	33 Å²	33	58%	0.578	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	37.7	-179.6	-55.5	-35.5	0	0	0	114.6	E202	N200-E202 PolarHBondContact O-N 3.34Å
201	N	86.3	Confident	90.3	Very high	108 Å²	108	36.8 Å²	36.8	58%	0.578	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	28.8	-175.3	-58.7	-25.4	0	0	0	113.8	F164 E199	F164-N201 HydrophobicContact CB-CB 4.01Å; F164-N201 VanDerWaalsContact CD2-CA 3.42Å; F164-N201 HydrophobicContact CD2-CB 3.65Å; F164-N201 WeakPolarHBondContact CD2-O 3.22Å; F164-N201 HydrophobicContact CE2-CB 4.21Å; F164-N201 HydrophobicContact CG-CB 3.83Å; E199-N201 VanDerWaalsContact C-N 3.25Å; E199-N201 PolarHBondContact O-N 3.48Å
202	E	89.9	Confident	89.6	Confident	33 Å²	33	37.4 Å²	37.4	15%	0.154	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	148.6	170.5	-63.1	-177.3	136	0	0	108.6	L29 V160 I161 V198 E199 N200 I204	L29-E202 WeakPolarHBondContact CD1-OE2 3.35Å; V160-E202 HydrophobicContact CG1-CB 3.9Å; V160-E202 HydrophobicContact CG1-CG 4.23Å; V160-E202 VanDerWaalsContact CG1-OE2 3.23Å; V160-E202 WeakPolarHBondContact CG1-OE2 3.49Å; I161-E202 CarbonylContact O-C 3.51Å; I161-E202 WeakPolarHBondContact O-CA 3.37Å; V198-E202 CarbonylContact C-O 3.59Å; V198-E202 VanDerWaalsContact CA-O 3.28Å; V198-E202 WeakPolarHBondContact CA-O 3.43Å; E199-E202 PolarHBondContact N-O 3.09Å; E199-E202 PolarHBondContact O-N 3.06Å; E199-E202 VanDerWaalsContact O-O 3.1Å; N200-E202 PolarHBondContact O-N 3.34Å; E202-I204 HydrophobicContact CB-CD1 4.15Å; E202-I204 VanDerWaalsContact O-CD1 3.28Å; E202-I204 WeakPolarHBondContact O-CD1 3.25Å
203	L	89.7	Confident	89.3	Confident	7 Å²	7	34.3 Å²	34.3	4%	0.037	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.1	169.5	165.3	73.2	0	0	0	108	V160 I161 I163 I179 V198 I205	V160-L203 CarbonylContact C-O 3.53Å; I161-L203 HydrophobicContact CB-CB 4.22Å; I161-L203 HydrophobicContact CB-CD2 4.25Å; I161-L203 HydrophobicContact CD1-CD2 3.76Å; I161-L203 HydrophobicContact CD1-CG 4.43Å; I161-L203 PolarHBondContact N-O 2.86Å; I161-L203 PolarHBondContact O-N 3.33Å; I163-L203 HydrophobicContact CB-CB 4.37Å; I163-L203 HydrophobicContact CD1-CB 3.86Å; I163-L203 HydrophobicContact CG1-CB 3.86Å; I163-L203 HydrophobicContact CG2-CB 3.59Å; I163-L203 HydrophobicContact CG2-CD2 3.75Å; I163-L203 HydrophobicContact CG2-CG 4.37Å; I179-L203 HydrophobicContact CD1-CD1 3.9Å; I179-L203 HydrophobicContact CD1-CD2 3.1Å; I179-L203 HydrophobicContact CD1-CG 4.06Å; I179-L203 HydrophobicContact CG1-CD2 4.27Å; V198-L203 HydrophobicContact CG2-CD1 4.26Å; L203-I205 HydrophobicContact CD2-CD1 4.34Å; L203-I205 HydrophobicContact CD2-CG1 4.38Å; L203-I205 HydrophobicContact CG-CG1 4.21Å
204	I	92.7	Very high	89.3	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.6	177.1	-60.9	71.7	0	0	0	107.6	L126 L158 V160 S196 F197 E199 E202	L126-I204 HydrophobicContact CD1-CD1 4.45Å; L126-I204 HydrophobicContact CD1-CG1 4.29Å; L126-I204 HydrophobicContact CD2-CG1 4Å; L126-I204 HydrophobicContact CD2-CG2 4.26Å; L126-I204 HydrophobicContact CG-CG1 4.17Å; L158-I204 HydrophobicContact CB-CG2 4.46Å; L158-I204 HydrophobicContact CD2-CG2 4.27Å; V160-I204 HydrophobicContact CG2-CG1 4.44Å; S196-I204 CarbonylContact C-O 3.44Å; S196-I204 WeakPolarHBondContact CA-O 3.43Å; S196-I204 WeakPolarHBondContact CB-O 3.37Å; F197-I204 HydrophobicContact CD1-CB 4.44Å; F197-I204 HydrophobicContact CD2-CB 4.17Å; F197-I204 HydrophobicContact CD2-CD1 4.27Å; F197-I204 HydrophobicContact CD2-CG1 4.44Å; F197-I204 HydrophobicContact CE1-CB 4.07Å; F197-I204 HydrophobicContact CE1-CG2 3.83Å; F197-I204 HydrophobicContact CE2-CB 3.77Å; F197-I204 HydrophobicContact CE2-CD1 4Å; F197-I204 HydrophobicContact CE2-CG1 3.84Å; F197-I204 HydrophobicContact CE2-CG2 4.16Å; F197-I204 HydrophobicContact CG-CB 4.49Å; F197-I204 HydrophobicContact CZ-CB 3.72Å; F197-I204 HydrophobicContact CZ-CG1 4.12Å; F197-I204 HydrophobicContact CZ-CG2 3.58Å; F197-I204 PolarHBondContact N-O 3.05Å; F197-I204 PolarHBondContact O-N 3.2Å; E199-I204 HydrophobicContact CB-CD1 4.06Å; E202-I204 HydrophobicContact CB-CD1 4.15Å; E202-I204 VanDerWaalsContact O-CD1 3.28Å; E202-I204 WeakPolarHBondContact O-CD1 3.25Å
205	I	92	Very high	89.4	Confident	3 Å²	3	33.4 Å²	33.4	2%	0.015	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.2	172	-53.8	177.4	0	0	0	108.4	L158 K159 I161 I179 Y193 L203 L207 L278	L158-I205 WeakPolarHBondContact CA-O 3.45Å; K159-I205 HydrophobicContact CB-CB 4.35Å; K159-I205 PolarHBondContact N-O 2.75Å; K159-I205 PolarHBondContact O-N 3.42Å; I161-I205 HydrophobicContact CD1-CD1 3.62Å; I161-I205 HydrophobicContact CD1-CG1 4.26Å; I179-I205 HydrophobicContact CD1-CD1 4.5Å; I179-I205 HydrophobicContact CG1-CD1 4.21Å; Y193-I205 HydrophobicContact CD2-CG2 3.92Å; Y193-I205 HydrophobicContact CE2-CG2 3.76Å; L203-I205 HydrophobicContact CD2-CD1 4.34Å; L203-I205 HydrophobicContact CD2-CG1 4.38Å; L203-I205 HydrophobicContact CG-CG1 4.21Å; I205-L207 HydrophobicContact CG2-CD2 3.73Å; I205-L207 HydrophobicContact CG2-CG 4.01Å; I205-L278 HydrophobicContact CD1-CD1 3.44Å; I205-L278 VanDerWaalsContact CD1-CD1 3.44Å
206	V	93.5	Very high	89.5	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	119.8	177.5	-167.3	0	0	0	0	108.6	F123 F129 V156 L158 L194 A195 F197	F123-V206 HydrophobicContact CB-CG2 4.37Å; F123-V206 HydrophobicContact CD2-CB 4.28Å; F123-V206 HydrophobicContact CD2-CG1 3.81Å; F123-V206 HydrophobicContact CE2-CG1 4.03Å; F123-V206 HydrophobicContact CG-CG1 4.39Å; F129-V206 HydrophobicContact CE1-CG1 4.1Å; F129-V206 HydrophobicContact CE2-CG2 4.43Å; F129-V206 HydrophobicContact CZ-CG1 4.11Å; F129-V206 HydrophobicContact CZ-CG2 3.93Å; V156-V206 HydrophobicContact CB-CG1 4.02Å; V156-V206 HydrophobicContact CG1-CG1 4.08Å; V156-V206 HydrophobicContact CG2-CG1 4.16Å; L158-V206 HydrophobicContact CD2-CB 4.24Å; L158-V206 HydrophobicContact CD2-CG1 3.99Å; L158-V206 HydrophobicContact CD2-CG2 3.85Å; L194-V206 WeakPolarHBondContact CA-O 3.4Å; L194-V206 HydrophobicContact CB-CB 4.3Å; L194-V206 HydrophobicContact CB-CG1 4.18Å; L194-V206 WeakPolarHBondContact CB-O 3.23Å; L194-V206 HydrophobicContact CD1-CG1 4.19Å; L194-V206 PolarHBondContact N-O 3.3Å; A195-V206 HydrophobicContact CB-CB 4.27Å; A195-V206 HydrophobicContact CB-CG2 4.23Å; A195-V206 PolarHBondContact N-O 2.96Å; A195-V206 PolarHBondContact O-N 2.94Å; F197-V206 HydrophobicContact CD1-CG2 4.46Å; F197-V206 HydrophobicContact CE1-CG2 3.87Å
207	L	92.9	Very high	89.5	Confident	24 Å²	24	35.4 Å²	35.4	13%	0.126	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	155.1	-177.2	-59.6	174.8	0	0	0	110.7	V156 A157 I191 Y193 I205 L209	V156-L207 WeakPolarHBondContact CA-O 3.17Å; V156-L207 WeakPolarHBondContact CB-O 3.35Å; A157-L207 HydrophobicContact CB-CB 4.31Å; A157-L207 PolarHBondContact N-O 3.45Å; A157-L207 PolarHBondContact O-N 3.46Å; I191-L207 HydrophobicContact CG2-CB 4.01Å; Y193-L207 HydrophobicContact CD2-CD2 4.37Å; I205-L207 HydrophobicContact CG2-CD2 3.73Å; I205-L207 HydrophobicContact CG2-CG 4.01Å; L207-L209 PolarHBondContact O-N 3.41Å
208	E	92	Very high	89.6	Confident	50 Å²	50	34.4 Å²	34.4	23%	0.234	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	130.9	162	175.6	-176.2	-174.8	0	0	110	I191 R192 K272	I191-E208 HydrophobicContact CG2-CB 4.32Å; R192-E208 HydrophobicContact CB-CB 4.05Å; R192-E208 WeakPolarHBondContact CB-OE2 3.37Å; R192-E208 PolarHBondContact N-OE2 2.97Å; R192-E208 PolarHBondContact O-N 3.34Å; E208-K272 VanDerWaalsContact CD-NZ 3.29Å; E208-K272 WeakPolarHBondContact OE1-CE 3.41Å; E208-K272 IonicContact OE1-NZ 3.89Å; E208-K272 PolarHBondContact OE1-NZ 3.19Å; E208-K272 IonicContact OE2-NZ 2.77Å; E208-K272 PolarHBondContact OE2-NZ 2.98Å
209	L	91.4	Very high	89.9	Confident	24 Å²	24	31.2 Å²	31.2	13%	0.126	17%	0.172	C	C	.	.			trans	-79.7	127.3	171.6	-174.6	69.7	0	0	0	109.5	I135 R145 N155 A157 L207 D211	I135-L209 HydrophobicContact CD1-CD1 4.05Å; R145-L209 HydrophobicContact CG-CD1 4.37Å; R145-L209 HydrophobicContact CG-CD2 3.83Å; N155-L209 HydrophobicContact CB-CD2 3.84Å; A157-L209 HydrophobicContact CB-CD1 4.03Å; L207-L209 PolarHBondContact O-N 3.41Å; L209-D211 HydrophobicContact CD2-CB 4.17Å; L209-D211 HydrophobicContact CG-CB 4.23Å
210	A	87.7	Confident	90.1	Very high	26 Å²	26	32.6 Å²	32.6	22%	0.215	18%	0.177	C	C	.	.			trans	-110.9	104.5	165.8	0	0	0	0	0	109.2	I191 F264	I191-A210 HydrophobicContact CD1-CB 3.52Å; A210-F264 HydrophobicContact CB-CB 3.66Å; A210-F264 HydrophobicContact CB-CD1 3.73Å; A210-F264 HydrophobicContact CB-CD2 4.15Å; A210-F264 HydrophobicContact CB-CE1 4.45Å; A210-F264 HydrophobicContact CB-CG 3.55Å
211	D	77.1	Confident	90.3	Very high	80 Å²	80	28 Å²	28	43%	0.428	15%	0.152	S	C	.	.			trans	-112.5	3.2	-174.5	61.4	-10.3	0	0	0	113.7	R145 L209 G213	R145-D211 IonicContact NH2-OD2 3.84Å; L209-D211 HydrophobicContact CD2-CB 4.17Å; L209-D211 HydrophobicContact CG-CB 4.23Å; D211-G213 PolarHBondContact O-N 2.47Å
212	A	77.5	Confident	90.7	Very high	20 Å²	20	22.8 Å²	22.8	17%	0.165	12%	0.124	C	C	.	.	S	Bend	trans	-83.2	14.4	179.7	0	0	0	0	0	113.8	F44 I265 N266	F44-A212 CarbonylContact C-O 3.49Å; F44-A212 WeakPolarHBondContact CA-O 2.94Å; A212-I265 CarbonylContact C-O 3.52Å; A212-N266 HydrophobicContact CB-CB 3.62Å
213	G	86.5	Confident	91	Very high	11 Å²	11	28.4 Å²	28.4	11%	0.113	14%	0.144	C	C	.	.			trans	89.6	-175.9	179.4	0	0	0	0	0	114.2	D211 F264 I265	D211-G213 PolarHBondContact O-N 2.47Å; G213-F264 WeakPolarHBondContact O-CA 3.34Å; G213-I265 PolarHBondContact O-N 3.23Å
214	D	91.7	Very high	91.2	Very high	23 Å²	23	33.4 Å²	33.4	12%	0.123	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-141.2	168.4	-170.1	62.4	66.8	0	0	0	112.5	S216 H217 M218 V263 F264	D214-S216 PolarHBondContact O-N 3.3Å; D214-S216 VanDerWaalsContact OD1-CA 3.26Å; D214-S216 WeakPolarHBondContact OD1-CA 3.45Å; D214-S216 WeakPolarHBondContact OD1-CB 3.49Å; D214-S216 PolarHBondContact OD1-N 3.05Å; D214-H217 PolarHBondContact O-N 3.22Å; D214-H217 IonicContact OD1-CG 2.77Å; D214-H217 PolarHBondContact OD1-N 2.84Å; D214-H217 IonicContact OD1-ND1 2.74Å; D214-H217 PolarHBondContact OD1-ND1 2.81Å; D214-H217 VanDerWaalsContact OD1-ND1 3.12Å; D214-H217 IonicContact OD2-CE1 3.03Å; D214-H217 PolarHBondContact OD2-CE1 2.91Å; D214-H217 VanDerWaalsContact OD2-CE1 3.31Å; D214-H217 IonicContact OD2-CG 2.77Å; D214-H217 IonicContact OD2-ND1 2.79Å; D214-H217 PolarHBondContact OD2-ND1 3.22Å; D214-M218 PolarHBondContact O-N 3.45Å; D214-V263 CarbonylContact C-O 3.5Å; D214-V263 WeakPolarHBondContact CA-O 3.4Å; D214-V263 WeakPolarHBondContact CB-O 3.48Å; D214-F264 HydrophobicContact CB-CD1 4.45Å
215	L	94.3	Very high	91.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-26.4	-178.5	-175.6	64.8	0	0	0	112.3	M218 I219 I241 P260 V263 I265 L321 M325	L215-M218 HydrophobicContact CD1-CB 4.45Å; L215-M218 HydrophobicContact CD1-SD 4.09Å; L215-M218 PolarHBondContact O-N 3.33Å; L215-I219 HydrophobicContact CG-CD1 4Å; L215-I219 WeakPolarHBondContact O-CD1 3.48Å; L215-I219 WeakPolarHBondContact O-CG1 3.48Å; L215-I219 PolarHBondContact O-N 2.77Å; L215-I241 HydrophobicContact CD2-CD1 4.32Å; L215-P260 HydrophobicContact CB-CB 4.07Å; L215-P260 WeakPolarHBondContact CB-O 3.37Å; L215-P260 HydrophobicContact CD2-CB 4.34Å; L215-P260 HydrophobicContact CG-CB 4.16Å; L215-P260 PolarHBondContact N-O 3.07Å; L215-V263 HydrophobicContact CB-CB 3.96Å; L215-V263 HydrophobicContact CB-CG1 4.17Å; L215-V263 HydrophobicContact CD2-CB 4.33Å; L215-V263 HydrophobicContact CD2-CG1 4.3Å; L215-V263 PolarHBondContact N-O 2.99Å; L215-I265 HydrophobicContact CB-CD1 4.03Å; L215-I265 HydrophobicContact CD1-CD1 3.76Å; L215-I265 HydrophobicContact CG-CD1 4.49Å; L215-L321 HydrophobicContact CD2-CD1 4.17Å; L215-L321 HydrophobicContact CD2-CD2 3.89Å; L215-L321 HydrophobicContact CD2-CG 4.08Å; L215-M325 HydrophobicContact CD1-CE 4Å; L215-M325 HydrophobicContact CD1-CG 4.22Å; L215-M325 HydrophobicContact CD1-SD 4.44Å; L215-M325 HydrophobicContact CD2-CE 4.41Å; L215-M325 HydrophobicContact CD2-CG 3.83Å; L215-M325 HydrophobicContact CD2-SD 3.84Å; L215-M325 HydrophobicContact CG-CG 4.4Å
216	S	93.2	Very high	91.4	Very high	30 Å²	30	48.6 Å²	48.6	21%	0.21	23%	0.232	C	C	.	.	H	α-helix	trans	-64	-43.9	174.3	-168.7	0	0	0	0	110.8	D214 M218 I219 K220 P260	D214-S216 PolarHBondContact O-N 3.3Å; D214-S216 VanDerWaalsContact OD1-CA 3.26Å; D214-S216 WeakPolarHBondContact OD1-CA 3.45Å; D214-S216 WeakPolarHBondContact OD1-CB 3.49Å; D214-S216 PolarHBondContact OD1-N 3.05Å; S216-M218 VanDerWaalsContact C-N 3.34Å; S216-M218 PolarHBondContact O-N 3.26Å; S216-I219 PolarHBondContact O-N 3.38Å; S216-K220 WeakPolarHBondContact O-CB 3.36Å; S216-K220 VanDerWaalsContact O-CG 3.3Å; S216-K220 WeakPolarHBondContact O-CG 3.48Å; S216-K220 PolarHBondContact O-N 3.34Å; S216-P260 PolarHBondContact N-O 2.78Å
217	H	91.8	Very high	91.5	Very high	55 Å²	55	52.3 Å²	52.3	26%	0.255	25%	0.245	S	C	.	.	H	α-helix	trans	-61.4	-41.2	174.1	-75	88.3	0	0	0	112.3	D214 K220 H221	D214-H217 PolarHBondContact O-N 3.22Å; D214-H217 IonicContact OD1-CG 2.77Å; D214-H217 PolarHBondContact OD1-N 2.84Å; D214-H217 IonicContact OD1-ND1 2.74Å; D214-H217 PolarHBondContact OD1-ND1 2.81Å; D214-H217 VanDerWaalsContact OD1-ND1 3.12Å; D214-H217 IonicContact OD2-CE1 3.03Å; D214-H217 PolarHBondContact OD2-CE1 2.91Å; D214-H217 VanDerWaalsContact OD2-CE1 3.31Å; D214-H217 IonicContact OD2-CG 2.77Å; D214-H217 IonicContact OD2-ND1 2.79Å; D214-H217 PolarHBondContact OD2-ND1 3.22Å; H217-K220 PolarHBondContact O-N 3.48Å; H217-H221 PolarHBondContact O-N 3.19Å
218	M	93.5	Very high	91.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.5	-49.3	173.8	175.3	175.4	-84.5	0	0	111.8	F45 D214 L215 S216 K220 H221 F222 I229 Y237 I265	F45-M218 HydrophobicContact CB-CE 3.98Å; F45-M218 HydrophobicContact CD1-CB 4.23Å; F45-M218 HydrophobicContact CD1-CE 4.28Å; F45-M218 HydrophobicContact CD2-CE 3.33Å; F45-M218 HydrophobicContact CE1-CB 3.92Å; F45-M218 HydrophobicContact CE2-CE 3.85Å; F45-M218 HydrophobicContact CE2-CG 4.23Å; F45-M218 HydrophobicContact CG-CE 3.6Å; F45-M218 HydrophobicContact CZ-CB 4.07Å; F45-M218 HydrophobicContact CZ-CG 4.21Å; D214-M218 PolarHBondContact O-N 3.45Å; L215-M218 HydrophobicContact CD1-CB 4.45Å; L215-M218 HydrophobicContact CD1-SD 4.09Å; L215-M218 PolarHBondContact O-N 3.33Å; S216-M218 VanDerWaalsContact C-N 3.34Å; S216-M218 PolarHBondContact O-N 3.26Å; M218-K220 VanDerWaalsContact C-N 3.32Å; M218-K220 PolarHBondContact O-N 3.07Å; M218-H221 WeakPolarHBondContact O-CB 3.36Å; M218-H221 PolarHBondContact O-N 3.47Å; M218-F222 HydrophobicContact CG-CD2 3.98Å; M218-F222 HydrophobicContact CG-CE2 4.09Å; M218-F222 WeakPolarHBondContact O-CD2 3.49Å; M218-F222 PolarHBondContact O-N 2.86Å; M218-F222 VanDerWaalsContact O-N 3.09Å; M218-I229 HydrophobicContact CG-CD1 4.19Å; M218-I229 HydrophobicContact SD-CD1 4.37Å; M218-Y237 HydrophobicContact CE-CE2 3.55Å; M218-Y237 HydrophobicContact SD-CD2 4.11Å; M218-Y237 HydrophobicContact SD-CE2 3.59Å; M218-Y237 VanDerWaalsContact SD-CE2 3.59Å; M218-I265 HydrophobicContact SD-CD1 4.32Å
219	I	95.3	Very high	91.9	Very high	5 Å²	5	51.9 Å²	51.9	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-59.2	-44.7	178.4	-72.4	157	0	0	0	110.8	L215 S216 H221 F222 R223 I229 P260 E324 L328	L215-I219 HydrophobicContact CG-CD1 4Å; L215-I219 WeakPolarHBondContact O-CD1 3.48Å; L215-I219 WeakPolarHBondContact O-CG1 3.48Å; L215-I219 PolarHBondContact O-N 2.77Å; S216-I219 PolarHBondContact O-N 3.38Å; I219-H221 VanDerWaalsContact C-N 3.35Å; I219-H221 PolarHBondContact O-N 2.8Å; I219-F222 PolarHBondContact O-N 3.46Å; I219-R223 WeakPolarHBondContact O-CB 3.48Å; I219-R223 PolarHBondContact O-N 3.19Å; I219-I229 HydrophobicContact CG1-CD1 4.29Å; I219-P260 HydrophobicContact CD1-CB 3.81Å; I219-P260 HydrophobicContact CD1-CG 3.77Å; I219-E324 HydrophobicContact CD1-CG 3.97Å; I219-E324 HydrophobicContact CG2-CG 4.5Å; I219-L328 HydrophobicContact CG2-CB 4.25Å; I219-L328 HydrophobicContact CG2-CD2 4.27Å
220	K	93.8	Very high	92.1	Very high	77 Å²	77	52.7 Å²	52.7	34%	0.335	25%	0.251	S	S	.	.	H	α-helix	trans	-59.6	-42.3	176.3	-73.5	176.8	-177.2	-174.7	0	112.4	L59 S216 H217 M218 R223 K224	L59-K220 HydrophobicContact CD2-CB 4.08Å; S216-K220 WeakPolarHBondContact O-CB 3.36Å; S216-K220 VanDerWaalsContact O-CG 3.3Å; S216-K220 WeakPolarHBondContact O-CG 3.48Å; S216-K220 PolarHBondContact O-N 3.34Å; H217-K220 PolarHBondContact O-N 3.48Å; M218-K220 VanDerWaalsContact C-N 3.32Å; M218-K220 PolarHBondContact O-N 3.07Å; K220-R223 PolarHBondContact O-N 3.23Å; K220-K224 WeakPolarHBondContact O-CB 3.31Å; K220-K224 PolarHBondContact O-N 2.87Å
221	H	93.3	Very high	92.6	Very high	11 Å²	11	52.9 Å²	52.9	5%	0.051	25%	0.248	C	C	.	.	H	α-helix	trans	-60	-51.7	177.1	171.9	80.1	0	0	0	111.9	F45 D47 L59 H217 M218 I219 R223 K224 K225	F45-H221 AromaticContact CE2-CD2 3.96Å; F45-H221 HydrophobicContact CZ-CB 3.76Å; F45-H221 AromaticContact CZ-CD2 3.79Å; F45-H221 AromaticContact CZ-CG 3.81Å; D47-H221 IonicContact OD2-CD2 3.35Å; D47-H221 IonicContact OD2-NE2 2.99Å; D47-H221 PolarHBondContact OD2-NE2 2.87Å; L59-H221 HydrophobicContact CD1-CB 4.44Å; L59-H221 HydrophobicContact CD2-CB 4.24Å; H217-H221 PolarHBondContact O-N 3.19Å; M218-H221 WeakPolarHBondContact O-CB 3.36Å; M218-H221 PolarHBondContact O-N 3.47Å; I219-H221 VanDerWaalsContact C-N 3.35Å; I219-H221 PolarHBondContact O-N 2.8Å; H221-R223 VanDerWaalsContact C-N 3.31Å; H221-R223 PolarHBondContact O-N 2.89Å; H221-K224 PolarHBondContact O-N 3.42Å; H221-K225 WeakPolarHBondContact O-CG 3.49Å; H221-K225 PolarHBondContact O-N 3.37Å
222	F	95.4	Very high	93.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.1	-40.5	178.4	-88.9	-91.8	0	0	0	112	F45 P48 M218 I219 K225 K226 R227 L228 I229 L328	F45-F222 HydrophobicContact CE2-CE2 4.48Å; P48-F222 HydrophobicContact CG-CE2 4.49Å; P48-F222 HydrophobicContact CG-CZ 3.76Å; M218-F222 HydrophobicContact CG-CD2 3.98Å; M218-F222 HydrophobicContact CG-CE2 4.09Å; M218-F222 WeakPolarHBondContact O-CD2 3.49Å; M218-F222 PolarHBondContact O-N 2.86Å; M218-F222 VanDerWaalsContact O-N 3.09Å; I219-F222 PolarHBondContact O-N 3.46Å; F222-K225 CarbonylContact O-C 3.52Å; F222-K225 PolarHBondContact O-N 2.9Å; F222-K226 PolarHBondContact O-N 3.46Å; F222-R227 CarbonylContact C-O 3.56Å; F222-R227 WeakPolarHBondContact CB-O 3.37Å; F222-R227 WeakPolarHBondContact CD1-O 3.19Å; F222-R227 PolarHBondContact O-N 3.16Å; F222-R227 VanDerWaalsContact O-O 3.07Å; F222-L228 WeakPolarHBondContact CD1-O 3.37Å; F222-L228 WeakPolarHBondContact CE1-O 3.41Å; F222-I229 HydrophobicContact CB-CG1 4.06Å; F222-I229 HydrophobicContact CD1-CB 4.48Å; F222-I229 HydrophobicContact CD1-CG1 3.79Å; F222-I229 HydrophobicContact CD2-CD1 4.28Å; F222-I229 HydrophobicContact CD2-CG1 3.74Å; F222-I229 HydrophobicContact CE1-CB 4.49Å; F222-I229 HydrophobicContact CE1-CG1 4.12Å; F222-I229 HydrophobicContact CE2-CG1 4.09Å; F222-I229 HydrophobicContact CG-CD1 4.43Å; F222-I229 HydrophobicContact CG-CG1 3.58Å; F222-I229 HydrophobicContact CZ-CG1 4.26Å; F222-L328 HydrophobicContact CB-CD1 4.19Å; F222-L328 HydrophobicContact CB-CD2 3.89Å
223	R	95.2	Very high	94.4	Very high	151 Å²	151	53.5 Å²	53.5	57%	0.57	24%	0.244	S	C	*	.	H	α-helix	trans	-61.7	-46.2	174.7	-172	175.1	60.8	126.1	3.2	112	I219 K220 H221 K225 K226 L328	I219-R223 WeakPolarHBondContact O-CB 3.48Å; I219-R223 PolarHBondContact O-N 3.19Å; K220-R223 PolarHBondContact O-N 3.23Å; H221-R223 VanDerWaalsContact C-N 3.31Å; H221-R223 PolarHBondContact O-N 2.89Å; R223-K225 VanDerWaalsContact C-N 3.29Å; R223-K225 PolarHBondContact O-N 3.35Å; R223-K226 PolarHBondContact O-N 3.22Å; R223-L328 HydrophobicContact CB-CB 4.33Å; R223-L328 HydrophobicContact CB-CD1 4.26Å
224	K	94.6	Very high	95	Very high	111 Å²	111	53 Å²	53	48%	0.483	24%	0.239	S	C	.	.	H	α-helix	trans	-60.7	-38.8	176.7	-175.8	178.5	-179.3	178.2	0	111.7	E58 K220 H221 K226	E58-K224 PolarHBondContact O-NZ 3.28Å; K220-K224 WeakPolarHBondContact O-CB 3.31Å; K220-K224 PolarHBondContact O-N 2.87Å; H221-K224 PolarHBondContact O-N 3.42Å; K224-K226 PolarHBondContact O-N 3.47Å
225	K	93.9	Very high	95.3	Very high	125 Å²	125	51.9 Å²	51.9	54%	0.543	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	1.3	176.1	-62.9	-69.3	-175.4	171.2	0	113.6	H221 F222 R223 R227	H221-K225 WeakPolarHBondContact O-CG 3.49Å; H221-K225 PolarHBondContact O-N 3.37Å; F222-K225 CarbonylContact O-C 3.52Å; F222-K225 PolarHBondContact O-N 2.9Å; R223-K225 VanDerWaalsContact C-N 3.29Å; R223-K225 PolarHBondContact O-N 3.35Å; K225-R227 PolarHBondContact O-N 3.44Å
226	K	95.2	Very high	95.4	Very high	198 Å²	198	55.7 Å²	55.7	86%	0.861	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	42.9	-178.5	-60	-176.3	179.3	-179.2	0	112.8	F222 R223 K224	F222-K226 PolarHBondContact O-N 3.46Å; R223-K226 PolarHBondContact O-N 3.22Å; K224-K226 PolarHBondContact O-N 3.47Å
227	R	94.7	Very high	95.6	Very high	77 Å²	77	54.6 Å²	54.6	29%	0.291	24%	0.24	S	C	.	.			trans	-137.6	140	-175.3	-159.9	167.8	57	76.9	6.7	109.6	D47 T49 F222 K225 L328	D47-R227 VanDerWaalsContact CG-NH2 3.28Å; D47-R227 IonicContact OD1-CZ 3.15Å; D47-R227 IonicContact OD1-NH2 3.73Å; D47-R227 PolarHBondContact OD1-NH2 3.1Å; D47-R227 IonicContact OD2-NH2 3.97Å; D47-R227 PolarHBondContact OD2-NH2 2.83Å; T49-R227 PolarHBondContact OG1-NH1 3.47Å; T49-R227 PolarHBondContact OG1-NH2 3.44Å; F222-R227 CarbonylContact C-O 3.56Å; F222-R227 WeakPolarHBondContact CB-O 3.37Å; F222-R227 WeakPolarHBondContact CD1-O 3.19Å; F222-R227 PolarHBondContact O-N 3.16Å; F222-R227 VanDerWaalsContact O-O 3.07Å; K225-R227 PolarHBondContact O-N 3.44Å; R227-L328 WeakPolarHBondContact O-CD1 3.45Å
228	L	96.5	Very high	96	Very high	64 Å²	64	52 Å²	52	34%	0.335	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-79.9	153.3	-179.8	-61.9	178.5	0	0	0	111.4	F222 L328 I358 Y359	F222-L228 WeakPolarHBondContact CD1-O 3.37Å; F222-L228 WeakPolarHBondContact CE1-O 3.41Å; L228-L328 HydrophobicContact CD2-CD1 3.93Å; L228-L328 HydrophobicContact CD2-CG 4.11Å; L228-I358 HydrophobicContact CD1-CD1 3.57Å; L228-I358 HydrophobicContact CD1-CG2 4.05Å; L228-Y359 HydrophobicContact CD1-CE2 4.33Å
229	I	97	Very high	96.2	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-71.9	127.6	172.5	-60.3	176.3	0	0	0	107.9	M218 I219 F222 E231 T233 I234 M325 L328 Y359	M218-I229 HydrophobicContact CG-CD1 4.19Å; M218-I229 HydrophobicContact SD-CD1 4.37Å; I219-I229 HydrophobicContact CG1-CD1 4.29Å; F222-I229 HydrophobicContact CB-CG1 4.06Å; F222-I229 HydrophobicContact CD1-CB 4.48Å; F222-I229 HydrophobicContact CD1-CG1 3.79Å; F222-I229 HydrophobicContact CD2-CD1 4.28Å; F222-I229 HydrophobicContact CD2-CG1 3.74Å; F222-I229 HydrophobicContact CE1-CB 4.49Å; F222-I229 HydrophobicContact CE1-CG1 4.12Å; F222-I229 HydrophobicContact CE2-CG1 4.09Å; F222-I229 HydrophobicContact CG-CD1 4.43Å; F222-I229 HydrophobicContact CG-CG1 3.58Å; F222-I229 HydrophobicContact CZ-CG1 4.26Å; I229-E231 PolarHBondContact O-N 3.34Å; I229-T233 HydrophobicContact CG2-CG2 3.91Å; I229-I234 HydrophobicContact CB-CD1 4.43Å; I229-I234 HydrophobicContact CB-CG1 4.14Å; I229-I234 HydrophobicContact CG2-CD1 4.5Å; I229-I234 HydrophobicContact CG2-CG1 3.69Å; I229-M325 WeakPolarHBondContact CD1-O 3.36Å; I229-L328 HydrophobicContact CD1-CD2 4.11Å; I229-L328 HydrophobicContact CG1-CD2 3.98Å; I229-Y359 PolarHBondContact O-OH 2.83Å
230	P	96.6	Very high	96.4	Very high	42 Å²	42	54.2 Å²	54.2	27%	0.273	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-58.8	137.5	175.6	-22.4	31.7	0	0	0	111.4	P48 T49 K232 T233 I234	P48-P230 HydrophobicContact CG-CG 4.45Å; T49-P230 HydrophobicContact CG2-CG 3.39Å; P230-K232 PolarHBondContact O-N 2.89Å; P230-T233 WeakPolarHBondContact O-CA 3.43Å; P230-T233 VanDerWaalsContact O-CB 3.27Å; P230-T233 WeakPolarHBondContact O-CB 3.38Å; P230-T233 PolarHBondContact O-N 3.39Å; P230-I234 PolarHBondContact O-N 3.36Å; P230-I234 VanDerWaalsContact O-N 3.07Å
231	E	97.5	Very high	96.6	Very high	29 Å²	29	50.6 Å²	50.6	14%	0.136	22%	0.224	C	C	.	.	H	α-helix	trans	-54.8	-40.1	-178.7	178.3	166.8	168.7	0	0	112.9	I229 T233 I234 W235 Y359 S360 L363 L395	I229-E231 PolarHBondContact O-N 3.34Å; E231-T233 PolarHBondContact O-N 2.95Å; E231-I234 WeakPolarHBondContact O-CA 3.41Å; E231-I234 WeakPolarHBondContact O-CB 3.39Å; E231-I234 PolarHBondContact O-N 3.45Å; E231-W235 VanDerWaalsContact CG-CD1 3.48Å; E231-W235 VanDerWaalsContact O-CD1 3.31Å; E231-W235 PolarHBondContact O-N 3.43Å; E231-W235 PolarHBondContact OE1-NE1 2.8Å; E231-Y359 HydrophobicContact CB-CD1 4.01Å; E231-Y359 HydrophobicContact CB-CE1 4.24Å; E231-Y359 HydrophobicContact CG-CD1 4.44Å; E231-Y359 WeakPolarHBondContact OE2-CA 3.07Å; E231-S360 WeakPolarHBondContact OE1-CB 3.48Å; E231-S360 PolarHBondContact OE1-OG 2.9Å; E231-S360 PolarHBondContact OE2-N 3.03Å; E231-L363 HydrophobicContact CG-CD1 3.9Å; E231-L395 HydrophobicContact CG-CD1 4.23Å
232	K	96.6	Very high	96.9	Very high	102 Å²	102	50 Å²	50	44%	0.443	22%	0.222	S	C	.	.	H	α-helix	trans	-54.5	-38.8	174.3	179.8	170.1	178.8	152.8	0	112.8	P230 K236 L395 N396	P230-K232 PolarHBondContact O-N 2.89Å; K232-K236 WeakPolarHBondContact O-CB 3.49Å; K232-K236 PolarHBondContact O-N 3.06Å; K232-K236 VanDerWaalsContact O-N 3.13Å; K232-L395 HydrophobicContact CB-CD1 4.42Å; K232-L395 WeakPolarHBondContact CE-O 3.26Å; K232-L395 HydrophobicContact CG-CB 4.3Å; K232-L395 PolarHBondContact NZ-O 3.16Å; K232-N396 WeakPolarHBondContact CE-OD1 3.27Å; K232-N396 PolarHBondContact NZ-OD1 2.78Å; K232-N396 VanDerWaalsContact NZ-OD1 3.17Å
233	T	96.2	Very high	97	Very high	12 Å²	12	50.8 Å²	50.8	7%	0.074	23%	0.227	C	C	.	.	H	α-helix	trans	-72.1	-39.8	175.8	-57.4	0	0	0	0	111.1	P48 I229 P230 E231 W235 K236 Y237	P48-T233 HydrophobicContact CB-CG2 4.23Å; P48-T233 VanDerWaalsContact CB-OG1 3.26Å; P48-T233 WeakPolarHBondContact CB-OG1 3.28Å; P48-T233 HydrophobicContact CG-CG2 3.88Å; P48-T233 WeakPolarHBondContact CG-OG1 3.25Å; I229-T233 HydrophobicContact CG2-CG2 3.91Å; P230-T233 WeakPolarHBondContact O-CA 3.43Å; P230-T233 VanDerWaalsContact O-CB 3.27Å; P230-T233 WeakPolarHBondContact O-CB 3.38Å; P230-T233 PolarHBondContact O-N 3.39Å; E231-T233 PolarHBondContact O-N 2.95Å; T233-W235 PolarHBondContact O-N 3.37Å; T233-K236 WeakPolarHBondContact O-CB 3.3Å; T233-K236 PolarHBondContact O-N 3.43Å; T233-Y237 HydrophobicContact CG2-CD2 3.78Å; T233-Y237 HydrophobicContact CG2-CE2 3.29Å; T233-Y237 WeakPolarHBondContact O-CD2 3.33Å; T233-Y237 PolarHBondContact O-N 3.02Å
234	I	98.2	Very high	97.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.3	-53.4	175.8	-60.7	179.5	0	0	0	109.5	I229 P230 E231 K236 Y237 F238 L322 M325 A326 Y359 L363	I229-I234 HydrophobicContact CB-CD1 4.43Å; I229-I234 HydrophobicContact CB-CG1 4.14Å; I229-I234 HydrophobicContact CG2-CD1 4.5Å; I229-I234 HydrophobicContact CG2-CG1 3.69Å; P230-I234 PolarHBondContact O-N 3.36Å; P230-I234 VanDerWaalsContact O-N 3.07Å; E231-I234 WeakPolarHBondContact O-CA 3.41Å; E231-I234 WeakPolarHBondContact O-CB 3.39Å; E231-I234 PolarHBondContact O-N 3.45Å; I234-K236 VanDerWaalsContact C-N 3.33Å; I234-K236 PolarHBondContact O-N 3.35Å; I234-Y237 PolarHBondContact O-N 3.13Å; I234-F238 WeakPolarHBondContact O-CB 3.38Å; I234-F238 PolarHBondContact O-N 3.5Å; I234-L322 HydrophobicContact CG2-CD1 3.54Å; I234-M325 HydrophobicContact CB-CE 4.31Å; I234-M325 HydrophobicContact CD1-CB 4.36Å; I234-M325 HydrophobicContact CG1-CB 4.28Å; I234-M325 HydrophobicContact CG1-CE 4.48Å; I234-M325 HydrophobicContact CG2-CB 4.19Å; I234-M325 HydrophobicContact CG2-CE 4.01Å; I234-M325 HydrophobicContact CG2-SD 4.26Å; I234-A326 HydrophobicContact CD1-CB 3.95Å; I234-Y359 HydrophobicContact CD1-CD1 4.37Å; I234-Y359 HydrophobicContact CD1-CE1 3.59Å; I234-L363 HydrophobicContact CD1-CD1 4.2Å; I234-L363 HydrophobicContact CG2-CD1 4.11Å
235	W	98.2	Very high	97.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-35.7	178.7	-69.7	116	0	0	0	113.5	E231 T233 Y237 F238 V239 L363 L366 I387 A388 M391 H392 L395	E231-W235 VanDerWaalsContact CG-CD1 3.48Å; E231-W235 VanDerWaalsContact O-CD1 3.31Å; E231-W235 PolarHBondContact O-N 3.43Å; E231-W235 PolarHBondContact OE1-NE1 2.8Å; T233-W235 PolarHBondContact O-N 3.37Å; W235-Y237 VanDerWaalsContact C-N 3.3Å; W235-Y237 PolarHBondContact O-N 3.17Å; W235-F238 HydrophobicContact CE3-CD1 4.12Å; W235-F238 AromaticContact CZ3-CD1 3.87Å; W235-F238 HydrophobicContact CZ3-CD1 3.87Å; W235-F238 HydrophobicContact CZ3-CE1 4.38Å; W235-F238 PolarHBondContact O-N 3.12Å; W235-V239 WeakPolarHBondContact O-CB 3.02Å; W235-V239 VanDerWaalsContact O-CG1 3.25Å; W235-V239 WeakPolarHBondContact O-CG1 3.5Å; W235-V239 PolarHBondContact O-N 3.08Å; W235-L363 HydrophobicContact CZ2-CB 3.78Å; W235-L363 HydrophobicContact CZ2-CG 4.29Å; W235-L366 HydrophobicContact CH2-CD2 3.56Å; W235-L366 HydrophobicContact CZ3-CD2 3.73Å; W235-I387 HydrophobicContact CH2-CG2 4.22Å; W235-A388 HydrophobicContact CE3-CB 4.01Å; W235-A388 HydrophobicContact CZ3-CB 3.91Å; W235-M391 HydrophobicContact CD2-CB 3.56Å; W235-M391 HydrophobicContact CD2-CG 4.3Å; W235-M391 HydrophobicContact CE3-CB 3.95Å; W235-M391 HydrophobicContact CG-CB 3.93Å; W235-M391 HydrophobicContact CH2-CB 4.29Å; W235-M391 HydrophobicContact CH2-CG 4.05Å; W235-M391 HydrophobicContact CZ2-CB 3.94Å; W235-M391 HydrophobicContact CZ2-CE 4.24Å; W235-M391 HydrophobicContact CZ2-CG 3.73Å; W235-M391 HydrophobicContact CZ3-CB 4.31Å; W235-M391 HydrophobicContact CZ3-CG 4.47Å; W235-H392 HydrophobicContact CB-CB 4.33Å; W235-L395 HydrophobicContact CG-CD1 4.23Å
236	K	97.3	Very high	97.6	Very high	80 Å²	80	34 Å²	34	35%	0.348	16%	0.16	S	C	.	.	H	α-helix	trans	-56.6	-40.1	174.6	175.1	-172.2	173.1	-175.5	0	113.1	K232 T233 I234 V239 Q240 H392	K232-K236 WeakPolarHBondContact O-CB 3.49Å; K232-K236 PolarHBondContact O-N 3.06Å; K232-K236 VanDerWaalsContact O-N 3.13Å; T233-K236 WeakPolarHBondContact O-CB 3.3Å; T233-K236 PolarHBondContact O-N 3.43Å; I234-K236 VanDerWaalsContact C-N 3.33Å; I234-K236 PolarHBondContact O-N 3.35Å; K236-V239 WeakPolarHBondContact O-CG1 3.37Å; K236-Q240 PolarHBondContact O-NE2 3.1Å; K236-H392 WeakPolarHBondContact CA-ND1 3.49Å
237	Y	98.1	Very high	97.7	Very high	6 Å²	6	26.1 Å²	26.1	2%	0.024	13%	0.126	C	C	.	.	H	α-helix	trans	-87.4	-41.5	178.2	-61.2	-47.6	0	0	0	111.4	M218 T233 I234 W235 V239 Q240 I241 I265 V271 M325	M218-Y237 HydrophobicContact CE-CE2 3.55Å; M218-Y237 HydrophobicContact SD-CD2 4.11Å; M218-Y237 HydrophobicContact SD-CE2 3.59Å; M218-Y237 VanDerWaalsContact SD-CE2 3.59Å; T233-Y237 HydrophobicContact CG2-CD2 3.78Å; T233-Y237 HydrophobicContact CG2-CE2 3.29Å; T233-Y237 WeakPolarHBondContact O-CD2 3.33Å; T233-Y237 PolarHBondContact O-N 3.02Å; I234-Y237 PolarHBondContact O-N 3.13Å; W235-Y237 VanDerWaalsContact C-N 3.3Å; W235-Y237 PolarHBondContact O-N 3.17Å; Y237-V239 VanDerWaalsContact C-N 3.31Å; Y237-V239 PolarHBondContact O-N 3.13Å; Y237-Q240 WeakPolarHBondContact O-CB 3.42Å; Y237-Q240 PolarHBondContact O-N 2.71Å; Y237-I241 WeakPolarHBondContact O-CG1 2.93Å; Y237-I241 PolarHBondContact O-N 3.35Å; Y237-I265 HydrophobicContact CD1-CD1 4.45Å; Y237-I265 HydrophobicContact CD1-CG2 4.47Å; Y237-I265 HydrophobicContact CD2-CD1 4.39Å; Y237-I265 HydrophobicContact CE1-CG2 3.85Å; Y237-I265 HydrophobicContact CE2-CD1 4.47Å; Y237-I265 HydrophobicContact CG-CD1 4.39Å; Y237-V271 HydrophobicContact CD1-CG2 3.56Å; Y237-V271 HydrophobicContact CE1-CG2 4.46Å; Y237-V271 HydrophobicContact CG-CG2 4.18Å; Y237-M325 HydrophobicContact CD2-CE 4.27Å
238	F	98.7	Very high	97.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-63.3	-34.6	-175.7	-166.3	-102.2	0	0	0	113.3	I234 W235 Q240 I241 S242 L318 L321 L322 L366 I384 A388	I234-F238 WeakPolarHBondContact O-CB 3.38Å; I234-F238 PolarHBondContact O-N 3.5Å; W235-F238 HydrophobicContact CE3-CD1 4.12Å; W235-F238 AromaticContact CZ3-CD1 3.87Å; W235-F238 HydrophobicContact CZ3-CD1 3.87Å; W235-F238 HydrophobicContact CZ3-CE1 4.38Å; W235-F238 PolarHBondContact O-N 3.12Å; F238-Q240 VanDerWaalsContact C-N 3.31Å; F238-Q240 PolarHBondContact O-N 3.49Å; F238-I241 PolarHBondContact O-N 2.68Å; F238-S242 WeakPolarHBondContact CE1-OG 3.47Å; F238-S242 WeakPolarHBondContact O-CB 3.07Å; F238-S242 PolarHBondContact O-N 3.23Å; F238-S242 PolarHBondContact O-OG 2.78Å; F238-L318 HydrophobicContact CD2-CD1 4.4Å; F238-L318 HydrophobicContact CE2-CD1 3.52Å; F238-L318 HydrophobicContact CE2-CD2 4.37Å; F238-L318 HydrophobicContact CE2-CG 3.74Å; F238-L318 HydrophobicContact CZ-CD1 3.97Å; F238-L318 HydrophobicContact CZ-CD2 3.95Å; F238-L318 HydrophobicContact CZ-CG 3.73Å; F238-L321 HydrophobicContact CD2-CD2 4.39Å; F238-L322 HydrophobicContact CB-CD1 4.47Å; F238-L322 HydrophobicContact CD1-CD1 4.33Å; F238-L322 HydrophobicContact CD2-CB 4.14Å; F238-L322 HydrophobicContact CD2-CD1 3.77Å; F238-L322 HydrophobicContact CD2-CG 4.39Å; F238-L322 HydrophobicContact CE1-CD2 4.09Å; F238-L322 HydrophobicContact CE2-CB 3.63Å; F238-L322 HydrophobicContact CE2-CD1 4.04Å; F238-L322 HydrophobicContact CE2-CD2 4.19Å; F238-L322 HydrophobicContact CE2-CG 4.15Å; F238-L322 HydrophobicContact CG-CD1 3.92Å; F238-L322 HydrophobicContact CZ-CB 4.1Å; F238-L322 HydrophobicContact CZ-CD1 4.42Å; F238-L322 HydrophobicContact CZ-CD2 3.88Å; F238-L322 HydrophobicContact CZ-CG 4.35Å; F238-L366 HydrophobicContact CE1-CD2 3.79Å; F238-I384 HydrophobicContact CE1-CG2 3.73Å; F238-I384 HydrophobicContact CZ-CG2 3.98Å; F238-A388 HydrophobicContact CD1-CB 3.81Å; F238-A388 HydrophobicContact CE1-CB 4.29Å
239	V	98.7	Very high	97.7	Very high	17 Å²	17	20.5 Å²	20.5	10%	0.103	10%	0.101	C	C	.	.	H	α-helix	trans	-61.8	-39	172.9	69.5	0	0	0	0	112.1	W235 K236 Y237 S243 Y385 A388 K389 H392	W235-V239 WeakPolarHBondContact O-CB 3.02Å; W235-V239 VanDerWaalsContact O-CG1 3.25Å; W235-V239 WeakPolarHBondContact O-CG1 3.5Å; W235-V239 PolarHBondContact O-N 3.08Å; K236-V239 WeakPolarHBondContact O-CG1 3.37Å; Y237-V239 VanDerWaalsContact C-N 3.31Å; Y237-V239 PolarHBondContact O-N 3.13Å; V239-S243 VanDerWaalsContact O-CB 3.28Å; V239-S243 WeakPolarHBondContact O-CB 3.39Å; V239-S243 PolarHBondContact O-N 3.48Å; V239-Y385 HydrophobicContact CG2-CD2 4.23Å; V239-Y385 HydrophobicContact CG2-CE2 3.83Å; V239-A388 HydrophobicContact CB-CB 4.13Å; V239-A388 HydrophobicContact CG2-CB 4.36Å; V239-K389 HydrophobicContact CG2-CB 4.06Å; V239-H392 HydrophobicContact CB-CB 4.35Å; V239-H392 HydrophobicContact CG1-CB 4.27Å
240	Q	98.6	Very high	97.6	Very high	36 Å²	36	24 Å²	24	17%	0.168	13%	0.126	C	C	.	.	H	α-helix	trans	-72.2	-40.7	178.5	-69.2	-178.3	77.1	0	0	111.8	N189 K236 Y237 F238 S243 G244 G269 V271	N189-Q240 WeakPolarHBondContact CB-O 3.32Å; N189-Q240 WeakPolarHBondContact ND2-CB 3.37Å; N189-Q240 PolarHBondContact ND2-OE1 3.03Å; K236-Q240 PolarHBondContact O-NE2 3.1Å; Y237-Q240 WeakPolarHBondContact O-CB 3.42Å; Y237-Q240 PolarHBondContact O-N 2.71Å; F238-Q240 VanDerWaalsContact C-N 3.31Å; F238-Q240 PolarHBondContact O-N 3.49Å; Q240-S243 PolarHBondContact O-N 2.9Å; Q240-G244 PolarHBondContact O-N 3Å; Q240-G269 PolarHBondContact NE2-O 2.94Å; Q240-V271 HydrophobicContact CB-CB 3.78Å; Q240-V271 HydrophobicContact CB-CG2 4.01Å
241	I	98.7	Very high	97.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59	-50.3	173.8	-63.3	169.6	0	0	0	109.8	L215 Y237 F238 S243 G244 L245 V263 V271 L273 L318 L321	L215-I241 HydrophobicContact CD2-CD1 4.32Å; Y237-I241 WeakPolarHBondContact O-CG1 2.93Å; Y237-I241 PolarHBondContact O-N 3.35Å; F238-I241 PolarHBondContact O-N 2.68Å; I241-S243 VanDerWaalsContact C-N 3.34Å; I241-S243 PolarHBondContact O-N 3.22Å; I241-G244 PolarHBondContact O-N 3.4Å; I241-L245 PolarHBondContact O-N 3.39Å; I241-V263 HydrophobicContact CD1-CG1 3.78Å; I241-V263 HydrophobicContact CD1-CG2 4.48Å; I241-V263 HydrophobicContact CG1-CG1 3.84Å; I241-V271 HydrophobicContact CG1-CG1 3.69Å; I241-L273 HydrophobicContact CG2-CD2 4.09Å; I241-L318 HydrophobicContact CG2-CD1 3.54Å; I241-L321 HydrophobicContact CD1-CD2 3.78Å
242	S	98.8	Very high	97.2	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.2	-39.3	-178.5	-56	0	0	0	0	111.7	F238 L245 D246	F238-S242 WeakPolarHBondContact CE1-OG 3.47Å; F238-S242 WeakPolarHBondContact O-CB 3.07Å; F238-S242 PolarHBondContact O-N 3.23Å; F238-S242 PolarHBondContact O-OG 2.78Å; S242-L245 PolarHBondContact O-N 3.35Å; S242-D246 VanDerWaalsContact O-CB 3.3Å; S242-D246 WeakPolarHBondContact O-CB 3.44Å; S242-D246 PolarHBondContact O-N 2.82Å
243	S	98.7	Very high	96.8	Very high	16 Å²	16	29.2 Å²	29.2	11%	0.112	14%	0.139	C	C	.	.	H	α-helix	trans	-60.3	-46	174	-174.4	0	0	0	0	112.3	H187 V239 Q240 I241 L245 D246 H247	H187-S243 PolarHBondContact CE1-OG 3.26Å; H187-S243 PolarHBondContact NE2-OG 3.24Å; V239-S243 VanDerWaalsContact O-CB 3.28Å; V239-S243 WeakPolarHBondContact O-CB 3.39Å; V239-S243 PolarHBondContact O-N 3.48Å; Q240-S243 PolarHBondContact O-N 2.9Å; I241-S243 VanDerWaalsContact C-N 3.34Å; I241-S243 PolarHBondContact O-N 3.22Å; S243-L245 PolarHBondContact O-N 3.07Å; S243-D246 PolarHBondContact O-N 3.15Å; S243-H247 PolarHBondContact O-N 2.91Å; S243-H247 VanDerWaalsContact O-N 3.1Å
244	G	98.1	Very high	96.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.9	-43.7	175.5	0	0	0	0	0	112.8	Q240 I241 H247 M248	Q240-G244 PolarHBondContact O-N 3Å; I241-G244 PolarHBondContact O-N 3.4Å; G244-H247 PolarHBondContact O-N 3.43Å; G244-M248 WeakPolarHBondContact O-CG 3.26Å; G244-M248 PolarHBondContact O-N 3.09Å; G244-M248 VanDerWaalsContact O-N 3.12Å
245	L	98.1	Very high	96.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-70.9	-38	179.8	-170.9	62.8	0	0	0	112.5	I241 S242 S243 H247 M248 H249 H255 I258 L273 D314 L318 I381	I241-L245 PolarHBondContact O-N 3.39Å; S242-L245 PolarHBondContact O-N 3.35Å; S243-L245 PolarHBondContact O-N 3.07Å; L245-H247 VanDerWaalsContact C-N 3.3Å; L245-H247 PolarHBondContact O-N 2.99Å; L245-M248 PolarHBondContact O-N 3.29Å; L245-M248 VanDerWaalsContact O-N 3.16Å; L245-H249 PolarHBondContact O-N 3.09Å; L245-H255 HydrophobicContact CD1-CB 3.92Å; L245-I258 HydrophobicContact CD1-CD1 3.81Å; L245-I258 HydrophobicContact CD2-CD1 3.55Å; L245-I258 HydrophobicContact CG-CD1 4.31Å; L245-L273 HydrophobicContact CB-CD1 4.06Å; L245-D314 HydrophobicContact CD1-CB 4.39Å; L245-D314 HydrophobicContact CD2-CB 4.27Å; L245-L318 HydrophobicContact CD2-CD2 3.98Å; L245-I381 HydrophobicContact CB-CD1 4.03Å; L245-I381 HydrophobicContact CB-CG1 3.94Å; L245-I381 HydrophobicContact CD2-CD1 3.75Å; L245-I381 HydrophobicContact CD2-CG1 4.06Å; L245-I381 HydrophobicContact CG-CD1 4.11Å; L245-I381 HydrophobicContact CG-CG1 3.92Å
246	D	98.4	Very high	95.8	Very high	34 Å²	34	30.6 Å²	30.6	18%	0.182	14%	0.144	C	C	.	.	H	α-helix	trans	-58.1	-45.2	174.7	-173.8	65.3	0	0	0	110.6	S242 S243 M248 H249 S250 I381 T382 Y385	S242-D246 VanDerWaalsContact O-CB 3.3Å; S242-D246 WeakPolarHBondContact O-CB 3.44Å; S242-D246 PolarHBondContact O-N 2.82Å; S243-D246 PolarHBondContact O-N 3.15Å; D246-M248 PolarHBondContact O-N 3.4Å; D246-H249 PolarHBondContact O-N 2.99Å; D246-S250 WeakPolarHBondContact O-CB 3.37Å; D246-S250 PolarHBondContact O-N 2.77Å; D246-I381 HydrophobicContact CB-CG1 3.97Å; D246-I381 HydrophobicContact CB-CG2 4.29Å; D246-T382 WeakPolarHBondContact OD1-CA 3.23Å; D246-T382 WeakPolarHBondContact OD1-CB 3.44Å; D246-T382 PolarHBondContact OD1-N 2.95Å; D246-T382 PolarHBondContact OD1-OG1 3.41Å; D246-Y385 HydrophobicContact CB-CD1 4.46Å
247	H	97.6	Very high	95.3	Very high	32 Å²	32	28.9 Å²	28.9	15%	0.148	14%	0.138	C	C	.	.	H	α-helix	trans	-60.1	-46.5	173.8	-178.9	76.1	0	0	0	112.3	D186 H187 S243 G244 L245 H249 S250 K251	D186-H247 PolarHBondContact N-NE2 2.91Å; D186-H247 PolarHBondContact O-CE1 3.3Å; D186-H247 VanDerWaalsContact O-CE1 3.29Å; D186-H247 PolarHBondContact O-NE2 3.19Å; D186-H247 VanDerWaalsContact O-NE2 3.14Å; H187-H247 HydrophobicContact CB-CB 4.24Å; H187-H247 VanDerWaalsContact CB-CD2 3.44Å; H187-H247 WeakPolarHBondContact CB-CD2 3.09Å; H187-H247 AromaticContact CD2-CG 3.93Å; H187-H247 AromaticContact CG-CG 3.98Å; S243-H247 PolarHBondContact O-N 2.91Å; S243-H247 VanDerWaalsContact O-N 3.1Å; G244-H247 PolarHBondContact O-N 3.43Å; L245-H247 VanDerWaalsContact C-N 3.3Å; L245-H247 PolarHBondContact O-N 2.99Å; H247-H249 PolarHBondContact O-N 3.03Å; H247-S250 PolarHBondContact O-N 3.11Å; H247-S250 PolarHBondContact O-OG 2.94Å; H247-K251 WeakPolarHBondContact O-CG 3.41Å; H247-K251 PolarHBondContact O-N 3.39Å
248	M	95.6	Very high	95.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-58.4	-48.6	177.7	-68.9	179.7	71.9	0	0	111.8	L185 V190 G244 L245 D246 S250 K251 R252 I253 H255 L273 L276	L185-M248 HydrophobicContact CD1-CE 4.3Å; L185-M248 HydrophobicContact CD1-CG 4.27Å; L185-M248 HydrophobicContact CD2-CB 4.32Å; L185-M248 HydrophobicContact CD2-CG 3.82Å; V190-M248 HydrophobicContact CG2-CG 4.16Å; V190-M248 HydrophobicContact CG2-SD 4.44Å; G244-M248 WeakPolarHBondContact O-CG 3.26Å; G244-M248 PolarHBondContact O-N 3.09Å; G244-M248 VanDerWaalsContact O-N 3.12Å; L245-M248 PolarHBondContact O-N 3.29Å; L245-M248 VanDerWaalsContact O-N 3.16Å; D246-M248 PolarHBondContact O-N 3.4Å; M248-S250 VanDerWaalsContact C-N 3.33Å; M248-S250 PolarHBondContact O-N 3.35Å; M248-K251 CarbonylContact O-C 3.49Å; M248-K251 PolarHBondContact O-N 3.39Å; M248-R252 PolarHBondContact O-N 3.31Å; M248-I253 CarbonylContact C-O 3.52Å; M248-I253 HydrophobicContact CB-CB 4.49Å; M248-I253 HydrophobicContact CE-CG2 3.83Å; M248-I253 PolarHBondContact O-N 3.32Å; M248-H255 HydrophobicContact CE-CB 4.01Å; M248-H255 HydrophobicContact SD-CB 4.38Å; M248-L273 HydrophobicContact SD-CD1 4.2Å; M248-L276 HydrophobicContact CE-CB 4.47Å; M248-L276 HydrophobicContact CE-CD2 3.87Å; M248-L276 HydrophobicContact SD-CD2 4.04Å
249	H	95.4	Very high	94.8	Very high	23 Å²	23	31.4 Å²	31.4	11%	0.106	15%	0.149	C	C	.	.	H	α-helix	trans	-64.5	-37	179.5	-75.9	-156.9	0	0	0	111.8	L245 D246 H247 K251 R252 I253 F311 D314 I381	L245-H249 PolarHBondContact O-N 3.09Å; D246-H249 PolarHBondContact O-N 2.99Å; H247-H249 PolarHBondContact O-N 3.03Å; H249-K251 PolarHBondContact O-N 2.69Å; H249-R252 WeakPolarHBondContact O-CA 3.45Å; H249-R252 PolarHBondContact O-N 3.28Å; H249-I253 PolarHBondContact CD2-O 2.79Å; H249-I253 PolarHBondContact N-O 3.48Å; H249-F311 HydrophobicContact CB-CD1 4.25Å; H249-F311 AromaticContact CD2-CD1 3.68Å; H249-F311 AromaticContact CE1-CD1 3.92Å; H249-F311 PolarHBondContact CE1-O 3.3Å; H249-F311 AromaticContact CG-CD1 3.69Å; H249-F311 AromaticContact ND1-CD1 3.84Å; H249-F311 AromaticContact NE2-CD1 3.81Å; H249-D314 IonicContact CD2-OD2 2.76Å; H249-D314 IonicContact CE1-OD2 3.31Å; H249-D314 IonicContact NE2-OD2 2.9Å; H249-D314 PolarHBondContact NE2-OD2 2.81Å; H249-I381 HydrophobicContact CB-CG2 3.7Å; H249-I381 WeakPolarHBondContact ND1-CG2 3.44Å
250	S	95.9	Very high	94.6	Very high	75 Å²	75	30.7 Å²	30.7	52%	0.524	15%	0.145	S	C	.	.	H	α-helix	trans	-59.9	-29	173.9	86	0	0	0	0	112.8	D246 H247 M248 R252	D246-S250 WeakPolarHBondContact O-CB 3.37Å; D246-S250 PolarHBondContact O-N 2.77Å; H247-S250 PolarHBondContact O-N 3.11Å; H247-S250 PolarHBondContact O-OG 2.94Å; M248-S250 VanDerWaalsContact C-N 3.33Å; M248-S250 PolarHBondContact O-N 3.35Å; S250-R252 VanDerWaalsContact C-N 3.32Å
251	K	93.6	Very high	94.2	Very high	88 Å²	88	30.9 Å²	30.9	38%	0.383	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	9.8	174.7	-57.8	-53.1	-179.2	-171.7	0	113.4	L185 H247 M248 H249 I253	L185-K251 HydrophobicContact CD2-CB 4.45Å; L185-K251 HydrophobicContact CD2-CG 4.37Å; H247-K251 WeakPolarHBondContact O-CG 3.41Å; H247-K251 PolarHBondContact O-N 3.39Å; M248-K251 CarbonylContact O-C 3.49Å; M248-K251 PolarHBondContact O-N 3.39Å; H249-K251 PolarHBondContact O-N 2.69Å; K251-I253 VanDerWaalsContact C-N 3.28Å; K251-I253 HydrophobicContact CB-CD1 3.94Å; K251-I253 HydrophobicContact CB-CG1 4.37Å; K251-I253 PolarHBondContact O-N 3.28Å
252	R	90.9	Very high	93.9	Very high	193 Å²	193	31.7 Å²	31.7	73%	0.728	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	33	-176	-56.1	-66.8	-166.1	167.3	2.2	113.2	M248 H249 S250 F311	M248-R252 PolarHBondContact O-N 3.31Å; H249-R252 WeakPolarHBondContact O-CA 3.45Å; H249-R252 PolarHBondContact O-N 3.28Å; S250-R252 VanDerWaalsContact C-N 3.32Å; R252-F311 HydrophobicContact CB-CZ 4.3Å
253	I	90.1	Very high	93.8	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	16%	0.157	C	C	.	.			trans	-111.6	126.5	177.9	-61.5	161.8	0	0	0	108.7	L181 L182 L185 M248 H249 K251	L181-I253 HydrophobicContact CB-CD1 3.8Å; L181-I253 HydrophobicContact CB-CG1 3.75Å; L181-I253 HydrophobicContact CD1-CG1 4.47Å; L181-I253 VanDerWaalsContact O-CD1 3.22Å; L181-I253 WeakPolarHBondContact O-CD1 3.48Å; L182-I253 HydrophobicContact CD2-CG2 4.24Å; L185-I253 HydrophobicContact CD1-CD1 3.98Å; L185-I253 HydrophobicContact CD1-CG2 4.45Å; L185-I253 HydrophobicContact CD2-CD1 3.71Å; L185-I253 HydrophobicContact CG-CD1 3.67Å; M248-I253 CarbonylContact C-O 3.52Å; M248-I253 HydrophobicContact CB-CB 4.49Å; M248-I253 HydrophobicContact CE-CG2 3.83Å; M248-I253 PolarHBondContact O-N 3.32Å; H249-I253 PolarHBondContact CD2-O 2.79Å; H249-I253 PolarHBondContact N-O 3.48Å; K251-I253 VanDerWaalsContact C-N 3.28Å; K251-I253 HydrophobicContact CB-CD1 3.94Å; K251-I253 HydrophobicContact CB-CG1 4.37Å; K251-I253 PolarHBondContact O-N 3.28Å
254	M	90.3	Very high	93.5	Very high	22 Å²	22	33.3 Å²	33.3	11%	0.108	16%	0.162	C	C	.	.			trans	-88.9	147.5	169.3	-65.6	-177.6	-77.2	0	0	109.7	R256 G277 Y309 D310 F311 D314	M254-R256 HydrophobicContact CB-CG 3.71Å; M254-G277 WeakPolarHBondContact O-CA 3.18Å; M254-Y309 HydrophobicContact CE-CD2 4.23Å; M254-Y309 HydrophobicContact CE-CE2 3.66Å; M254-Y309 HydrophobicContact SD-CD2 4.09Å; M254-Y309 HydrophobicContact SD-CE2 3.97Å; M254-D310 VanDerWaalsContact SD-O 3.34Å; M254-F311 HydrophobicContact CG-CD1 3.48Å; M254-F311 VanDerWaalsContact CG-CD1 3.48Å; M254-F311 HydrophobicContact CG-CE1 3.58Å; M254-F311 HydrophobicContact CG-CG 4.03Å; M254-F311 HydrophobicContact CG-CZ 4.2Å; M254-D314 VanDerWaalsContact CA-OD2 3.31Å; M254-D314 WeakPolarHBondContact CA-OD2 3.24Å
255	H	91.8	Very high	93.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.			trans	-77.6	-47	174.7	-170.8	-72.7	0	0	0	111.8	L245 M248 D257 I258 G274 G277 D314	L245-H255 HydrophobicContact CD1-CB 3.92Å; M248-H255 HydrophobicContact CE-CB 4.01Å; M248-H255 HydrophobicContact SD-CB 4.38Å; H255-D257 PolarHBondContact CE1-O 3.48Å; H255-D257 VanDerWaalsContact CE1-O 3.28Å; H255-D257 VanDerWaalsContact ND1-C 3.28Å; H255-D257 PolarHBondContact ND1-N 2.64Å; H255-D257 PolarHBondContact ND1-O 2.95Å; H255-D257 PolarHBondContact O-N 2.68Å; H255-D257 VanDerWaalsContact O-N 3.11Å; H255-I258 HydrophobicContact CB-CD1 3.98Å; H255-I258 HydrophobicContact CB-CG1 3.65Å; H255-I258 VanDerWaalsContact CG-CG1 3.47Å; H255-I258 WeakPolarHBondContact ND1-CG1 3.41Å; H255-I258 PolarHBondContact ND1-N 3.47Å; H255-G274 PolarHBondContact CE1-O 2.9Å; H255-G274 PolarHBondContact NE2-O 3.14Å; H255-G277 PolarHBondContact O-N 2.83Å; H255-D314 PolarHBondContact N-OD2 3.3Å
256	R	88.4	Confident	92.7	Very high	19 Å²	19	35.4 Å²	35.4	7%	0.072	17%	0.173	C	C	.	.			trans	71.4	-14.7	175	-47.6	179.8	178	154.1	2	117.4	E178 M254 G277 R280 R303 Y309 D314	E178-R256 IonicContact OE1-CZ 2.78Å; E178-R256 IonicContact OE1-NE 3.81Å; E178-R256 IonicContact OE1-NH1 2.86Å; E178-R256 PolarHBondContact OE1-NH1 2.9Å; E178-R256 IonicContact OE1-NH2 3.41Å; E178-R256 PolarHBondContact OE1-NH2 2.9Å; E178-R256 IonicContact OE2-CZ 3.64Å; E178-R256 IonicContact OE2-NH1 3.82Å; E178-R256 PolarHBondContact OE2-NH1 3.31Å; E178-R256 IonicContact OE2-NH2 2.75Å; E178-R256 PolarHBondContact OE2-NH2 2.86Å; M254-R256 HydrophobicContact CB-CG 3.71Å; R256-G277 WeakPolarHBondContact CD-O 3.36Å; R256-G277 PolarHBondContact NH1-O 2.7Å; R256-R280 VanDerWaalsContact CZ-CD 3.48Å; R256-R303 PolarHBondContact O-NH1 2.84Å; R256-Y309 VanDerWaalsContact CD-OH 3.26Å; R256-Y309 WeakPolarHBondContact CD-OH 3.45Å; R256-Y309 HydrophobicContact CG-CE2 3.87Å; R256-Y309 PolarHBondContact NE-OH 3.31Å; R256-Y309 VanDerWaalsContact NE-OH 3.09Å; R256-D314 WeakPolarHBondContact CA-OD1 3.37Å; R256-D314 PolarHBondContact N-OD1 3.29Å
257	D	87.1	Confident	92	Very high	44 Å²	44	36.8 Å²	36.8	24%	0.235	18%	0.183	C	C	.	.			trans	-138.3	49.9	177	-165.1	28.8	0	0	0	112.3	H255 K259 N262	H255-D257 PolarHBondContact CE1-O 3.48Å; H255-D257 VanDerWaalsContact CE1-O 3.28Å; H255-D257 VanDerWaalsContact ND1-C 3.28Å; H255-D257 PolarHBondContact ND1-N 2.64Å; H255-D257 PolarHBondContact ND1-O 2.95Å; H255-D257 PolarHBondContact O-N 2.68Å; H255-D257 VanDerWaalsContact O-N 3.11Å; D257-K259 VanDerWaalsContact CG-NZ 3.29Å; D257-K259 PolarHBondContact O-N 2.91Å; D257-K259 IonicContact OD1-NZ 3.99Å; D257-K259 PolarHBondContact OD1-NZ 3.31Å; D257-K259 VanDerWaalsContact OD1-NZ 3.15Å; D257-K259 WeakPolarHBondContact OD2-CE 3.25Å; D257-K259 IonicContact OD2-NZ 3Å; D257-K259 PolarHBondContact OD2-NZ 2.94Å; D257-N262 PolarHBondContact O-ND2 3.02Å; D257-N262 PolarHBondContact OD2-ND2 2.99Å
258	I	93.4	Very high	91.5	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	21%	0.21	C	C	.	.			trans	-72.4	117.2	176.1	-60.8	173.8	0	0	0	108.4	L245 H255 D314 L321	L245-I258 HydrophobicContact CD1-CD1 3.81Å; L245-I258 HydrophobicContact CD2-CD1 3.55Å; L245-I258 HydrophobicContact CG-CD1 4.31Å; H255-I258 HydrophobicContact CB-CD1 3.98Å; H255-I258 HydrophobicContact CB-CG1 3.65Å; H255-I258 VanDerWaalsContact CG-CG1 3.47Å; H255-I258 WeakPolarHBondContact ND1-CG1 3.41Å; H255-I258 PolarHBondContact ND1-N 3.47Å; I258-D314 HydrophobicContact CD1-CB 3.85Å; I258-L321 HydrophobicContact CG2-CB 4.5Å; I258-L321 HydrophobicContact CG2-CD1 3.83Å
259	K	93	Very high	91.2	Very high	58 Å²	58	43.4 Å²	43.4	25%	0.252	21%	0.213	S	C	.	.	S	Bend	trans	-157.9	158.7	175.5	63	-168.2	-178.6	-147.5	0	109.4	D257 A261 N262 Y298	D257-K259 VanDerWaalsContact CG-NZ 3.29Å; D257-K259 PolarHBondContact O-N 2.91Å; D257-K259 IonicContact OD1-NZ 3.99Å; D257-K259 PolarHBondContact OD1-NZ 3.31Å; D257-K259 VanDerWaalsContact OD1-NZ 3.15Å; D257-K259 WeakPolarHBondContact OD2-CE 3.25Å; D257-K259 IonicContact OD2-NZ 3Å; D257-K259 PolarHBondContact OD2-NZ 2.94Å; K259-A261 HydrophobicContact CG-CB 4.35Å; K259-A261 PolarHBondContact O-N 3.12Å; K259-A261 VanDerWaalsContact O-N 3.11Å; K259-N262 WeakPolarHBondContact CE-ND2 3.22Å; K259-N262 HydrophobicContact CG-CB 4.16Å; K259-N262 PolarHBondContact O-N 3.47Å; K259-Y298 HydrophobicContact CB-CD1 4.47Å; K259-Y298 HydrophobicContact CB-CD2 3.56Å; K259-Y298 HydrophobicContact CB-CE1 4.41Å; K259-Y298 HydrophobicContact CB-CE2 3.46Å; K259-Y298 VanDerWaalsContact CB-CE2 3.46Å; K259-Y298 HydrophobicContact CB-CG 4.1Å
260	P	94.2	Very high	91.1	Very high	2 Å²	2	47 Å²	47	1%	0.013	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-53.9	-34.4	-178.3	-28.4	36.1	0	0	0	114.6	L215 S216 I219 N262 V263 Y298	L215-P260 HydrophobicContact CB-CB 4.07Å; L215-P260 WeakPolarHBondContact CB-O 3.37Å; L215-P260 HydrophobicContact CD2-CB 4.34Å; L215-P260 HydrophobicContact CG-CB 4.16Å; L215-P260 PolarHBondContact N-O 3.07Å; S216-P260 PolarHBondContact N-O 2.78Å; I219-P260 HydrophobicContact CD1-CB 3.81Å; I219-P260 HydrophobicContact CD1-CG 3.77Å; P260-N262 PolarHBondContact O-N 2.69Å; P260-V263 PolarHBondContact O-N 3.47Å; P260-Y298 WeakPolarHBondContact CD-OH 3.22Å; P260-Y298 HydrophobicContact CG-CE1 4.43Å
261	A	90.5	Very high	91.1	Very high	40 Å²	40	43.5 Å²	43.5	33%	0.331	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-67.3	-19.4	177.7	0	0	0	0	0	114	K259	K259-A261 HydrophobicContact CG-CB 4.35Å; K259-A261 PolarHBondContact O-N 3.12Å; K259-A261 VanDerWaalsContact O-N 3.11Å
262	N	92.2	Very high	91.3	Very high	16 Å²	16	41.1 Å²	41.1	9%	0.086	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-101.5	8.3	177.7	-71	-7.1	0	0	0	112.4	D257 K259 P260 G274	D257-N262 PolarHBondContact O-ND2 3.02Å; D257-N262 PolarHBondContact OD2-ND2 2.99Å; K259-N262 WeakPolarHBondContact CE-ND2 3.22Å; K259-N262 HydrophobicContact CG-CB 4.16Å; K259-N262 PolarHBondContact O-N 3.47Å; P260-N262 PolarHBondContact O-N 2.69Å; N262-G274 PolarHBondContact O-N 3.2Å
263	V	95.6	Very high	91.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	98.5	175.6	-178.8	0	0	0	0	108.7	D214 L215 I241 P260 V271 L273 L321	D214-V263 CarbonylContact C-O 3.5Å; D214-V263 WeakPolarHBondContact CA-O 3.4Å; D214-V263 WeakPolarHBondContact CB-O 3.48Å; L215-V263 HydrophobicContact CB-CB 3.96Å; L215-V263 HydrophobicContact CB-CG1 4.17Å; L215-V263 HydrophobicContact CD2-CB 4.33Å; L215-V263 HydrophobicContact CD2-CG1 4.3Å; L215-V263 PolarHBondContact N-O 2.99Å; I241-V263 HydrophobicContact CD1-CG1 3.78Å; I241-V263 HydrophobicContact CD1-CG2 4.48Å; I241-V263 HydrophobicContact CG1-CG1 3.84Å; P260-V263 PolarHBondContact O-N 3.47Å; V263-V271 HydrophobicContact CG1-CG1 3.4Å; V263-V271 VanDerWaalsContact CG1-CG1 3.4Å; V263-L273 HydrophobicContact CG2-CD2 3.96Å; V263-L321 HydrophobicContact CG2-CD1 3.65Å
264	F	94.2	Very high	91.5	Very high	51 Å²	51	31.9 Å²	31.9	22%	0.224	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	138.6	-178.6	-59.9	-84.8	0	0	0	110.7	I191 A210 G213 D214 V271 K272	I191-F264 HydrophobicContact CD1-CD2 4.21Å; I191-F264 HydrophobicContact CG1-CD2 4.22Å; A210-F264 HydrophobicContact CB-CB 3.66Å; A210-F264 HydrophobicContact CB-CD1 3.73Å; A210-F264 HydrophobicContact CB-CD2 4.15Å; A210-F264 HydrophobicContact CB-CE1 4.45Å; A210-F264 HydrophobicContact CB-CG 3.55Å; G213-F264 WeakPolarHBondContact O-CA 3.34Å; D214-F264 HydrophobicContact CB-CD1 4.45Å; F264-V271 CarbonylContact O-C 3.21Å; F264-V271 VanDerWaalsContact O-CA 3.26Å; F264-V271 WeakPolarHBondContact O-CA 3.15Å; F264-K272 HydrophobicContact CB-CB 4.44Å; F264-K272 PolarHBondContact N-O 3.29Å; F264-K272 PolarHBondContact O-N 3.29Å
265	I	92.2	Very high	91.2	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	131.4	179.1	-51.9	-179.9	0	0	0	107.5	A212 G213 L215 M218 Y237 Q270 V271	A212-I265 CarbonylContact C-O 3.52Å; G213-I265 PolarHBondContact O-N 3.23Å; L215-I265 HydrophobicContact CB-CD1 4.03Å; L215-I265 HydrophobicContact CD1-CD1 3.76Å; L215-I265 HydrophobicContact CG-CD1 4.49Å; M218-I265 HydrophobicContact SD-CD1 4.32Å; Y237-I265 HydrophobicContact CD1-CD1 4.45Å; Y237-I265 HydrophobicContact CD1-CG2 4.47Å; Y237-I265 HydrophobicContact CD2-CD1 4.39Å; Y237-I265 HydrophobicContact CE1-CG2 3.85Å; Y237-I265 HydrophobicContact CE2-CD1 4.47Å; Y237-I265 HydrophobicContact CG-CD1 4.39Å; I265-Q270 WeakPolarHBondContact CA-O 3.48Å; I265-V271 HydrophobicContact CG1-CG2 4.35Å
266	N	87.3	Confident	90.5	Very high	40 Å²	40	34 Å²	34	21%	0.214	17%	0.172	C	C	.	.			trans	-101	172.1	173.6	74.7	16.6	0	0	0	113.4	F44 A212 K268 G269 Q270	F44-N266 CarbonylContact O-C 3.55Å; A212-N266 HydrophobicContact CB-CB 3.62Å; N266-K268 PolarHBondContact O-N 3.02Å; N266-K268 VanDerWaalsContact O-N 3.07Å; N266-K268 WeakPolarHBondContact OD1-CA 3.35Å; N266-K268 WeakPolarHBondContact OD1-CB 3.08Å; N266-K268 PolarHBondContact OD1-N 3.05Å; N266-G269 WeakPolarHBondContact O-CA 3.44Å; N266-G269 PolarHBondContact O-N 2.89Å; N266-G269 PolarHBondContact OD1-N 2.98Å; N266-Q270 PolarHBondContact N-O 3.24Å; N266-Q270 PolarHBondContact ND2-OE1 3.23Å; N266-Q270 WeakPolarHBondContact OD1-CB 3.3Å; N266-Q270 PolarHBondContact OD1-N 3.41Å
267	V	82	Confident	89.4	Confident	63 Å²	63	33.1 Å²	33.1	38%	0.382	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-26.2	179.6	-48.6	0	0	0	0	114	V43 F44 G269	V43-V267 HydrophobicContact CB-CG1 3.57Å; V43-V267 HydrophobicContact CG1-CB 4.16Å; V43-V267 HydrophobicContact CG1-CG1 3.48Å; V43-V267 VanDerWaalsContact CG1-CG1 3.48Å; V43-V267 WeakPolarHBondContact O-CG1 3.04Å; F44-V267 PolarHBondContact O-N 2.99Å; V267-G269 PolarHBondContact O-N 3.14Å
268	K	87.3	Confident	88.5	Confident	166 Å²	166	31.2 Å²	31.2	72%	0.722	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-3.4	176.6	-58.9	-179.7	-180	176.9	0	112	N266 Q270	N266-K268 PolarHBondContact O-N 3.02Å; N266-K268 VanDerWaalsContact O-N 3.07Å; N266-K268 WeakPolarHBondContact OD1-CA 3.35Å; N266-K268 WeakPolarHBondContact OD1-CB 3.08Å; N266-K268 PolarHBondContact OD1-N 3.05Å; K268-Q270 VanDerWaalsContact C-N 3.35Å; K268-Q270 HydrophobicContact CB-CG 4.24Å
269	G	90.1	Very high	87	Confident	5 Å²	5	32 Å²	32	5%	0.052	17%	0.167	C	C	.	.			trans	75.7	20.4	-175.8	0	0	0	0	0	114	Q240 N266 V267	Q240-G269 PolarHBondContact NE2-O 2.94Å; N266-G269 WeakPolarHBondContact O-CA 3.44Å; N266-G269 PolarHBondContact O-N 2.89Å; N266-G269 PolarHBondContact OD1-N 2.98Å; V267-G269 PolarHBondContact O-N 3.14Å
270	Q	93.5	Very high	85.6	Confident	99 Å²	99	34 Å²	34	46%	0.463	17%	0.173	S	C	.	.			trans	-82.3	134.1	174.5	-58.5	174.1	-53.6	0	0	109.5	I265 N266 K268	I265-Q270 WeakPolarHBondContact CA-O 3.48Å; N266-Q270 PolarHBondContact N-O 3.24Å; N266-Q270 PolarHBondContact ND2-OE1 3.23Å; N266-Q270 WeakPolarHBondContact OD1-CB 3.3Å; N266-Q270 PolarHBondContact OD1-N 3.41Å; K268-Q270 VanDerWaalsContact C-N 3.35Å; K268-Q270 HydrophobicContact CB-CG 4.24Å
271	V	96.5	Very high	83.9	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.006	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	142	-180	-179.9	0	0	0	0	110.8	N189 Y237 Q240 I241 V263 F264 I265	N189-V271 VanDerWaalsContact CA-O 3.28Å; N189-V271 WeakPolarHBondContact CA-O 3.47Å; N189-V271 PolarHBondContact ND2-O 3.32Å; Y237-V271 HydrophobicContact CD1-CG2 3.56Å; Y237-V271 HydrophobicContact CE1-CG2 4.46Å; Y237-V271 HydrophobicContact CG-CG2 4.18Å; Q240-V271 HydrophobicContact CB-CB 3.78Å; Q240-V271 HydrophobicContact CB-CG2 4.01Å; I241-V271 HydrophobicContact CG1-CG1 3.69Å; V263-V271 HydrophobicContact CG1-CG1 3.4Å; V263-V271 VanDerWaalsContact CG1-CG1 3.4Å; F264-V271 CarbonylContact O-C 3.21Å; F264-V271 VanDerWaalsContact O-CA 3.26Å; F264-V271 WeakPolarHBondContact O-CA 3.15Å; I265-V271 HydrophobicContact CG1-CG2 4.35Å
272	K	96.1	Very high	82.1	Confident	37 Å²	37	34.5 Å²	34.5	16%	0.161	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127.8	169.8	-73	175.9	172.9	-88	0	111.4	P188 I191 E208 F264	P188-K272 PolarHBondContact O-NZ 3.17Å; I191-K272 HydrophobicContact CD1-CB 3.92Å; I191-K272 HydrophobicContact CD1-CD 4.02Å; I191-K272 HydrophobicContact CG1-CB 4.15Å; E208-K272 VanDerWaalsContact CD-NZ 3.29Å; E208-K272 WeakPolarHBondContact OE1-CE 3.41Å; E208-K272 IonicContact OE1-NZ 3.89Å; E208-K272 PolarHBondContact OE1-NZ 3.19Å; E208-K272 IonicContact OE2-NZ 2.77Å; E208-K272 PolarHBondContact OE2-NZ 2.98Å; F264-K272 HydrophobicContact CB-CB 4.44Å; F264-K272 PolarHBondContact N-O 3.29Å; F264-K272 PolarHBondContact O-N 3.29Å
273	L	95.6	Very high	80	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	127.9	166.6	-71.1	178.1	0	0	0	110.1	N189 I191 I241 L245 M248 V263	N189-L273 PolarHBondContact O-N 3.43Å; I191-L273 WeakPolarHBondContact CB-O 3.23Å; I191-L273 VanDerWaalsContact CG1-O 3.29Å; I191-L273 WeakPolarHBondContact CG1-O 3.44Å; I191-L273 PolarHBondContact N-O 3.42Å; I241-L273 HydrophobicContact CG2-CD2 4.09Å; L245-L273 HydrophobicContact CB-CD1 4.06Å; M248-L273 HydrophobicContact SD-CD1 4.2Å; V263-L273 HydrophobicContact CG2-CD2 3.96Å
274	G	91.2	Very high	77.5	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.01	18%	0.184	C	C	.	.			trans	-127.6	-175.7	175	0	0	0	0	0	113.8	H255 N262	H255-G274 PolarHBondContact CE1-O 2.9Å; H255-G274 PolarHBondContact NE2-O 3.14Å; N262-G274 PolarHBondContact O-N 3.2Å
275	D	82.4	Confident	75	Confident	57 Å²	57	43.8 Å²	43.8	31%	0.305	21%	0.214	S	C	.	.	S	Bend	trans	55.5	51.8	-169.9	-155.6	13.5	0	0	0	113.9	K159 G277	K159-D275 IonicContact NZ-OD1 3.03Å; K159-D275 PolarHBondContact NZ-OD1 3.14Å; D275-G277 PolarHBondContact O-N 2.92Å
276	L	77.6	Confident	72.9	Confident	10 Å²	10	46.8 Å²	46.8	5%	0.052	23%	0.233	C	C	.	.			trans	-69.9	128.3	-167.4	-52	175.1	0	0	0	113.2	L182 L185 V190 I191 M248 L278	L182-L276 HydrophobicContact CD2-CB 3.72Å; L185-L276 HydrophobicContact CD1-CD1 3.97Å; V190-L276 HydrophobicContact CG1-CD1 3.73Å; V190-L276 HydrophobicContact CG1-CD2 3.76Å; V190-L276 HydrophobicContact CG1-CG 4.41Å; I191-L276 WeakPolarHBondContact O-CD1 3.43Å; M248-L276 HydrophobicContact CE-CB 4.47Å; M248-L276 HydrophobicContact CE-CD2 3.87Å; M248-L276 HydrophobicContact SD-CD2 4.04Å; L276-L278 PolarHBondContact O-N 3.21Å
277	G	65.3	Low	70.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	66.1	-26.7	152.5	0	0	0	0	0	117.6	M254 H255 R256 D275 G279	M254-G277 WeakPolarHBondContact O-CA 3.18Å; H255-G277 PolarHBondContact O-N 2.83Å; R256-G277 WeakPolarHBondContact CD-O 3.36Å; R256-G277 PolarHBondContact NH1-O 2.7Å; D275-G277 PolarHBondContact O-N 2.92Å; G277-G279 VanDerWaalsContact C-N 3.29Å; G277-G279 PolarHBondContact O-N 2.8Å
278	L	68	Low	68.9	Low	3 Å²	3	47.5 Å²	47.5	2%	0.016	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-2.2	-169.7	-62.3	164.7	0	0	0	113.7	I161 E178 I179 L182 I205 L276 R280 Y281 F282	I161-L278 HydrophobicContact CD1-CD1 3.83Å; E178-L278 HydrophobicContact CG-CD2 4.36Å; I179-L278 HydrophobicContact CG1-CD2 4.36Å; L182-L278 HydrophobicContact CD1-CD1 3.99Å; L182-L278 HydrophobicContact CD1-CD2 4.26Å; L182-L278 HydrophobicContact CD1-CG 3.93Å; I205-L278 HydrophobicContact CD1-CD1 3.44Å; I205-L278 VanDerWaalsContact CD1-CD1 3.44Å; L276-L278 PolarHBondContact O-N 3.21Å; L278-R280 PolarHBondContact O-N 3.41Å; L278-Y281 HydrophobicContact CD2-CD2 4.3Å; L278-Y281 HydrophobicContact CD2-CE2 4.47Å; L278-Y281 PolarHBondContact O-N 2.84Å; L278-Y281 VanDerWaalsContact O-N 3.15Å; L278-F282 HydrophobicContact CB-CD2 3.92Å; L278-F282 HydrophobicContact CB-CE2 3.4Å; L278-F282 HydrophobicContact CB-CZ 4.27Å; L278-F282 HydrophobicContact CD1-CE2 4.3Å; L278-F282 HydrophobicContact CG-CE2 4.3Å; L278-F282 WeakPolarHBondContact O-CD2 3.39Å
279	G	61.3	Low	66.6	Low	19 Å²	19	40.8 Å²	40.8	20%	0.196	22%	0.217	C	C	.	.	H	α-helix	trans	-53.1	-29	-177.5	0	0	0	0	0	114.2	G277 Y281 F282 S283	G277-G279 VanDerWaalsContact C-N 3.29Å; G277-G279 PolarHBondContact O-N 2.8Å; G279-Y281 PolarHBondContact O-N 3.25Å; G279-F282 PolarHBondContact O-N 3.4Å; G279-S283 WeakPolarHBondContact O-CB 3.41Å; G279-S283 PolarHBondContact O-N 3.47Å
280	R	64.5	Low	64.5	Low	99 Å²	99	42.8 Å²	42.8	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-71.7	-28.4	-177.8	94.3	171.2	-176	176.6	10.8	115.5	D174 E178 R256 L278 F282 Y309	D174-R280 IonicContact OD2-NH2 2.61Å; E178-R280 IonicContact OE2-NE 3.65Å; R256-R280 VanDerWaalsContact CZ-CD 3.48Å; L278-R280 PolarHBondContact O-N 3.41Å; R280-F282 VanDerWaalsContact C-N 3.31Å; R280-Y309 WeakPolarHBondContact CB-OH 3.39Å; R280-Y309 WeakPolarHBondContact CD-OH 3.04Å
281	Y	57.9	Low	62	Low	30 Å²	30	41.6 Å²	41.6	12%	0.118	23%	0.228	C	C	.	.	H	α-helix	trans	-85.4	-16.8	-179	-56.4	-71.8	0	0	0	111	M166 D174 C175 E178 L278 G279	M166-Y281 HydrophobicContact CE-CD1 4.45Å; D174-Y281 VanDerWaalsContact C-OH 3.26Å; D174-Y281 HydrophobicContact CB-CE1 3.7Å; D174-Y281 WeakPolarHBondContact CB-OH 3.41Å; D174-Y281 PolarHBondContact O-OH 3.31Å; D174-Y281 VanDerWaalsContact O-OH 3.08Å; C175-Y281 HydrophobicContact CB-CD1 4.39Å; C175-Y281 HydrophobicContact CB-CD2 4.13Å; C175-Y281 HydrophobicContact CB-CE1 4.5Å; C175-Y281 HydrophobicContact CB-CE2 4.21Å; C175-Y281 HydrophobicContact CB-CG 4.22Å; E178-Y281 HydrophobicContact CB-CE2 4.05Å; E178-Y281 HydrophobicContact CG-CE2 4.38Å; E178-Y281 WeakPolarHBondContact OE2-CE2 3.26Å; E178-Y281 PolarHBondContact OE2-OH 3.07Å; L278-Y281 HydrophobicContact CD2-CD2 4.3Å; L278-Y281 HydrophobicContact CD2-CE2 4.47Å; L278-Y281 PolarHBondContact O-N 2.84Å; L278-Y281 VanDerWaalsContact O-N 3.15Å; G279-Y281 PolarHBondContact O-N 3.25Å
282	F	52.7	Low	59.2	Low	23 Å²	23	48.9 Å²	48.9	10%	0.101	27%	0.266	C	S	.	.	H	α-helix	trans	-115.5	-19.3	-171.9	-49.6	-41.1	0	0	0	113.3	F140 I161 L278 G279 R280 S284	F140-F282 HydrophobicContact CB-CD1 3.74Å; F140-F282 HydrophobicContact CB-CE1 4.42Å; F140-F282 HydrophobicContact CB-CG 4.46Å; I161-F282 HydrophobicContact CB-CZ 4.19Å; I161-F282 HydrophobicContact CD1-CE2 3.85Å; I161-F282 HydrophobicContact CD1-CZ 3.72Å; I161-F282 HydrophobicContact CG1-CE2 4.03Å; I161-F282 HydrophobicContact CG1-CZ 3.85Å; I161-F282 HydrophobicContact CG2-CE1 3.41Å; I161-F282 VanDerWaalsContact CG2-CE1 3.41Å; I161-F282 HydrophobicContact CG2-CE2 4.22Å; I161-F282 HydrophobicContact CG2-CZ 3.25Å; L278-F282 HydrophobicContact CB-CD2 3.92Å; L278-F282 HydrophobicContact CB-CE2 3.4Å; L278-F282 HydrophobicContact CB-CZ 4.27Å; L278-F282 HydrophobicContact CD1-CE2 4.3Å; L278-F282 HydrophobicContact CG-CE2 4.3Å; L278-F282 WeakPolarHBondContact O-CD2 3.39Å; G279-F282 PolarHBondContact O-N 3.4Å; R280-F282 VanDerWaalsContact C-N 3.31Å; F282-S284 PolarHBondContact O-N 3.01Å
283	S	49	Very low	56.7	Low	34 Å²	34	53.3 Å²	53.3	24%	0.238	30%	0.296	C	S	.	.	S	Bend	trans	-75.6	96.8	159.1	170	0	0	0	0	106	G279 K285 H290	G279-S283 WeakPolarHBondContact O-CB 3.41Å; G279-S283 PolarHBondContact O-N 3.47Å; S283-K285 PolarHBondContact O-N 2.91Å; S283-H290 PolarHBondContact OG-NE2 3.15Å
284	S	42	Very low	54.8	Low	31 Å²	31	55.1 Å²	55.1	22%	0.217	31%	0.314	C	S	.	.			trans	-47.7	135.2	172.5	23.6	0	0	0	0	108.8	Q139 F282 T286 A289	Q139-S284 PolarHBondContact OE1-OG 2.66Å; F282-S284 PolarHBondContact O-N 3.01Å; S284-T286 PolarHBondContact O-N 3.11Å; S284-A289 WeakPolarHBondContact OG-CB 3.38Å
285	K	42.8	Very low	53.6	Low	196 Å²	196	58.4 Å²	58.4	85%	0.852	33%	0.334	S	S	*	.	S	Bend	trans	-54.8	84.9	168.9	-70.5	177.6	176.6	176.1	0	109	S283	S283-K285 PolarHBondContact O-N 2.91Å
286	T	47.3	Very low	53.6	Low	68 Å²	68	56.5 Å²	56.5	42%	0.417	33%	0.325	S	S	.	.			trans	175.8	133.5	159.2	16.7	0	0	0	0	110.4	S284 A288 A289	S284-T286 PolarHBondContact O-N 3.11Å; T286-A288 HydrophobicContact CG2-CB 4.12Å; T286-A288 PolarHBondContact O-N 2.94Å; T286-A288 VanDerWaalsContact O-N 3.13Å; T286-A289 PolarHBondContact O-N 3.31Å; T286-A289 VanDerWaalsContact O-N 3.12Å
287	M	44.4	Very low	54.1	Low	60 Å²	60	58.3 Å²	58.3	30%	0.296	33%	0.332	S	S	.	.	H	α-helix	trans	-52.3	-26.9	158.9	-72	-179.7	64.2	0	0	112.6	A289 H290 S291 I304 L339 C343	M287-A289 PolarHBondContact O-N 3.33Å; M287-H290 PolarHBondContact O-N 3.12Å; M287-S291 PolarHBondContact O-N 2.92Å; M287-S291 VanDerWaalsContact O-N 3.08Å; M287-I304 HydrophobicContact CE-CG2 4.16Å; M287-I304 HydrophobicContact SD-CG2 3.98Å; M287-L339 HydrophobicContact CE-CD1 4.39Å; M287-L339 HydrophobicContact CE-CD2 4.17Å; M287-L339 HydrophobicContact CE-CG 4.16Å; M287-C343 HydrophobicContact CE-CB 4.42Å; M287-C343 WeakPolarHBondContact CE-SG 3.46Å
288	A	40.5	Very low	55.4	Low	58 Å²	58	60.1 Å²	60.1	48%	0.479	34%	0.339	S	S	.	.	H	α-helix	trans	-60.6	-40.9	175.9	0	0	0	0	0	112.7	T286 H290 S291	T286-A288 HydrophobicContact CG2-CB 4.12Å; T286-A288 PolarHBondContact O-N 2.94Å; T286-A288 VanDerWaalsContact O-N 3.13Å; A288-H290 VanDerWaalsContact C-N 3.34Å; A288-H290 PolarHBondContact O-N 3.2Å; A288-S291 PolarHBondContact O-N 2.86Å; A288-S291 PolarHBondContact O-OG 3.29Å
289	A	40.7	Very low	56.5	Low	25 Å²	25	60.9 Å²	60.9	21%	0.207	34%	0.342	C	S	.	.	H	α-helix	trans	-67.4	-35.2	175.6	0	0	0	0	0	112.3	S284 T286 M287 L292 V293	S284-A289 WeakPolarHBondContact OG-CB 3.38Å; T286-A289 PolarHBondContact O-N 3.31Å; T286-A289 VanDerWaalsContact O-N 3.12Å; M287-A289 PolarHBondContact O-N 3.33Å; A289-L292 PolarHBondContact O-N 3.47Å; A289-V293 WeakPolarHBondContact O-CG2 3.45Å
290	H	44.2	Very low	57.9	Low	47 Å²	47	60 Å²	60	22%	0.218	33%	0.333	C	S	.	.	H	α-helix	trans	-67.1	-35.3	175.7	-79.9	-68.8	0	0	0	112.7	S283 M287 A288 L292 V293 G294	S283-H290 PolarHBondContact OG-NE2 3.15Å; M287-H290 PolarHBondContact O-N 3.12Å; A288-H290 VanDerWaalsContact C-N 3.34Å; A288-H290 PolarHBondContact O-N 3.2Å; H290-L292 PolarHBondContact O-N 2.84Å; H290-L292 VanDerWaalsContact O-N 3.14Å; H290-V293 PolarHBondContact O-N 2.97Å; H290-V293 VanDerWaalsContact O-N 3.1Å; H290-G294 CarbonylContact O-C 3.44Å; H290-G294 PolarHBondContact O-N 3.46Å
291	S	42.7	Very low	59.2	Low	74 Å²	74	55.2 Å²	55.2	52%	0.517	32%	0.315	S	S	.	.	H	α-helix	trans	-59.3	-27.5	178.7	76.4	0	0	0	0	114.2	M287 A288	M287-S291 PolarHBondContact O-N 2.92Å; M287-S291 VanDerWaalsContact O-N 3.08Å; A288-S291 PolarHBondContact O-N 2.86Å; A288-S291 PolarHBondContact O-OG 3.29Å
292	L	35.9	Very low	60.8	Low	154 Å²	154	54.2 Å²	54.2	81%	0.806	31%	0.311	S	S	*	.	H	α-helix	trans	-87.7	-21	179	-85.2	147.7	0	0	0	113.8	A289 H290	A289-L292 PolarHBondContact O-N 3.47Å; H290-L292 PolarHBondContact O-N 2.84Å; H290-L292 VanDerWaalsContact O-N 3.14Å
293	V	44.6	Very low	62.3	Low	130 Å²	130	55.4 Å²	55.4	79%	0.788	32%	0.315	S	S	*	.	H	α-helix	trans	-116.9	-17.9	-166.7	-171.6	0	0	0	0	112.6	A289 H290	A289-V293 WeakPolarHBondContact O-CG2 3.45Å; H290-V293 PolarHBondContact O-N 2.97Å; H290-V293 VanDerWaalsContact O-N 3.1Å
294	G	55	Low	64	Low	38 Å²	38	54.5 Å²	54.5	39%	0.392	31%	0.307	S	S	.	.			trans	157.3	151.8	171.7	0	0	0	0	0	113.8	H290 P296	H290-G294 CarbonylContact O-C 3.44Å; H290-G294 PolarHBondContact O-N 3.46Å; G294-P296 WeakPolarHBondContact O-CD 3.02Å
295	T	66.3	Low	66	Low	70 Å²	70	57.5 Å²	57.5	43%	0.429	31%	0.314	S	S	.	.			trans	-68.9	121.6	-178	-53.3	0	0	0	0	111.4	Y297 L342	T295-Y297 VanDerWaalsContact C-N 3.26Å; T295-Y297 VanDerWaalsContact CB-CE2 3.46Å; T295-Y297 HydrophobicContact CG2-CD1 4.06Å; T295-Y297 HydrophobicContact CG2-CD2 4.01Å; T295-Y297 HydrophobicContact CG2-CE1 3.57Å; T295-Y297 HydrophobicContact CG2-CE2 3.55Å; T295-Y297 HydrophobicContact CG2-CG 4.25Å; T295-Y297 WeakPolarHBondContact O-CD2 3.36Å; T295-Y297 PolarHBondContact O-N 3.48Å; T295-L342 HydrophobicContact CG2-CD2 3.26Å
296	P	82.1	Confident	67.6	Low	17 Å²	17	54.9 Å²	54.9	11%	0.11	31%	0.305	C	S	.	.			trans	-80.6	59.6	-169	33.6	-38.3	0	0	0	113.6	G294 Y298 M299 L339 L342	G294-P296 WeakPolarHBondContact O-CD 3.02Å; P296-Y298 PolarHBondContact O-N 3.21Å; P296-Y298 VanDerWaalsContact O-N 3.09Å; P296-M299 HydrophobicContact CB-CB 3.92Å; P296-M299 HydrophobicContact CB-CE 3.88Å; P296-M299 HydrophobicContact CB-SD 4.28Å; P296-M299 WeakPolarHBondContact O-CB 3.35Å; P296-M299 PolarHBondContact O-N 2.91Å; P296-L339 HydrophobicContact CG-CD1 3.66Å; P296-L342 HydrophobicContact CG-CD2 4.12Å
297	Y	89.3	Confident	68.7	Low	49 Å²	49	57.1 Å²	57.1	19%	0.192	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.9	-171.9	-73.2	-61.6	0	0	0	116.6	T295 S330 Y333 L342	T295-Y297 VanDerWaalsContact C-N 3.26Å; T295-Y297 VanDerWaalsContact CB-CE2 3.46Å; T295-Y297 HydrophobicContact CG2-CD1 4.06Å; T295-Y297 HydrophobicContact CG2-CD2 4.01Å; T295-Y297 HydrophobicContact CG2-CE1 3.57Å; T295-Y297 HydrophobicContact CG2-CE2 3.55Å; T295-Y297 HydrophobicContact CG2-CG 4.25Å; T295-Y297 WeakPolarHBondContact O-CD2 3.36Å; T295-Y297 PolarHBondContact O-N 3.48Å; Y297-S330 WeakPolarHBondContact CB-OG 2.99Å; Y297-Y333 HydrophobicContact CE1-CD2 4.11Å; Y297-Y333 AromaticContact CZ-CD2 3.8Å; Y297-Y333 WeakPolarHBondContact OH-CD2 3.41Å; Y297-L342 HydrophobicContact CD1-CD1 4.04Å; Y297-L342 HydrophobicContact CD1-CD2 4.3Å; Y297-L342 HydrophobicContact CE1-CD1 4.24Å; Y297-L342 HydrophobicContact CE1-CD2 4.39Å
298	Y	92.3	Very high	69.8	Low	38 Å²	38	58 Å²	58	15%	0.149	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	2.9	-179.3	-46.7	-87.6	0	0	0	112.2	K259 P260 P296 S317 C320 E324	K259-Y298 HydrophobicContact CB-CD1 4.47Å; K259-Y298 HydrophobicContact CB-CD2 3.56Å; K259-Y298 HydrophobicContact CB-CE1 4.41Å; K259-Y298 HydrophobicContact CB-CE2 3.46Å; K259-Y298 VanDerWaalsContact CB-CE2 3.46Å; K259-Y298 HydrophobicContact CB-CG 4.1Å; P260-Y298 WeakPolarHBondContact CD-OH 3.22Å; P260-Y298 HydrophobicContact CG-CE1 4.43Å; P296-Y298 PolarHBondContact O-N 3.21Å; P296-Y298 VanDerWaalsContact O-N 3.09Å; Y298-S317 PolarHBondContact O-OG 2.97Å; Y298-S317 VanDerWaalsContact O-OG 3.05Å; Y298-C320 HydrophobicContact CD1-CB 3.68Å; Y298-C320 HydrophobicContact CE1-CB 4.32Å; Y298-E324 VanDerWaalsContact CE1-OE2 3.23Å; Y298-E324 WeakPolarHBondContact CE1-OE2 3.44Å; Y298-E324 PolarHBondContact OH-OE1 2.99Å; Y298-E324 PolarHBondContact OH-OE2 3.06Å
299	M	89.9	Confident	71.4	Confident	18 Å²	18	57.9 Å²	57.9	9%	0.089	32%	0.323	C	S	.	.			trans	-72.6	132.6	-179.3	-169.9	173.2	-71.7	0	0	110.2	P296 R303 I304 W316	P296-M299 HydrophobicContact CB-CB 3.92Å; P296-M299 HydrophobicContact CB-CE 3.88Å; P296-M299 HydrophobicContact CB-SD 4.28Å; P296-M299 WeakPolarHBondContact O-CB 3.35Å; P296-M299 PolarHBondContact O-N 2.91Å; M299-R303 HydrophobicContact CG-CB 3.53Å; M299-R303 HydrophobicContact SD-CB 4.19Å; M299-I304 HydrophobicContact CG-CG1 3.95Å; M299-I304 HydrophobicContact SD-CG1 3.9Å; M299-W316 PolarHBondContact O-NE1 3.08Å; M299-W316 VanDerWaalsContact O-NE1 3.15Å
300	S	91.8	Very high	73.4	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.332	C	S	.	.			trans	-78.2	157.7	-179.4	61.9	0	0	0	0	112.6	E302 R303 I304 S313	S300-E302 VanDerWaalsContact C-N 3.31Å; S300-E302 VanDerWaalsContact CB-CD 3.44Å; S300-E302 WeakPolarHBondContact CB-OE1 3.4Å; S300-E302 WeakPolarHBondContact CB-OE2 3.48Å; S300-E302 PolarHBondContact O-N 3.31Å; S300-E302 PolarHBondContact OG-OE1 2.72Å; S300-E302 PolarHBondContact OG-OE2 3.2Å; S300-R303 WeakPolarHBondContact O-CB 3.11Å; S300-R303 PolarHBondContact O-N 3.29Å; S300-R303 VanDerWaalsContact O-N 3.09Å; S300-R303 WeakPolarHBondContact OG-CG 3.38Å; S300-I304 PolarHBondContact O-N 3.25Å; S300-I304 VanDerWaalsContact O-N 3.1Å; S300-S313 PolarHBondContact OG-OG 2.87Å
301	P	92.2	Very high	75.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-56.1	-41.8	-180	-24.9	33	0	0	0	113.4	R303 I304 R305 W316 I346	P301-R303 VanDerWaalsContact C-N 3.31Å; P301-R303 PolarHBondContact O-N 3.28Å; P301-I304 PolarHBondContact O-N 2.9Å; P301-R305 WeakPolarHBondContact O-CG 3.29Å; P301-R305 PolarHBondContact O-N 2.72Å; P301-W316 HydrophobicContact CG-CE3 4.23Å; P301-W316 HydrophobicContact CG-CH2 3.6Å; P301-W316 HydrophobicContact CG-CZ2 4.07Å; P301-W316 HydrophobicContact CG-CZ3 3.69Å; P301-I346 HydrophobicContact CB-CG2 4.31Å; P301-I346 HydrophobicContact CG-CG2 3.78Å
302	E	90.4	Very high	78.3	Confident	9 Å²	9	58.3 Å²	58.3	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-35.3	178.1	66.2	-78.6	-178.9	0	0	112.3	S300 R305 E306 Q307 S313 P375 R378	S300-E302 VanDerWaalsContact C-N 3.31Å; S300-E302 VanDerWaalsContact CB-CD 3.44Å; S300-E302 WeakPolarHBondContact CB-OE1 3.4Å; S300-E302 WeakPolarHBondContact CB-OE2 3.48Å; S300-E302 PolarHBondContact O-N 3.31Å; S300-E302 PolarHBondContact OG-OE1 2.72Å; S300-E302 PolarHBondContact OG-OE2 3.2Å; E302-R305 PolarHBondContact O-N 3Å; E302-E306 PolarHBondContact O-N 3.36Å; E302-Q307 CarbonylContact C-O 3.58Å; E302-Q307 HydrophobicContact CB-CB 4.42Å; E302-Q307 PolarHBondContact O-N 3.12Å; E302-Q307 VanDerWaalsContact O-O 3.05Å; E302-S313 WeakPolarHBondContact OE1-CA 3.43Å; E302-S313 WeakPolarHBondContact OE1-CB 3.44Å; E302-S313 PolarHBondContact OE1-OG 3.07Å; E302-P375 HydrophobicContact CB-CG 4.28Å; E302-P375 HydrophobicContact CG-CG 4.07Å; E302-R378 IonicContact OE1-CZ 3.69Å; E302-R378 IonicContact OE1-NH1 3.64Å; E302-R378 PolarHBondContact OE1-NH1 3.49Å; E302-R378 IonicContact OE1-NH2 3.56Å; E302-R378 IonicContact OE2-CZ 3.54Å; E302-R378 IonicContact OE2-NH1 3.9Å; E302-R378 PolarHBondContact OE2-NH1 2.93Å; E302-R378 IonicContact OE2-NH2 2.93Å; E302-R378 PolarHBondContact OE2-NH2 3.11Å
303	R	85.7	Confident	81.1	Confident	47 Å²	47	51.1 Å²	51.1	18%	0.177	28%	0.279	C	S	.	.	H	α-helix	trans	-67.4	-38.3	174	-79.9	-171.3	68.4	171.5	1.9	112.5	R256 M299 S300 P301 R305 E306 Y309	R256-R303 PolarHBondContact O-NH1 2.84Å; M299-R303 HydrophobicContact CG-CB 3.53Å; M299-R303 HydrophobicContact SD-CB 4.19Å; S300-R303 WeakPolarHBondContact O-CB 3.11Å; S300-R303 PolarHBondContact O-N 3.29Å; S300-R303 VanDerWaalsContact O-N 3.09Å; S300-R303 WeakPolarHBondContact OG-CG 3.38Å; P301-R303 VanDerWaalsContact C-N 3.31Å; P301-R303 PolarHBondContact O-N 3.28Å; R303-R305 VanDerWaalsContact C-N 3.28Å; R303-E306 PolarHBondContact O-N 3.45Å; R303-Y309 VanDerWaalsContact CG-CB 3.41Å; R303-Y309 HydrophobicContact CG-CD1 4.25Å; R303-Y309 HydrophobicContact CG-CG 3.9Å
304	I	84.4	Confident	83.5	Confident	15 Å²	15	45 Å²	45	8%	0.077	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-38.4	175.6	-67.2	173.2	0	0	0	110.5	M287 M299 S300 P301 E306 C343 I346	M287-I304 HydrophobicContact CE-CG2 4.16Å; M287-I304 HydrophobicContact SD-CG2 3.98Å; M299-I304 HydrophobicContact CG-CG1 3.95Å; M299-I304 HydrophobicContact SD-CG1 3.9Å; S300-I304 PolarHBondContact O-N 3.25Å; S300-I304 VanDerWaalsContact O-N 3.1Å; P301-I304 PolarHBondContact O-N 2.9Å; I304-E306 PolarHBondContact O-N 3.32Å; I304-C343 HydrophobicContact CD1-CB 4.39Å; I304-C343 HydrophobicContact CG2-CB 4.06Å; I304-I346 HydrophobicContact CD1-CB 3.78Å; I304-I346 HydrophobicContact CD1-CD1 3.62Å; I304-I346 HydrophobicContact CD1-CG1 4.3Å; I304-I346 HydrophobicContact CD1-CG2 3.42Å; I304-I346 VanDerWaalsContact CD1-CG2 3.42Å
305	R	83.1	Confident	85.5	Confident	94 Å²	94	43.4 Å²	43.4	36%	0.355	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	2.2	178.5	-65.2	173	-167.8	143.9	2.4	114	P301 E302 R303 Q307 E347	P301-R305 WeakPolarHBondContact O-CG 3.29Å; P301-R305 PolarHBondContact O-N 2.72Å; E302-R305 PolarHBondContact O-N 3Å; R303-R305 VanDerWaalsContact C-N 3.28Å; R305-Q307 HydrophobicContact CB-CG 3.97Å; R305-Q307 PolarHBondContact O-N 2.93Å; R305-E347 IonicContact CZ-OE1 2.66Å; R305-E347 IonicContact NE-OE1 3.12Å; R305-E347 PolarHBondContact NE-OE1 3.15Å; R305-E347 IonicContact NH2-OE1 2.86Å
306	E	77.5	Confident	87	Confident	142 Å²	142	40 Å²	40	66%	0.664	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	22.8	-172.7	-55.7	-171.9	162	0	0	113.6	E302 R303 I304	E302-E306 PolarHBondContact O-N 3.36Å; R303-E306 PolarHBondContact O-N 3.45Å; I304-E306 PolarHBondContact O-N 3.32Å
307	Q	69.3	Low	87.7	Confident	115 Å²	115	39.4 Å²	39.4	54%	0.537	20%	0.2	S	C	.	.			trans	-81.7	126.1	171.4	-66.3	174.9	11.2	0	0	106.2	E302 R305 Y309	E302-Q307 CarbonylContact C-O 3.58Å; E302-Q307 HydrophobicContact CB-CB 4.42Å; E302-Q307 PolarHBondContact O-N 3.12Å; E302-Q307 VanDerWaalsContact O-O 3.05Å; R305-Q307 HydrophobicContact CB-CG 3.97Å; R305-Q307 PolarHBondContact O-N 2.93Å; Q307-Y309 PolarHBondContact O-N 2.97Å
308	G	68.9	Low	88.1	Confident	79 Å²	79	37.1 Å²	37.1	81%	0.814	19%	0.191	S	C	*	.			trans	-41.4	128.1	-171.5	0	0	0	0	0	112.3
309	Y	73.2	Confident	88.4	Confident	55 Å²	55	35.3 Å²	35.3	22%	0.216	18%	0.183	C	C	.	.			trans	-93.2	145.3	-175	73.1	-91.2	0	0	0	110.4	M254 R256 R280 R303 Q307 S313	M254-Y309 HydrophobicContact CE-CD2 4.23Å; M254-Y309 HydrophobicContact CE-CE2 3.66Å; M254-Y309 HydrophobicContact SD-CD2 4.09Å; M254-Y309 HydrophobicContact SD-CE2 3.97Å; R256-Y309 VanDerWaalsContact CD-OH 3.26Å; R256-Y309 WeakPolarHBondContact CD-OH 3.45Å; R256-Y309 HydrophobicContact CG-CE2 3.87Å; R256-Y309 PolarHBondContact NE-OH 3.31Å; R256-Y309 VanDerWaalsContact NE-OH 3.09Å; R280-Y309 WeakPolarHBondContact CB-OH 3.39Å; R280-Y309 WeakPolarHBondContact CD-OH 3.04Å; R303-Y309 VanDerWaalsContact CG-CB 3.41Å; R303-Y309 HydrophobicContact CG-CD1 4.25Å; R303-Y309 HydrophobicContact CG-CG 3.9Å; Q307-Y309 PolarHBondContact O-N 2.97Å; Y309-S313 WeakPolarHBondContact CB-OG 3.42Å
310	D	83.2	Confident	88.8	Confident	74 Å²	74	34.4 Å²	34.4	40%	0.396	18%	0.179	S	C	.	.			trans	-128.5	-167.8	-174.8	72.4	-1.8	0	0	0	111.2	M254 A312 S313	M254-D310 VanDerWaalsContact SD-O 3.34Å; D310-A312 PolarHBondContact O-N 3.27Å; D310-A312 WeakPolarHBondContact OD1-CA 3.26Å; D310-A312 WeakPolarHBondContact OD1-CB 3.36Å; D310-A312 PolarHBondContact OD1-N 3.2Å; D310-S313 WeakPolarHBondContact O-CB 3.41Å; D310-S313 PolarHBondContact O-N 2.8Å; D310-S313 PolarHBondContact O-OG 2.78Å
311	F	92.9	Very high	89.1	Confident	66 Å²	66	34.4 Å²	34.4	29%	0.289	18%	0.179	S	C	.	.	H	α-helix	trans	-58.8	-26.8	178.2	-64.8	-81.2	0	0	0	112.7	H249 R252 M254 S313 D314	H249-F311 HydrophobicContact CB-CD1 4.25Å; H249-F311 AromaticContact CD2-CD1 3.68Å; H249-F311 AromaticContact CE1-CD1 3.92Å; H249-F311 PolarHBondContact CE1-O 3.3Å; H249-F311 AromaticContact CG-CD1 3.69Å; H249-F311 AromaticContact ND1-CD1 3.84Å; H249-F311 AromaticContact NE2-CD1 3.81Å; R252-F311 HydrophobicContact CB-CZ 4.3Å; M254-F311 HydrophobicContact CG-CD1 3.48Å; M254-F311 VanDerWaalsContact CG-CD1 3.48Å; M254-F311 HydrophobicContact CG-CE1 3.58Å; M254-F311 HydrophobicContact CG-CG 4.03Å; M254-F311 HydrophobicContact CG-CZ 4.2Å; F311-S313 PolarHBondContact O-N 2.91Å; F311-D314 WeakPolarHBondContact O-CB 3.19Å; F311-D314 PolarHBondContact O-N 2.85Å
312	A	95.9	Very high	89.4	Confident	15 Å²	15	34.4 Å²	34.4	12%	0.124	18%	0.179	C	C	.	.	H	α-helix	trans	-71.6	-19.4	178.5	0	0	0	0	0	112.4	D310 D314 I315 W316 P375 R378	D310-A312 PolarHBondContact O-N 3.27Å; D310-A312 WeakPolarHBondContact OD1-CA 3.26Å; D310-A312 WeakPolarHBondContact OD1-CB 3.36Å; D310-A312 PolarHBondContact OD1-N 3.2Å; A312-D314 VanDerWaalsContact C-N 3.35Å; A312-I315 WeakPolarHBondContact O-CB 3.49Å; A312-I315 PolarHBondContact O-N 3.06Å; A312-W316 PolarHBondContact O-N 3.4Å; A312-W316 VanDerWaalsContact O-N 3.15Å; A312-P375 HydrophobicContact CB-CB 3.85Å; A312-R378 VanDerWaalsContact C-NH1 3.33Å; A312-R378 WeakPolarHBondContact O-CD 3.13Å; A312-R378 PolarHBondContact O-NH1 3.15Å
313	S	94.3	Very high	89.8	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.014	18%	0.179	C	C	.	.	H	α-helix	trans	-69.5	-31.9	172.3	-53.3	0	0	0	0	112.7	S300 E302 Y309 D310 F311 I315 W316 S317	S300-S313 PolarHBondContact OG-OG 2.87Å; E302-S313 WeakPolarHBondContact OE1-CA 3.43Å; E302-S313 WeakPolarHBondContact OE1-CB 3.44Å; E302-S313 PolarHBondContact OE1-OG 3.07Å; Y309-S313 WeakPolarHBondContact CB-OG 3.42Å; D310-S313 WeakPolarHBondContact O-CB 3.41Å; D310-S313 PolarHBondContact O-N 2.8Å; D310-S313 PolarHBondContact O-OG 2.78Å; F311-S313 PolarHBondContact O-N 2.91Å; S313-I315 VanDerWaalsContact C-N 3.28Å; S313-W316 PolarHBondContact O-N 2.89Å; S313-S317 PolarHBondContact O-N 2.87Å; S313-S317 PolarHBondContact O-OG 3.27Å
314	D	95.2	Very high	90.4	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.011	18%	0.175	C	C	.	.	H	α-helix	trans	-65.7	-35.8	170	-76.7	-19.1	0	0	0	110.6	L245 H249 M254 H255 R256 I258 F311 A312 S317 L318	L245-D314 HydrophobicContact CD1-CB 4.39Å; L245-D314 HydrophobicContact CD2-CB 4.27Å; H249-D314 IonicContact CD2-OD2 2.76Å; H249-D314 IonicContact CE1-OD2 3.31Å; H249-D314 IonicContact NE2-OD2 2.9Å; H249-D314 PolarHBondContact NE2-OD2 2.81Å; M254-D314 VanDerWaalsContact CA-OD2 3.31Å; M254-D314 WeakPolarHBondContact CA-OD2 3.24Å; H255-D314 PolarHBondContact N-OD2 3.3Å; R256-D314 WeakPolarHBondContact CA-OD1 3.37Å; R256-D314 PolarHBondContact N-OD1 3.29Å; I258-D314 HydrophobicContact CD1-CB 3.85Å; F311-D314 WeakPolarHBondContact O-CB 3.19Å; F311-D314 PolarHBondContact O-N 2.85Å; A312-D314 VanDerWaalsContact C-N 3.35Å; D314-S317 WeakPolarHBondContact O-CB 3.28Å; D314-S317 PolarHBondContact O-N 3.41Å; D314-L318 WeakPolarHBondContact O-CB 3.41Å; D314-L318 PolarHBondContact O-N 3.47Å
315	I	98.2	Very high	91.1	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-41.5	178.4	-54.2	-51.6	0	0	0	111.6	A312 S313 S317 L318 G319 C370 R378 I381 I384	A312-I315 WeakPolarHBondContact O-CB 3.49Å; A312-I315 PolarHBondContact O-N 3.06Å; S313-I315 VanDerWaalsContact C-N 3.28Å; I315-S317 VanDerWaalsContact C-N 3.33Å; I315-S317 PolarHBondContact O-N 3.03Å; I315-L318 PolarHBondContact O-N 3.06Å; I315-G319 PolarHBondContact O-N 3.22Å; I315-C370 HydrophobicContact CG2-CB 4.09Å; I315-R378 HydrophobicContact CB-CB 4.31Å; I315-R378 HydrophobicContact CG2-CB 3.9Å; I315-I381 HydrophobicContact CD1-CB 3.87Å; I315-I381 HydrophobicContact CD1-CD1 4.38Å; I315-I384 HydrophobicContact CD1-CD1 3.85Å; I315-I384 HydrophobicContact CG2-CD1 3.62Å
316	W	97.6	Very high	91.8	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.6	-48.4	172.1	174.7	-82.6	0	0	0	111.7	M299 P301 A312 S313 L318 G319 C320 F332 I346 I371 Q372	M299-W316 PolarHBondContact O-NE1 3.08Å; M299-W316 VanDerWaalsContact O-NE1 3.15Å; P301-W316 HydrophobicContact CG-CE3 4.23Å; P301-W316 HydrophobicContact CG-CH2 3.6Å; P301-W316 HydrophobicContact CG-CZ2 4.07Å; P301-W316 HydrophobicContact CG-CZ3 3.69Å; A312-W316 PolarHBondContact O-N 3.4Å; A312-W316 VanDerWaalsContact O-N 3.15Å; S313-W316 PolarHBondContact O-N 2.89Å; W316-L318 VanDerWaalsContact C-N 3.3Å; W316-L318 PolarHBondContact O-N 3.26Å; W316-G319 PolarHBondContact O-N 3.17Å; W316-C320 PolarHBondContact O-N 3.18Å; W316-C320 PolarHBondContact O-SG 3.07Å; W316-C320 VanDerWaalsContact O-SG 3.33Å; W316-F332 AromaticContact CE2-CE2 3.94Å; W316-F332 HydrophobicContact CH2-CE2 4.02Å; W316-F332 AromaticContact CH2-CZ 3.65Å; W316-F332 HydrophobicContact CH2-CZ 3.65Å; W316-F332 HydrophobicContact CZ2-CD2 4.31Å; W316-F332 AromaticContact CZ2-CE2 3.24Å; W316-F332 HydrophobicContact CZ2-CE2 3.24Å; W316-F332 AromaticContact CZ2-CZ 3.37Å; W316-F332 HydrophobicContact CZ2-CZ 3.37Å; W316-I346 HydrophobicContact CH2-CG2 4.22Å; W316-I346 HydrophobicContact CZ2-CB 4.49Å; W316-I346 HydrophobicContact CZ2-CG2 3.69Å; W316-I371 HydrophobicContact CD2-CG2 4.31Å; W316-I371 HydrophobicContact CE3-CB 4.45Å; W316-I371 HydrophobicContact CE3-CG2 3.97Å; W316-I371 HydrophobicContact CH2-CG2 3.51Å; W316-I371 HydrophobicContact CZ2-CG2 3.86Å; W316-I371 HydrophobicContact CZ3-CB 4.36Å; W316-I371 HydrophobicContact CZ3-CG2 3.56Å; W316-I371 WeakPolarHBondContact CZ3-O 3.5Å; W316-Q372 WeakPolarHBondContact CZ3-O 3.29Å
317	S	96.3	Very high	92.8	Very high	4 Å²	4	22.5 Å²	22.5	3%	0.028	13%	0.133	C	C	.	.	H	α-helix	trans	-62.7	-40	-179.3	-52.3	0	0	0	0	111.1	Y298 S313 D314 I315 C320 L321	Y298-S317 PolarHBondContact O-OG 2.97Å; Y298-S317 VanDerWaalsContact O-OG 3.05Å; S313-S317 PolarHBondContact O-N 2.87Å; S313-S317 PolarHBondContact O-OG 3.27Å; D314-S317 WeakPolarHBondContact O-CB 3.28Å; D314-S317 PolarHBondContact O-N 3.41Å; I315-S317 VanDerWaalsContact C-N 3.33Å; I315-S317 PolarHBondContact O-N 3.03Å; S317-C320 PolarHBondContact O-N 3.32Å; S317-L321 WeakPolarHBondContact O-CB 3.39Å; S317-L321 PolarHBondContact O-N 3.35Å
318	L	98.3	Very high	94.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64.7	-39.9	174.9	-175.1	66.1	0	0	0	112.2	F238 I241 L245 D314 I315 W316 L321 L322 I381 I384	F238-L318 HydrophobicContact CD2-CD1 4.4Å; F238-L318 HydrophobicContact CE2-CD1 3.52Å; F238-L318 HydrophobicContact CE2-CD2 4.37Å; F238-L318 HydrophobicContact CE2-CG 3.74Å; F238-L318 HydrophobicContact CZ-CD1 3.97Å; F238-L318 HydrophobicContact CZ-CD2 3.95Å; F238-L318 HydrophobicContact CZ-CG 3.73Å; I241-L318 HydrophobicContact CG2-CD1 3.54Å; L245-L318 HydrophobicContact CD2-CD2 3.98Å; D314-L318 WeakPolarHBondContact O-CB 3.41Å; D314-L318 PolarHBondContact O-N 3.47Å; I315-L318 PolarHBondContact O-N 3.06Å; W316-L318 VanDerWaalsContact C-N 3.3Å; W316-L318 PolarHBondContact O-N 3.26Å; L318-L321 WeakPolarHBondContact O-CB 3.5Å; L318-L321 PolarHBondContact O-N 2.99Å; L318-L322 PolarHBondContact O-N 2.93Å; L318-I381 HydrophobicContact CD2-CD1 3.6Å; L318-I384 HydrophobicContact CD2-CD1 4.25Å; L318-I384 HydrophobicContact CD2-CG2 4.01Å
319	G	98.6	Very high	95.3	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62.7	-44.1	173.9	0	0	0	0	0	112.5	I315 W316 L321 L322 Y323	I315-G319 PolarHBondContact O-N 3.22Å; W316-G319 PolarHBondContact O-N 3.17Å; G319-L321 VanDerWaalsContact C-N 3.31Å; G319-L321 PolarHBondContact O-N 3.33Å; G319-L322 PolarHBondContact O-N 3.3Å; G319-Y323 PolarHBondContact O-N 3.13Å
320	C	98.2	Very high	96.4	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61	-40.9	174	-66.6	0	0	0	0	111.8	Y298 W316 S317 Y323 E324 P331	Y298-C320 HydrophobicContact CD1-CB 3.68Å; Y298-C320 HydrophobicContact CE1-CB 4.32Å; W316-C320 PolarHBondContact O-N 3.18Å; W316-C320 PolarHBondContact O-SG 3.07Å; W316-C320 VanDerWaalsContact O-SG 3.33Å; S317-C320 PolarHBondContact O-N 3.32Å; C320-Y323 PolarHBondContact O-N 3.37Å; C320-E324 WeakPolarHBondContact O-CB 3.43Å; C320-E324 PolarHBondContact O-N 3.16Å; C320-P331 HydrophobicContact CB-CG 4.07Å
321	L	98.4	Very high	97	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.8	-45.6	175.4	-177.8	149.8	0	0	0	111.6	L215 F238 I241 I258 V263 S317 L318 G319 Y323 E324 M325	L215-L321 HydrophobicContact CD2-CD1 4.17Å; L215-L321 HydrophobicContact CD2-CD2 3.89Å; L215-L321 HydrophobicContact CD2-CG 4.08Å; F238-L321 HydrophobicContact CD2-CD2 4.39Å; I241-L321 HydrophobicContact CD1-CD2 3.78Å; I258-L321 HydrophobicContact CG2-CB 4.5Å; I258-L321 HydrophobicContact CG2-CD1 3.83Å; V263-L321 HydrophobicContact CG2-CD1 3.65Å; S317-L321 WeakPolarHBondContact O-CB 3.39Å; S317-L321 PolarHBondContact O-N 3.35Å; L318-L321 WeakPolarHBondContact O-CB 3.5Å; L318-L321 PolarHBondContact O-N 2.99Å; G319-L321 VanDerWaalsContact C-N 3.31Å; G319-L321 PolarHBondContact O-N 3.33Å; L321-Y323 PolarHBondContact O-N 3.46Å; L321-E324 PolarHBondContact O-N 2.76Å; L321-M325 HydrophobicContact CD2-CG 4.25Å; L321-M325 HydrophobicContact CD2-SD 3.67Å; L321-M325 WeakPolarHBondContact O-CG 3.43Å; L321-M325 PolarHBondContact O-N 2.61Å
322	L	98.8	Very high	97.1	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-61.5	-44.2	177.3	-179	57.4	0	0	0	111.6	I234 F238 L318 G319 E324 M325 A326 L363 L366 V367	I234-L322 HydrophobicContact CG2-CD1 3.54Å; F238-L322 HydrophobicContact CB-CD1 4.47Å; F238-L322 HydrophobicContact CD1-CD1 4.33Å; F238-L322 HydrophobicContact CD2-CB 4.14Å; F238-L322 HydrophobicContact CD2-CD1 3.77Å; F238-L322 HydrophobicContact CD2-CG 4.39Å; F238-L322 HydrophobicContact CE1-CD2 4.09Å; F238-L322 HydrophobicContact CE2-CB 3.63Å; F238-L322 HydrophobicContact CE2-CD1 4.04Å; F238-L322 HydrophobicContact CE2-CD2 4.19Å; F238-L322 HydrophobicContact CE2-CG 4.15Å; F238-L322 HydrophobicContact CG-CD1 3.92Å; F238-L322 HydrophobicContact CZ-CB 4.1Å; F238-L322 HydrophobicContact CZ-CD1 4.42Å; F238-L322 HydrophobicContact CZ-CD2 3.88Å; F238-L322 HydrophobicContact CZ-CG 4.35Å; L318-L322 PolarHBondContact O-N 2.93Å; G319-L322 PolarHBondContact O-N 3.3Å; L322-E324 VanDerWaalsContact C-N 3.32Å; L322-E324 PolarHBondContact O-N 3.19Å; L322-M325 PolarHBondContact O-N 3.03Å; L322-A326 PolarHBondContact O-N 3.48Å; L322-L363 HydrophobicContact CD1-CG 4.45Å; L322-L366 HydrophobicContact CD2-CB 4.21Å; L322-L366 HydrophobicContact CD2-CD2 3.92Å; L322-L366 HydrophobicContact CD2-CG 4.03Å; L322-V367 HydrophobicContact CB-CG2 4.09Å; L322-V367 HydrophobicContact CD2-CG2 3.67Å; L322-V367 HydrophobicContact CG-CG2 3.63Å
323	Y	98.7	Very high	96.8	Very high	8 Å²	8	13.5 Å²	13.5	3%	0.031	7%	0.066	C	C	.	.	H	α-helix	trans	-57	-47.9	174.3	-179.8	-82.6	0	0	0	111	G319 C320 L321 M325 A326 A327 Q329 P331 Y351 A352 L354 V367	G319-Y323 PolarHBondContact O-N 3.13Å; C320-Y323 PolarHBondContact O-N 3.37Å; L321-Y323 PolarHBondContact O-N 3.46Å; Y323-M325 VanDerWaalsContact C-N 3.34Å; Y323-M325 PolarHBondContact O-N 2.97Å; Y323-A326 CarbonylContact O-C 3.58Å; Y323-A326 WeakPolarHBondContact O-CA 3.44Å; Y323-A326 WeakPolarHBondContact O-CB 3.41Å; Y323-A326 PolarHBondContact O-N 3.42Å; Y323-A327 HydrophobicContact CD1-CB 3.78Å; Y323-A327 HydrophobicContact CE1-CB 3.29Å; Y323-A327 WeakPolarHBondContact O-CB 3.32Å; Y323-A327 PolarHBondContact O-N 3.31Å; Y323-Q329 WeakPolarHBondContact CD1-O 3.44Å; Y323-Q329 WeakPolarHBondContact CE1-O 3.06Å; Y323-P331 HydrophobicContact CD1-CB 3.72Å; Y323-P331 VanDerWaalsContact CD1-CD 3.49Å; Y323-P331 HydrophobicContact CD1-CG 4.12Å; Y323-P331 HydrophobicContact CD2-CB 4.19Å; Y323-P331 HydrophobicContact CE1-CB 3.92Å; Y323-P331 HydrophobicContact CE2-CB 4.37Å; Y323-P331 HydrophobicContact CG-CB 3.85Å; Y323-P331 HydrophobicContact CG-CG 4.24Å; Y323-Y351 HydrophobicContact CD2-CD2 4.03Å; Y323-Y351 HydrophobicContact CD2-CE2 4.21Å; Y323-Y351 AromaticContact CE2-CD2 3.66Å; Y323-Y351 HydrophobicContact CE2-CD2 3.66Å; Y323-Y351 HydrophobicContact CE2-CE2 4.15Å; Y323-A352 WeakPolarHBondContact CE2-O 3.43Å; Y323-A352 PolarHBondContact OH-O 2.96Å; Y323-L354 HydrophobicContact CD2-CD1 4.32Å; Y323-L354 HydrophobicContact CD2-CD2 3.83Å; Y323-L354 HydrophobicContact CD2-CG 3.9Å; Y323-L354 HydrophobicContact CE2-CD2 3.66Å; Y323-L354 HydrophobicContact CE2-CG 3.87Å; Y323-L354 HydrophobicContact CG-CD2 4.4Å; Y323-V367 HydrophobicContact CD2-CG1 3.96Å
324	E	98.1	Very high	96.3	Very high	22 Å²	22	14.4 Å²	14.4	10%	0.103	8%	0.076	C	C	.	.	H	α-helix	trans	-69.1	-31.7	-175.7	-175.5	169.6	-167.5	0	0	113.1	I219 Y298 C320 L321 L322 A326 L328 Q329	I219-E324 HydrophobicContact CD1-CG 3.97Å; I219-E324 HydrophobicContact CG2-CG 4.5Å; Y298-E324 VanDerWaalsContact CE1-OE2 3.23Å; Y298-E324 WeakPolarHBondContact CE1-OE2 3.44Å; Y298-E324 PolarHBondContact OH-OE1 2.99Å; Y298-E324 PolarHBondContact OH-OE2 3.06Å; C320-E324 WeakPolarHBondContact O-CB 3.43Å; C320-E324 PolarHBondContact O-N 3.16Å; L321-E324 PolarHBondContact O-N 2.76Å; L322-E324 VanDerWaalsContact C-N 3.32Å; L322-E324 PolarHBondContact O-N 3.19Å; E324-A326 PolarHBondContact O-N 3.14Å; E324-L328 WeakPolarHBondContact O-CA 3.25Å; E324-L328 PolarHBondContact O-N 3.25Å; E324-Q329 WeakPolarHBondContact CA-O 3.35Å
325	M	98.4	Very high	95.5	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59	-35.4	169.2	-69.7	177.9	75.7	0	0	112	L215 I229 I234 Y237 L321 L322 Y323	L215-M325 HydrophobicContact CD1-CE 4Å; L215-M325 HydrophobicContact CD1-CG 4.22Å; L215-M325 HydrophobicContact CD1-SD 4.44Å; L215-M325 HydrophobicContact CD2-CE 4.41Å; L215-M325 HydrophobicContact CD2-CG 3.83Å; L215-M325 HydrophobicContact CD2-SD 3.84Å; L215-M325 HydrophobicContact CG-CG 4.4Å; I229-M325 WeakPolarHBondContact CD1-O 3.36Å; I234-M325 HydrophobicContact CB-CE 4.31Å; I234-M325 HydrophobicContact CD1-CB 4.36Å; I234-M325 HydrophobicContact CG1-CB 4.28Å; I234-M325 HydrophobicContact CG1-CE 4.48Å; I234-M325 HydrophobicContact CG2-CB 4.19Å; I234-M325 HydrophobicContact CG2-CE 4.01Å; I234-M325 HydrophobicContact CG2-SD 4.26Å; Y237-M325 HydrophobicContact CD2-CE 4.27Å; L321-M325 HydrophobicContact CD2-CG 4.25Å; L321-M325 HydrophobicContact CD2-SD 3.67Å; L321-M325 WeakPolarHBondContact O-CG 3.43Å; L321-M325 PolarHBondContact O-N 2.61Å; L322-M325 PolarHBondContact O-N 3.03Å; Y323-M325 VanDerWaalsContact C-N 3.34Å; Y323-M325 PolarHBondContact O-N 2.97Å
326	A	98.4	Very high	94.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-84.8	-42.3	-179.8	0	0	0	0	0	113	I234 L322 Y323 E324 L354 Y359 L363	I234-A326 HydrophobicContact CD1-CB 3.95Å; L322-A326 PolarHBondContact O-N 3.48Å; Y323-A326 CarbonylContact O-C 3.58Å; Y323-A326 WeakPolarHBondContact O-CA 3.44Å; Y323-A326 WeakPolarHBondContact O-CB 3.41Å; Y323-A326 PolarHBondContact O-N 3.42Å; E324-A326 PolarHBondContact O-N 3.14Å; A326-L354 HydrophobicContact CB-CD1 3.79Å; A326-L354 HydrophobicContact CB-CD2 3.72Å; A326-L354 HydrophobicContact CB-CG 4.41Å; A326-Y359 HydrophobicContact CB-CD1 4.47Å; A326-Y359 HydrophobicContact CB-CD2 4.1Å; A326-Y359 HydrophobicContact CB-CE1 4.11Å; A326-Y359 HydrophobicContact CB-CE2 3.68Å; A326-Y359 HydrophobicContact CB-CG 4.48Å; A326-Y359 WeakPolarHBondContact O-CE2 3.15Å; A326-Y359 PolarHBondContact O-OH 3.26Å; A326-L363 HydrophobicContact CB-CD2 4.26Å
327	A	97.6	Very high	93.8	Very high	26 Å²	26	31.2 Å²	31.2	22%	0.215	16%	0.156	C	C	.	.	H	α-helix	trans	-93.7	-11.1	-174.4	0	0	0	0	0	114.3	Y323 Q329 L354	Y323-A327 HydrophobicContact CD1-CB 3.78Å; Y323-A327 HydrophobicContact CE1-CB 3.29Å; Y323-A327 WeakPolarHBondContact O-CB 3.32Å; Y323-A327 PolarHBondContact O-N 3.31Å; A327-Q329 HydrophobicContact CB-CG 4.3Å; A327-Q329 PolarHBondContact O-N 2.8Å; A327-L354 HydrophobicContact CB-CD2 3.84Å
328	L	96.8	Very high	93.3	Very high	17 Å²	17	35.3 Å²	35.3	9%	0.089	18%	0.177	C	C	.	.	S	Bend	trans	60.5	16.3	-173.3	-48.8	177.4	0	0	0	115	I219 F222 R223 R227 L228 I229 E324	I219-L328 HydrophobicContact CG2-CB 4.25Å; I219-L328 HydrophobicContact CG2-CD2 4.27Å; F222-L328 HydrophobicContact CB-CD1 4.19Å; F222-L328 HydrophobicContact CB-CD2 3.89Å; R223-L328 HydrophobicContact CB-CB 4.33Å; R223-L328 HydrophobicContact CB-CD1 4.26Å; R227-L328 WeakPolarHBondContact O-CD1 3.45Å; L228-L328 HydrophobicContact CD2-CD1 3.93Å; L228-L328 HydrophobicContact CD2-CG 4.11Å; I229-L328 HydrophobicContact CD1-CD2 4.11Å; I229-L328 HydrophobicContact CG1-CD2 3.98Å; E324-L328 WeakPolarHBondContact O-CA 3.25Å; E324-L328 PolarHBondContact O-N 3.25Å
329	Q	94.7	Very high	92.6	Very high	91 Å²	91	37.3 Å²	37.3	43%	0.425	19%	0.188	S	C	.	.	S	Bend	trans	-152.7	152.9	174.3	63.8	-177.6	-3.2	0	0	109.9	Y323 E324 A327 Y333	Y323-Q329 WeakPolarHBondContact CD1-O 3.44Å; Y323-Q329 WeakPolarHBondContact CE1-O 3.06Å; E324-Q329 WeakPolarHBondContact CA-O 3.35Å; A327-Q329 HydrophobicContact CB-CG 4.3Å; A327-Q329 PolarHBondContact O-N 2.8Å; Q329-Y333 HydrophobicContact CB-CD1 4.5Å
330	S	95.1	Very high	92	Very high	5 Å²	5	44 Å²	44	4%	0.035	22%	0.217	C	C	.	.			trans	-57.5	145.1	173.9	165.7	0	0	0	0	111.6	Y297 F332 Y333	Y297-S330 WeakPolarHBondContact CB-OG 2.99Å; S330-F332 PolarHBondContact O-N 2.91Å; S330-F332 PolarHBondContact OG-N 3.43Å; S330-Y333 VanDerWaalsContact O-CB 3.25Å; S330-Y333 WeakPolarHBondContact O-CB 3.46Å; S330-Y333 PolarHBondContact O-N 3.48Å
331	P	96	Very high	91.6	Very high	5 Å²	5	51.6 Å²	51.6	3%	0.032	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-34.2	176.9	21.8	-32.9	0	0	0	112.9	C320 Y323 Y351 I371	C320-P331 HydrophobicContact CB-CG 4.07Å; Y323-P331 HydrophobicContact CD1-CB 3.72Å; Y323-P331 VanDerWaalsContact CD1-CD 3.49Å; Y323-P331 HydrophobicContact CD1-CG 4.12Å; Y323-P331 HydrophobicContact CD2-CB 4.19Å; Y323-P331 HydrophobicContact CE1-CB 3.92Å; Y323-P331 HydrophobicContact CE2-CB 4.37Å; Y323-P331 HydrophobicContact CG-CB 3.85Å; Y323-P331 HydrophobicContact CG-CG 4.24Å; P331-Y351 HydrophobicContact CB-CD1 4.42Å; P331-Y351 HydrophobicContact CB-CD2 4.12Å; P331-Y351 HydrophobicContact CB-CG 3.81Å; P331-Y351 WeakPolarHBondContact O-CB 3.35Å; P331-I371 HydrophobicContact CB-CD1 4.41Å; P331-I371 HydrophobicContact CG-CD1 4.12Å
332	F	95	Very high	91.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	13.4	-179	-50.3	-67.8	0	0	0	112.7	W316 S330 M337 L342 K345 I346 Y351 I371	W316-F332 AromaticContact CE2-CE2 3.94Å; W316-F332 HydrophobicContact CH2-CE2 4.02Å; W316-F332 AromaticContact CH2-CZ 3.65Å; W316-F332 HydrophobicContact CH2-CZ 3.65Å; W316-F332 HydrophobicContact CZ2-CD2 4.31Å; W316-F332 AromaticContact CZ2-CE2 3.24Å; W316-F332 HydrophobicContact CZ2-CE2 3.24Å; W316-F332 AromaticContact CZ2-CZ 3.37Å; W316-F332 HydrophobicContact CZ2-CZ 3.37Å; S330-F332 PolarHBondContact O-N 2.91Å; S330-F332 PolarHBondContact OG-N 3.43Å; F332-M337 WeakPolarHBondContact O-CE 3.43Å; F332-L342 HydrophobicContact CB-CD1 3.53Å; F332-L342 WeakPolarHBondContact O-CD1 3.4Å; F332-K345 HydrophobicContact CD1-CB 4.03Å; F332-I346 HydrophobicContact CB-CG1 4.07Å; F332-I346 HydrophobicContact CD1-CG1 4.14Å; F332-I346 HydrophobicContact CD2-CD1 4.48Å; F332-I346 HydrophobicContact CD2-CG1 3.67Å; F332-I346 HydrophobicContact CE2-CG1 4.15Å; F332-I346 HydrophobicContact CG-CG1 3.66Å; F332-Y351 AromaticContact CE1-CD1 3.95Å; F332-Y351 HydrophobicContact CE1-CD1 3.95Å; F332-Y351 HydrophobicContact CZ-CD1 4.11Å; F332-I371 HydrophobicContact CE2-CG2 4.03Å; F332-I371 HydrophobicContact CZ-CG2 3.6Å
333	Y	90.3	Very high	90.8	Very high	97 Å²	97	52.1 Å²	52.1	38%	0.38	25%	0.249	S	C	.	.			trans	-61.7	153.1	169.8	-177.4	-102.2	0	0	0	111	Y297 Q329 S330 M337 K345	Y297-Y333 HydrophobicContact CE1-CD2 4.11Å; Y297-Y333 AromaticContact CZ-CD2 3.8Å; Y297-Y333 WeakPolarHBondContact OH-CD2 3.41Å; Q329-Y333 HydrophobicContact CB-CD1 4.5Å; S330-Y333 VanDerWaalsContact O-CB 3.25Å; S330-Y333 WeakPolarHBondContact O-CB 3.46Å; S330-Y333 PolarHBondContact O-N 3.48Å; Y333-M337 VanDerWaalsContact C-CE 3.47Å; Y333-K345 PolarHBondContact O-NZ 2.83Å
334	G	83.6	Confident	90.3	Very high	21 Å²	21	55.5 Å²	55.5	22%	0.216	27%	0.265	C	S	.	.			trans	-169.7	134.9	176.5	0	0	0	0	0	109.2	K336 M337	G334-K336 PolarHBondContact O-N 3.15Å; G334-M337 VanDerWaalsContact CA-CE 3.42Å; G334-M337 WeakPolarHBondContact O-CB 3.29Å; G334-M337 PolarHBondContact O-N 3.14Å
335	D	79.4	Confident	90.1	Very high	124 Å²	124	56.8 Å²	56.8	66%	0.663	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	135.7	-177.2	-169.1	20.1	0	0	0	110.8	M337	D335-M337 PolarHBondContact O-N 3.22Å
336	K	77.4	Confident	89.8	Confident	196 Å²	196	56.8 Å²	56.8	85%	0.852	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	29	-178.1	-56.7	177.8	-174.5	178.2	0	114.6	G334	G334-K336 PolarHBondContact O-N 3.15Å
337	M	82.2	Confident	89.5	Confident	40 Å²	40	59.9 Å²	59.9	20%	0.197	29%	0.285	C	S	.	.			trans	-78.6	130.6	-177.7	-173.7	150.3	51.3	0	0	111.7	F332 Y333 G334 D335 R341 L342 K345	F332-M337 WeakPolarHBondContact O-CE 3.43Å; Y333-M337 VanDerWaalsContact C-CE 3.47Å; G334-M337 VanDerWaalsContact CA-CE 3.42Å; G334-M337 WeakPolarHBondContact O-CB 3.29Å; G334-M337 PolarHBondContact O-N 3.14Å; D335-M337 PolarHBondContact O-N 3.22Å; M337-R341 HydrophobicContact CG-CB 3.66Å; M337-R341 HydrophobicContact SD-CB 3.91Å; M337-L342 HydrophobicContact CE-CD1 4.46Å; M337-L342 HydrophobicContact CG-CB 4.43Å; M337-K345 HydrophobicContact CE-CD 3.9Å; M337-K345 HydrophobicContact SD-CD 3.68Å; M337-K345 HydrophobicContact SD-CG 4.38Å
338	N	85.6	Confident	89.2	Confident	89 Å²	89	64.4 Å²	64.4	48%	0.476	30%	0.301	S	S	.	.			trans	-82.5	165.3	171.2	67.4	30.6	0	0	0	111.5	F340 R341 L342	N338-F340 VanDerWaalsContact C-N 3.28Å; N338-F340 PolarHBondContact O-N 3.37Å; N338-F340 PolarHBondContact OD1-N 3.04Å; N338-R341 PolarHBondContact O-N 2.94Å; N338-R341 PolarHBondContact OD1-N 3.41Å; N338-L342 PolarHBondContact O-N 3.37Å; N338-L342 VanDerWaalsContact O-N 3.1Å
339	L	83.9	Confident	88.9	Confident	43 Å²	43	64.6 Å²	64.6	23%	0.225	31%	0.307	C	S	.	.	H	α-helix	trans	-57.8	-39.7	-177.9	-178.6	59.9	0	0	0	112.6	M287 P296 R341 L342 C343	M287-L339 HydrophobicContact CE-CD1 4.39Å; M287-L339 HydrophobicContact CE-CD2 4.17Å; M287-L339 HydrophobicContact CE-CG 4.16Å; P296-L339 HydrophobicContact CG-CD1 3.66Å; L339-R341 PolarHBondContact O-N 3.03Å; L339-L342 HydrophobicContact CD1-CD2 4.41Å; L339-L342 WeakPolarHBondContact O-CB 3.45Å; L339-L342 PolarHBondContact O-N 3.16Å; L339-C343 PolarHBondContact O-N 2.74Å; L339-C343 PolarHBondContact O-SG 2.98Å
340	F	86.2	Confident	88.7	Confident	140 Å²	140	65 Å²	65	61%	0.614	31%	0.312	S	S	*	.	H	α-helix	trans	-59.8	-47.9	179.6	178.1	-98.7	0	0	0	112.1	N338 L342 C343 Q344	N338-F340 VanDerWaalsContact C-N 3.28Å; N338-F340 PolarHBondContact O-N 3.37Å; N338-F340 PolarHBondContact OD1-N 3.04Å; F340-L342 VanDerWaalsContact C-N 3.35Å; F340-L342 PolarHBondContact O-N 3.49Å; F340-C343 PolarHBondContact O-N 3.17Å; F340-Q344 HydrophobicContact CE1-CG 4.15Å; F340-Q344 VanDerWaalsContact CE1-NE2 3.29Å; F340-Q344 HydrophobicContact CZ-CG 4.3Å; F340-Q344 WeakPolarHBondContact O-CG 3.13Å; F340-Q344 PolarHBondContact O-N 2.77Å
341	R	89	Confident	88.7	Confident	160 Å²	160	66.8 Å²	66.8	60%	0.604	32%	0.319	S	S	*	.	H	α-helix	trans	-66.3	-36.4	177.4	-76.8	-164.5	-177.3	-156.4	2.6	112.7	M337 N338 L339 Q344 K345	M337-R341 HydrophobicContact CG-CB 3.66Å; M337-R341 HydrophobicContact SD-CB 3.91Å; N338-R341 PolarHBondContact O-N 2.94Å; N338-R341 PolarHBondContact OD1-N 3.41Å; L339-R341 PolarHBondContact O-N 3.03Å; R341-Q344 PolarHBondContact O-N 2.87Å; R341-K345 PolarHBondContact O-N 3.04Å
342	L	90.2	Very high	88.7	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-59.7	-48.4	173.1	171.6	62.7	0	0	0	111	T295 P296 Y297 F332 M337 N338 L339 F340 Q344 K345 I346	T295-L342 HydrophobicContact CG2-CD2 3.26Å; P296-L342 HydrophobicContact CG-CD2 4.12Å; Y297-L342 HydrophobicContact CD1-CD1 4.04Å; Y297-L342 HydrophobicContact CD1-CD2 4.3Å; Y297-L342 HydrophobicContact CE1-CD1 4.24Å; Y297-L342 HydrophobicContact CE1-CD2 4.39Å; F332-L342 HydrophobicContact CB-CD1 3.53Å; F332-L342 WeakPolarHBondContact O-CD1 3.4Å; M337-L342 HydrophobicContact CE-CD1 4.46Å; M337-L342 HydrophobicContact CG-CB 4.43Å; N338-L342 PolarHBondContact O-N 3.37Å; N338-L342 VanDerWaalsContact O-N 3.1Å; L339-L342 HydrophobicContact CD1-CD2 4.41Å; L339-L342 WeakPolarHBondContact O-CB 3.45Å; L339-L342 PolarHBondContact O-N 3.16Å; F340-L342 VanDerWaalsContact C-N 3.35Å; F340-L342 PolarHBondContact O-N 3.49Å; L342-Q344 VanDerWaalsContact C-N 3.28Å; L342-Q344 PolarHBondContact O-N 2.76Å; L342-K345 PolarHBondContact O-N 3.1Å; L342-K345 VanDerWaalsContact O-N 3.13Å; L342-I346 HydrophobicContact CD1-CD1 3.77Å; L342-I346 HydrophobicContact CD1-CG1 4.12Å; L342-I346 HydrophobicContact CD2-CD1 4.48Å; L342-I346 HydrophobicContact CG-CD1 3.81Å; L342-I346 WeakPolarHBondContact O-CG1 3.4Å; L342-I346 PolarHBondContact O-N 2.92Å
343	C	89.1	Confident	88.7	Confident	10 Å²	10	75 Å²	75	7%	0.068	38%	0.377	C	S	.	.	H	α-helix	trans	-59.8	-41.8	177.9	-66.2	0	0	0	0	111.4	M287 I304 L339 F340 K345 I346 E347	M287-C343 HydrophobicContact CE-CB 4.42Å; M287-C343 WeakPolarHBondContact CE-SG 3.46Å; I304-C343 HydrophobicContact CD1-CB 4.39Å; I304-C343 HydrophobicContact CG2-CB 4.06Å; L339-C343 PolarHBondContact O-N 2.74Å; L339-C343 PolarHBondContact O-SG 2.98Å; F340-C343 PolarHBondContact O-N 3.17Å; C343-K345 PolarHBondContact O-N 3.16Å; C343-I346 PolarHBondContact O-N 3.4Å; C343-E347 WeakPolarHBondContact O-CB 3.34Å; C343-E347 WeakPolarHBondContact O-CG 3.48Å; C343-E347 PolarHBondContact O-N 2.8Å
344	Q	90.1	Very high	89.1	Confident	79 Å²	79	71.1 Å²	71.1	37%	0.369	36%	0.363	S	S	.	.	H	α-helix	trans	-58.7	-47.5	172.8	-71.3	-175.6	-41	0	0	112.2	F340 R341 L342 I346 E347 H348	F340-Q344 HydrophobicContact CE1-CG 4.15Å; F340-Q344 VanDerWaalsContact CE1-NE2 3.29Å; F340-Q344 HydrophobicContact CZ-CG 4.3Å; F340-Q344 WeakPolarHBondContact O-CG 3.13Å; F340-Q344 PolarHBondContact O-N 2.77Å; R341-Q344 PolarHBondContact O-N 2.87Å; L342-Q344 VanDerWaalsContact C-N 3.28Å; L342-Q344 PolarHBondContact O-N 2.76Å; Q344-I346 VanDerWaalsContact C-N 3.31Å; Q344-I346 PolarHBondContact O-N 3.21Å; Q344-E347 PolarHBondContact O-N 2.78Å; Q344-H348 WeakPolarHBondContact O-CB 3.49Å; Q344-H348 PolarHBondContact O-N 2.54Å; Q344-H348 PolarHBondContact O-ND1 2.86Å
345	K	92.6	Very high	89.6	Confident	48 Å²	48	73.1 Å²	73.1	21%	0.209	37%	0.372	C	S	.	.	H	α-helix	trans	-59.1	-43	177.2	-74	-170.8	69.1	174.9	0	112	F332 Y333 M337 R341 L342 C343 H348 G349 D350	F332-K345 HydrophobicContact CD1-CB 4.03Å; Y333-K345 PolarHBondContact O-NZ 2.83Å; M337-K345 HydrophobicContact CE-CD 3.9Å; M337-K345 HydrophobicContact SD-CD 3.68Å; M337-K345 HydrophobicContact SD-CG 4.38Å; R341-K345 PolarHBondContact O-N 3.04Å; L342-K345 PolarHBondContact O-N 3.1Å; L342-K345 VanDerWaalsContact O-N 3.13Å; C343-K345 PolarHBondContact O-N 3.16Å; K345-H348 CarbonylContact O-C 3.58Å; K345-H348 PolarHBondContact O-N 3.45Å; K345-G349 PolarHBondContact O-N 2.9Å; K345-D350 WeakPolarHBondContact CE-O 3.17Å; K345-D350 PolarHBondContact O-N 3.1Å
346	I	93.3	Very high	90.4	Very high	0 Å²	0	74 Å²	74	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-62.6	-48.3	178.1	-70.6	168.8	0	0	0	110.7	P301 I304 W316 F332 L342 C343 Q344 H348 G349	P301-I346 HydrophobicContact CB-CG2 4.31Å; P301-I346 HydrophobicContact CG-CG2 3.78Å; I304-I346 HydrophobicContact CD1-CB 3.78Å; I304-I346 HydrophobicContact CD1-CD1 3.62Å; I304-I346 HydrophobicContact CD1-CG1 4.3Å; I304-I346 HydrophobicContact CD1-CG2 3.42Å; I304-I346 VanDerWaalsContact CD1-CG2 3.42Å; W316-I346 HydrophobicContact CH2-CG2 4.22Å; W316-I346 HydrophobicContact CZ2-CB 4.49Å; W316-I346 HydrophobicContact CZ2-CG2 3.69Å; F332-I346 HydrophobicContact CB-CG1 4.07Å; F332-I346 HydrophobicContact CD1-CG1 4.14Å; F332-I346 HydrophobicContact CD2-CD1 4.48Å; F332-I346 HydrophobicContact CD2-CG1 3.67Å; F332-I346 HydrophobicContact CE2-CG1 4.15Å; F332-I346 HydrophobicContact CG-CG1 3.66Å; L342-I346 HydrophobicContact CD1-CD1 3.77Å; L342-I346 HydrophobicContact CD1-CG1 4.12Å; L342-I346 HydrophobicContact CD2-CD1 4.48Å; L342-I346 HydrophobicContact CG-CD1 3.81Å; L342-I346 WeakPolarHBondContact O-CG1 3.4Å; L342-I346 PolarHBondContact O-N 2.92Å; C343-I346 PolarHBondContact O-N 3.4Å; Q344-I346 VanDerWaalsContact C-N 3.31Å; Q344-I346 PolarHBondContact O-N 3.21Å; I346-H348 VanDerWaalsContact C-N 3.29Å; I346-H348 PolarHBondContact O-N 2.78Å; I346-G349 PolarHBondContact O-N 3.39Å; I346-G349 VanDerWaalsContact O-N 3.11Å
347	E	90.7	Very high	91.3	Very high	65 Å²	65	71.8 Å²	71.8	30%	0.304	36%	0.363	S	S	.	.	H	α-helix	trans	-64.6	-33.7	179	-70.8	-166.5	122.7	0	0	112.9	R305 C343 Q344 G349 K373	R305-E347 IonicContact CZ-OE1 2.66Å; R305-E347 IonicContact NE-OE1 3.12Å; R305-E347 PolarHBondContact NE-OE1 3.15Å; R305-E347 IonicContact NH2-OE1 2.86Å; C343-E347 WeakPolarHBondContact O-CB 3.34Å; C343-E347 WeakPolarHBondContact O-CG 3.48Å; C343-E347 PolarHBondContact O-N 2.8Å; Q344-E347 PolarHBondContact O-N 2.78Å; E347-G349 VanDerWaalsContact C-N 3.34Å; E347-K373 WeakPolarHBondContact O-CD 3.46Å
348	H	91.2	Very high	92	Very high	121 Å²	121	74.1 Å²	74.1	56%	0.56	38%	0.375	S	S	*	.	H	α-helix	trans	-83.2	-10.6	176	-68.5	86	0	0	0	113.3	Q344 K345 I346 D350 K373	Q344-H348 WeakPolarHBondContact O-CB 3.49Å; Q344-H348 PolarHBondContact O-N 2.54Å; Q344-H348 PolarHBondContact O-ND1 2.86Å; K345-H348 CarbonylContact O-C 3.58Å; K345-H348 PolarHBondContact O-N 3.45Å; I346-H348 VanDerWaalsContact C-N 3.29Å; I346-H348 PolarHBondContact O-N 2.78Å; H348-D350 HydrophobicContact CB-CB 4.3Å; H348-D350 PolarHBondContact O-N 2.85Å; H348-K373 VanDerWaalsContact C-NZ 3.3Å; H348-K373 WeakPolarHBondContact O-CE 3.45Å; H348-K373 PolarHBondContact O-NZ 2.83Å
349	G	90.8	Very high	92.6	Very high	21 Å²	21	70 Å²	70	22%	0.216	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	33.5	-174.1	0	0	0	0	0	112.2	K345 I346 E347 Y351	K345-G349 PolarHBondContact O-N 2.9Å; I346-G349 PolarHBondContact O-N 3.39Å; I346-G349 VanDerWaalsContact O-N 3.11Å; E347-G349 VanDerWaalsContact C-N 3.34Å; G349-Y351 WeakPolarHBondContact O-CD1 3.17Å; G349-Y351 PolarHBondContact O-N 3.3Å
350	D	90.9	Very high	93.2	Very high	100 Å²	100	69.3 Å²	69.3	54%	0.535	35%	0.352	S	S	.	.			trans	-91.6	102.8	-173.6	-178.7	23	0	0	0	111.1	K345 H348	K345-D350 WeakPolarHBondContact CE-O 3.17Å; K345-D350 PolarHBondContact O-N 3.1Å; H348-D350 HydrophobicContact CB-CB 4.3Å; H348-D350 PolarHBondContact O-N 2.85Å
351	Y	94.8	Very high	93.8	Very high	42 Å²	42	64.8 Å²	64.8	17%	0.165	34%	0.34	C	S	.	.			trans	-144.2	151.3	175.5	63.7	-88.3	0	0	0	111.3	Y323 P331 F332 G349 V367 I371	Y323-Y351 HydrophobicContact CD2-CD2 4.03Å; Y323-Y351 HydrophobicContact CD2-CE2 4.21Å; Y323-Y351 AromaticContact CE2-CD2 3.66Å; Y323-Y351 HydrophobicContact CE2-CD2 3.66Å; Y323-Y351 HydrophobicContact CE2-CE2 4.15Å; P331-Y351 HydrophobicContact CB-CD1 4.42Å; P331-Y351 HydrophobicContact CB-CD2 4.12Å; P331-Y351 HydrophobicContact CB-CG 3.81Å; P331-Y351 WeakPolarHBondContact O-CB 3.35Å; F332-Y351 AromaticContact CE1-CD1 3.95Å; F332-Y351 HydrophobicContact CE1-CD1 3.95Å; F332-Y351 HydrophobicContact CZ-CD1 4.11Å; G349-Y351 WeakPolarHBondContact O-CD1 3.17Å; G349-Y351 PolarHBondContact O-N 3.3Å; Y351-V367 HydrophobicContact CE2-CG1 4.28Å; Y351-I371 HydrophobicContact CD1-CG2 4.3Å; Y351-I371 HydrophobicContact CE1-CB 4.15Å; Y351-I371 HydrophobicContact CE1-CD1 4.39Å; Y351-I371 HydrophobicContact CE1-CG2 3.78Å
352	A	95.5	Very high	94.2	Very high	61 Å²	61	61.6 Å²	61.6	50%	0.504	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-69.7	135	-179.1	0	0	0	0	0	110.8	Y323	Y323-A352 WeakPolarHBondContact CE2-O 3.43Å; Y323-A352 PolarHBondContact OH-O 2.96Å
353	P	96.3	Very high	94.6	Very high	117 Å²	117	61.6 Å²	61.6	76%	0.76	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-65.8	147.5	177.9	28	-34.6	0	0	0	111.4
354	L	97.6	Very high	95.1	Very high	15 Å²	15	64.9 Å²	64.9	8%	0.079	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-68.5	145.4	174.1	-66.7	175.1	0	0	0	110.9	Y323 A326 A327 K356 Y359 L363 R364 V367	Y323-L354 HydrophobicContact CD2-CD1 4.32Å; Y323-L354 HydrophobicContact CD2-CD2 3.83Å; Y323-L354 HydrophobicContact CD2-CG 3.9Å; Y323-L354 HydrophobicContact CE2-CD2 3.66Å; Y323-L354 HydrophobicContact CE2-CG 3.87Å; Y323-L354 HydrophobicContact CG-CD2 4.4Å; A326-L354 HydrophobicContact CB-CD1 3.79Å; A326-L354 HydrophobicContact CB-CD2 3.72Å; A326-L354 HydrophobicContact CB-CG 4.41Å; A327-L354 HydrophobicContact CB-CD2 3.84Å; L354-K356 PolarHBondContact O-N 2.94Å; L354-K356 VanDerWaalsContact O-N 3.15Å; L354-Y359 HydrophobicContact CB-CD2 4.37Å; L354-L363 HydrophobicContact CD1-CD2 3.4Å; L354-R364 HydrophobicContact CB-CG 4.01Å; L354-R364 WeakPolarHBondContact O-CD 3.12Å; L354-V367 HydrophobicContact CD1-CG2 4.11Å
355	P	95.4	Very high	95.5	Very high	64 Å²	64	67.1 Å²	67.1	42%	0.416	35%	0.354	S	S	.	.			trans	-62.5	115.3	-178.6	-21.2	32	0	0	0	112.4	E357 I358 Y359	P355-E357 PolarHBondContact O-N 2.86Å; P355-I358 HydrophobicContact CB-CB 4.26Å; P355-I358 HydrophobicContact CB-CD1 3.98Å; P355-I358 HydrophobicContact CB-CG1 4.04Å; P355-I358 HydrophobicContact CG-CD1 4.26Å; P355-I358 PolarHBondContact O-N 2.8Å; P355-I358 VanDerWaalsContact O-N 3.11Å; P355-Y359 PolarHBondContact O-N 3.39Å
356	K	96.6	Very high	95.8	Very high	141 Å²	141	65 Å²	65	61%	0.613	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-19.8	179.8	45.5	153.3	-161.2	-170.1	0	114.5	L354 I358	L354-K356 PolarHBondContact O-N 2.94Å; L354-K356 VanDerWaalsContact O-N 3.15Å; K356-I358 VanDerWaalsContact C-N 3.3Å
357	E	96.1	Very high	96	Very high	151 Å²	151	65.1 Å²	65.1	71%	0.706	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-13.4	-179.8	-80.5	52.4	106.1	0	0	112.1	P355	P355-E357 PolarHBondContact O-N 2.86Å
358	I	96	Very high	96.4	Very high	89 Å²	89	65.1 Å²	65.1	46%	0.456	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-40.9	-175.4	-55.4	-178.3	0	0	0	110.6	L228 P355 K356	L228-I358 HydrophobicContact CD1-CD1 3.57Å; L228-I358 HydrophobicContact CD1-CG2 4.05Å; P355-I358 HydrophobicContact CB-CB 4.26Å; P355-I358 HydrophobicContact CB-CD1 3.98Å; P355-I358 HydrophobicContact CB-CG1 4.04Å; P355-I358 HydrophobicContact CG-CD1 4.26Å; P355-I358 PolarHBondContact O-N 2.8Å; P355-I358 VanDerWaalsContact O-N 3.11Å; K356-I358 VanDerWaalsContact C-N 3.3Å
359	Y	97.9	Very high	96.7	Very high	3 Å²	3	61.5 Å²	61.5	1%	0.012	34%	0.336	C	S	.	.	S	Bend	trans	-116.6	136.2	-175.1	-63.1	-65.4	0	0	0	112.1	L228 I229 E231 I234 A326 L354 P355 L363 R364	L228-Y359 HydrophobicContact CD1-CE2 4.33Å; I229-Y359 PolarHBondContact O-OH 2.83Å; E231-Y359 HydrophobicContact CB-CD1 4.01Å; E231-Y359 HydrophobicContact CB-CE1 4.24Å; E231-Y359 HydrophobicContact CG-CD1 4.44Å; E231-Y359 WeakPolarHBondContact OE2-CA 3.07Å; I234-Y359 HydrophobicContact CD1-CD1 4.37Å; I234-Y359 HydrophobicContact CD1-CE1 3.59Å; A326-Y359 HydrophobicContact CB-CD1 4.47Å; A326-Y359 HydrophobicContact CB-CD2 4.1Å; A326-Y359 HydrophobicContact CB-CE1 4.11Å; A326-Y359 HydrophobicContact CB-CE2 3.68Å; A326-Y359 HydrophobicContact CB-CG 4.48Å; A326-Y359 WeakPolarHBondContact O-CE2 3.15Å; A326-Y359 PolarHBondContact O-OH 3.26Å; L354-Y359 HydrophobicContact CB-CD2 4.37Å; P355-Y359 PolarHBondContact O-N 3.39Å; Y359-L363 HydrophobicContact CD1-CD1 3.97Å; Y359-L363 HydrophobicContact CG-CD2 4.37Å; Y359-R364 PolarHBondContact O-NE 3.35Å; Y359-R364 VanDerWaalsContact O-NE 3.12Å
360	S	97.8	Very high	97.1	Very high	28 Å²	28	60.5 Å²	60.5	20%	0.196	33%	0.326	C	S	.	.			trans	-54.2	162.1	-179.4	70.5	0	0	0	0	113.8	E231 E362 L363 R364	E231-S360 WeakPolarHBondContact OE1-CB 3.48Å; E231-S360 PolarHBondContact OE1-OG 2.9Å; E231-S360 PolarHBondContact OE2-N 3.03Å; S360-E362 VanDerWaalsContact CB-OE2 3.28Å; S360-E362 WeakPolarHBondContact CB-OE2 3.5Å; S360-E362 PolarHBondContact O-N 3.27Å; S360-L363 WeakPolarHBondContact OG-CB 3.37Å; S360-L363 PolarHBondContact OG-N 3.48Å; S360-L363 VanDerWaalsContact OG-N 3.11Å; S360-R364 VanDerWaalsContact O-CG 3.29Å; S360-R364 WeakPolarHBondContact O-CG 3.15Å; S360-R364 PolarHBondContact O-N 3.32Å; S360-R364 PolarHBondContact O-NE 2.77Å
361	A	98.1	Very high	97.4	Very high	45 Å²	45	56 Å²	56	37%	0.372	30%	0.302	S	S	.	.	H	α-helix	trans	-62.4	-39.3	174.6	0	0	0	0	0	111.1	R364 E365	A361-R364 VanDerWaalsContact CA-NH2 3.29Å; A361-R364 PolarHBondContact O-N 3.37Å; A361-E365 VanDerWaalsContact O-CB 3.22Å; A361-E365 WeakPolarHBondContact O-CB 3.1Å; A361-E365 PolarHBondContact O-N 3.35Å
362	E	98.3	Very high	97.5	Very high	93 Å²	93	57.2 Å²	57.2	44%	0.435	31%	0.309	S	S	.	.	H	α-helix	trans	-62.6	-45.9	-177.8	-63.4	77.7	-173.8	0	0	111.4	S360 L366 M391	S360-E362 VanDerWaalsContact CB-OE2 3.28Å; S360-E362 WeakPolarHBondContact CB-OE2 3.5Å; S360-E362 PolarHBondContact O-N 3.27Å; E362-L366 VanDerWaalsContact O-CB 3.25Å; E362-L366 WeakPolarHBondContact O-CB 3.43Å; E362-L366 PolarHBondContact O-N 3.21Å; E362-M391 HydrophobicContact CB-CE 3.8Å; E362-M391 HydrophobicContact CB-CG 4.36Å; E362-M391 HydrophobicContact CB-SD 3.81Å; E362-M391 HydrophobicContact CG-CE 4.11Å; E362-M391 HydrophobicContact CG-SD 3.78Å
363	L	98.6	Very high	97.4	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.4	-46.4	176.5	-172.8	154.5	0	0	0	111	E231 I234 W235 L322 A326 L354 Y359 S360 L366 V367	E231-L363 HydrophobicContact CG-CD1 3.9Å; I234-L363 HydrophobicContact CD1-CD1 4.2Å; I234-L363 HydrophobicContact CG2-CD1 4.11Å; W235-L363 HydrophobicContact CZ2-CB 3.78Å; W235-L363 HydrophobicContact CZ2-CG 4.29Å; L322-L363 HydrophobicContact CD1-CG 4.45Å; A326-L363 HydrophobicContact CB-CD2 4.26Å; L354-L363 HydrophobicContact CD1-CD2 3.4Å; Y359-L363 HydrophobicContact CD1-CD1 3.97Å; Y359-L363 HydrophobicContact CG-CD2 4.37Å; S360-L363 WeakPolarHBondContact OG-CB 3.37Å; S360-L363 PolarHBondContact OG-N 3.48Å; S360-L363 VanDerWaalsContact OG-N 3.11Å; L363-L366 PolarHBondContact O-N 3.34Å; L363-V367 HydrophobicContact CD2-CG2 4.31Å; L363-V367 WeakPolarHBondContact O-CG2 3.5Å; L363-V367 PolarHBondContact O-N 2.99Å; L363-V367 VanDerWaalsContact O-N 3.08Å
364	R	98.6	Very high	97.3	Very high	79 Å²	79	57.8 Å²	57.8	30%	0.298	29%	0.29	S	S	.	.	H	α-helix	trans	-65.6	-40.7	-178.3	-67.6	-174.5	-70.5	98.3	-4.5	112.2	L354 Y359 S360 A361 T368	L354-R364 HydrophobicContact CB-CG 4.01Å; L354-R364 WeakPolarHBondContact O-CD 3.12Å; Y359-R364 PolarHBondContact O-NE 3.35Å; Y359-R364 VanDerWaalsContact O-NE 3.12Å; S360-R364 VanDerWaalsContact O-CG 3.29Å; S360-R364 WeakPolarHBondContact O-CG 3.15Å; S360-R364 PolarHBondContact O-N 3.32Å; S360-R364 PolarHBondContact O-NE 2.77Å; A361-R364 VanDerWaalsContact CA-NH2 3.29Å; A361-R364 PolarHBondContact O-N 3.37Å; R364-T368 PolarHBondContact O-N 3.44Å; R364-T368 VanDerWaalsContact O-N 3.1Å; R364-T368 PolarHBondContact O-OG1 3.33Å
365	E	98.3	Very high	97.2	Very high	127 Å²	127	58.1 Å²	58.1	59%	0.593	29%	0.292	S	S	*	.	H	α-helix	trans	-67.2	-45.3	176.9	-175.1	168.5	-163.3	0	0	110.6	A361 V367 T368 V369	A361-E365 VanDerWaalsContact O-CB 3.22Å; A361-E365 WeakPolarHBondContact O-CB 3.1Å; A361-E365 PolarHBondContact O-N 3.35Å; E365-V367 VanDerWaalsContact C-N 3.31Å; E365-V367 PolarHBondContact O-N 3.23Å; E365-T368 CarbonylContact O-C 3.59Å; E365-T368 WeakPolarHBondContact O-CA 3.23Å; E365-T368 WeakPolarHBondContact O-CB 3.3Å; E365-T368 PolarHBondContact O-N 2.81Å; E365-V369 HydrophobicContact CG-CG1 4.38Å; E365-V369 WeakPolarHBondContact O-CG2 3.41Å; E365-V369 PolarHBondContact O-N 2.79Å
366	L	98.6	Very high	97.2	Very high	4 Å²	4	60.5 Å²	60.5	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-58.4	-42.9	178.1	-170.8	60	0	0	0	112.1	W235 F238 L322 E362 L363 T368 V369 C370 I384 I387	W235-L366 HydrophobicContact CH2-CD2 3.56Å; W235-L366 HydrophobicContact CZ3-CD2 3.73Å; F238-L366 HydrophobicContact CE1-CD2 3.79Å; L322-L366 HydrophobicContact CD2-CB 4.21Å; L322-L366 HydrophobicContact CD2-CD2 3.92Å; L322-L366 HydrophobicContact CD2-CG 4.03Å; E362-L366 VanDerWaalsContact O-CB 3.25Å; E362-L366 WeakPolarHBondContact O-CB 3.43Å; E362-L366 PolarHBondContact O-N 3.21Å; L363-L366 PolarHBondContact O-N 3.34Å; L366-T368 VanDerWaalsContact C-N 3.34Å; L366-T368 PolarHBondContact O-N 3.05Å; L366-V369 HydrophobicContact CD1-CG2 4.2Å; L366-V369 WeakPolarHBondContact O-CG2 3.27Å; L366-C370 WeakPolarHBondContact O-CB 3.28Å; L366-C370 PolarHBondContact O-N 2.92Å; L366-C370 VanDerWaalsContact O-N 3.08Å; L366-C370 PolarHBondContact O-SG 2.86Å; L366-I384 HydrophobicContact CD1-CG1 4.14Å; L366-I384 HydrophobicContact CD1-CG2 4.29Å; L366-I384 HydrophobicContact CD2-CG2 4.28Å; L366-I387 HydrophobicContact CD1-CD1 4.01Å; L366-I387 HydrophobicContact CD2-CG2 4.1Å
367	V	98.6	Very high	97.3	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-57.1	-48.8	171.2	167.1	0	0	0	0	110.9	L322 Y323 Y351 L354 L363 E365 V369 C370 I371	L322-V367 HydrophobicContact CB-CG2 4.09Å; L322-V367 HydrophobicContact CD2-CG2 3.67Å; L322-V367 HydrophobicContact CG-CG2 3.63Å; Y323-V367 HydrophobicContact CD2-CG1 3.96Å; Y351-V367 HydrophobicContact CE2-CG1 4.28Å; L354-V367 HydrophobicContact CD1-CG2 4.11Å; L363-V367 HydrophobicContact CD2-CG2 4.31Å; L363-V367 WeakPolarHBondContact O-CG2 3.5Å; L363-V367 PolarHBondContact O-N 2.99Å; L363-V367 VanDerWaalsContact O-N 3.08Å; E365-V367 VanDerWaalsContact C-N 3.31Å; E365-V367 PolarHBondContact O-N 3.23Å; V367-V369 PolarHBondContact O-N 2.96Å; V367-C370 PolarHBondContact O-N 2.82Å; V367-I371 HydrophobicContact CG1-CD1 3.77Å; V367-I371 WeakPolarHBondContact O-CG1 3.37Å; V367-I371 PolarHBondContact O-N 2.8Å
368	T	97.9	Very high	97.3	Very high	65 Å²	65	52.1 Å²	52.1	40%	0.399	27%	0.272	S	S	.	.	H	α-helix	trans	-63.6	-39.8	-175.8	-58	0	0	0	0	112.6	R364 E365 L366 Q372	R364-T368 PolarHBondContact O-N 3.44Å; R364-T368 VanDerWaalsContact O-N 3.1Å; R364-T368 PolarHBondContact O-OG1 3.33Å; E365-T368 CarbonylContact O-C 3.59Å; E365-T368 WeakPolarHBondContact O-CA 3.23Å; E365-T368 WeakPolarHBondContact O-CB 3.3Å; E365-T368 PolarHBondContact O-N 2.81Å; L366-T368 VanDerWaalsContact C-N 3.34Å; L366-T368 PolarHBondContact O-N 3.05Å; T368-Q372 PolarHBondContact O-NE2 3.25Å
369	V	97.9	Very high	97.4	Very high	45 Å²	45	49 Å²	49	27%	0.273	26%	0.257	S	S	.	.	H	α-helix	trans	-76.5	-26.9	178.2	-58.9	0	0	0	0	112.5	E365 L366 V367 Q372 P379	E365-V369 HydrophobicContact CG-CG1 4.38Å; E365-V369 WeakPolarHBondContact O-CG2 3.41Å; E365-V369 PolarHBondContact O-N 2.79Å; L366-V369 HydrophobicContact CD1-CG2 4.2Å; L366-V369 WeakPolarHBondContact O-CG2 3.27Å; V367-V369 PolarHBondContact O-N 2.96Å; V369-Q372 VanDerWaalsContact O-CG 3.3Å; V369-Q372 WeakPolarHBondContact O-CG 3.44Å; V369-P379 HydrophobicContact CG2-CG 3.93Å; V369-P379 WeakPolarHBondContact O-CD 3.28Å
370	C	98.4	Very high	97.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-75.3	-36.7	174.8	-67	0	0	0	0	112.7	I315 L366 V367 Q372 R378	I315-C370 HydrophobicContact CG2-CB 4.09Å; L366-C370 WeakPolarHBondContact O-CB 3.28Å; L366-C370 PolarHBondContact O-N 2.92Å; L366-C370 VanDerWaalsContact O-N 3.08Å; L366-C370 PolarHBondContact O-SG 2.86Å; V367-C370 PolarHBondContact O-N 2.82Å; C370-Q372 PolarHBondContact O-N 2.93Å; C370-R378 WeakPolarHBondContact O-CD 3.05Å
371	I	97.5	Very high	97.5	Very high	6 Å²	6	52.4 Å²	52.4	3%	0.031	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	37.5	-179.2	-49.1	175.8	0	0	0	110.6	W316 P331 F332 Y351 V367	W316-I371 HydrophobicContact CD2-CG2 4.31Å; W316-I371 HydrophobicContact CE3-CB 4.45Å; W316-I371 HydrophobicContact CE3-CG2 3.97Å; W316-I371 HydrophobicContact CH2-CG2 3.51Å; W316-I371 HydrophobicContact CZ2-CG2 3.86Å; W316-I371 HydrophobicContact CZ3-CB 4.36Å; W316-I371 HydrophobicContact CZ3-CG2 3.56Å; W316-I371 WeakPolarHBondContact CZ3-O 3.5Å; P331-I371 HydrophobicContact CB-CD1 4.41Å; P331-I371 HydrophobicContact CG-CD1 4.12Å; F332-I371 HydrophobicContact CE2-CG2 4.03Å; F332-I371 HydrophobicContact CZ-CG2 3.6Å; Y351-I371 HydrophobicContact CD1-CG2 4.3Å; Y351-I371 HydrophobicContact CE1-CB 4.15Å; Y351-I371 HydrophobicContact CE1-CD1 4.39Å; Y351-I371 HydrophobicContact CE1-CG2 3.78Å; V367-I371 HydrophobicContact CG1-CD1 3.77Å; V367-I371 WeakPolarHBondContact O-CG1 3.37Å; V367-I371 PolarHBondContact O-N 2.8Å
372	Q	96.6	Very high	97.5	Very high	67 Å²	67	53.5 Å²	53.5	31%	0.313	28%	0.279	S	S	.	.			trans	-76.7	136.9	171.9	-71.5	-65.1	-37.5	0	0	110.7	W316 T368 V369 C370 E374 N377 R378	W316-Q372 WeakPolarHBondContact CZ3-O 3.29Å; T368-Q372 PolarHBondContact O-NE2 3.25Å; V369-Q372 VanDerWaalsContact O-CG 3.3Å; V369-Q372 WeakPolarHBondContact O-CG 3.44Å; C370-Q372 PolarHBondContact O-N 2.93Å; Q372-E374 PolarHBondContact O-N 3.49Å; Q372-N377 HydrophobicContact CB-CB 4.07Å; Q372-N377 HydrophobicContact CG-CB 4.27Å; Q372-R378 HydrophobicContact CB-CG 3.99Å; Q372-R378 PolarHBondContact O-NE 3.42Å; Q372-R378 PolarHBondContact O-NH2 3.27Å; Q372-R378 VanDerWaalsContact O-NH2 3.09Å
373	K	94.5	Very high	97.5	Very high	91 Å²	91	53.6 Å²	53.6	40%	0.396	28%	0.279	S	S	.	.	S	Bend	trans	-61.2	-47.3	-179.5	-59.7	175.9	-166.5	-170.7	0	111.4	E347 H348 P375 R378	E347-K373 WeakPolarHBondContact O-CD 3.46Å; H348-K373 VanDerWaalsContact C-NZ 3.3Å; H348-K373 WeakPolarHBondContact O-CE 3.45Å; H348-K373 PolarHBondContact O-NZ 2.83Å; K373-P375 WeakPolarHBondContact O-CD 3.26Å; K373-R378 PolarHBondContact O-NH2 3.06Å
374	E	94.4	Very high	97.5	Very high	99 Å²	99	53.6 Å²	53.6	46%	0.463	28%	0.279	S	S	.	.	S	Bend	trans	-78.4	119.5	179.1	-167	58.4	-138	0	0	109.6	Q372 T376 N377	Q372-E374 PolarHBondContact O-N 3.49Å; E374-T376 WeakPolarHBondContact CG-OG1 3.49Å; E374-T376 PolarHBondContact O-N 3.11Å; E374-N377 HydrophobicContact CB-CB 4.38Å; E374-N377 PolarHBondContact O-N 3.19Å; E374-N377 VanDerWaalsContact O-N 3.08Å
375	P	95.3	Very high	97.5	Very high	21 Å²	21	52.6 Å²	52.6	14%	0.136	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-58.2	-34.7	-176.6	-24.3	34.2	0	0	0	113.2	E302 A312 K373 N377 R378	E302-P375 HydrophobicContact CB-CG 4.28Å; E302-P375 HydrophobicContact CG-CG 4.07Å; A312-P375 HydrophobicContact CB-CB 3.85Å; K373-P375 WeakPolarHBondContact O-CD 3.26Å; P375-N377 PolarHBondContact O-N 3.08Å; P375-R378 WeakPolarHBondContact O-CB 3.44Å; P375-R378 PolarHBondContact O-N 3.24Å; P375-R378 VanDerWaalsContact O-N 3.16Å
376	T	95.6	Very high	97.5	Very high	114 Å²	114	50.7 Å²	50.7	70%	0.699	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-69.3	-17.3	-179.6	60.3	0	0	0	0	113.9	E374 R378	E374-T376 WeakPolarHBondContact CG-OG1 3.49Å; E374-T376 PolarHBondContact O-N 3.11Å; T376-R378 VanDerWaalsContact C-N 3.34Å
377	N	97.1	Very high	97.5	Very high	100 Å²	100	52.4 Å²	52.4	54%	0.535	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-87.6	-7.8	177.2	-67	-7.2	0	0	0	112.3	Q372 E374 P375	Q372-N377 HydrophobicContact CB-CB 4.07Å; Q372-N377 HydrophobicContact CG-CB 4.27Å; E374-N377 HydrophobicContact CB-CB 4.38Å; E374-N377 PolarHBondContact O-N 3.19Å; E374-N377 VanDerWaalsContact O-N 3.08Å; P375-N377 PolarHBondContact O-N 3.08Å
378	R	97.9	Very high	97.5	Very high	17 Å²	17	52.3 Å²	52.3	6%	0.064	28%	0.278	C	S	.	.	S	Bend	trans	-79.3	141.2	176.9	-58.1	177.4	-162.4	145.8	9.9	109.4	E302 A312 I315 C370 Q372 K373 P375 T376	E302-R378 IonicContact OE1-CZ 3.69Å; E302-R378 IonicContact OE1-NH1 3.64Å; E302-R378 PolarHBondContact OE1-NH1 3.49Å; E302-R378 IonicContact OE1-NH2 3.56Å; E302-R378 IonicContact OE2-CZ 3.54Å; E302-R378 IonicContact OE2-NH1 3.9Å; E302-R378 PolarHBondContact OE2-NH1 2.93Å; E302-R378 IonicContact OE2-NH2 2.93Å; E302-R378 PolarHBondContact OE2-NH2 3.11Å; A312-R378 VanDerWaalsContact C-NH1 3.33Å; A312-R378 WeakPolarHBondContact O-CD 3.13Å; A312-R378 PolarHBondContact O-NH1 3.15Å; I315-R378 HydrophobicContact CB-CB 4.31Å; I315-R378 HydrophobicContact CG2-CB 3.9Å; C370-R378 WeakPolarHBondContact O-CD 3.05Å; Q372-R378 HydrophobicContact CB-CG 3.99Å; Q372-R378 PolarHBondContact O-NE 3.42Å; Q372-R378 PolarHBondContact O-NH2 3.27Å; Q372-R378 VanDerWaalsContact O-NH2 3.09Å; K373-R378 PolarHBondContact O-NH2 3.06Å; P375-R378 WeakPolarHBondContact O-CB 3.44Å; P375-R378 PolarHBondContact O-N 3.24Å; P375-R378 VanDerWaalsContact O-N 3.16Å; T376-R378 VanDerWaalsContact C-N 3.34Å
379	P	98.1	Very high	97.5	Very high	24 Å²	24	53.4 Å²	53.4	16%	0.156	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-69.4	161.9	178	27	-32	0	0	0	111.9	V369 H383 I384	V369-P379 HydrophobicContact CG2-CG 3.93Å; V369-P379 WeakPolarHBondContact O-CD 3.28Å; P379-H383 HydrophobicContact CB-CB 4.36Å; P379-I384 HydrophobicContact CB-CG1 4.24Å; P379-I384 HydrophobicContact CG-CD1 3.98Å; P379-I384 HydrophobicContact CG-CG1 3.75Å
380	T	97.8	Very high	97.5	Very high	94 Å²	94	56.3 Å²	56.3	58%	0.577	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-70.5	153.1	170	63.6	0	0	0	0	110.6	T382 H383 I384	T380-T382 PolarHBondContact O-N 3.32Å; T380-H383 WeakPolarHBondContact O-CB 3.39Å; T380-H383 PolarHBondContact O-N 3.14Å; T380-H383 VanDerWaalsContact O-N 3.08Å; T380-H383 PolarHBondContact OG1-N 3.12Å; T380-I384 PolarHBondContact O-N 3.19Å; T380-I384 VanDerWaalsContact O-N 3.16Å
381	I	98.5	Very high	97.5	Very high	7 Å²	7	57.1 Å²	57.1	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-60.1	-34	177.1	-174.7	53.7	0	0	0	112.7	L245 D246 H249 I315 L318 H383 I384 Y385	L245-I381 HydrophobicContact CB-CD1 4.03Å; L245-I381 HydrophobicContact CB-CG1 3.94Å; L245-I381 HydrophobicContact CD2-CD1 3.75Å; L245-I381 HydrophobicContact CD2-CG1 4.06Å; L245-I381 HydrophobicContact CG-CD1 4.11Å; L245-I381 HydrophobicContact CG-CG1 3.92Å; D246-I381 HydrophobicContact CB-CG1 3.97Å; D246-I381 HydrophobicContact CB-CG2 4.29Å; H249-I381 HydrophobicContact CB-CG2 3.7Å; H249-I381 WeakPolarHBondContact ND1-CG2 3.44Å; I315-I381 HydrophobicContact CD1-CB 3.87Å; I315-I381 HydrophobicContact CD1-CD1 4.38Å; L318-I381 HydrophobicContact CD2-CD1 3.6Å; I381-H383 VanDerWaalsContact C-N 3.31Å; I381-H383 PolarHBondContact O-N 3.36Å; I381-I384 HydrophobicContact CD1-CB 4.24Å; I381-I384 HydrophobicContact CD1-CD1 4.39Å; I381-I384 HydrophobicContact CD1-CG2 4.38Å; I381-I384 PolarHBondContact O-N 2.87Å; I381-Y385 WeakPolarHBondContact O-CB 3.46Å; I381-Y385 PolarHBondContact O-N 2.88Å
382	T	98.5	Very high	97.5	Very high	68 Å²	68	58.9 Å²	58.9	42%	0.417	30%	0.3	S	S	.	.	H	α-helix	trans	-61.2	-40.1	175.7	-48.3	0	0	0	0	111.8	D246 T380 N386	D246-T382 WeakPolarHBondContact OD1-CA 3.23Å; D246-T382 WeakPolarHBondContact OD1-CB 3.44Å; D246-T382 PolarHBondContact OD1-N 2.95Å; D246-T382 PolarHBondContact OD1-OG1 3.41Å; T380-T382 PolarHBondContact O-N 3.32Å; T382-N386 VanDerWaalsContact O-CG 3.25Å; T382-N386 PolarHBondContact O-N 3.24Å; T382-N386 VanDerWaalsContact O-N 3.1Å; T382-N386 PolarHBondContact O-ND2 3.15Å; T382-N386 VanDerWaalsContact O-ND2 3.15Å
383	H	98.4	Very high	97.4	Very high	96 Å²	96	58.2 Å²	58.2	44%	0.444	30%	0.296	S	S	.	.	H	α-helix	trans	-65.5	-45.8	175.6	-180	70.3	0	0	0	111.6	P379 T380 I381 Y385 N386 I387	P379-H383 HydrophobicContact CB-CB 4.36Å; T380-H383 WeakPolarHBondContact O-CB 3.39Å; T380-H383 PolarHBondContact O-N 3.14Å; T380-H383 VanDerWaalsContact O-N 3.08Å; T380-H383 PolarHBondContact OG1-N 3.12Å; I381-H383 VanDerWaalsContact C-N 3.31Å; I381-H383 PolarHBondContact O-N 3.36Å; H383-Y385 VanDerWaalsContact C-N 3.34Å; H383-Y385 PolarHBondContact O-N 3.26Å; H383-N386 PolarHBondContact O-N 2.76Å; H383-I387 VanDerWaalsContact NE2-CD1 3.35Å; H383-I387 WeakPolarHBondContact NE2-CD1 3.47Å; H383-I387 PolarHBondContact O-N 2.93Å; H383-I387 VanDerWaalsContact O-N 3.12Å
384	I	98.8	Very high	97.5	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.7	-45.1	177	-62.7	168.2	0	0	0	111.1	F238 I315 L318 L366 P379 T380 I381 N386 I387 A388	F238-I384 HydrophobicContact CE1-CG2 3.73Å; F238-I384 HydrophobicContact CZ-CG2 3.98Å; I315-I384 HydrophobicContact CD1-CD1 3.85Å; I315-I384 HydrophobicContact CG2-CD1 3.62Å; L318-I384 HydrophobicContact CD2-CD1 4.25Å; L318-I384 HydrophobicContact CD2-CG2 4.01Å; L366-I384 HydrophobicContact CD1-CG1 4.14Å; L366-I384 HydrophobicContact CD1-CG2 4.29Å; L366-I384 HydrophobicContact CD2-CG2 4.28Å; P379-I384 HydrophobicContact CB-CG1 4.24Å; P379-I384 HydrophobicContact CG-CD1 3.98Å; P379-I384 HydrophobicContact CG-CG1 3.75Å; T380-I384 PolarHBondContact O-N 3.19Å; T380-I384 VanDerWaalsContact O-N 3.16Å; I381-I384 HydrophobicContact CD1-CB 4.24Å; I381-I384 HydrophobicContact CD1-CD1 4.39Å; I381-I384 HydrophobicContact CD1-CG2 4.38Å; I381-I384 PolarHBondContact O-N 2.87Å; I384-N386 VanDerWaalsContact C-N 3.32Å; I384-N386 PolarHBondContact O-N 3.5Å; I384-I387 PolarHBondContact O-N 2.8Å; I384-A388 WeakPolarHBondContact O-CB 3.49Å; I384-A388 PolarHBondContact O-N 2.87Å
385	Y	98.7	Very high	97.4	Very high	57 Å²	57	54.5 Å²	54.5	22%	0.224	28%	0.284	C	S	.	.	H	α-helix	trans	-61.2	-41.3	178.9	172.7	-133.6	0	0	0	111.7	V239 D246 I381 H383 A388 K389	V239-Y385 HydrophobicContact CG2-CD2 4.23Å; V239-Y385 HydrophobicContact CG2-CE2 3.83Å; D246-Y385 HydrophobicContact CB-CD1 4.46Å; I381-Y385 WeakPolarHBondContact O-CB 3.46Å; I381-Y385 PolarHBondContact O-N 2.88Å; H383-Y385 VanDerWaalsContact C-N 3.34Å; H383-Y385 PolarHBondContact O-N 3.26Å; Y385-A388 PolarHBondContact O-N 3.06Å; Y385-K389 WeakPolarHBondContact O-CB 3.49Å; Y385-K389 PolarHBondContact O-N 2.62Å
386	N	98.5	Very high	97.2	Very high	87 Å²	87	56.4 Å²	56.4	47%	0.465	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-45	177	-71.7	-29	0	0	0	112.3	T382 H383 I384 A388 K389 E390	T382-N386 VanDerWaalsContact O-CG 3.25Å; T382-N386 PolarHBondContact O-N 3.24Å; T382-N386 VanDerWaalsContact O-N 3.1Å; T382-N386 PolarHBondContact O-ND2 3.15Å; T382-N386 VanDerWaalsContact O-ND2 3.15Å; H383-N386 PolarHBondContact O-N 2.76Å; I384-N386 VanDerWaalsContact C-N 3.32Å; I384-N386 PolarHBondContact O-N 3.5Å; N386-A388 VanDerWaalsContact C-N 3.34Å; N386-A388 PolarHBondContact O-N 2.74Å; N386-K389 PolarHBondContact O-N 2.75Å; N386-E390 PolarHBondContact O-N 3.22Å
387	I	98.4	Very high	96.6	Very high	40 Å²	40	54.3 Å²	54.3	21%	0.205	29%	0.293	C	S	.	.	H	α-helix	trans	-59.3	-47.6	174.1	-67.4	169.4	0	0	0	110.2	W235 L366 H383 I384 K389 E390 M391	W235-I387 HydrophobicContact CH2-CG2 4.22Å; L366-I387 HydrophobicContact CD1-CD1 4.01Å; L366-I387 HydrophobicContact CD2-CG2 4.1Å; H383-I387 VanDerWaalsContact NE2-CD1 3.35Å; H383-I387 WeakPolarHBondContact NE2-CD1 3.47Å; H383-I387 PolarHBondContact O-N 2.93Å; H383-I387 VanDerWaalsContact O-N 3.12Å; I384-I387 PolarHBondContact O-N 2.8Å; I387-K389 VanDerWaalsContact C-N 3.26Å; I387-K389 PolarHBondContact O-N 3.48Å; I387-E390 PolarHBondContact O-N 3.09Å; I387-M391 HydrophobicContact CG2-CG 4.29Å; I387-M391 WeakPolarHBondContact O-CB 3.37Å; I387-M391 WeakPolarHBondContact O-CG 3.3Å; I387-M391 PolarHBondContact O-N 3.15Å
388	A	98.6	Very high	95.5	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-36.8	-179.4	0	0	0	0	0	112.4	W235 F238 V239 I384 Y385 N386 H392	W235-A388 HydrophobicContact CE3-CB 4.01Å; W235-A388 HydrophobicContact CZ3-CB 3.91Å; F238-A388 HydrophobicContact CD1-CB 3.81Å; F238-A388 HydrophobicContact CE1-CB 4.29Å; V239-A388 HydrophobicContact CB-CB 4.13Å; V239-A388 HydrophobicContact CG2-CB 4.36Å; I384-A388 WeakPolarHBondContact O-CB 3.49Å; I384-A388 PolarHBondContact O-N 2.87Å; Y385-A388 PolarHBondContact O-N 3.06Å; N386-A388 VanDerWaalsContact C-N 3.34Å; N386-A388 PolarHBondContact O-N 2.74Å; A388-H392 WeakPolarHBondContact O-CB 3.29Å; A388-H392 PolarHBondContact O-N 2.86Å
389	K	98.1	Very high	94.3	Very high	89 Å²	89	59.4 Å²	59.4	39%	0.387	31%	0.314	S	S	.	.	H	α-helix	trans	-67	-48.9	176	-174	-176.6	173.4	-169.1	0	111.7	V239 Y385 N386 I387 M391 H392 E393	V239-K389 HydrophobicContact CG2-CB 4.06Å; Y385-K389 WeakPolarHBondContact O-CB 3.49Å; Y385-K389 PolarHBondContact O-N 2.62Å; N386-K389 PolarHBondContact O-N 2.75Å; I387-K389 VanDerWaalsContact C-N 3.26Å; I387-K389 PolarHBondContact O-N 3.48Å; K389-M391 PolarHBondContact O-N 3.09Å; K389-H392 PolarHBondContact O-N 3.26Å; K389-E393 WeakPolarHBondContact CE-OE1 3.44Å; K389-E393 WeakPolarHBondContact O-CB 3.46Å; K389-E393 WeakPolarHBondContact O-CG 3.32Å; K389-E393 PolarHBondContact O-N 2.84Å
390	E	97.9	Very high	92.6	Very high	106 Å²	106	63.4 Å²	63.4	50%	0.495	34%	0.342	S	S	.	.	H	α-helix	trans	-58.1	-49.9	177.9	-178.4	176.4	-177.3	0	0	111.4	N386 I387 H392 E393 L394	N386-E390 PolarHBondContact O-N 3.22Å; I387-E390 PolarHBondContact O-N 3.09Å; E390-H392 VanDerWaalsContact C-N 3.33Å; E390-H392 PolarHBondContact O-N 3.03Å; E390-E393 PolarHBondContact O-N 3.13Å; E390-E393 VanDerWaalsContact O-N 3.17Å; E390-L394 WeakPolarHBondContact O-CB 3.41Å; E390-L394 PolarHBondContact O-N 3.08Å
391	M	97.9	Very high	90.7	Very high	16 Å²	16	63.2 Å²	63.2	8%	0.079	35%	0.345	C	S	.	.	H	α-helix	trans	-63.2	-39.2	179	-69.6	-59.1	-67.3	0	0	112.4	W235 E362 I387 K389 L395	W235-M391 HydrophobicContact CD2-CB 3.56Å; W235-M391 HydrophobicContact CD2-CG 4.3Å; W235-M391 HydrophobicContact CE3-CB 3.95Å; W235-M391 HydrophobicContact CG-CB 3.93Å; W235-M391 HydrophobicContact CH2-CB 4.29Å; W235-M391 HydrophobicContact CH2-CG 4.05Å; W235-M391 HydrophobicContact CZ2-CB 3.94Å; W235-M391 HydrophobicContact CZ2-CE 4.24Å; W235-M391 HydrophobicContact CZ2-CG 3.73Å; W235-M391 HydrophobicContact CZ3-CB 4.31Å; W235-M391 HydrophobicContact CZ3-CG 4.47Å; E362-M391 HydrophobicContact CB-CE 3.8Å; E362-M391 HydrophobicContact CB-CG 4.36Å; E362-M391 HydrophobicContact CB-SD 3.81Å; E362-M391 HydrophobicContact CG-CE 4.11Å; E362-M391 HydrophobicContact CG-SD 3.78Å; I387-M391 HydrophobicContact CG2-CG 4.29Å; I387-M391 WeakPolarHBondContact O-CB 3.37Å; I387-M391 WeakPolarHBondContact O-CG 3.3Å; I387-M391 PolarHBondContact O-N 3.15Å; K389-M391 PolarHBondContact O-N 3.09Å; M391-L395 WeakPolarHBondContact O-CB 3.41Å; M391-L395 WeakPolarHBondContact O-CG 3.24Å; M391-L395 PolarHBondContact O-N 3.28Å
392	H	97.2	Very high	88.4	Confident	43 Å²	43	67.5 Å²	67.5	20%	0.199	38%	0.376	C	S	.	.	H	α-helix	trans	-64.8	-39	175.2	-177.7	65.3	0	0	0	112.4	W235 K236 V239 A388 K389 E390 N396	W235-H392 HydrophobicContact CB-CB 4.33Å; K236-H392 WeakPolarHBondContact CA-ND1 3.49Å; V239-H392 HydrophobicContact CB-CB 4.35Å; V239-H392 HydrophobicContact CG1-CB 4.27Å; A388-H392 WeakPolarHBondContact O-CB 3.29Å; A388-H392 PolarHBondContact O-N 2.86Å; K389-H392 PolarHBondContact O-N 3.26Å; E390-H392 VanDerWaalsContact C-N 3.33Å; E390-H392 PolarHBondContact O-N 3.03Å; H392-N396 PolarHBondContact CE1-ND2 3.27Å; H392-N396 PolarHBondContact ND1-ND2 3.11Å; H392-N396 PolarHBondContact NE2-ND2 3.37Å; H392-N396 WeakPolarHBondContact O-CB 3.4Å; H392-N396 PolarHBondContact O-N 3.1Å; H392-N396 PolarHBondContact O-ND2 3.47Å
393	E	96.2	Very high	85.5	Confident	53 Å²	53	70.2 Å²	70.2	25%	0.248	39%	0.394	C	S	.	.	H	α-helix	trans	-71.1	-41.8	178.1	-73.9	172.3	167.7	0	0	111.8	K389 E390 N396 G397 K398 I399	K389-E393 WeakPolarHBondContact CE-OE1 3.44Å; K389-E393 WeakPolarHBondContact O-CB 3.46Å; K389-E393 WeakPolarHBondContact O-CG 3.32Å; K389-E393 PolarHBondContact O-N 2.84Å; E390-E393 PolarHBondContact O-N 3.13Å; E390-E393 VanDerWaalsContact O-N 3.17Å; E393-N396 CarbonylContact O-C 3.57Å; E393-N396 PolarHBondContact O-N 3.28Å; E393-G397 PolarHBondContact O-N 2.95Å; E393-K398 HydrophobicContact CB-CB 4.23Å; E393-K398 PolarHBondContact O-N 3.41Å; E393-I399 HydrophobicContact CB-CD1 3.7Å; E393-I399 HydrophobicContact CB-CG1 4.01Å; E393-I399 HydrophobicContact CG-CD1 4.47Å; E393-I399 WeakPolarHBondContact OE2-CD1 3.39Å
394	L	94.9	Very high	82.8	Confident	56 Å²	56	70.2 Å²	70.2	29%	0.293	41%	0.405	S	S	.	.	H	α-helix	trans	-60.4	-49.1	176.5	-175.9	139.2	0	0	0	111.8	E390 N396 G397	E390-L394 WeakPolarHBondContact O-CB 3.41Å; E390-L394 PolarHBondContact O-N 3.08Å; L394-N396 PolarHBondContact O-N 2.72Å; L394-G397 PolarHBondContact O-N 2.86Å
395	L	92.6	Very high	79.4	Confident	57 Å²	57	76.3 Å²	76.3	30%	0.298	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-9.4	179.4	-66.9	174.2	0	0	0	114.3	E231 K232 W235 M391	E231-L395 HydrophobicContact CG-CD1 4.23Å; K232-L395 HydrophobicContact CB-CD1 4.42Å; K232-L395 WeakPolarHBondContact CE-O 3.26Å; K232-L395 HydrophobicContact CG-CB 4.3Å; K232-L395 PolarHBondContact NZ-O 3.16Å; W235-L395 HydrophobicContact CG-CD1 4.23Å; M391-L395 WeakPolarHBondContact O-CB 3.41Å; M391-L395 WeakPolarHBondContact O-CG 3.24Å; M391-L395 PolarHBondContact O-N 3.28Å
396	N	90.7	Very high	76.2	Confident	61 Å²	61	78 Å²	78	33%	0.326	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	8.1	170.9	-74.6	-54.4	0	0	0	113.4	K232 H392 E393 L394 K398	K232-N396 WeakPolarHBondContact CE-OD1 3.27Å; K232-N396 PolarHBondContact NZ-OD1 2.78Å; K232-N396 VanDerWaalsContact NZ-OD1 3.17Å; H392-N396 PolarHBondContact CE1-ND2 3.27Å; H392-N396 PolarHBondContact ND1-ND2 3.11Å; H392-N396 PolarHBondContact NE2-ND2 3.37Å; H392-N396 WeakPolarHBondContact O-CB 3.4Å; H392-N396 PolarHBondContact O-N 3.1Å; H392-N396 PolarHBondContact O-ND2 3.47Å; E393-N396 CarbonylContact O-C 3.57Å; E393-N396 PolarHBondContact O-N 3.28Å; L394-N396 PolarHBondContact O-N 2.72Å; N396-K398 HydrophobicContact CB-CG 4.46Å; N396-K398 PolarHBondContact O-N 3.09Å
397	G	84.9	Confident	73.1	Confident	69 Å²	69	82.1 Å²	82.1	71%	0.711	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	19.3	177.4	0	0	0	0	0	113.9	E393 L394	E393-G397 PolarHBondContact O-N 2.95Å; L394-G397 PolarHBondContact O-N 2.86Å
398	K	73	Confident	70.2	Confident	156 Å²	156	87.8 Å²	87.8	68%	0.678	51%	0.513	S	S	*	.	S	Bend	trans	-84.9	-22.4	177.9	-66.9	-175.9	177.1	-179.8	0	112.7	E393 N396	E393-K398 HydrophobicContact CB-CB 4.23Å; E393-K398 PolarHBondContact O-N 3.41Å; N396-K398 HydrophobicContact CB-CG 4.46Å; N396-K398 PolarHBondContact O-N 3.09Å
399	I	73.4	Confident	67.1	Low	69 Å²	69	94.1 Å²	94.1	35%	0.354	55%	0.547	S	S	.	.	S	Bend	trans	-130.4	127.3	177.3	-62.5	177.3	0	0	0	107.3	E393	E393-I399 HydrophobicContact CB-CD1 3.7Å; E393-I399 HydrophobicContact CB-CG1 4.01Å; E393-I399 HydrophobicContact CG-CD1 4.47Å; E393-I399 WeakPolarHBondContact OE2-CD1 3.39Å
400	S	62.5	Low	64.1	Low	108 Å²	108	95.8 Å²	95.8	76%	0.755	57%	0.568	S	S	*	*			trans	-73.6	131	167.9	54	0	0	0	0	108.7	S402	S400-S402 PolarHBondContact O-N 3.16Å
401	S	57.5	Low	61.2	Low	90 Å²	90	100.9 Å²	100.9	63%	0.629	58%	0.583	S	S	*	*			trans	-50.2	113.3	173.9	56.1	0	0	0	0	109.3
402	S	49.8	Very low	58.5	Low	97 Å²	97	106 Å²	106	68%	0.678	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-64.1	137.1	168.4	65.3	0	0	0	0	108.2	S400 S404	S400-S402 PolarHBondContact O-N 3.16Å; S402-S404 PolarHBondContact O-N 3.43Å; S402-S404 VanDerWaalsContact O-N 3.14Å
403	P	38.1	Very low	56	Low	124 Å²	124	109.5 Å²	109.5	81%	0.805	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-66.3	120	176	27.3	-30.8	0	0	0	107.3	C405	P403-C405 PolarHBondContact O-N 3.03Å
404	S	40.5	Very low	53.5	Low	97 Å²	97	112.1 Å²	112.1	68%	0.678	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-53.2	124.5	171.5	54.9	0	0	0	0	108.9	S402 S406	S402-S404 PolarHBondContact O-N 3.43Å; S402-S404 VanDerWaalsContact O-N 3.14Å; S404-S406 VanDerWaalsContact C-N 3.32Å; S404-S406 PolarHBondContact O-N 3.05Å; S404-S406 PolarHBondContact O-OG 2.72Å; S404-S406 VanDerWaalsContact O-OG 3.11Å
405	C	28.6	Very low	50.9	Low	127 Å²	127	114 Å²	114	86%	0.858	69%	0.694	S	S	*	*			trans	-58.4	94.8	177.9	-164.8	0	0	0	0	108.9	P403	P403-C405 PolarHBondContact O-N 3.03Å
406	S	32	Very low	48.9	Very low	94 Å²	94	117.2 Å²	117.2	66%	0.657	72%	0.716	S	S	*	*			trans	-140.8	43.9	178.4	53.7	0	0	0	0	110.4	S404	S404-S406 VanDerWaalsContact C-N 3.32Å; S404-S406 PolarHBondContact O-N 3.05Å; S404-S406 PolarHBondContact O-OG 2.72Å; S404-S406 VanDerWaalsContact O-OG 3.11Å
407	Q	32.2	Very low	46.9	Very low	173 Å²	173	120.3 Å²	120.3	81%	0.808	74%	0.738	S	S	*	*			trans	-143.4	73.9	158.1	-72.7	-165.1	-12.4	0	0	108.9	D409	Q407-D409 PolarHBondContact O-N 3.25Å
408	L	37.2	Very low	45.1	Very low	158 Å²	158	130.2 Å²	130.2	83%	0.827	76%	0.761	S	S	*	*			trans	-80.5	97.3	148.9	-84.7	163.3	0	0	0	106.1	C410	L408-C410 VanDerWaalsContact C-N 3.28Å; L408-C410 PolarHBondContact O-N 3.29Å
409	D	34.6	Very low	43.7	Very low	133 Å²	133	129 Å²	129	71%	0.711	77%	0.765	S	S	*	*			trans	-53.1	90.1	162.2	-95.4	-31.6	0	0	0	109.6	Q407 R411	Q407-D409 PolarHBondContact O-N 3.25Å; D409-R411 VanDerWaalsContact C-N 3.25Å; D409-R411 PolarHBondContact O-N 3.29Å
410	C	34	Very low	42.1	Very low	124 Å²	124	132.1 Å²	132.1	84%	0.838	79%	0.787	S	S	*	*			trans	-81.1	80.4	156	-74.6	0	0	0	0	107.9	L408	L408-C410 VanDerWaalsContact C-N 3.28Å; L408-C410 PolarHBondContact O-N 3.29Å
411	R	38.5	Very low	40.9	Very low	214 Å²	214	133.4 Å²	133.4	81%	0.808	79%	0.789	S	S	*	*			trans	-64.5	133.8	160.9	-82.2	-175.6	177	-167.6	-1	109	D409 S413	D409-R411 VanDerWaalsContact C-N 3.25Å; D409-R411 PolarHBondContact O-N 3.29Å; R411-S413 PolarHBondContact O-N 2.81Å
412	P	40.1	Very low	40	Very low	122 Å²	122	136 Å²	136	79%	0.792	80%	0.798	S	S	*	*			trans	-73.2	118.3	169.6	29.4	-28.6	0	0	0	108.2	S414	P412-S414 PolarHBondContact O-N 3.09Å; P412-S414 VanDerWaalsContact O-N 3.17Å
413	S	45.7	Very low	39.4	Very low	118 Å²	118	138.4 Å²	138.4	83%	0.825	81%	0.806	S	S	*	*			trans	-73.2	105.6	164.5	-174.8	0	0	0	0	107.7	R411 A415	R411-S413 PolarHBondContact O-N 2.81Å; S413-A415 PolarHBondContact O-N 2.79Å
414	S	42.5	Very low	39.4	Very low	107 Å²	107	139.4 Å²	139.4	75%	0.748	81%	0.806	S	S	*	*			trans	-63.3	111.2	165.5	48.6	0	0	0	0	109.8	P412	P412-S414 PolarHBondContact O-N 3.09Å; P412-S414 VanDerWaalsContact O-N 3.17Å
415	A	40.7	Very low	39.4	Very low	96 Å²	96	142.4 Å²	142.4	79%	0.793	82%	0.815	S	S	*	*			trans	-98.2	96.1	164.9	0	0	0	0	0	109.7	S413	S413-A415 PolarHBondContact O-N 2.79Å
416	T	51.2	Low	40.2	Very low	124 Å²	124	143.6 Å²	143.6	76%	0.761	81%	0.812	S	S	*	*			trans	-160	120.7	160.8	-24.4	0	0	0	0	102.7
417	T	47.1	Very low	40.9	Very low	126 Å²	126	147.8 Å²	147.8	77%	0.773	82%	0.824	S	S	*	*			cis	-170.2	136.7	41.6	-44.7	0	0	0	0	108.2
418	K	46.9	Very low	41.7	Very low	278 Å²	278	145.5 Å²	145.5	100%	1.209	83%	0.826	S	S	*	*			trans	-172.7	0	130.3	-106.8	-176.1	-176.8	-177	0	110.9

Retrieved 418 of 418 residues in 138.1 ms (Link to these results)

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