A0A087Y4G5_POEFO Loading...

Colony stimulating factor 1b (macrophage)

AlphaFold DB , UniProt , Accession A0A087Y4G5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 269 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	39.5	Very low	37.7	Very low	239 Å²	239	134.3 Å²	134.3	100%	1.177	78%	0.784	S	S	*	*				0	102	0	-170.7	180	-162.3	0	0	107.6
2	T	31.4	Very low	37.8	Very low	146 Å²	146	137.1 Å²	137.1	90%	0.896	78%	0.78	S	S	*	*			trans	176.2	137.7	142.4	31.6	0	0	0	0	109.4
3	I	32.8	Very low	38.3	Very low	145 Å²	145	132.3 Å²	132.3	74%	0.744	77%	0.768	S	S	*	*			trans	-84.6	149.3	-165.7	-61.3	157.9	0	0	0	110.1	V5	I3-V5 HydrophobicContact CG2-CG2 3.91Å
4	P	38.8	Very low	38.6	Very low	130 Å²	130	134.6 Å²	134.6	84%	0.844	76%	0.764	S	S	*	*			trans	-80.7	121.7	166	32.6	-28.3	0	0	0	109.5
5	V	36.5	Very low	39.3	Very low	119 Å²	119	131.8 Å²	131.8	72%	0.721	75%	0.75	S	S	*	*			trans	-123.1	125.8	176.9	166.9	0	0	0	0	110.4	I3	I3-V5 HydrophobicContact CG2-CG2 3.91Å
6	S	35	Very low	39.9	Very low	91 Å²	91	133.2 Å²	133.2	64%	0.636	75%	0.745	S	S	*	*			trans	88.9	77.1	152.3	-61.9	0	0	0	0	120.2	V8	S6-V8 PolarHBondContact O-N 3.42Å
7	T	41.1	Very low	40.7	Very low	147 Å²	147	130.3 Å²	130.3	90%	0.902	74%	0.735	S	S	*	*			trans	-72.7	75	137.7	41.7	0	0	0	0	110.3
8	V	40	Very low	41.2	Very low	108 Å²	108	129.6 Å²	129.6	66%	0.655	73%	0.728	S	S	*	*			trans	-131.7	68.3	174.8	-173.3	0	0	0	0	110	S6	S6-V8 PolarHBondContact O-N 3.42Å
9	S	38.6	Very low	42	Very low	104 Å²	104	126.3 Å²	126.3	73%	0.727	71%	0.714	S	S	*	*	S	Bend	trans	-149.8	-17.1	169.1	58.2	0	0	0	0	115.1
10	Q	38.8	Very low	42.7	Very low	176 Å²	176	122.9 Å²	122.9	82%	0.822	70%	0.696	S	S	*	*	S	Bend	trans	-88.1	-13.5	176.8	-83.2	-172.1	-7.4	0	0	115.2
11	S	42	Very low	43.3	Very low	72 Å²	72	122.3 Å²	122.3	50%	0.503	69%	0.69	S	S	.	*	H	α-helix	trans	-81.4	-22.6	-178.1	55	0	0	0	0	113.9	A13 V15	S11-A13 PolarHBondContact O-N 2.93Å; S11-V15 WeakPolarHBondContact O-CG2 3.24Å
12	K	39.2	Very low	44	Very low	168 Å²	168	116.9 Å²	116.9	73%	0.73	66%	0.664	S	S	*	*	H	α-helix	trans	-74.5	-24.7	-174.2	-107.9	177.7	178.9	173.5	0	114.7
13	A	44.7	Very low	45.1	Very low	75 Å²	75	117.8 Å²	117.8	62%	0.62	66%	0.655	S	S	*	*	H	α-helix	trans	-85.6	-35.6	-178.3	0	0	0	0	0	112.9	S11	S11-A13 PolarHBondContact O-N 2.93Å
14	K	42.5	Very low	46.1	Very low	164 Å²	164	117.6 Å²	117.6	71%	0.713	66%	0.655	S	S	*	*	H	α-helix	trans	-69.9	-36.4	178.6	-87.7	179.9	172.9	172.4	0	113.2	K16 L18	K14-K16 PolarHBondContact O-N 2.85Å; K14-L18 PolarHBondContact O-N 3.26Å
15	V	48.6	Very low	46.8	Very low	93 Å²	93	115 Å²	115	56%	0.564	64%	0.64	S	S	*	*	H	α-helix	trans	-68.1	-35.3	-179	177.3	0	0	0	0	111.8	S11 C19	S11-V15 WeakPolarHBondContact O-CG2 3.24Å; V15-C19 PolarHBondContact O-N 3.23Å; V15-C19 PolarHBondContact O-SG 3.45Å
16	K	49.5	Very low	47.3	Very low	154 Å²	154	116.8 Å²	116.8	67%	0.67	64%	0.638	S	S	*	*	H	α-helix	trans	-70.9	-36	-179.9	-71.8	-179.4	175.9	-175.4	0	113.1	K14 V20	K14-K16 PolarHBondContact O-N 2.85Å; K16-V20 WeakPolarHBondContact O-CG2 3.39Å; K16-V20 PolarHBondContact O-N 3.28Å
17	C	52.3	Low	48	Very low	84 Å²	84	116.4 Å²	116.4	57%	0.568	63%	0.634	S	S	*	*	H	α-helix	trans	-71.7	-37	178.3	-162.7	0	0	0	0	111.9	V20 L21	C17-V20 PolarHBondContact O-N 3.02Å; C17-L21 PolarHBondContact O-N 3.09Å
18	L	50.6	Low	48.5	Very low	117 Å²	117	117.3 Å²	117.3	61%	0.613	63%	0.632	S	S	*	*	H	α-helix	trans	-64.1	-40.5	175.1	-109	114.4	0	0	0	112.6	K14 V20 L21 M22	K14-L18 PolarHBondContact O-N 3.26Å; L18-V20 VanDerWaalsContact C-N 3.29Å; L18-V20 PolarHBondContact O-N 3.33Å; L18-L21 PolarHBondContact O-N 3.42Å; L18-M22 WeakPolarHBondContact O-CG 3.21Å; L18-M22 PolarHBondContact O-N 3.32Å; L18-M22 VanDerWaalsContact O-N 3.11Å
19	C	55.5	Low	48.8	Very low	67 Å²	67	116.1 Å²	116.1	45%	0.453	63%	0.629	S	S	.	*	H	α-helix	trans	-63.2	-35	177	-70.9	0	0	0	0	112.5	V15 M22 F23	V15-C19 PolarHBondContact O-N 3.23Å; V15-C19 PolarHBondContact O-SG 3.45Å; C19-M22 PolarHBondContact O-N 2.7Å; C19-F23 VanDerWaalsContact O-CD2 3.24Å; C19-F23 WeakPolarHBondContact O-CD2 3.22Å; C19-F23 PolarHBondContact O-N 2.98Å
20	V	56.9	Low	48.8	Very low	59 Å²	59	119.6 Å²	119.6	36%	0.358	64%	0.636	S	S	.	*	H	α-helix	trans	-68.8	-36.1	178.4	176	0	0	0	0	111.7	K16 C17 L18 F23 L24	K16-V20 WeakPolarHBondContact O-CG2 3.39Å; K16-V20 PolarHBondContact O-N 3.28Å; C17-V20 PolarHBondContact O-N 3.02Å; L18-V20 VanDerWaalsContact C-N 3.29Å; L18-V20 PolarHBondContact O-N 3.33Å; V20-F23 PolarHBondContact O-N 3.01Å; V20-L24 PolarHBondContact O-N 3.31Å
21	L	54.4	Low	49	Very low	111 Å²	111	114.1 Å²	114.1	58%	0.581	62%	0.621	S	S	*	*	H	α-helix	trans	-69.9	-32.5	174.2	-75.7	163.2	0	0	0	112.8	C17 L18 F23 L24 S25	C17-L21 PolarHBondContact O-N 3.09Å; L18-L21 PolarHBondContact O-N 3.42Å; L21-F23 VanDerWaalsContact C-N 3.33Å; L21-L24 PolarHBondContact O-N 2.72Å; L21-S25 PolarHBondContact O-N 3.27Å; L21-S25 PolarHBondContact O-OG 3.04Å
22	M	54.6	Low	49.3	Very low	125 Å²	125	119.6 Å²	119.6	62%	0.616	64%	0.638	S	S	*	*	H	α-helix	trans	-67.6	-30.6	175.2	-69.7	-70.2	-62	0	0	112.8	L18 C19 S25	L18-M22 WeakPolarHBondContact O-CG 3.21Å; L18-M22 PolarHBondContact O-N 3.32Å; L18-M22 VanDerWaalsContact O-N 3.11Å; C19-M22 PolarHBondContact O-N 2.7Å; M22-S25 VanDerWaalsContact CA-OG 3.3Å; M22-S25 WeakPolarHBondContact CA-OG 3.35Å; M22-S25 PolarHBondContact O-OG 3.02Å; M22-S25 VanDerWaalsContact O-OG 3.13Å
23	F	54.4	Low	49.7	Very low	165 Å²	165	117 Å²	117	72%	0.724	64%	0.636	S	S	*	*	H	α-helix	trans	-78	-30	174.5	-82.5	-74.2	0	0	0	113.2	C19 V20 L21 S25	C19-F23 VanDerWaalsContact O-CD2 3.24Å; C19-F23 WeakPolarHBondContact O-CD2 3.22Å; C19-F23 PolarHBondContact O-N 2.98Å; V20-F23 PolarHBondContact O-N 3.01Å; L21-F23 VanDerWaalsContact C-N 3.33Å; F23-S25 VanDerWaalsContact C-N 3.28Å
24	L	54.8	Low	50.3	Low	140 Å²	140	117.1 Å²	117.1	73%	0.733	63%	0.63	S	S	*	*	H	α-helix	trans	-74.8	-17.6	173.9	-72.4	166.4	0	0	0	113.3	V20 L21	V20-L24 PolarHBondContact O-N 3.31Å; L21-L24 PolarHBondContact O-N 2.72Å
25	S	52.1	Low	51.3	Low	76 Å²	76	110.4 Å²	110.4	53%	0.531	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.5	5.2	-179.9	46.9	0	0	0	0	113.6	L21 M22 F23 P27	L21-S25 PolarHBondContact O-N 3.27Å; L21-S25 PolarHBondContact O-OG 3.04Å; M22-S25 VanDerWaalsContact CA-OG 3.3Å; M22-S25 WeakPolarHBondContact CA-OG 3.35Å; M22-S25 PolarHBondContact O-OG 3.02Å; M22-S25 VanDerWaalsContact O-OG 3.13Å; F23-S25 VanDerWaalsContact C-N 3.28Å; S25-P27 WeakPolarHBondContact O-CD 3.4Å; S25-P27 VanDerWaalsContact O-N 3.14Å
26	F	47.7	Very low	52.6	Low	156 Å²	156	110.7 Å²	110.7	68%	0.684	61%	0.612	S	S	*	*	S	Bend	trans	-66	109.9	162.5	-106	-91.8	0	0	0	107.6	L28	F26-L28 PolarHBondContact O-N 2.87Å; F26-L28 VanDerWaalsContact O-N 3.13Å
27	P	49.1	Very low	54.5	Low	83 Å²	83	104.1 Å²	104.1	54%	0.539	59%	0.585	S	S	.	*			trans	-64.3	124.6	171.8	30.8	-32.1	0	0	0	105.9	S25 S29	S25-P27 WeakPolarHBondContact O-CD 3.4Å; S25-P27 VanDerWaalsContact O-N 3.14Å; P27-S29 WeakPolarHBondContact CB-OG 3.38Å; P27-S29 PolarHBondContact O-N 3.15Å
28	L	51.6	Low	56.1	Low	166 Å²	166	107 Å²	107	87%	0.869	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-59.7	11.5	166.7	-80.7	152.7	0	0	0	112.5	F26 M30	F26-L28 PolarHBondContact O-N 2.87Å; F26-L28 VanDerWaalsContact O-N 3.13Å; L28-M30 PolarHBondContact O-N 2.74Å
29	S	46.7	Very low	57.8	Low	84 Å²	84	107.9 Å²	107.9	59%	0.587	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-74.3	-0.1	-176.7	67.4	0	0	0	0	114.5	P27	P27-S29 WeakPolarHBondContact CB-OG 3.38Å; P27-S29 PolarHBondContact O-N 3.15Å
30	M	39.8	Very low	59.5	Low	177 Å²	177	105.4 Å²	105.4	87%	0.872	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-105.5	4.2	179.9	-66.3	-62.3	-166.4	0	0	113.7	L28	L28-M30 PolarHBondContact O-N 2.74Å
31	A	42.8	Very low	61.1	Low	61 Å²	61	102.7 Å²	102.7	50%	0.504	55%	0.552	S	S	.	*	S	Bend	trans	-101.3	98.3	159.8	0	0	0	0	0	106.3	V33	A31-V33 HydrophobicContact CB-CG2 3.75Å; A31-V33 PolarHBondContact O-N 3.15Å
32	E	46.5	Very low	62.8	Low	187 Å²	187	100.1 Å²	100.1	87%	0.874	54%	0.54	S	S	*	.			trans	-67.1	71.9	168.2	-169.2	150	-159.8	0	0	108	P34	E32-P34 VanDerWaalsContact O-CD 3.3Å; E32-P34 WeakPolarHBondContact O-CD 3.41Å
33	V	48.9	Very low	64.4	Low	113 Å²	113	103.2 Å²	103.2	69%	0.685	55%	0.545	S	S	*	.			trans	-80	114	176.5	-176.8	0	0	0	0	105	A31 G35	A31-V33 HydrophobicContact CB-CG2 3.75Å; A31-V33 PolarHBondContact O-N 3.15Å; V33-G35 PolarHBondContact O-N 3.03Å
34	P	57.1	Low	66.2	Low	77 Å²	77	100.5 Å²	100.5	50%	0.5	54%	0.535	S	S	.	.			trans	-49.5	137.2	170.9	-21.7	31.7	0	0	0	108.2	E32	E32-P34 VanDerWaalsContact O-CD 3.3Å; E32-P34 WeakPolarHBondContact O-CD 3.41Å
35	G	62.8	Low	68.1	Low	24 Å²	24	96 Å²	96	25%	0.247	51%	0.51	C	S	.	.			trans	-54.1	171.3	176	0	0	0	0	0	111.5	V33 C37	V33-G35 PolarHBondContact O-N 3.03Å; G35-C37 PolarHBondContact O-N 2.8Å; G35-C37 PolarHBondContact O-SG 2.98Å
36	P	76.9	Confident	70.1	Confident	98 Å²	98	93.4 Å²	93.4	64%	0.636	49%	0.49	S	S	*	.	S	Bend	trans	-69.6	65.3	176.9	30.7	-35.5	0	0	0	111.8	R38 H39	P36-R38 PolarHBondContact O-N 3.37Å; P36-H39 PolarHBondContact O-N 2.87Å
37	C	88.4	Confident	72.5	Confident	17 Å²	17	89.5 Å²	89.5	12%	0.115	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-70.2	-22.2	-170.7	-61.5	0	0	0	0	113.1	G35 H39 S40 C121	G35-C37 PolarHBondContact O-N 2.8Å; G35-C37 PolarHBondContact O-SG 2.98Å; C37-H39 PolarHBondContact O-N 3Å; C37-S40 WeakPolarHBondContact O-CB 3.31Å; C37-S40 PolarHBondContact O-N 3.06Å; C37-S40 PolarHBondContact O-OG 3.43Å; C37-C121 WeakPolarHBondContact CA-SG 3.37Å; C37-C121 HydrophobicContact CB-CB 3.62Å; C37-C121 WeakPolarHBondContact CB-SG 3.44Å; C37-C121 WeakPolarHBondContact SG-CA 3.43Å; C37-C121 WeakPolarHBondContact SG-CB 3.44Å; C37-C121 CovalentContact SG-SG 2.04Å; C37-C121 PolarHBondContact SG-SG 3.3Å
38	R	86	Confident	74.8	Confident	144 Å²	144	86.2 Å²	86.2	54%	0.543	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-54.1	-27.3	173.1	-170.5	168.6	-166.9	-142.8	4.7	113.5	P36 V162 T163	P36-R38 PolarHBondContact O-N 3.37Å; R38-V162 WeakPolarHBondContact CG-O 3.3Å; R38-T163 HydrophobicContact CG-CG2 4.49Å
39	H	87	Confident	77	Confident	135 Å²	135	78.3 Å²	78.3	63%	0.625	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-115.4	11	179.4	-53.6	106.2	0	0	0	113.3	P36 C37 I41	P36-H39 PolarHBondContact O-N 2.87Å; C37-H39 PolarHBondContact O-N 3Å; H39-I41 VanDerWaalsContact C-N 3.33Å; H39-I41 PolarHBondContact O-N 3.42Å
40	S	89.9	Confident	79.4	Confident	15 Å²	15	81.5 Å²	81.5	11%	0.105	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-36.8	179.7	57.7	0	0	0	0	112.3	C37 H45 L112 Y158	C37-S40 WeakPolarHBondContact O-CB 3.31Å; C37-S40 PolarHBondContact O-N 3.06Å; C37-S40 PolarHBondContact O-OG 3.43Å; S40-H45 PolarHBondContact O-CE1 3.13Å; S40-H45 PolarHBondContact O-ND1 3.07Å; S40-L112 VanDerWaalsContact O-CD1 3.24Å; S40-L112 WeakPolarHBondContact O-CD1 3.47Å; S40-Y158 VanDerWaalsContact OG-CE1 3.24Å; S40-Y158 WeakPolarHBondContact OG-CE1 3.24Å; S40-Y158 PolarHBondContact OG-OH 2.71Å
41	I	91.3	Very high	82.2	Confident	3 Å²	3	76.2 Å²	76.2	2%	0.015	39%	0.385	C	S	.	.	S	Bend	trans	-105.2	132.4	166.3	-62.5	-165.4	0	0	0	109.2	H39 H45 L46 L112 M116 L155 Y158 W159	H39-I41 VanDerWaalsContact C-N 3.33Å; H39-I41 PolarHBondContact O-N 3.42Å; I41-H45 HydrophobicContact CG2-CB 4.26Å; I41-L46 HydrophobicContact CG2-CD2 4.29Å; I41-L46 HydrophobicContact CG2-CG 4.28Å; I41-L112 HydrophobicContact CD1-CD2 4.29Å; I41-L112 HydrophobicContact CG1-CD1 4.15Å; I41-L112 HydrophobicContact CG1-CD2 4.2Å; I41-L112 HydrophobicContact CG1-CG 4.5Å; I41-M116 HydrophobicContact CD1-CE 4.44Å; I41-M116 HydrophobicContact CD1-SD 4.05Å; I41-M116 HydrophobicContact CG1-SD 4.25Å; I41-L155 HydrophobicContact CD1-CB 4.02Å; I41-L155 HydrophobicContact CD1-CD2 3.67Å; I41-L155 HydrophobicContact CD1-CG 4.34Å; I41-Y158 HydrophobicContact CB-CD1 4.23Å; I41-Y158 HydrophobicContact CB-CE1 4.24Å; I41-Y158 HydrophobicContact CD1-CD1 3.38Å; I41-Y158 HydrophobicContact CD1-CE1 3.91Å; I41-Y158 HydrophobicContact CD1-CG 4.25Å; I41-Y158 HydrophobicContact CG1-CD1 3.67Å; I41-Y158 HydrophobicContact CG1-CE1 3.68Å; I41-W159 HydrophobicContact CG2-CB 4.4Å
42	T	89.7	Confident	84.8	Confident	56 Å²	56	73.3 Å²	73.3	34%	0.344	36%	0.361	S	S	.	.			trans	-115.4	168.6	174	68.9	0	0	0	0	109.8	E44 H45 L46	T42-E44 PolarHBondContact O-N 2.72Å; T42-E44 PolarHBondContact OG1-N 3.17Å; T42-H45 PolarHBondContact N-ND1 3.42Å; T42-H45 PolarHBondContact O-N 2.84Å; T42-L46 PolarHBondContact O-N 3.48Å
43	R	89.9	Confident	87.2	Confident	190 Å²	190	66 Å²	66	72%	0.717	33%	0.327	S	S	*	.	H	α-helix	trans	-57.4	-32.2	172.3	-71.4	-177.7	179.6	167.1	-0.1	112.3	H45 L46 L47 W159	R43-H45 VanDerWaalsContact C-N 3.33Å; R43-H45 PolarHBondContact O-N 3.34Å; R43-L46 PolarHBondContact O-N 2.84Å; R43-L47 WeakPolarHBondContact O-CG 3.31Å; R43-L47 PolarHBondContact O-N 3.46Å; R43-W159 HydrophobicContact CG-CZ2 4.47Å
44	E	91.5	Very high	89.4	Confident	108 Å²	108	66.9 Å²	66.9	51%	0.505	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-43.3	177.9	-172.6	58.9	-155.1	0	0	111.4	T42 L46 L47 I48	T42-E44 PolarHBondContact O-N 2.72Å; T42-E44 PolarHBondContact OG1-N 3.17Å; E44-L46 VanDerWaalsContact C-N 3.31Å; E44-L46 PolarHBondContact O-N 3.4Å; E44-L47 WeakPolarHBondContact O-CB 3.45Å; E44-L47 PolarHBondContact O-N 3.03Å; E44-L47 VanDerWaalsContact O-N 3.11Å; E44-I48 WeakPolarHBondContact O-CG1 3.31Å; E44-I48 PolarHBondContact O-N 2.96Å
45	H	94.1	Very high	91.2	Very high	47 Å²	47	67.3 Å²	67.3	22%	0.218	33%	0.326	C	S	.	.	H	α-helix	trans	-62.4	-38.1	177.1	-59.4	151.4	0	0	0	112.6	S40 I41 T42 R43 L47 I48 V49 L112	S40-H45 PolarHBondContact O-CE1 3.13Å; S40-H45 PolarHBondContact O-ND1 3.07Å; I41-H45 HydrophobicContact CG2-CB 4.26Å; T42-H45 PolarHBondContact N-ND1 3.42Å; T42-H45 PolarHBondContact O-N 2.84Å; R43-H45 VanDerWaalsContact C-N 3.33Å; R43-H45 PolarHBondContact O-N 3.34Å; H45-L47 VanDerWaalsContact C-N 3.34Å; H45-I48 WeakPolarHBondContact O-CB 3.37Å; H45-I48 PolarHBondContact O-N 2.79Å; H45-V49 PolarHBondContact O-N 2.71Å; H45-L112 HydrophobicContact CB-CD2 3.69Å; H45-L112 WeakPolarHBondContact ND1-CD1 3.34Å
46	L	95.5	Very high	92.7	Very high	21 Å²	21	67.7 Å²	67.7	11%	0.11	32%	0.321	C	S	.	.	H	α-helix	trans	-69.9	-32.7	175.7	-60.6	178.7	0	0	0	111.9	I41 T42 R43 E44 I48 V49 R50 L155 W159	I41-L46 HydrophobicContact CG2-CD2 4.29Å; I41-L46 HydrophobicContact CG2-CG 4.28Å; T42-L46 PolarHBondContact O-N 3.48Å; R43-L46 PolarHBondContact O-N 2.84Å; E44-L46 VanDerWaalsContact C-N 3.31Å; E44-L46 PolarHBondContact O-N 3.4Å; L46-I48 VanDerWaalsContact C-N 3.35Å; L46-V49 PolarHBondContact O-N 3.23Å; L46-R50 PolarHBondContact O-N 3.08Å; L46-L155 HydrophobicContact CD2-CB 3.79Å; L46-W159 HydrophobicContact CD1-CD2 4.25Å; L46-W159 HydrophobicContact CD1-CE3 3.83Å; L46-W159 HydrophobicContact CD1-CZ3 4.29Å
47	L	96.8	Very high	93.3	Very high	74 Å²	74	69.9 Å²	69.9	39%	0.387	33%	0.327	S	S	.	.	H	α-helix	trans	-65.3	-37.5	172.9	-71	175.9	0	0	0	111.8	R43 E44 H45 V49 R50 Q51	R43-L47 WeakPolarHBondContact O-CG 3.31Å; R43-L47 PolarHBondContact O-N 3.46Å; E44-L47 WeakPolarHBondContact O-CB 3.45Å; E44-L47 PolarHBondContact O-N 3.03Å; E44-L47 VanDerWaalsContact O-N 3.11Å; H45-L47 VanDerWaalsContact C-N 3.34Å; L47-V49 VanDerWaalsContact C-N 3.29Å; L47-V49 PolarHBondContact O-N 3.32Å; L47-R50 PolarHBondContact O-N 3.18Å; L47-R50 VanDerWaalsContact O-N 3.15Å; L47-Q51 WeakPolarHBondContact O-CG 3.46Å; L47-Q51 PolarHBondContact O-N 3.43Å
48	I	97.6	Very high	92.9	Very high	13 Å²	13	81 Å²	81	7%	0.067	37%	0.366	C	S	.	.	H	α-helix	trans	-58	-42.8	174.7	-67.6	171.5	0	0	0	111	E44 H45 L46 Q51 L52 Y105 L109	E44-I48 WeakPolarHBondContact O-CG1 3.31Å; E44-I48 PolarHBondContact O-N 2.96Å; H45-I48 WeakPolarHBondContact O-CB 3.37Å; H45-I48 PolarHBondContact O-N 2.79Å; L46-I48 VanDerWaalsContact C-N 3.35Å; I48-Q51 PolarHBondContact O-N 3.37Å; I48-L52 PolarHBondContact O-N 3.29Å; I48-Y105 HydrophobicContact CG1-CD1 4.34Å; I48-Y105 HydrophobicContact CG2-CD1 3.89Å; I48-Y105 HydrophobicContact CG2-CG 3.92Å; I48-L109 HydrophobicContact CB-CD2 4.4Å; I48-L109 HydrophobicContact CG2-CD1 4.16Å; I48-L109 HydrophobicContact CG2-CD2 4.06Å; I48-L109 HydrophobicContact CG2-CG 3.84Å
49	V	97.7	Very high	92.6	Very high	0 Å²	0	79.7 Å²	79.7	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-63.1	-44.5	176.2	-173.8	0	0	0	0	111	H45 L46 L47 Q51 L52 M53 L109 V151 L155	H45-V49 PolarHBondContact O-N 2.71Å; L46-V49 PolarHBondContact O-N 3.23Å; L47-V49 VanDerWaalsContact C-N 3.29Å; L47-V49 PolarHBondContact O-N 3.32Å; V49-Q51 VanDerWaalsContact C-N 3.35Å; V49-Q51 PolarHBondContact O-N 3.46Å; V49-L52 WeakPolarHBondContact O-CB 3.45Å; V49-L52 PolarHBondContact O-N 2.96Å; V49-M53 HydrophobicContact CG1-SD 4.21Å; V49-M53 VanDerWaalsContact O-CG 3.31Å; V49-M53 WeakPolarHBondContact O-CG 3.42Å; V49-M53 PolarHBondContact O-N 3.32Å; V49-L109 HydrophobicContact CG2-CD1 3.93Å; V49-L109 HydrophobicContact CG2-CD2 3.71Å; V49-L109 HydrophobicContact CG2-CG 4.5Å; V49-V151 HydrophobicContact CG1-CG1 4.48Å; V49-V151 HydrophobicContact CG2-CG1 4.42Å; V49-L155 HydrophobicContact CG2-CD1 3.9Å
50	R	97.6	Very high	92.4	Very high	151 Å²	151	75.3 Å²	75.3	57%	0.57	37%	0.371	S	S	*	.	H	α-helix	trans	-61	-42.1	176.2	-72.8	-174.5	-177.5	175.4	-0	112.4	L46 L47 L52 M53 D54	L46-R50 PolarHBondContact O-N 3.08Å; L47-R50 PolarHBondContact O-N 3.18Å; L47-R50 VanDerWaalsContact O-N 3.15Å; R50-L52 VanDerWaalsContact C-N 3.32Å; R50-L52 PolarHBondContact O-N 3.36Å; R50-M53 WeakPolarHBondContact O-CA 3.06Å; R50-M53 WeakPolarHBondContact O-CB 3.49Å; R50-M53 PolarHBondContact O-N 3.45Å; R50-M53 VanDerWaalsContact O-N 3.09Å; R50-D54 PolarHBondContact O-N 2.75Å
51	Q	98	Very high	92.3	Very high	66 Å²	66	80.1 Å²	80.1	31%	0.308	40%	0.403	S	S	.	.	H	α-helix	trans	-61.9	-41.3	176.5	-73.1	170.1	-16	0	0	111.4	L47 I48 V49 M53 D54 N55 Y105	L47-Q51 WeakPolarHBondContact O-CG 3.46Å; L47-Q51 PolarHBondContact O-N 3.43Å; I48-Q51 PolarHBondContact O-N 3.37Å; V49-Q51 VanDerWaalsContact C-N 3.35Å; V49-Q51 PolarHBondContact O-N 3.46Å; Q51-M53 VanDerWaalsContact C-N 3.33Å; Q51-M53 PolarHBondContact O-N 2.93Å; Q51-D54 PolarHBondContact O-N 3.46Å; Q51-N55 WeakPolarHBondContact O-CB 3.4Å; Q51-N55 PolarHBondContact O-N 2.71Å; Q51-N55 VanDerWaalsContact O-N 3.08Å; Q51-N55 PolarHBondContact O-ND2 2.8Å; Q51-Y105 HydrophobicContact CB-CD2 4.23Å; Q51-Y105 HydrophobicContact CB-CE2 3.67Å; Q51-Y105 PolarHBondContact OE1-OH 3.46Å
52	L	97.1	Very high	92.5	Very high	0 Å²	0	83.4 Å²	83.4	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-61.6	-41.2	172.1	-78.9	172.7	0	0	0	111.9	I48 V49 R50 N55 Q56 Y96 N102 Y105 V106 L109 L148	I48-L52 PolarHBondContact O-N 3.29Å; V49-L52 WeakPolarHBondContact O-CB 3.45Å; V49-L52 PolarHBondContact O-N 2.96Å; R50-L52 VanDerWaalsContact C-N 3.32Å; R50-L52 PolarHBondContact O-N 3.36Å; L52-N55 PolarHBondContact O-N 3.19Å; L52-Q56 WeakPolarHBondContact O-CG 3.46Å; L52-Q56 PolarHBondContact O-N 3.5Å; L52-Q56 PolarHBondContact O-NE2 3.35Å; L52-Y96 HydrophobicContact CD2-CE2 4.01Å; L52-N102 HydrophobicContact CD2-CB 4.1Å; L52-Y105 HydrophobicContact CD2-CD2 4.06Å; L52-Y105 HydrophobicContact CD2-CG 4.49Å; L52-Y105 HydrophobicContact CG-CD2 4.1Å; L52-Y105 HydrophobicContact CG-CG 4.35Å; L52-V106 HydrophobicContact CD1-CG2 4.05Å; L52-V106 HydrophobicContact CD2-CG2 4.18Å; L52-L109 HydrophobicContact CD1-CD1 3.59Å; L52-L148 HydrophobicContact CB-CD1 3.9Å; L52-L148 HydrophobicContact CB-CD2 4.32Å; L52-L148 HydrophobicContact CD1-CD2 4.43Å
53	M	96.7	Very high	92.8	Very high	34 Å²	34	82.2 Å²	82.2	17%	0.167	42%	0.418	C	S	.	.	H	α-helix	trans	-63	-47.4	177	-69.9	168.7	54.7	0	0	112.1	V49 R50 Q51 N55 Q56 L145 L148 Q149	V49-M53 HydrophobicContact CG1-SD 4.21Å; V49-M53 VanDerWaalsContact O-CG 3.31Å; V49-M53 WeakPolarHBondContact O-CG 3.42Å; V49-M53 PolarHBondContact O-N 3.32Å; R50-M53 WeakPolarHBondContact O-CA 3.06Å; R50-M53 WeakPolarHBondContact O-CB 3.49Å; R50-M53 PolarHBondContact O-N 3.45Å; R50-M53 VanDerWaalsContact O-N 3.09Å; Q51-M53 VanDerWaalsContact C-N 3.33Å; Q51-M53 PolarHBondContact O-N 2.93Å; M53-N55 PolarHBondContact O-N 3.2Å; M53-Q56 WeakPolarHBondContact O-CB 3.17Å; M53-Q56 PolarHBondContact O-N 2.67Å; M53-L145 HydrophobicContact CB-CD1 3.6Å; M53-L145 HydrophobicContact CE-CD1 3.92Å; M53-L145 HydrophobicContact CG-CD1 3.9Å; M53-L148 HydrophobicContact CG-CB 3.56Å; M53-L148 HydrophobicContact CG-CD1 4.12Å; M53-L148 HydrophobicContact CG-CG 4.48Å; M53-Q149 HydrophobicContact CE-CG 3.57Å; M53-Q149 HydrophobicContact SD-CG 4.34Å
54	D	96.7	Very high	93.2	Very high	131 Å²	131	76.3 Å²	76.3	70%	0.701	40%	0.403	S	S	*	.	H	α-helix	trans	-64.9	-28.4	-179.3	-69.3	-23.9	0	0	0	112	R50 Q51 Q56	R50-D54 PolarHBondContact O-N 2.75Å; Q51-D54 PolarHBondContact O-N 3.46Å; D54-Q56 VanDerWaalsContact C-N 3.29Å; D54-Q56 PolarHBondContact O-N 3Å
55	N	94.9	Very high	93.4	Very high	86 Å²	86	71.8 Å²	71.8	46%	0.46	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-2.2	176.2	-69	-15	0	0	0	113.6	Q51 L52 M53 N102	Q51-N55 WeakPolarHBondContact O-CB 3.4Å; Q51-N55 PolarHBondContact O-N 2.71Å; Q51-N55 VanDerWaalsContact O-N 3.08Å; Q51-N55 PolarHBondContact O-ND2 2.8Å; L52-N55 PolarHBondContact O-N 3.19Å; M53-N55 PolarHBondContact O-N 3.2Å; N55-N102 PolarHBondContact ND2-OD1 2.71Å
56	Q	93.4	Very high	93.6	Very high	32 Å²	32	71.4 Å²	71.4	15%	0.15	38%	0.382	C	S	.	.	S	Bend	trans	-77.5	144.8	174.5	-59	-49.9	-60.4	0	0	111.8	L52 M53 D54 R58 Y96 P144 L145 L148	L52-Q56 WeakPolarHBondContact O-CG 3.46Å; L52-Q56 PolarHBondContact O-N 3.5Å; L52-Q56 PolarHBondContact O-NE2 3.35Å; M53-Q56 WeakPolarHBondContact O-CB 3.17Å; M53-Q56 PolarHBondContact O-N 2.67Å; D54-Q56 VanDerWaalsContact C-N 3.29Å; D54-Q56 PolarHBondContact O-N 3Å; Q56-R58 PolarHBondContact O-N 2.68Å; Q56-Y96 PolarHBondContact NE2-OH 2.81Å; Q56-P144 HydrophobicContact CG-CB 4.48Å; Q56-L145 HydrophobicContact CB-CB 4.47Å; Q56-L148 HydrophobicContact CG-CD1 3.78Å
57	L	88.8	Confident	93.7	Very high	144 Å²	144	70.4 Å²	70.4	75%	0.754	38%	0.377	S	S	*	.			trans	-64.6	127.6	169.2	-68.2	173.1	0	0	0	109.9	S59	L57-S59 PolarHBondContact O-N 3.31Å
58	R	81.5	Confident	93.6	Very high	250 Å²	250	67 Å²	67	94%	0.943	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-27.3	179.2	-67.6	-178.1	179.2	-98.5	-2.9	113.5	Q56	Q56-R58 PolarHBondContact O-N 2.68Å
59	S	80.2	Confident	93.5	Very high	117 Å²	117	68.8 Å²	68.8	82%	0.818	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.3	63.7	-179.9	60.9	0	0	0	0	110.6	L57	L57-S59 PolarHBondContact O-N 3.31Å
60	G	81.8	Confident	93.3	Very high	44 Å²	44	72 Å²	72	45%	0.454	38%	0.382	S	S	.	.			trans	-92.5	-178.1	178.9	0	0	0	0	0	114.3
61	C	87.8	Confident	93	Very high	115 Å²	115	71.1 Å²	71.1	78%	0.777	38%	0.379	S	S	*	.			trans	-70.5	152.1	168.7	-66.2	0	0	0	0	110.9	P144	C61-P144 WeakPolarHBondContact O-CD 3.38Å
62	S	95	Very high	92.7	Very high	72 Å²	72	71.6 Å²	71.6	50%	0.503	39%	0.386	S	S	.	.			trans	-78	145.7	170.3	-51	0	0	0	0	111.4	G142	S62-G142 CarbonylContact C-O 3.44Å; S62-G142 WeakPolarHBondContact CA-O 3.39Å; S62-G142 WeakPolarHBondContact CB-O 3.21Å
63	I	95.8	Very high	92.6	Very high	32 Å²	32	71.8 Å²	71.8	16%	0.164	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	154	168.1	56.5	166.7	0	0	0	109.8	Y65 L89 H93 F94 R141 G142 P144 A147	I63-Y65 HydrophobicContact CD1-CD1 3.82Å; I63-Y65 HydrophobicContact CD1-CE1 4.21Å; I63-Y65 HydrophobicContact CG1-CD1 3.83Å; I63-Y65 HydrophobicContact CG1-CE1 4.14Å; I63-L89 HydrophobicContact CD1-CD1 4.31Å; I63-H93 HydrophobicContact CD1-CB 4.25Å; I63-F94 HydrophobicContact CD1-CZ 4.49Å; I63-R141 WeakPolarHBondContact O-CA 3.41Å; I63-G142 PolarHBondContact N-O 3.33Å; I63-G142 PolarHBondContact O-N 2.87Å; I63-P144 HydrophobicContact CG2-CG 4.25Å; I63-A147 HydrophobicContact CD1-CB 3.84Å
64	T	97.8	Very high	92.6	Very high	66 Å²	66	72 Å²	72	41%	0.405	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.2	171.3	-55	0	0	0	0	108.1	H93 V139 Y140 R141	T64-H93 PolarHBondContact O-CE1 3.35Å; T64-H93 PolarHBondContact O-NE2 2.04Å; T64-V139 HydrophobicContact CG2-CG1 3.67Å; T64-Y140 CarbonylContact C-O 3.57Å; T64-Y140 WeakPolarHBondContact CA-O 3.37Å; T64-R141 PolarHBondContact OG1-NH1 2.97Å
65	Y	97.2	Very high	92.6	Very high	12 Å²	12	69.6 Å²	69.6	5%	0.047	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	150.6	-175.6	62.6	-82.3	0	0	0	110.5	I63 F67 L89 Y140 A147 R150	I63-Y65 HydrophobicContact CD1-CD1 3.82Å; I63-Y65 HydrophobicContact CD1-CE1 4.21Å; I63-Y65 HydrophobicContact CG1-CD1 3.83Å; I63-Y65 HydrophobicContact CG1-CE1 4.14Å; Y65-F67 HydrophobicContact CD2-CB 4.1Å; Y65-F67 HydrophobicContact CE2-CB 4Å; Y65-F67 HydrophobicContact CE2-CG 4.47Å; Y65-L89 HydrophobicContact CD2-CD1 4.12Å; Y65-L89 HydrophobicContact CG-CD1 3.93Å; Y65-Y140 HydrophobicContact CD2-CD2 4.5Å; Y65-Y140 AromaticContact CE2-CD2 3.95Å; Y65-Y140 HydrophobicContact CE2-CD2 3.95Å; Y65-Y140 HydrophobicContact CE2-CG 4.17Å; Y65-Y140 PolarHBondContact N-O 3.4Å; Y65-Y140 PolarHBondContact O-N 3.17Å; Y65-A147 HydrophobicContact CD1-CB 4.2Å; Y65-A147 HydrophobicContact CE1-CB 3.62Å; Y65-A147 HydrophobicContact CE2-CB 4.05Å; Y65-A147 WeakPolarHBondContact OH-CA 3.17Å; Y65-R150 WeakPolarHBondContact OH-CD 2.94Å; Y65-R150 PolarHBondContact OH-NE 3.49Å
66	T	97.1	Very high	92.6	Very high	39 Å²	39	66.4 Å²	66.4	24%	0.239	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	140.7	172.5	-56.8	0	0	0	0	109.7	W85 E137 A138	T66-W85 HydrophobicContact CG2-CD2 4.23Å; T66-W85 HydrophobicContact CG2-CE3 4.04Å; T66-W85 HydrophobicContact CG2-CH2 3.69Å; T66-W85 HydrophobicContact CG2-CZ2 3.89Å; T66-W85 HydrophobicContact CG2-CZ3 3.78Å; T66-E137 HydrophobicContact CG2-CB 3.93Å; T66-E137 HydrophobicContact CG2-CG 4.23Å; T66-A138 WeakPolarHBondContact CA-O 3.48Å
67	F	97.4	Very high	92.8	Very high	1 Å²	1	65 Å²	65	0%	0.004	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	163.9	175.6	-150.3	-100.4	0	0	0	111	Y65 A82 W85 I86 A138 Y140 R150 V154	Y65-F67 HydrophobicContact CD2-CB 4.1Å; Y65-F67 HydrophobicContact CE2-CB 4Å; Y65-F67 HydrophobicContact CE2-CG 4.47Å; F67-A82 HydrophobicContact CE1-CB 4.23Å; F67-A82 HydrophobicContact CZ-CB 4.29Å; F67-W85 HydrophobicContact CD2-CB 3.91Å; F67-W85 HydrophobicContact CE2-CB 4.19Å; F67-I86 HydrophobicContact CE2-CG1 3.58Å; F67-I86 HydrophobicContact CZ-CD1 4.17Å; F67-I86 HydrophobicContact CZ-CG1 3.57Å; F67-A138 PolarHBondContact N-O 3.44Å; F67-A138 PolarHBondContact O-N 3.25Å; F67-Y140 HydrophobicContact CB-CD2 3.78Å; F67-Y140 HydrophobicContact CB-CE2 3.81Å; F67-R150 HydrophobicContact CD1-CB 4.13Å; F67-R150 HydrophobicContact CE1-CB 3.79Å; F67-R150 HydrophobicContact CZ-CB 4.09Å; F67-V154 HydrophobicContact CE1-CG2 3.92Å; F67-V154 HydrophobicContact CZ-CG2 3.99Å
68	I	96.4	Very high	93.2	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	135.1	177.8	-61.6	-62.6	0	0	0	111	L73 F78 A81 A82 F136 E137	I68-L73 HydrophobicContact CG2-CD1 3.91Å; I68-F78 HydrophobicContact CB-CE2 4.46Å; I68-F78 HydrophobicContact CG2-CD2 3.85Å; I68-F78 HydrophobicContact CG2-CE2 4.13Å; I68-A81 HydrophobicContact CD1-CB 4.12Å; I68-A81 HydrophobicContact CG1-CB 3.86Å; I68-A81 WeakPolarHBondContact CG1-O 3.28Å; I68-A81 HydrophobicContact CG2-CB 4.04Å; I68-A82 HydrophobicContact CB-CB 4.16Å; I68-A82 HydrophobicContact CG1-CB 4.37Å; I68-F136 WeakPolarHBondContact CA-O 3.32Å; I68-F136 HydrophobicContact CD1-CB 4.39Å; I68-F136 HydrophobicContact CG2-CB 4.08Å; I68-E137 HydrophobicContact CD1-CG 3.7Å
69	E	94.4	Very high	94	Very high	52 Å²	52	46.3 Å²	46.3	24%	0.243	27%	0.273	C	S	.	.			trans	-89.5	132.4	164	-73.7	-173.3	154.4	0	0	110.9	R71 F136 A138 Y140	E69-R71 HydrophobicContact CB-CG 3.75Å; E69-R71 PolarHBondContact O-N 3.17Å; E69-R71 IonicContact OE2-CZ 3.62Å; E69-R71 IonicContact OE2-NE 2.74Å; E69-R71 PolarHBondContact OE2-NE 3.46Å; E69-R71 IonicContact OE2-NH2 3.2Å; E69-R71 PolarHBondContact OE2-NH2 3.08Å; E69-F136 PolarHBondContact N-O 2.82Å; E69-A138 HydrophobicContact CG-CB 3.88Å; E69-Y140 VanDerWaalsContact CD-OH 3.24Å; E69-Y140 WeakPolarHBondContact CG-OH 2.89Å; E69-Y140 PolarHBondContact OE1-OH 3.08Å
70	Q	93.6	Very high	94.8	Very high	68 Å²	68	41 Å²	41	32%	0.318	24%	0.235	S	C	.	.			trans	-60.7	-46.2	178.3	-175.1	173.2	-0.8	0	0	111.7	T72 L73 F78	Q70-T72 PolarHBondContact O-N 2.99Å; Q70-T72 VanDerWaalsContact O-N 3.07Å; Q70-L73 WeakPolarHBondContact O-CA 3.17Å; Q70-L73 WeakPolarHBondContact O-CB 3.26Å; Q70-L73 WeakPolarHBondContact O-CG 3.43Å; Q70-L73 PolarHBondContact O-N 3.33Å; Q70-F78 HydrophobicContact CB-CD1 4.4Å; Q70-F78 HydrophobicContact CB-CD2 3.73Å; Q70-F78 HydrophobicContact CB-CE2 3.93Å; Q70-F78 HydrophobicContact CB-CG 3.98Å; Q70-F78 HydrophobicContact CB-CZ 4.34Å; Q70-F78 HydrophobicContact CG-CB 4.07Å; Q70-F78 HydrophobicContact CG-CD1 4.31Å; Q70-F78 HydrophobicContact CG-CD2 4.16Å; Q70-F78 HydrophobicContact CG-CG 3.92Å
71	R	91.4	Very high	95.6	Very high	131 Å²	131	39 Å²	39	49%	0.494	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	42.8	-114.3	-178.2	-58.5	-173.1	176.8	-172.2	1	112.1	E69 F136	E69-R71 HydrophobicContact CB-CG 3.75Å; E69-R71 PolarHBondContact O-N 3.17Å; E69-R71 IonicContact OE2-CZ 3.62Å; E69-R71 IonicContact OE2-NE 2.74Å; E69-R71 PolarHBondContact OE2-NE 3.46Å; E69-R71 IonicContact OE2-NH2 3.2Å; E69-R71 PolarHBondContact OE2-NH2 3.08Å; R71-F136 HydrophobicContact CB-CD1 4.2Å; R71-F136 HydrophobicContact CB-CE1 4.29Å
72	T	92	Very high	96	Very high	76 Å²	76	33.5 Å²	33.5	47%	0.466	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-5.1	178.8	57.5	0	0	0	0	113.6	Q70 S74 F181	Q70-T72 PolarHBondContact O-N 2.99Å; Q70-T72 VanDerWaalsContact O-N 3.07Å; T72-S74 PolarHBondContact O-N 3.24Å; T72-F181 HydrophobicContact CG2-CE1 3.82Å; T72-F181 HydrophobicContact CG2-CE2 4.45Å; T72-F181 HydrophobicContact CG2-CZ 3.49Å; T72-F181 VanDerWaalsContact CG2-CZ 3.49Å; T72-F181 VanDerWaalsContact OG1-CE2 3.29Å; T72-F181 WeakPolarHBondContact OG1-CE2 3.24Å; T72-F181 WeakPolarHBondContact OG1-CZ 3.33Å
73	L	94.9	Very high	96.2	Very high	4 Å²	4	30 Å²	30	2%	0.021	15%	0.153	C	C	.	.			trans	-61.1	133.7	179.8	-63.8	174.8	0	0	0	110.5	I68 Q70 C77 F78 F136 E176 Y177	I68-L73 HydrophobicContact CG2-CD1 3.91Å; Q70-L73 WeakPolarHBondContact O-CA 3.17Å; Q70-L73 WeakPolarHBondContact O-CB 3.26Å; Q70-L73 WeakPolarHBondContact O-CG 3.43Å; Q70-L73 PolarHBondContact O-N 3.33Å; L73-C77 HydrophobicContact CB-CB 4.49Å; L73-C77 HydrophobicContact CD2-CB 4.17Å; L73-F78 HydrophobicContact CB-CB 4.08Å; L73-F78 HydrophobicContact CD1-CB 4.44Å; L73-F136 HydrophobicContact CD1-CB 4.17Å; L73-F136 HydrophobicContact CD1-CD1 3.77Å; L73-F136 HydrophobicContact CD1-CD2 4.24Å; L73-F136 HydrophobicContact CD1-CE1 4.19Å; L73-F136 HydrophobicContact CD1-CG 3.8Å; L73-F136 HydrophobicContact CD2-CD1 4.14Å; L73-F136 HydrophobicContact CD2-CD2 4.14Å; L73-F136 HydrophobicContact CD2-CE1 3.72Å; L73-F136 HydrophobicContact CD2-CE2 3.73Å; L73-F136 HydrophobicContact CD2-CG 4.32Å; L73-F136 HydrophobicContact CD2-CZ 3.48Å; L73-F136 VanDerWaalsContact CD2-CZ 3.48Å; L73-F136 HydrophobicContact CG-CD1 3.65Å; L73-F136 HydrophobicContact CG-CD2 4.4Å; L73-F136 HydrophobicContact CG-CE1 3.54Å; L73-F136 HydrophobicContact CG-CE2 4.32Å; L73-F136 HydrophobicContact CG-CG 4.08Å; L73-F136 HydrophobicContact CG-CZ 3.88Å; L73-E176 WeakPolarHBondContact CA-OE2 3.44Å; L73-E176 HydrophobicContact CD2-CB 3.97Å; L73-Y177 HydrophobicContact CD2-CD1 3.86Å; L73-Y177 HydrophobicContact CD2-CE1 3.85Å
74	S	96.3	Very high	96.2	Very high	39 Å²	39	30.9 Å²	30.9	27%	0.273	16%	0.16	S	C	.	.			trans	-58	155.3	164.3	67.3	0	0	0	0	110.2	T72 C76 C77 F78 E176	T72-S74 PolarHBondContact O-N 3.24Å; S74-C76 PolarHBondContact O-N 3.3Å; S74-C76 VanDerWaalsContact O-N 3.17Å; S74-C76 PolarHBondContact OG-SG 3.23Å; S74-C77 PolarHBondContact O-N 3.2Å; S74-C77 VanDerWaalsContact O-N 3.12Å; S74-C77 WeakPolarHBondContact OG-CB 3.49Å; S74-C77 PolarHBondContact OG-N 2.79Å; S74-C77 PolarHBondContact OG-SG 3.49Å; S74-C77 VanDerWaalsContact OG-SG 3.36Å; S74-F78 WeakPolarHBondContact O-CB 3.43Å; S74-F78 PolarHBondContact O-N 3.45Å; S74-E176 WeakPolarHBondContact CB-OE1 3.21Å; S74-E176 PolarHBondContact N-OE2 3.11Å; S74-E176 VanDerWaalsContact OG-CD 3.3Å; S74-E176 PolarHBondContact OG-OE1 3.11Å; S74-E176 PolarHBondContact OG-OE2 2.93Å; S74-E176 VanDerWaalsContact OG-OE2 3.09Å
75	K	97	Very high	96.2	Very high	81 Å²	81	29.4 Å²	29.4	35%	0.352	15%	0.147	S	C	.	.	H	α-helix	trans	-53.5	-40.1	-178.8	-72	-174.2	-179.1	-169	0	112.2	V79 V157 E160 L161	K75-V79 VanDerWaalsContact O-CG2 3.3Å; K75-V79 WeakPolarHBondContact O-CG2 3.01Å; K75-V79 PolarHBondContact O-N 3.23Å; K75-V79 VanDerWaalsContact O-N 3.15Å; K75-V157 HydrophobicContact CB-CG1 3.69Å; K75-V157 HydrophobicContact CD-CG1 4.2Å; K75-V157 HydrophobicContact CG-CG1 3.96Å; K75-E160 IonicContact NZ-OE1 2.71Å; K75-E160 PolarHBondContact NZ-OE1 2.65Å; K75-E160 IonicContact NZ-OE2 2.74Å; K75-E160 PolarHBondContact NZ-OE2 3.09Å; K75-L161 HydrophobicContact CB-CD1 4.06Å; K75-L161 HydrophobicContact CB-CD2 3.91Å; K75-L161 HydrophobicContact CB-CG 4.17Å
76	C	95.9	Very high	96.3	Very high	19 Å²	19	28.8 Å²	28.8	13%	0.128	15%	0.145	C	C	.	.	H	α-helix	trans	-70.3	-43.9	179.2	55.8	0	0	0	0	111.7	S74 F78 V79 K80 L161 V169 D170 W171	S74-C76 PolarHBondContact O-N 3.3Å; S74-C76 VanDerWaalsContact O-N 3.17Å; S74-C76 PolarHBondContact OG-SG 3.23Å; C76-F78 PolarHBondContact O-N 3.13Å; C76-V79 PolarHBondContact O-N 3.32Å; C76-K80 WeakPolarHBondContact O-CB 2.86Å; C76-K80 PolarHBondContact O-N 2.95Å; C76-L161 HydrophobicContact CB-CD1 4.17Å; C76-V169 HydrophobicContact CB-CG1 3.67Å; C76-D170 PolarHBondContact SG-O 3.07Å; C76-W171 HydrophobicContact CB-CE3 3.76Å; C76-W171 HydrophobicContact CB-CH2 4.46Å; C76-W171 HydrophobicContact CB-CZ3 3.75Å; C76-W171 VanDerWaalsContact O-CZ3 3.24Å; C76-W171 WeakPolarHBondContact O-CZ3 3.29Å
77	C	96.5	Very high	96.3	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-69.8	-32.8	179.7	-63.9	0	0	0	0	113.2	L73 S74 A81 C173 E176 Y177	L73-C77 HydrophobicContact CB-CB 4.49Å; L73-C77 HydrophobicContact CD2-CB 4.17Å; S74-C77 PolarHBondContact O-N 3.2Å; S74-C77 VanDerWaalsContact O-N 3.12Å; S74-C77 WeakPolarHBondContact OG-CB 3.49Å; S74-C77 PolarHBondContact OG-N 2.79Å; S74-C77 PolarHBondContact OG-SG 3.49Å; S74-C77 VanDerWaalsContact OG-SG 3.36Å; C77-A81 VanDerWaalsContact O-CB 3.26Å; C77-A81 WeakPolarHBondContact O-CB 3.26Å; C77-A81 PolarHBondContact O-N 3.23Å; C77-C173 WeakPolarHBondContact CA-SG 3.3Å; C77-C173 HydrophobicContact CB-CB 3.78Å; C77-C173 WeakPolarHBondContact CB-SG 3.39Å; C77-C173 WeakPolarHBondContact SG-CA 3.38Å; C77-C173 WeakPolarHBondContact SG-CB 3.36Å; C77-C173 CovalentContact SG-SG 2.04Å; C77-C173 PolarHBondContact SG-SG 3.45Å; C77-E176 WeakPolarHBondContact CB-OE2 3.4Å; C77-Y177 HydrophobicContact CB-CE1 3.9Å; C77-Y177 PolarHBondContact O-OH 3.13Å
78	F	97.9	Very high	96.4	Very high	3 Å²	3	33.4 Å²	33.4	1%	0.013	17%	0.165	C	C	.	.	H	α-helix	trans	-60.4	-51.5	169.1	172.5	-121.2	0	0	0	112	I68 Q70 L73 S74 C76 K80 A81 A82 V154 V157	I68-F78 HydrophobicContact CB-CE2 4.46Å; I68-F78 HydrophobicContact CG2-CD2 3.85Å; I68-F78 HydrophobicContact CG2-CE2 4.13Å; Q70-F78 HydrophobicContact CB-CD1 4.4Å; Q70-F78 HydrophobicContact CB-CD2 3.73Å; Q70-F78 HydrophobicContact CB-CE2 3.93Å; Q70-F78 HydrophobicContact CB-CG 3.98Å; Q70-F78 HydrophobicContact CB-CZ 4.34Å; Q70-F78 HydrophobicContact CG-CB 4.07Å; Q70-F78 HydrophobicContact CG-CD1 4.31Å; Q70-F78 HydrophobicContact CG-CD2 4.16Å; Q70-F78 HydrophobicContact CG-CG 3.92Å; L73-F78 HydrophobicContact CB-CB 4.08Å; L73-F78 HydrophobicContact CD1-CB 4.44Å; S74-F78 WeakPolarHBondContact O-CB 3.43Å; S74-F78 PolarHBondContact O-N 3.45Å; C76-F78 PolarHBondContact O-N 3.13Å; F78-K80 PolarHBondContact O-N 3.33Å; F78-A81 PolarHBondContact O-N 3.42Å; F78-A82 HydrophobicContact CE2-CB 4.38Å; F78-A82 VanDerWaalsContact O-CB 3.24Å; F78-A82 WeakPolarHBondContact O-CB 3.45Å; F78-A82 PolarHBondContact O-N 3.03Å; F78-V154 HydrophobicContact CE1-CG2 3.7Å; F78-V154 HydrophobicContact CE2-CG2 4.37Å; F78-V154 HydrophobicContact CZ-CG2 3.55Å; F78-V157 HydrophobicContact CE1-CG2 4.5Å
79	V	97.9	Very high	96.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.4	-47.2	178.4	168.1	0	0	0	0	111.2	K75 C76 A81 A82 L83 V154 V157 Y158 L161 W171	K75-V79 VanDerWaalsContact O-CG2 3.3Å; K75-V79 WeakPolarHBondContact O-CG2 3.01Å; K75-V79 PolarHBondContact O-N 3.23Å; K75-V79 VanDerWaalsContact O-N 3.15Å; C76-V79 PolarHBondContact O-N 3.32Å; V79-A81 VanDerWaalsContact C-N 3.31Å; V79-A81 PolarHBondContact O-N 3.16Å; V79-A82 PolarHBondContact O-N 3.18Å; V79-L83 HydrophobicContact CG1-CD1 3.91Å; V79-L83 HydrophobicContact CG1-CG 4.19Å; V79-L83 WeakPolarHBondContact O-CG 3.24Å; V79-L83 PolarHBondContact O-N 2.79Å; V79-L83 VanDerWaalsContact O-N 3.08Å; V79-V154 HydrophobicContact CG1-CG1 4.44Å; V79-V154 HydrophobicContact CG2-CG1 4.26Å; V79-V157 HydrophobicContact CG2-CB 4.01Å; V79-V157 HydrophobicContact CG2-CG1 3.67Å; V79-Y158 HydrophobicContact CG1-CD2 3.97Å; V79-Y158 HydrophobicContact CG1-CG 4.38Å; V79-L161 HydrophobicContact CG2-CD1 4.22Å; V79-W171 HydrophobicContact CB-CZ3 4.36Å; V79-W171 HydrophobicContact CG1-CH2 4.27Å; V79-W171 HydrophobicContact CG1-CZ3 4.3Å
80	K	97.4	Very high	96.6	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-59.4	-42.1	180	-176	180	-179.7	-177.2	0	111.8	C76 F78 P84 V122 P123 I125 E130 W171	C76-K80 WeakPolarHBondContact O-CB 2.86Å; C76-K80 PolarHBondContact O-N 2.95Å; F78-K80 PolarHBondContact O-N 3.33Å; K80-P84 WeakPolarHBondContact O-CD 3.39Å; K80-V122 HydrophobicContact CB-CG1 4.15Å; K80-V122 HydrophobicContact CG-CG1 4.18Å; K80-P123 HydrophobicContact CD-CG 4.39Å; K80-I125 HydrophobicContact CG-CG1 4.36Å; K80-E130 WeakPolarHBondContact CE-OE2 3.42Å; K80-E130 IonicContact NZ-OE1 3.34Å; K80-E130 PolarHBondContact NZ-OE1 2.8Å; K80-E130 IonicContact NZ-OE2 2.82Å; K80-E130 PolarHBondContact NZ-OE2 3.08Å; K80-W171 HydrophobicContact CB-CE3 4.12Å; K80-W171 HydrophobicContact CB-CZ3 4.29Å; K80-W171 PolarHBondContact NZ-O 3.03Å
81	A	96.9	Very high	96.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-71	-36.7	177.3	0	0	0	0	0	112.8	I68 C77 F78 V79 P84 P133 Y177	I68-A81 HydrophobicContact CD1-CB 4.12Å; I68-A81 HydrophobicContact CG1-CB 3.86Å; I68-A81 WeakPolarHBondContact CG1-O 3.28Å; I68-A81 HydrophobicContact CG2-CB 4.04Å; C77-A81 VanDerWaalsContact O-CB 3.26Å; C77-A81 WeakPolarHBondContact O-CB 3.26Å; C77-A81 PolarHBondContact O-N 3.23Å; F78-A81 PolarHBondContact O-N 3.42Å; V79-A81 VanDerWaalsContact C-N 3.31Å; V79-A81 PolarHBondContact O-N 3.16Å; A81-P84 WeakPolarHBondContact O-CD 3.46Å; A81-P133 HydrophobicContact CB-CB 4.01Å; A81-P133 HydrophobicContact CB-CG 3.79Å; A81-Y177 HydrophobicContact CB-CE1 4.14Å; A81-Y177 PolarHBondContact N-OH 2.62Å
82	A	98.1	Very high	97.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-82.4	-29	-172.1	0	0	0	0	0	114.4	F67 I68 F78 V79 W85 I86 V154	F67-A82 HydrophobicContact CE1-CB 4.23Å; F67-A82 HydrophobicContact CZ-CB 4.29Å; I68-A82 HydrophobicContact CB-CB 4.16Å; I68-A82 HydrophobicContact CG1-CB 4.37Å; F78-A82 HydrophobicContact CE2-CB 4.38Å; F78-A82 VanDerWaalsContact O-CB 3.24Å; F78-A82 WeakPolarHBondContact O-CB 3.45Å; F78-A82 PolarHBondContact O-N 3.03Å; V79-A82 PolarHBondContact O-N 3.18Å; A82-W85 WeakPolarHBondContact O-CB 3.42Å; A82-W85 PolarHBondContact O-N 3.49Å; A82-W85 VanDerWaalsContact O-N 3.08Å; A82-I86 WeakPolarHBondContact O-CG1 3.42Å; A82-I86 PolarHBondContact O-N 3.23Å; A82-V154 HydrophobicContact CB-CB 4.48Å; A82-V154 HydrophobicContact CB-CG1 3.98Å; A82-V154 HydrophobicContact CB-CG2 3.63Å
83	L	97.9	Very high	97.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-57	-41.7	-176.6	-78.3	171	0	0	0	114.8	V79 W85 I86 L87 I113 M116 Y117 V122 L155	V79-L83 HydrophobicContact CG1-CD1 3.91Å; V79-L83 HydrophobicContact CG1-CG 4.19Å; V79-L83 WeakPolarHBondContact O-CG 3.24Å; V79-L83 PolarHBondContact O-N 2.79Å; V79-L83 VanDerWaalsContact O-N 3.08Å; L83-W85 VanDerWaalsContact C-N 3.33Å; L83-W85 PolarHBondContact O-N 2.89Å; L83-I86 HydrophobicContact CD2-CD1 4.33Å; L83-I86 PolarHBondContact O-N 2.94Å; L83-L87 PolarHBondContact O-N 3.4Å; L83-L87 VanDerWaalsContact O-N 3.13Å; L83-I113 HydrophobicContact CD2-CG1 4.23Å; L83-I113 HydrophobicContact CD2-CG2 4.31Å; L83-M116 HydrophobicContact CD1-CE 3.74Å; L83-M116 HydrophobicContact CD2-CE 4.14Å; L83-M116 HydrophobicContact CD2-SD 4.38Å; L83-Y117 VanDerWaalsContact CB-OH 3.24Å; L83-Y117 WeakPolarHBondContact CB-OH 3.24Å; L83-V122 HydrophobicContact CD1-CB 3.95Å; L83-V122 HydrophobicContact CD1-CG1 3.92Å; L83-V122 HydrophobicContact CD1-CG2 3.77Å; L83-L155 HydrophobicContact CD2-CD2 4.32Å
84	P	96.8	Very high	97.3	Very high	49 Å²	49	27.3 Å²	27.3	32%	0.318	14%	0.144	S	C	.	.	H	α-helix	trans	-56.7	-44.6	172.4	-24.8	34.7	0	0	0	112.6	K80 A81 I86 L87 E88 Y117 I125	K80-P84 WeakPolarHBondContact O-CD 3.39Å; A81-P84 WeakPolarHBondContact O-CD 3.46Å; P84-I86 PolarHBondContact O-N 3.23Å; P84-L87 WeakPolarHBondContact O-CB 3.38Å; P84-L87 PolarHBondContact O-N 3.36Å; P84-L87 VanDerWaalsContact O-N 3.17Å; P84-E88 PolarHBondContact O-N 3.34Å; P84-Y117 WeakPolarHBondContact CD-OH 3.3Å; P84-I125 HydrophobicContact CG-CD1 4.3Å
85	W	97.9	Very high	97.3	Very high	35 Å²	35	32.9 Å²	32.9	13%	0.133	16%	0.164	C	C	.	.	H	α-helix	trans	-67.5	-32.9	179.3	-67.9	106.2	0	0	0	113	T66 F67 A82 L83 E88 L89 E137	T66-W85 HydrophobicContact CG2-CD2 4.23Å; T66-W85 HydrophobicContact CG2-CE3 4.04Å; T66-W85 HydrophobicContact CG2-CH2 3.69Å; T66-W85 HydrophobicContact CG2-CZ2 3.89Å; T66-W85 HydrophobicContact CG2-CZ3 3.78Å; F67-W85 HydrophobicContact CD2-CB 3.91Å; F67-W85 HydrophobicContact CE2-CB 4.19Å; A82-W85 WeakPolarHBondContact O-CB 3.42Å; A82-W85 PolarHBondContact O-N 3.49Å; A82-W85 VanDerWaalsContact O-N 3.08Å; L83-W85 VanDerWaalsContact C-N 3.33Å; L83-W85 PolarHBondContact O-N 2.89Å; W85-E88 WeakPolarHBondContact CZ3-OE2 3.46Å; W85-E88 PolarHBondContact O-N 3.04Å; W85-L89 WeakPolarHBondContact O-CB 3.43Å; W85-L89 PolarHBondContact O-N 2.85Å; W85-E137 HydrophobicContact CZ2-CG 3.97Å; W85-E137 VanDerWaalsContact CZ2-OE1 3.31Å; W85-E137 WeakPolarHBondContact CZ2-OE1 3.4Å; W85-E137 WeakPolarHBondContact CZ2-OE2 3.35Å
86	I	98.4	Very high	97.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.3	-45.6	171.4	-63	172	0	0	0	110.3	F67 A82 L83 P84 E88 L89 L90 I113 V151 V154	F67-I86 HydrophobicContact CE2-CG1 3.58Å; F67-I86 HydrophobicContact CZ-CD1 4.17Å; F67-I86 HydrophobicContact CZ-CG1 3.57Å; A82-I86 WeakPolarHBondContact O-CG1 3.42Å; A82-I86 PolarHBondContact O-N 3.23Å; L83-I86 HydrophobicContact CD2-CD1 4.33Å; L83-I86 PolarHBondContact O-N 2.94Å; P84-I86 PolarHBondContact O-N 3.23Å; I86-E88 VanDerWaalsContact C-N 3.29Å; I86-E88 PolarHBondContact O-N 3.15Å; I86-L89 PolarHBondContact O-N 3.34Å; I86-L90 HydrophobicContact CG2-CD1 3.83Å; I86-L90 HydrophobicContact CG2-CG 4.22Å; I86-L90 WeakPolarHBondContact O-CB 3.48Å; I86-L90 VanDerWaalsContact O-CG 3.27Å; I86-L90 WeakPolarHBondContact O-CG 3.46Å; I86-L90 PolarHBondContact O-N 3.32Å; I86-I113 HydrophobicContact CB-CD1 3.92Å; I86-I113 HydrophobicContact CG2-CD1 3.35Å; I86-V151 HydrophobicContact CD1-CG1 4.41Å; I86-V151 HydrophobicContact CG1-CG2 4.23Å; I86-V151 HydrophobicContact CG2-CB 4.37Å; I86-V151 HydrophobicContact CG2-CG1 3.68Å; I86-V151 HydrophobicContact CG2-CG2 3.91Å; I86-V154 HydrophobicContact CD1-CB 3.66Å; I86-V154 HydrophobicContact CD1-CG1 3.56Å; I86-V154 HydrophobicContact CD1-CG2 4.12Å
87	L	98.1	Very high	97.3	Very high	40 Å²	40	35.7 Å²	35.7	21%	0.209	18%	0.184	C	C	.	.	H	α-helix	trans	-62.3	-40	179.2	-175.1	62.2	0	0	0	111.4	L83 P84 T91 R110 I113 L114	L83-L87 PolarHBondContact O-N 3.4Å; L83-L87 VanDerWaalsContact O-N 3.13Å; P84-L87 WeakPolarHBondContact O-CB 3.38Å; P84-L87 PolarHBondContact O-N 3.36Å; P84-L87 VanDerWaalsContact O-N 3.17Å; L87-T91 VanDerWaalsContact O-CB 3.28Å; L87-T91 WeakPolarHBondContact O-CB 3.36Å; L87-T91 PolarHBondContact O-N 3Å; L87-T91 VanDerWaalsContact O-N 3.13Å; L87-T91 PolarHBondContact O-OG1 3.37Å; L87-R110 HydrophobicContact CD1-CB 4.06Å; L87-R110 HydrophobicContact CD1-CG 4.05Å; L87-I113 HydrophobicContact CB-CD1 4.48Å; L87-I113 HydrophobicContact CB-CG2 4.35Å; L87-L114 HydrophobicContact CD2-CD2 3.99Å
88	E	97.8	Very high	97.4	Very high	96 Å²	96	47.2 Å²	47.2	45%	0.449	23%	0.228	S	C	.	.	H	α-helix	trans	-63.1	-52.1	173.6	-176.3	173.3	161.9	0	0	111.8	P84 W85 I86 L90 T91 T92	P84-E88 PolarHBondContact O-N 3.34Å; W85-E88 WeakPolarHBondContact CZ3-OE2 3.46Å; W85-E88 PolarHBondContact O-N 3.04Å; I86-E88 VanDerWaalsContact C-N 3.29Å; I86-E88 PolarHBondContact O-N 3.15Å; E88-L90 VanDerWaalsContact C-N 3.34Å; E88-L90 PolarHBondContact O-N 2.99Å; E88-T91 PolarHBondContact O-N 3.49Å; E88-T92 HydrophobicContact CG-CG2 4.02Å; E88-T92 WeakPolarHBondContact O-CB 3.27Å; E88-T92 WeakPolarHBondContact O-CG2 3.49Å; E88-T92 PolarHBondContact O-N 3.09Å; E88-T92 PolarHBondContact O-OG1 3.07Å
89	L	98	Very high	97.3	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-55.9	-47.5	-179.5	177.5	67.6	0	0	0	111.6	I63 Y65 W85 I86 T91 T92 H93 F94 A147 V151	I63-L89 HydrophobicContact CD1-CD1 4.31Å; Y65-L89 HydrophobicContact CD2-CD1 4.12Å; Y65-L89 HydrophobicContact CG-CD1 3.93Å; W85-L89 WeakPolarHBondContact O-CB 3.43Å; W85-L89 PolarHBondContact O-N 2.85Å; I86-L89 PolarHBondContact O-N 3.34Å; L89-T91 VanDerWaalsContact C-N 3.28Å; L89-T91 PolarHBondContact O-N 2.72Å; L89-T92 PolarHBondContact O-N 3.41Å; L89-H93 HydrophobicContact CD1-CB 4.04Å; L89-H93 PolarHBondContact O-N 3.16Å; L89-F94 HydrophobicContact CD1-CD2 4.34Å; L89-F94 HydrophobicContact CD1-CE2 3.86Å; L89-F94 HydrophobicContact CD2-CE2 4.07Å; L89-F94 HydrophobicContact CG-CD2 4Å; L89-F94 HydrophobicContact CG-CE2 3.72Å; L89-F94 PolarHBondContact O-N 3.18Å; L89-A147 HydrophobicContact CD1-CB 4.24Å; L89-A147 HydrophobicContact CD2-CB 3.98Å; L89-V151 HydrophobicContact CD2-CG2 3.8Å
90	L	98.1	Very high	97.3	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-33.8	177.2	-70.4	174.4	0	0	0	112.5	I86 E88 F94 V106 L109 R110 I113	I86-L90 HydrophobicContact CG2-CD1 3.83Å; I86-L90 HydrophobicContact CG2-CG 4.22Å; I86-L90 WeakPolarHBondContact O-CB 3.48Å; I86-L90 VanDerWaalsContact O-CG 3.27Å; I86-L90 WeakPolarHBondContact O-CG 3.46Å; I86-L90 PolarHBondContact O-N 3.32Å; E88-L90 VanDerWaalsContact C-N 3.34Å; E88-L90 PolarHBondContact O-N 2.99Å; L90-F94 HydrophobicContact CD2-CD2 4.47Å; L90-V106 HydrophobicContact CB-CG1 4.29Å; L90-L109 HydrophobicContact CD1-CB 3.66Å; L90-L109 HydrophobicContact CD1-CD1 4.49Å; L90-L109 HydrophobicContact CD2-CD1 4.21Å; L90-R110 HydrophobicContact CB-CG 3.96Å; L90-R110 HydrophobicContact CD1-CG 4.2Å; L90-I113 HydrophobicContact CD1-CD1 4.02Å
91	T	97.4	Very high	97.3	Very high	54 Å²	54	57.8 Å²	57.8	33%	0.331	30%	0.304	S	S	.	.	H	α-helix	trans	-81.1	-33.8	-178.2	-59.5	0	0	0	0	112.3	L87 E88 L89 K95 R110	L87-T91 VanDerWaalsContact O-CB 3.28Å; L87-T91 WeakPolarHBondContact O-CB 3.36Å; L87-T91 PolarHBondContact O-N 3Å; L87-T91 VanDerWaalsContact O-N 3.13Å; L87-T91 PolarHBondContact O-OG1 3.37Å; E88-T91 PolarHBondContact O-N 3.49Å; L89-T91 VanDerWaalsContact C-N 3.28Å; L89-T91 PolarHBondContact O-N 2.72Å; T91-K95 WeakPolarHBondContact O-CE 3.25Å; T91-R110 PolarHBondContact OG1-NE 3.45Å; T91-R110 VanDerWaalsContact OG1-NE 3.07Å; T91-R110 PolarHBondContact OG1-NH2 2.71Å
92	T	97	Very high	97.3	Very high	60 Å²	60	59.3 Å²	59.3	37%	0.368	31%	0.312	S	S	.	.	H	α-helix	trans	-96.8	-44.4	-170.6	54.6	0	0	0	0	112.7	E88 L89 K95	E88-T92 HydrophobicContact CG-CG2 4.02Å; E88-T92 WeakPolarHBondContact O-CB 3.27Å; E88-T92 WeakPolarHBondContact O-CG2 3.49Å; E88-T92 PolarHBondContact O-N 3.09Å; E88-T92 PolarHBondContact O-OG1 3.07Å; L89-T92 PolarHBondContact O-N 3.41Å; T92-K95 VanDerWaalsContact O-CE 3.31Å; T92-K95 WeakPolarHBondContact O-CE 3.41Å
93	H	95.9	Very high	97.3	Very high	77 Å²	77	60.5 Å²	60.5	36%	0.356	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-35.1	-171.9	-67.9	-81.2	0	0	0	113.9	I63 T64 L89 K95	I63-H93 HydrophobicContact CD1-CB 4.25Å; T64-H93 PolarHBondContact O-CE1 3.35Å; T64-H93 PolarHBondContact O-NE2 2.04Å; L89-H93 HydrophobicContact CD1-CB 4.04Å; L89-H93 PolarHBondContact O-N 3.16Å; H93-K95 PolarHBondContact O-N 3.31Å
94	F	96.3	Very high	97.3	Very high	8 Å²	8	62 Å²	62	4%	0.035	33%	0.334	C	S	.	.			trans	-95.4	63.4	-176.2	-68.8	-82.7	0	0	0	112.4	I63 L89 L90 Y96 V106 P144 A147 L148	I63-F94 HydrophobicContact CD1-CZ 4.49Å; L89-F94 HydrophobicContact CD1-CD2 4.34Å; L89-F94 HydrophobicContact CD1-CE2 3.86Å; L89-F94 HydrophobicContact CD2-CE2 4.07Å; L89-F94 HydrophobicContact CG-CD2 4Å; L89-F94 HydrophobicContact CG-CE2 3.72Å; L89-F94 PolarHBondContact O-N 3.18Å; L90-F94 HydrophobicContact CD2-CD2 4.47Å; F94-Y96 HydrophobicContact CB-CE2 4.14Å; F94-Y96 HydrophobicContact CD1-CE2 4.4Å; F94-V106 HydrophobicContact CB-CG2 3.95Å; F94-P144 HydrophobicContact CE1-CB 3.94Å; F94-P144 HydrophobicContact CZ-CB 4.04Å; F94-P144 WeakPolarHBondContact CZ-O 3.38Å; F94-A147 HydrophobicContact CE2-CB 4.29Å; F94-A147 HydrophobicContact CZ-CB 4.21Å; F94-L148 HydrophobicContact CD1-CD1 4.34Å; F94-L148 HydrophobicContact CD1-CD2 4.17Å; F94-L148 HydrophobicContact CD1-CG 4.37Å; F94-L148 HydrophobicContact CD2-CD2 4.44Å; F94-L148 HydrophobicContact CE1-CD1 3.6Å; F94-L148 HydrophobicContact CE1-CD2 3.82Å; F94-L148 HydrophobicContact CE1-CG 3.56Å; F94-L148 HydrophobicContact CE2-CD2 4.1Å; F94-L148 HydrophobicContact CE2-CG 4.24Å; F94-L148 HydrophobicContact CG-CD2 4.49Å; F94-L148 HydrophobicContact CZ-CD1 4.06Å; F94-L148 HydrophobicContact CZ-CD2 3.79Å; F94-L148 HydrophobicContact CZ-CG 3.49Å; F94-L148 VanDerWaalsContact CZ-CG 3.49Å
95	K	95.4	Very high	97.4	Very high	156 Å²	156	62 Å²	62	68%	0.678	33%	0.328	S	S	*	.			trans	-97.6	123	178.8	-65.3	177.5	-177.7	170.2	0	110.8	T91 T92 H93	T91-K95 WeakPolarHBondContact O-CE 3.25Å; T92-K95 VanDerWaalsContact O-CE 3.31Å; T92-K95 WeakPolarHBondContact O-CE 3.41Å; H93-K95 PolarHBondContact O-N 3.31Å
96	Y	96.4	Very high	97.4	Very high	61 Å²	61	60.5 Å²	60.5	24%	0.239	32%	0.322	C	S	.	.			trans	-119.3	163.5	178.1	-63.1	-81.8	0	0	0	110.8	L52 Q56 F94 R98 N102 V106	L52-Y96 HydrophobicContact CD2-CE2 4.01Å; Q56-Y96 PolarHBondContact NE2-OH 2.81Å; F94-Y96 HydrophobicContact CB-CE2 4.14Å; F94-Y96 HydrophobicContact CD1-CE2 4.4Å; Y96-R98 PolarHBondContact O-N 3.36Å; Y96-N102 HydrophobicContact CD1-CB 3.5Å; Y96-N102 HydrophobicContact CD2-CB 3.66Å; Y96-N102 HydrophobicContact CE1-CB 3.73Å; Y96-N102 HydrophobicContact CE2-CB 3.87Å; Y96-N102 HydrophobicContact CG-CB 3.47Å; Y96-N102 VanDerWaalsContact CG-CB 3.47Å; Y96-V106 HydrophobicContact CD2-CG2 3.8Å; Y96-V106 HydrophobicContact CE2-CG2 3.7Å
97	S	97.6	Very high	97.4	Very high	97 Å²	97	64.2 Å²	64.2	68%	0.678	34%	0.34	S	S	*	.			trans	-56.5	130.7	174	-61.1	0	0	0	0	110.1	G99 S100 D103	S97-G99 PolarHBondContact O-N 2.76Å; S97-S100 WeakPolarHBondContact O-CB 3.43Å; S97-S100 PolarHBondContact O-N 3.09Å; S97-S100 PolarHBondContact O-OG 2.92Å; S97-D103 WeakPolarHBondContact O-CB 3.27Å
98	R	97.3	Very high	97.4	Very high	243 Å²	243	65 Å²	65	92%	0.917	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	129.7	-177.8	-174.2	178	-179.3	179.1	0.3	111	Y96 S100 D103	Y96-R98 PolarHBondContact O-N 3.36Å; R98-S100 VanDerWaalsContact C-N 3.27Å; R98-S100 PolarHBondContact O-N 2.78Å; R98-D103 WeakPolarHBondContact CA-OD2 3.42Å
99	G	96.3	Very high	97.4	Very high	71 Å²	71	60.5 Å²	60.5	73%	0.732	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	1.2	-179.1	0	0	0	0	0	114.9	S97 D103	S97-G99 PolarHBondContact O-N 2.76Å; G99-D103 PolarHBondContact N-OD2 3.14Å
100	S	97.8	Very high	97.4	Very high	40 Å²	40	63.6 Å²	63.6	28%	0.28	34%	0.339	S	S	.	.	S	Bend	trans	-68.8	160	167.5	68.3	0	0	0	0	111.2	S97 R98 N102 D103 G104	S97-S100 WeakPolarHBondContact O-CB 3.43Å; S97-S100 PolarHBondContact O-N 3.09Å; S97-S100 PolarHBondContact O-OG 2.92Å; R98-S100 VanDerWaalsContact C-N 3.27Å; R98-S100 PolarHBondContact O-N 2.78Å; S100-N102 VanDerWaalsContact C-N 3.29Å; S100-N102 PolarHBondContact O-N 3.04Å; S100-D103 WeakPolarHBondContact O-CB 3.37Å; S100-D103 PolarHBondContact O-N 3.46Å; S100-D103 WeakPolarHBondContact OG-CB 3.37Å; S100-D103 PolarHBondContact OG-N 3.15Å; S100-D103 VanDerWaalsContact OG-N 3.16Å; S100-G104 PolarHBondContact O-N 3.41Å
101	I	97.4	Very high	97.4	Very high	121 Å²	121	65.6 Å²	65.6	62%	0.621	36%	0.355	S	S	*	.	H	α-helix	trans	-57.3	-45	177.3	-62.1	173.8	0	0	0	110.7	D103 G104 Y105	I101-D103 PolarHBondContact O-N 2.9Å; I101-G104 WeakPolarHBondContact O-CA 3.35Å; I101-G104 PolarHBondContact O-N 3.31Å; I101-G104 VanDerWaalsContact O-N 3.15Å; I101-Y105 HydrophobicContact CG2-CD2 4.17Å; I101-Y105 HydrophobicContact CG2-CE1 4.03Å; I101-Y105 HydrophobicContact CG2-CE2 3.45Å; I101-Y105 VanDerWaalsContact CG2-CE2 3.45Å; I101-Y105 WeakPolarHBondContact CG2-OH 3.3Å; I101-Y105 PolarHBondContact O-N 2.9Å
102	N	97.8	Very high	97.4	Very high	31 Å²	31	63.5 Å²	63.5	17%	0.166	34%	0.342	C	S	.	.	H	α-helix	trans	-67.4	-34.7	178.7	-69	-21	0	0	0	113	L52 N55 Y96 S100 G104 Y105 V106	L52-N102 HydrophobicContact CD2-CB 4.1Å; N55-N102 PolarHBondContact ND2-OD1 2.71Å; Y96-N102 HydrophobicContact CD1-CB 3.5Å; Y96-N102 HydrophobicContact CD2-CB 3.66Å; Y96-N102 HydrophobicContact CE1-CB 3.73Å; Y96-N102 HydrophobicContact CE2-CB 3.87Å; Y96-N102 HydrophobicContact CG-CB 3.47Å; Y96-N102 VanDerWaalsContact CG-CB 3.47Å; S100-N102 VanDerWaalsContact C-N 3.29Å; S100-N102 PolarHBondContact O-N 3.04Å; N102-G104 VanDerWaalsContact C-N 3.33Å; N102-Y105 PolarHBondContact O-N 3.32Å; N102-V106 WeakPolarHBondContact O-CG2 3.35Å; N102-V106 PolarHBondContact O-N 3.48Å
103	D	98.1	Very high	97.4	Very high	25 Å²	25	60.7 Å²	60.7	13%	0.134	33%	0.325	C	S	.	.	H	α-helix	trans	-60.4	-46.3	170.2	176.1	47.1	0	0	0	110.2	S97 R98 G99 S100 I101 Y105 V106 Q107	S97-D103 WeakPolarHBondContact O-CB 3.27Å; R98-D103 WeakPolarHBondContact CA-OD2 3.42Å; G99-D103 PolarHBondContact N-OD2 3.14Å; S100-D103 WeakPolarHBondContact O-CB 3.37Å; S100-D103 PolarHBondContact O-N 3.46Å; S100-D103 WeakPolarHBondContact OG-CB 3.37Å; S100-D103 PolarHBondContact OG-N 3.15Å; S100-D103 VanDerWaalsContact OG-N 3.16Å; I101-D103 PolarHBondContact O-N 2.9Å; D103-Y105 VanDerWaalsContact C-N 3.32Å; D103-Y105 PolarHBondContact O-N 3.4Å; D103-V106 PolarHBondContact O-N 3.2Å; D103-Q107 WeakPolarHBondContact O-CG 3.38Å; D103-Q107 PolarHBondContact O-N 3.37Å; D103-Q107 PolarHBondContact OD1-NE2 3.39Å
104	G	98.2	Very high	97.5	Very high	32 Å²	32	61.3 Å²	61.3	33%	0.33	33%	0.33	S	S	.	.	H	α-helix	trans	-56.4	-42.2	174.7	0	0	0	0	0	113.6	S100 I101 N102 S108	S100-G104 PolarHBondContact O-N 3.41Å; I101-G104 WeakPolarHBondContact O-CA 3.35Å; I101-G104 PolarHBondContact O-N 3.31Å; I101-G104 VanDerWaalsContact O-N 3.15Å; N102-G104 VanDerWaalsContact C-N 3.33Å; G104-S108 WeakPolarHBondContact O-CB 3.47Å; G104-S108 PolarHBondContact O-N 3.26Å; G104-S108 PolarHBondContact O-OG 3.41Å
105	Y	98.3	Very high	97.4	Very high	49 Å²	49	64.8 Å²	64.8	19%	0.192	35%	0.349	C	S	.	.	H	α-helix	trans	-62.1	-47.8	174.5	-66.3	-26	0	0	0	112.6	I48 Q51 L52 I101 N102 D103 Q107 S108 L109	I48-Y105 HydrophobicContact CG1-CD1 4.34Å; I48-Y105 HydrophobicContact CG2-CD1 3.89Å; I48-Y105 HydrophobicContact CG2-CG 3.92Å; Q51-Y105 HydrophobicContact CB-CD2 4.23Å; Q51-Y105 HydrophobicContact CB-CE2 3.67Å; Q51-Y105 PolarHBondContact OE1-OH 3.46Å; L52-Y105 HydrophobicContact CD2-CD2 4.06Å; L52-Y105 HydrophobicContact CD2-CG 4.49Å; L52-Y105 HydrophobicContact CG-CD2 4.1Å; L52-Y105 HydrophobicContact CG-CG 4.35Å; I101-Y105 HydrophobicContact CG2-CD2 4.17Å; I101-Y105 HydrophobicContact CG2-CE1 4.03Å; I101-Y105 HydrophobicContact CG2-CE2 3.45Å; I101-Y105 VanDerWaalsContact CG2-CE2 3.45Å; I101-Y105 WeakPolarHBondContact CG2-OH 3.3Å; I101-Y105 PolarHBondContact O-N 2.9Å; N102-Y105 PolarHBondContact O-N 3.32Å; D103-Y105 VanDerWaalsContact C-N 3.32Å; D103-Y105 PolarHBondContact O-N 3.4Å; Y105-Q107 PolarHBondContact O-N 2.84Å; Y105-S108 PolarHBondContact O-N 3.33Å; Y105-L109 WeakPolarHBondContact O-CG 3.33Å; Y105-L109 PolarHBondContact O-N 3.19Å
106	V	98.3	Very high	97.4	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.018	32%	0.317	C	S	.	.	H	α-helix	trans	-62.7	-43.9	178.2	170.8	0	0	0	0	111.1	L52 L90 F94 Y96 N102 D103 S108 L109 R110	L52-V106 HydrophobicContact CD1-CG2 4.05Å; L52-V106 HydrophobicContact CD2-CG2 4.18Å; L90-V106 HydrophobicContact CB-CG1 4.29Å; F94-V106 HydrophobicContact CB-CG2 3.95Å; Y96-V106 HydrophobicContact CD2-CG2 3.8Å; Y96-V106 HydrophobicContact CE2-CG2 3.7Å; N102-V106 WeakPolarHBondContact O-CG2 3.35Å; N102-V106 PolarHBondContact O-N 3.48Å; D103-V106 PolarHBondContact O-N 3.2Å; V106-S108 VanDerWaalsContact C-N 3.3Å; V106-S108 PolarHBondContact O-N 3.48Å; V106-L109 PolarHBondContact O-N 3.04Å; V106-R110 HydrophobicContact CG1-CG 4.38Å; V106-R110 VanDerWaalsContact O-CG 3.27Å; V106-R110 WeakPolarHBondContact O-CG 3.22Å; V106-R110 PolarHBondContact O-N 3.38Å
107	Q	98.1	Very high	97.3	Very high	79 Å²	79	56 Å²	56	37%	0.369	31%	0.311	S	S	.	.	H	α-helix	trans	-62.2	-38.8	176.5	-61.8	-45.2	-34.8	0	0	111.9	D103 Y105 R110 A111	D103-Q107 WeakPolarHBondContact O-CG 3.38Å; D103-Q107 PolarHBondContact O-N 3.37Å; D103-Q107 PolarHBondContact OD1-NE2 3.39Å; Y105-Q107 PolarHBondContact O-N 2.84Å; Q107-R110 PolarHBondContact O-N 2.93Å; Q107-A111 VanDerWaalsContact O-CB 3.32Å; Q107-A111 WeakPolarHBondContact O-CB 3.39Å; Q107-A111 PolarHBondContact O-N 3.26Å
108	S	97.8	Very high	97.1	Very high	55 Å²	55	55.2 Å²	55.2	39%	0.385	31%	0.306	S	S	.	.	H	α-helix	trans	-64.1	-42.4	178.2	-59.4	0	0	0	0	111.9	G104 Y105 V106 A111 L112	G104-S108 WeakPolarHBondContact O-CB 3.47Å; G104-S108 PolarHBondContact O-N 3.26Å; G104-S108 PolarHBondContact O-OG 3.41Å; Y105-S108 PolarHBondContact O-N 3.33Å; V106-S108 VanDerWaalsContact C-N 3.3Å; V106-S108 PolarHBondContact O-N 3.48Å; S108-A111 PolarHBondContact O-N 2.92Å; S108-L112 WeakPolarHBondContact O-CB 3.27Å; S108-L112 PolarHBondContact O-N 3.38Å
109	L	98.2	Very high	96.8	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-68	-39.4	175.8	-67.2	176.4	0	0	0	112.5	I48 V49 L52 L90 Y105 V106 L112 I113 L155	I48-L109 HydrophobicContact CB-CD2 4.4Å; I48-L109 HydrophobicContact CG2-CD1 4.16Å; I48-L109 HydrophobicContact CG2-CD2 4.06Å; I48-L109 HydrophobicContact CG2-CG 3.84Å; V49-L109 HydrophobicContact CG2-CD1 3.93Å; V49-L109 HydrophobicContact CG2-CD2 3.71Å; V49-L109 HydrophobicContact CG2-CG 4.5Å; L52-L109 HydrophobicContact CD1-CD1 3.59Å; L90-L109 HydrophobicContact CD1-CB 3.66Å; L90-L109 HydrophobicContact CD1-CD1 4.49Å; L90-L109 HydrophobicContact CD2-CD1 4.21Å; Y105-L109 WeakPolarHBondContact O-CG 3.33Å; Y105-L109 PolarHBondContact O-N 3.19Å; V106-L109 PolarHBondContact O-N 3.04Å; L109-L112 WeakPolarHBondContact O-CB 2.97Å; L109-L112 PolarHBondContact O-N 2.92Å; L109-I113 WeakPolarHBondContact O-CG1 3.33Å; L109-I113 PolarHBondContact O-N 3.14Å; L109-I113 VanDerWaalsContact O-N 3.11Å; L109-L155 HydrophobicContact CD2-CD1 4.37Å
110	R	98.4	Very high	96.5	Very high	70 Å²	70	52.6 Å²	52.6	26%	0.264	28%	0.278	S	S	.	.	H	α-helix	trans	-62.2	-45.9	174.4	-67.8	171.6	75.9	-141.9	3.5	110.9	L87 L90 T91 V106 Q107 L112 I113 L114	L87-R110 HydrophobicContact CD1-CB 4.06Å; L87-R110 HydrophobicContact CD1-CG 4.05Å; L90-R110 HydrophobicContact CB-CG 3.96Å; L90-R110 HydrophobicContact CD1-CG 4.2Å; T91-R110 PolarHBondContact OG1-NE 3.45Å; T91-R110 VanDerWaalsContact OG1-NE 3.07Å; T91-R110 PolarHBondContact OG1-NH2 2.71Å; V106-R110 HydrophobicContact CG1-CG 4.38Å; V106-R110 VanDerWaalsContact O-CG 3.27Å; V106-R110 WeakPolarHBondContact O-CG 3.22Å; V106-R110 PolarHBondContact O-N 3.38Å; Q107-R110 PolarHBondContact O-N 2.93Å; R110-L112 VanDerWaalsContact C-N 3.31Å; R110-L112 PolarHBondContact O-N 2.94Å; R110-I113 PolarHBondContact O-N 2.84Å; R110-L114 VanDerWaalsContact O-CG 3.3Å; R110-L114 WeakPolarHBondContact O-CG 3.44Å; R110-L114 PolarHBondContact O-N 3.05Å
111	A	97.8	Very high	96.3	Very high	43 Å²	43	50.9 Å²	50.9	36%	0.355	27%	0.265	S	S	.	.	H	α-helix	trans	-61.6	-39.2	176.3	0	0	0	0	0	111.8	Q107 S108 L114 N115	Q107-A111 VanDerWaalsContact O-CB 3.32Å; Q107-A111 WeakPolarHBondContact O-CB 3.39Å; Q107-A111 PolarHBondContact O-N 3.26Å; S108-A111 PolarHBondContact O-N 2.92Å; A111-L114 PolarHBondContact O-N 3.21Å; A111-N115 VanDerWaalsContact O-CB 3.27Å; A111-N115 WeakPolarHBondContact O-CB 3.01Å; A111-N115 PolarHBondContact O-N 3.11Å; A111-N115 PolarHBondContact O-ND2 3.21Å
112	L	96.6	Very high	96.2	Very high	10 Å²	10	45.1 Å²	45.1	5%	0.052	24%	0.236	C	C	.	.	H	α-helix	trans	-57.3	-52.1	174.8	174.6	61.5	0	0	0	111.9	S40 I41 H45 S108 L109 R110 L114 N115 M116	S40-L112 VanDerWaalsContact O-CD1 3.24Å; S40-L112 WeakPolarHBondContact O-CD1 3.47Å; I41-L112 HydrophobicContact CD1-CD2 4.29Å; I41-L112 HydrophobicContact CG1-CD1 4.15Å; I41-L112 HydrophobicContact CG1-CD2 4.2Å; I41-L112 HydrophobicContact CG1-CG 4.5Å; H45-L112 HydrophobicContact CB-CD2 3.69Å; H45-L112 WeakPolarHBondContact ND1-CD1 3.34Å; S108-L112 WeakPolarHBondContact O-CB 3.27Å; S108-L112 PolarHBondContact O-N 3.38Å; L109-L112 WeakPolarHBondContact O-CB 2.97Å; L109-L112 PolarHBondContact O-N 2.92Å; R110-L112 VanDerWaalsContact C-N 3.31Å; R110-L112 PolarHBondContact O-N 2.94Å; L112-L114 VanDerWaalsContact C-N 3.34Å; L112-L114 PolarHBondContact O-N 3.33Å; L112-N115 WeakPolarHBondContact O-CB 3.42Å; L112-N115 PolarHBondContact O-N 3.44Å; L112-N115 VanDerWaalsContact O-N 3.14Å; L112-M116 HydrophobicContact CG-SD 4.39Å; L112-M116 WeakPolarHBondContact O-CG 3.36Å; L112-M116 PolarHBondContact O-N 3.3Å
113	I	97.5	Very high	96	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-61.9	-44.6	-179	-64	165.2	0	0	0	110.5	L83 I86 L87 L90 L109 R110 N115 M116 Y117	L83-I113 HydrophobicContact CD2-CG1 4.23Å; L83-I113 HydrophobicContact CD2-CG2 4.31Å; I86-I113 HydrophobicContact CB-CD1 3.92Å; I86-I113 HydrophobicContact CG2-CD1 3.35Å; L87-I113 HydrophobicContact CB-CD1 4.48Å; L87-I113 HydrophobicContact CB-CG2 4.35Å; L90-I113 HydrophobicContact CD1-CD1 4.02Å; L109-I113 WeakPolarHBondContact O-CG1 3.33Å; L109-I113 PolarHBondContact O-N 3.14Å; L109-I113 VanDerWaalsContact O-N 3.11Å; R110-I113 PolarHBondContact O-N 2.84Å; I113-N115 VanDerWaalsContact C-N 3.28Å; I113-N115 PolarHBondContact O-N 3.45Å; I113-M116 WeakPolarHBondContact O-CB 3.16Å; I113-M116 PolarHBondContact O-N 3.43Å; I113-Y117 HydrophobicContact CG2-CD2 4.17Å; I113-Y117 HydrophobicContact CG2-CE2 3.67Å; I113-Y117 VanDerWaalsContact O-CD2 3.25Å; I113-Y117 WeakPolarHBondContact O-CD2 3.24Å; I113-Y117 PolarHBondContact O-N 2.97Å
114	L	96.9	Very high	95.7	Very high	91 Å²	91	51 Å²	51	48%	0.476	27%	0.266	S	S	.	.	H	α-helix	trans	-62.2	-36.5	176.3	-67.9	171.5	0	0	0	112.2	L87 R110 A111 L112 Y117 S118	L87-L114 HydrophobicContact CD2-CD2 3.99Å; R110-L114 VanDerWaalsContact O-CG 3.3Å; R110-L114 WeakPolarHBondContact O-CG 3.44Å; R110-L114 PolarHBondContact O-N 3.05Å; A111-L114 PolarHBondContact O-N 3.21Å; L112-L114 VanDerWaalsContact C-N 3.34Å; L112-L114 PolarHBondContact O-N 3.33Å; L114-Y117 PolarHBondContact O-N 3.46Å; L114-S118 PolarHBondContact O-N 3.46Å
115	N	95.1	Very high	95.5	Very high	80 Å²	80	51.2 Å²	51.2	43%	0.428	26%	0.259	S	S	.	.	H	α-helix	trans	-68.5	-35.5	175.6	-74.5	-22.5	0	0	0	112.6	A111 L112 I113 Y117 S118 Q119	A111-N115 VanDerWaalsContact O-CB 3.27Å; A111-N115 WeakPolarHBondContact O-CB 3.01Å; A111-N115 PolarHBondContact O-N 3.11Å; A111-N115 PolarHBondContact O-ND2 3.21Å; L112-N115 WeakPolarHBondContact O-CB 3.42Å; L112-N115 PolarHBondContact O-N 3.44Å; L112-N115 VanDerWaalsContact O-N 3.14Å; I113-N115 VanDerWaalsContact C-N 3.28Å; I113-N115 PolarHBondContact O-N 3.45Å; N115-Y117 VanDerWaalsContact C-N 3.27Å; N115-Y117 PolarHBondContact O-N 3.24Å; N115-S118 WeakPolarHBondContact CA-OG 3.34Å; N115-S118 PolarHBondContact O-N 3.09Å; N115-S118 PolarHBondContact O-OG 3.48Å; N115-Q119 VanDerWaalsContact O-CB 3.28Å; N115-Q119 WeakPolarHBondContact O-CB 3.41Å; N115-Q119 VanDerWaalsContact O-CG 3.3Å; N115-Q119 WeakPolarHBondContact O-CG 3.36Å; N115-Q119 PolarHBondContact O-N 3.45Å
116	M	94.9	Very high	95.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.2	-40.1	173.4	-67.4	168.7	64	0	0	111.2	I41 L83 L112 I113 R120 C121 V122 Y158	I41-M116 HydrophobicContact CD1-CE 4.44Å; I41-M116 HydrophobicContact CD1-SD 4.05Å; I41-M116 HydrophobicContact CG1-SD 4.25Å; L83-M116 HydrophobicContact CD1-CE 3.74Å; L83-M116 HydrophobicContact CD2-CE 4.14Å; L83-M116 HydrophobicContact CD2-SD 4.38Å; L112-M116 HydrophobicContact CG-SD 4.39Å; L112-M116 WeakPolarHBondContact O-CG 3.36Å; L112-M116 PolarHBondContact O-N 3.3Å; I113-M116 WeakPolarHBondContact O-CB 3.16Å; I113-M116 PolarHBondContact O-N 3.43Å; M116-R120 PolarHBondContact O-N 2.91Å; M116-C121 HydrophobicContact CB-CB 4.47Å; M116-C121 WeakPolarHBondContact O-CB 3.45Å; M116-C121 PolarHBondContact O-N 3.38Å; M116-V122 HydrophobicContact CE-CG2 3.72Å; M116-Y158 HydrophobicContact CE-CD1 3.82Å; M116-Y158 HydrophobicContact CE-CD2 3.6Å; M116-Y158 HydrophobicContact CE-CE1 3.73Å; M116-Y158 HydrophobicContact CE-CE2 3.52Å; M116-Y158 HydrophobicContact CE-CG 3.72Å
117	Y	94.7	Very high	94.6	Very high	32 Å²	32	59.6 Å²	59.6	13%	0.125	30%	0.302	C	S	.	.	H	α-helix	trans	-71.2	-46	174.8	-68	-57.4	0	0	0	112.8	L83 P84 I113 L114 N115 Q119 R120 V122 Q124	L83-Y117 VanDerWaalsContact CB-OH 3.24Å; L83-Y117 WeakPolarHBondContact CB-OH 3.24Å; P84-Y117 WeakPolarHBondContact CD-OH 3.3Å; I113-Y117 HydrophobicContact CG2-CD2 4.17Å; I113-Y117 HydrophobicContact CG2-CE2 3.67Å; I113-Y117 VanDerWaalsContact O-CD2 3.25Å; I113-Y117 WeakPolarHBondContact O-CD2 3.24Å; I113-Y117 PolarHBondContact O-N 2.97Å; L114-Y117 PolarHBondContact O-N 3.46Å; N115-Y117 VanDerWaalsContact C-N 3.27Å; N115-Y117 PolarHBondContact O-N 3.24Å; Y117-Q119 VanDerWaalsContact C-N 3.29Å; Y117-Q119 PolarHBondContact O-N 2.95Å; Y117-R120 PolarHBondContact O-N 2.84Å; Y117-V122 VanDerWaalsContact CD1-O 3.3Å; Y117-V122 WeakPolarHBondContact CD1-O 3.34Å; Y117-Q124 HydrophobicContact CD1-CG 3.85Å; Y117-Q124 HydrophobicContact CE1-CG 4.1Å; Y117-Q124 HydrophobicContact CG-CG 4.49Å
118	S	93.5	Very high	94	Very high	81 Å²	81	64.6 Å²	64.6	57%	0.566	33%	0.325	S	S	*	.	H	α-helix	trans	-65.6	-33.2	-177.1	73.1	0	0	0	0	112.6	L114 N115 R120	L114-S118 PolarHBondContact O-N 3.46Å; N115-S118 WeakPolarHBondContact CA-OG 3.34Å; N115-S118 PolarHBondContact O-N 3.09Å; N115-S118 PolarHBondContact O-OG 3.48Å; S118-R120 VanDerWaalsContact C-N 3.27Å; S118-R120 PolarHBondContact O-N 3.43Å
119	Q	91.2	Very high	93.4	Very high	81 Å²	81	65.3 Å²	65.3	38%	0.379	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	5.6	175.2	-62.1	-178.5	12.2	0	0	113.5	N115 Y117 C121	N115-Q119 VanDerWaalsContact O-CB 3.28Å; N115-Q119 WeakPolarHBondContact O-CB 3.41Å; N115-Q119 VanDerWaalsContact O-CG 3.3Å; N115-Q119 WeakPolarHBondContact O-CG 3.36Å; N115-Q119 PolarHBondContact O-N 3.45Å; Y117-Q119 VanDerWaalsContact C-N 3.29Å; Y117-Q119 PolarHBondContact O-N 2.95Å; Q119-C121 PolarHBondContact O-N 3.04Å
120	R	90.6	Very high	92.9	Very high	178 Å²	178	65.8 Å²	65.8	67%	0.672	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	35	179	-54	-63.6	-169.8	170.6	2.7	113.5	M116 Y117 S118	M116-R120 PolarHBondContact O-N 2.91Å; Y117-R120 PolarHBondContact O-N 2.84Å; S118-R120 VanDerWaalsContact C-N 3.27Å; S118-R120 PolarHBondContact O-N 3.43Å
121	C	92.8	Very high	92	Very high	4 Å²	4	67.4 Å²	67.4	3%	0.027	34%	0.343	C	S	.	.	S	Bend	trans	-81.1	-34	177.6	-66.2	0	0	0	0	113.5	C37 M116 Q119 Y158 W171	C37-C121 WeakPolarHBondContact CA-SG 3.37Å; C37-C121 HydrophobicContact CB-CB 3.62Å; C37-C121 WeakPolarHBondContact CB-SG 3.44Å; C37-C121 WeakPolarHBondContact SG-CA 3.43Å; C37-C121 WeakPolarHBondContact SG-CB 3.44Å; C37-C121 CovalentContact SG-SG 2.04Å; C37-C121 PolarHBondContact SG-SG 3.3Å; M116-C121 HydrophobicContact CB-CB 4.47Å; M116-C121 WeakPolarHBondContact O-CB 3.45Å; M116-C121 PolarHBondContact O-N 3.38Å; Q119-C121 PolarHBondContact O-N 3.04Å; C121-Y158 VanDerWaalsContact CB-OH 3.28Å; C121-Y158 WeakPolarHBondContact CB-OH 3.47Å; C121-W171 WeakPolarHBondContact O-CZ2 3.42Å; C121-W171 PolarHBondContact O-NE1 3.13Å
122	V	94.8	Very high	90.8	Very high	1 Å²	1	69.7 Å²	69.7	1%	0.006	35%	0.345	C	S	.	.	S	Bend	trans	-127.5	124.8	167.4	-172.2	0	0	0	0	106.8	K80 L83 M116 Y117 Y158 W171	K80-V122 HydrophobicContact CB-CG1 4.15Å; K80-V122 HydrophobicContact CG-CG1 4.18Å; L83-V122 HydrophobicContact CD1-CB 3.95Å; L83-V122 HydrophobicContact CD1-CG1 3.92Å; L83-V122 HydrophobicContact CD1-CG2 3.77Å; M116-V122 HydrophobicContact CE-CG2 3.72Å; Y117-V122 VanDerWaalsContact CD1-O 3.3Å; Y117-V122 WeakPolarHBondContact CD1-O 3.34Å; V122-Y158 HydrophobicContact CG2-CD2 3.89Å; V122-Y158 HydrophobicContact CG2-CE2 3.51Å; V122-W171 HydrophobicContact CB-CH2 4.49Å; V122-W171 HydrophobicContact CG1-CE3 4.13Å; V122-W171 HydrophobicContact CG1-CH2 4.19Å; V122-W171 HydrophobicContact CG1-CZ3 3.95Å; V122-W171 HydrophobicContact CG2-CH2 3.75Å; V122-W171 HydrophobicContact CG2-CZ2 3.87Å; V122-W171 HydrophobicContact CG2-CZ3 4.34Å
123	P	93.9	Very high	90.2	Very high	46 Å²	46	69.3 Å²	69.3	30%	0.299	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-69.1	149.1	174	28.4	-32	0	0	0	110	K80 W171	K80-P123 HydrophobicContact CD-CG 4.39Å; P123-W171 VanDerWaalsContact CD-CG 3.43Å; P123-W171 HydrophobicContact CG-CB 3.45Å; P123-W171 VanDerWaalsContact CG-CB 3.45Å; P123-W171 HydrophobicContact CG-CD2 4.47Å; P123-W171 HydrophobicContact CG-CG 3.77Å
124	Q	92.9	Very high	89.6	Confident	132 Å²	132	74.5 Å²	74.5	62%	0.617	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-64.4	156.4	168.8	-64.3	-179.9	26.1	0	0	109.8	Y117 N126	Y117-Q124 HydrophobicContact CD1-CG 3.85Å; Y117-Q124 HydrophobicContact CE1-CG 4.1Å; Y117-Q124 HydrophobicContact CG-CG 4.49Å; Q124-N126 PolarHBondContact O-N 3.45Å
125	I	92.4	Very high	89.2	Confident	38 Å²	38	72 Å²	72	20%	0.195	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-65.4	125.4	172.1	-60.3	169.4	0	0	0	107.3	K80 P84 E127 E130 P133	K80-I125 HydrophobicContact CG-CG1 4.36Å; P84-I125 HydrophobicContact CG-CD1 4.3Å; I125-E127 PolarHBondContact O-N 2.89Å; I125-E130 HydrophobicContact CG2-CB 4.36Å; I125-P133 HydrophobicContact CD1-CG 3.87Å
126	N	90.4	Very high	89.1	Confident	71 Å²	71	68.1 Å²	68.1	38%	0.38	34%	0.337	S	S	.	.			trans	-89.4	93.8	176.9	-176.8	-6	0	0	0	109.4	Q124 E128 V129 E130	Q124-N126 PolarHBondContact O-N 3.45Å; N126-E128 PolarHBondContact O-N 3.03Å; N126-E128 WeakPolarHBondContact OD1-CB 3.4Å; N126-E128 PolarHBondContact OD1-N 3.23Å; N126-E128 VanDerWaalsContact OD1-N 3.15Å; N126-V129 WeakPolarHBondContact ND2-CG2 3.46Å; N126-V129 PolarHBondContact O-N 2.98Å; N126-E130 PolarHBondContact N-OE2 3.48Å; N126-E130 WeakPolarHBondContact O-CA 3.27Å; N126-E130 WeakPolarHBondContact O-CB 3.39Å; N126-E130 PolarHBondContact O-N 3.19Å
127	E	87.1	Confident	89.1	Confident	156 Å²	156	70.4 Å²	70.4	73%	0.729	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-19	-177.9	-62.6	178.7	-173.9	0	0	114.2	I125	I125-E127 PolarHBondContact O-N 2.89Å
128	E	86	Confident	89.2	Confident	185 Å²	185	69.8 Å²	69.8	86%	0.864	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-24.1	177.2	-60	-178	174.6	0	0	113.2	N126	N126-E128 PolarHBondContact O-N 3.03Å; N126-E128 WeakPolarHBondContact OD1-CB 3.4Å; N126-E128 PolarHBondContact OD1-N 3.23Å; N126-E128 VanDerWaalsContact OD1-N 3.15Å
129	V	86.7	Confident	89.3	Confident	70 Å²	70	71.1 Å²	71.1	42%	0.424	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	-37.5	-170.8	-178.4	0	0	0	0	112	N126 Q174	N126-V129 WeakPolarHBondContact ND2-CG2 3.46Å; N126-V129 PolarHBondContact O-N 2.98Å; V129-Q174 VanDerWaalsContact O-CD 3.24Å; V129-Q174 VanDerWaalsContact O-CG 3.26Å; V129-Q174 WeakPolarHBondContact O-CG 3.41Å; V129-Q174 PolarHBondContact O-NE2 3.18Å; V129-Q174 VanDerWaalsContact O-NE2 3.08Å
130	E	87.3	Confident	89.6	Confident	12 Å²	12	68.9 Å²	68.9	6%	0.056	34%	0.342	C	S	.	.	S	Bend	trans	-100.5	111.5	177	-59.1	-179.3	124.5	0	0	107.3	K80 I125 N126 K132 C173 Q174 Y177	K80-E130 WeakPolarHBondContact CE-OE2 3.42Å; K80-E130 IonicContact NZ-OE1 3.34Å; K80-E130 PolarHBondContact NZ-OE1 2.8Å; K80-E130 IonicContact NZ-OE2 2.82Å; K80-E130 PolarHBondContact NZ-OE2 3.08Å; I125-E130 HydrophobicContact CG2-CB 4.36Å; N126-E130 PolarHBondContact N-OE2 3.48Å; N126-E130 WeakPolarHBondContact O-CA 3.27Å; N126-E130 WeakPolarHBondContact O-CB 3.39Å; N126-E130 PolarHBondContact O-N 3.19Å; E130-K132 PolarHBondContact O-N 3.28Å; E130-C173 PolarHBondContact OE1-N 3.01Å; E130-Q174 HydrophobicContact CG-CB 4.2Å; E130-Y177 HydrophobicContact CB-CD2 4.1Å
131	D	77.9	Confident	89.9	Confident	104 Å²	104	69.6 Å²	69.6	56%	0.556	34%	0.344	S	S	*	.			trans	-51.6	134.7	169.8	-73.1	-33.5	0	0	0	108.5	Y177	D131-Y177 VanDerWaalsContact O-CB 3.31Å; D131-Y177 WeakPolarHBondContact O-CB 3.49Å
132	K	74.1	Confident	89.9	Confident	90 Å²	90	69.7 Å²	69.7	39%	0.391	35%	0.346	S	S	.	.			trans	-55.4	135.3	-178.4	-174.4	-179.8	157.5	-151	0	108.3	E130 E134 E137	E130-K132 PolarHBondContact O-N 3.28Å; K132-E134 HydrophobicContact CB-CG 3.93Å; K132-E134 HydrophobicContact CD-CG 3.54Å; K132-E134 VanDerWaalsContact CD-OE1 3.24Å; K132-E134 WeakPolarHBondContact CD-OE1 3.49Å; K132-E134 WeakPolarHBondContact CE-OE1 3.5Å; K132-E134 HydrophobicContact CG-CG 3.61Å; K132-E134 IonicContact NZ-OE1 3.66Å; K132-E134 PolarHBondContact NZ-OE1 3.45Å; K132-E134 PolarHBondContact O-N 2.76Å; K132-E137 WeakPolarHBondContact CE-OE1 3.31Å; K132-E137 IonicContact NZ-OE1 2.7Å
133	P	83.9	Confident	90	Very high	2 Å²	2	71.4 Å²	71.4	1%	0.013	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-73	37.2	-175.5	31.6	-37.7	0	0	0	113.3	A81 I125 S135 F136 Y177	A81-P133 HydrophobicContact CB-CB 4.01Å; A81-P133 HydrophobicContact CB-CG 3.79Å; I125-P133 HydrophobicContact CD1-CG 3.87Å; P133-S135 PolarHBondContact O-N 2.69Å; P133-F136 HydrophobicContact CB-CD2 4.28Å; P133-F136 PolarHBondContact O-N 2.97Å; P133-Y177 HydrophobicContact CB-CD1 3.84Å; P133-Y177 HydrophobicContact CB-CD2 4.26Å; P133-Y177 HydrophobicContact CB-CE1 3.96Å; P133-Y177 HydrophobicContact CB-CE2 4.4Å; P133-Y177 HydrophobicContact CB-CG 4.01Å; P133-Y177 HydrophobicContact CG-CE2 4.4Å
134	E	85.4	Confident	90.1	Very high	111 Å²	111	70.4 Å²	70.4	52%	0.519	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-60.8	-30.8	-178.8	-60.3	-170.3	155.3	0	0	112.1	K132 F136 E137	K132-E134 HydrophobicContact CB-CG 3.93Å; K132-E134 HydrophobicContact CD-CG 3.54Å; K132-E134 VanDerWaalsContact CD-OE1 3.24Å; K132-E134 WeakPolarHBondContact CD-OE1 3.49Å; K132-E134 WeakPolarHBondContact CE-OE1 3.5Å; K132-E134 HydrophobicContact CG-CG 3.61Å; K132-E134 IonicContact NZ-OE1 3.66Å; K132-E134 PolarHBondContact NZ-OE1 3.45Å; K132-E134 PolarHBondContact O-N 2.76Å; E134-F136 PolarHBondContact O-N 3.34Å; E134-F136 VanDerWaalsContact O-N 3.15Å; E134-E137 WeakPolarHBondContact O-CB 3.35Å; E134-E137 PolarHBondContact O-N 3.14Å
135	S	88.4	Confident	90.2	Very high	37 Å²	37	66.9 Å²	66.9	26%	0.259	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-62.6	-18.8	175.9	57.9	0	0	0	0	113.6	P133	P133-S135 PolarHBondContact O-N 2.69Å
136	F	93.1	Very high	90.4	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-103.6	-2.7	176.4	-58.6	-88.7	0	0	0	112.9	I68 E69 R71 L73 P133 E134 E176 Y177 F181	I68-F136 WeakPolarHBondContact CA-O 3.32Å; I68-F136 HydrophobicContact CD1-CB 4.39Å; I68-F136 HydrophobicContact CG2-CB 4.08Å; E69-F136 PolarHBondContact N-O 2.82Å; R71-F136 HydrophobicContact CB-CD1 4.2Å; R71-F136 HydrophobicContact CB-CE1 4.29Å; L73-F136 HydrophobicContact CD1-CB 4.17Å; L73-F136 HydrophobicContact CD1-CD1 3.77Å; L73-F136 HydrophobicContact CD1-CD2 4.24Å; L73-F136 HydrophobicContact CD1-CE1 4.19Å; L73-F136 HydrophobicContact CD1-CG 3.8Å; L73-F136 HydrophobicContact CD2-CD1 4.14Å; L73-F136 HydrophobicContact CD2-CD2 4.14Å; L73-F136 HydrophobicContact CD2-CE1 3.72Å; L73-F136 HydrophobicContact CD2-CE2 3.73Å; L73-F136 HydrophobicContact CD2-CG 4.32Å; L73-F136 HydrophobicContact CD2-CZ 3.48Å; L73-F136 VanDerWaalsContact CD2-CZ 3.48Å; L73-F136 HydrophobicContact CG-CD1 3.65Å; L73-F136 HydrophobicContact CG-CD2 4.4Å; L73-F136 HydrophobicContact CG-CE1 3.54Å; L73-F136 HydrophobicContact CG-CE2 4.32Å; L73-F136 HydrophobicContact CG-CG 4.08Å; L73-F136 HydrophobicContact CG-CZ 3.88Å; P133-F136 HydrophobicContact CB-CD2 4.28Å; P133-F136 PolarHBondContact O-N 2.97Å; E134-F136 PolarHBondContact O-N 3.34Å; E134-F136 VanDerWaalsContact O-N 3.15Å; F136-E176 WeakPolarHBondContact CE2-O 3.09Å; F136-E176 WeakPolarHBondContact CZ-O 3.45Å; F136-Y177 HydrophobicContact CE2-CD1 4.5Å; F136-F181 AromaticContact CE1-CD2 3.84Å; F136-F181 HydrophobicContact CE1-CD2 3.84Å; F136-F181 AromaticContact CE1-CE2 3.47Å; F136-F181 HydrophobicContact CE1-CE2 3.47Å; F136-F181 VanDerWaalsContact CE1-CE2 3.47Å; F136-F181 AromaticContact CZ-CD2 4Å; F136-F181 HydrophobicContact CZ-CD2 4Å; F136-F181 AromaticContact CZ-CE2 3.52Å; F136-F181 HydrophobicContact CZ-CE2 3.52Å
137	E	94.5	Very high	90.7	Very high	48 Å²	48	66.1 Å²	66.1	22%	0.224	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	131.7	174.5	-68	173.4	-160	0	0	110.1	T66 I68 W85 K132 E134	T66-E137 HydrophobicContact CG2-CB 3.93Å; T66-E137 HydrophobicContact CG2-CG 4.23Å; I68-E137 HydrophobicContact CD1-CG 3.7Å; W85-E137 HydrophobicContact CZ2-CG 3.97Å; W85-E137 VanDerWaalsContact CZ2-OE1 3.31Å; W85-E137 WeakPolarHBondContact CZ2-OE1 3.4Å; W85-E137 WeakPolarHBondContact CZ2-OE2 3.35Å; K132-E137 WeakPolarHBondContact CE-OE1 3.31Å; K132-E137 IonicContact NZ-OE1 2.7Å; E134-E137 WeakPolarHBondContact O-CB 3.35Å; E134-E137 PolarHBondContact O-N 3.14Å
138	A	95.4	Very high	91.2	Very high	18 Å²	18	58.7 Å²	58.7	15%	0.149	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	137.6	172.6	0	0	0	0	0	109.8	T66 F67 E69 Y140	T66-A138 WeakPolarHBondContact CA-O 3.48Å; F67-A138 PolarHBondContact N-O 3.44Å; F67-A138 PolarHBondContact O-N 3.25Å; E69-A138 HydrophobicContact CG-CB 3.88Å; A138-Y140 HydrophobicContact CB-CD2 4.46Å; A138-Y140 HydrophobicContact CB-CE2 3.8Å; A138-Y140 WeakPolarHBondContact O-CD2 3.4Å
139	V	97	Very high	91.8	Very high	110 Å²	110	54.3 Å²	54.3	67%	0.667	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	115.4	172	-178.7	0	0	0	0	108.4	T64	T64-V139 HydrophobicContact CG2-CG1 3.67Å
140	Y	96.8	Very high	92.3	Very high	33 Å²	33	54.1 Å²	54.1	13%	0.129	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	141.5	177.4	-70.5	-71.8	0	0	0	111.4	T64 Y65 F67 E69 A138 R150	T64-Y140 CarbonylContact C-O 3.57Å; T64-Y140 WeakPolarHBondContact CA-O 3.37Å; Y65-Y140 HydrophobicContact CD2-CD2 4.5Å; Y65-Y140 AromaticContact CE2-CD2 3.95Å; Y65-Y140 HydrophobicContact CE2-CD2 3.95Å; Y65-Y140 HydrophobicContact CE2-CG 4.17Å; Y65-Y140 PolarHBondContact N-O 3.4Å; Y65-Y140 PolarHBondContact O-N 3.17Å; F67-Y140 HydrophobicContact CB-CD2 3.78Å; F67-Y140 HydrophobicContact CB-CE2 3.81Å; E69-Y140 VanDerWaalsContact CD-OH 3.24Å; E69-Y140 WeakPolarHBondContact CG-OH 2.89Å; E69-Y140 PolarHBondContact OE1-OH 3.08Å; A138-Y140 HydrophobicContact CB-CD2 4.46Å; A138-Y140 HydrophobicContact CB-CE2 3.8Å; A138-Y140 WeakPolarHBondContact O-CD2 3.4Å; Y140-R150 VanDerWaalsContact CZ-CZ 3.41Å; Y140-R150 PolarHBondContact OH-NH1 3.21Å
141	R	96.7	Very high	92.8	Very high	193 Å²	193	53.6 Å²	53.6	73%	0.728	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	107	166.1	-172.9	-179.6	-179	94.2	-3.3	108.4	I63 T64	I63-R141 WeakPolarHBondContact O-CA 3.41Å; T64-R141 PolarHBondContact OG1-NH1 2.97Å
142	G	93.4	Very high	93.8	Very high	6 Å²	6	49.8 Å²	49.8	6%	0.062	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	-178.2	-170.8	0	0	0	0	0	112.7	S62 I63 E146	S62-G142 CarbonylContact C-O 3.44Å; S62-G142 WeakPolarHBondContact CA-O 3.39Å; S62-G142 WeakPolarHBondContact CB-O 3.21Å; I63-G142 PolarHBondContact N-O 3.33Å; I63-G142 PolarHBondContact O-N 2.87Å; G142-E146 WeakPolarHBondContact CA-OE2 3.3Å
143	S	95.6	Very high	94.9	Very high	37 Å²	37	49.7 Å²	49.7	26%	0.259	25%	0.247	S	C	.	.			trans	-71.7	154.9	176.1	69.8	0	0	0	0	111.6	L145 E146 A147	S143-L145 PolarHBondContact O-N 3.12Å; S143-E146 PolarHBondContact N-OE2 3.39Å; S143-E146 PolarHBondContact O-N 3.31Å; S143-E146 VanDerWaalsContact O-N 3.16Å; S143-E146 WeakPolarHBondContact OG-CG 3.4Å; S143-E146 PolarHBondContact OG-N 2.92Å; S143-E146 PolarHBondContact OG-OE2 3.11Å; S143-A147 PolarHBondContact O-N 2.97Å
144	P	96.4	Very high	95.6	Very high	26 Å²	26	49.6 Å²	49.6	17%	0.169	25%	0.246	C	C	.	.	H	α-helix	trans	-56.2	-32	170.1	-26.6	35.2	0	0	0	113.1	Q56 C61 I63 F94 A147 L148	Q56-P144 HydrophobicContact CG-CB 4.48Å; C61-P144 WeakPolarHBondContact O-CD 3.38Å; I63-P144 HydrophobicContact CG2-CG 4.25Å; F94-P144 HydrophobicContact CE1-CB 3.94Å; F94-P144 HydrophobicContact CZ-CB 4.04Å; F94-P144 WeakPolarHBondContact CZ-O 3.38Å; P144-A147 PolarHBondContact O-N 3.39Å; P144-L148 WeakPolarHBondContact O-CG 3.45Å; P144-L148 PolarHBondContact O-N 3.22Å
145	L	96.1	Very high	96.2	Very high	58 Å²	58	44.4 Å²	44.4	30%	0.304	22%	0.222	S	C	.	.	H	α-helix	trans	-61.6	-46.8	175.6	176.9	62.1	0	0	0	111.7	M53 Q56 S143 A147 L148 Q149	M53-L145 HydrophobicContact CB-CD1 3.6Å; M53-L145 HydrophobicContact CE-CD1 3.92Å; M53-L145 HydrophobicContact CG-CD1 3.9Å; Q56-L145 HydrophobicContact CB-CB 4.47Å; S143-L145 PolarHBondContact O-N 3.12Å; L145-A147 VanDerWaalsContact C-N 3.29Å; L145-A147 PolarHBondContact O-N 3.11Å; L145-L148 PolarHBondContact O-N 2.04Å; L145-Q149 WeakPolarHBondContact O-CG 3.28Å; L145-Q149 PolarHBondContact O-N 3.3Å
146	E	96.1	Very high	96.6	Very high	93 Å²	93	44.7 Å²	44.7	44%	0.435	22%	0.224	S	C	.	.	H	α-helix	trans	-61.9	-38.1	177	-72.1	165	160.5	0	0	111.7	G142 S143 Q149 R150	G142-E146 WeakPolarHBondContact CA-OE2 3.3Å; S143-E146 PolarHBondContact N-OE2 3.39Å; S143-E146 PolarHBondContact O-N 3.31Å; S143-E146 VanDerWaalsContact O-N 3.16Å; S143-E146 WeakPolarHBondContact OG-CG 3.4Å; S143-E146 PolarHBondContact OG-N 2.92Å; S143-E146 PolarHBondContact OG-OE2 3.11Å; E146-Q149 WeakPolarHBondContact O-CB 2.99Å; E146-Q149 PolarHBondContact O-N 3.3Å; E146-R150 PolarHBondContact O-N 2.89Å
147	A	97.3	Very high	96.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.3	-42.7	175.9	0	0	0	0	0	111.8	I63 Y65 L89 F94 S143 P144 L145 Q149 R150 V151	I63-A147 HydrophobicContact CD1-CB 3.84Å; Y65-A147 HydrophobicContact CD1-CB 4.2Å; Y65-A147 HydrophobicContact CE1-CB 3.62Å; Y65-A147 HydrophobicContact CE2-CB 4.05Å; Y65-A147 WeakPolarHBondContact OH-CA 3.17Å; L89-A147 HydrophobicContact CD1-CB 4.24Å; L89-A147 HydrophobicContact CD2-CB 3.98Å; F94-A147 HydrophobicContact CE2-CB 4.29Å; F94-A147 HydrophobicContact CZ-CB 4.21Å; S143-A147 PolarHBondContact O-N 2.97Å; P144-A147 PolarHBondContact O-N 3.39Å; L145-A147 VanDerWaalsContact C-N 3.29Å; L145-A147 PolarHBondContact O-N 3.11Å; A147-Q149 VanDerWaalsContact C-N 3.34Å; A147-Q149 PolarHBondContact O-N 2.72Å; A147-R150 PolarHBondContact O-N 3.43Å; A147-V151 PolarHBondContact O-N 3.41Å
148	L	97.8	Very high	96.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-67.9	-30.9	174.9	-70.4	170.5	0	0	0	113	L52 M53 Q56 F94 P144 L145 R150 V151 S152	L52-L148 HydrophobicContact CB-CD1 3.9Å; L52-L148 HydrophobicContact CB-CD2 4.32Å; L52-L148 HydrophobicContact CD1-CD2 4.43Å; M53-L148 HydrophobicContact CG-CB 3.56Å; M53-L148 HydrophobicContact CG-CD1 4.12Å; M53-L148 HydrophobicContact CG-CG 4.48Å; Q56-L148 HydrophobicContact CG-CD1 3.78Å; F94-L148 HydrophobicContact CD1-CD1 4.34Å; F94-L148 HydrophobicContact CD1-CD2 4.17Å; F94-L148 HydrophobicContact CD1-CG 4.37Å; F94-L148 HydrophobicContact CD2-CD2 4.44Å; F94-L148 HydrophobicContact CE1-CD1 3.6Å; F94-L148 HydrophobicContact CE1-CD2 3.82Å; F94-L148 HydrophobicContact CE1-CG 3.56Å; F94-L148 HydrophobicContact CE2-CD2 4.1Å; F94-L148 HydrophobicContact CE2-CG 4.24Å; F94-L148 HydrophobicContact CG-CD2 4.49Å; F94-L148 HydrophobicContact CZ-CD1 4.06Å; F94-L148 HydrophobicContact CZ-CD2 3.79Å; F94-L148 HydrophobicContact CZ-CG 3.49Å; F94-L148 VanDerWaalsContact CZ-CG 3.49Å; P144-L148 WeakPolarHBondContact O-CG 3.45Å; P144-L148 PolarHBondContact O-N 3.22Å; L145-L148 PolarHBondContact O-N 2.04Å; L148-R150 VanDerWaalsContact C-N 3.33Å; L148-V151 WeakPolarHBondContact O-CB 3.37Å; L148-V151 PolarHBondContact O-N 3.47Å; L148-S152 PolarHBondContact O-N 3.36Å
149	Q	97.2	Very high	96.8	Very high	93 Å²	93	46.3 Å²	46.3	44%	0.435	23%	0.226	S	C	.	.	H	α-helix	trans	-61.8	-41.6	173.1	-75.2	170	-18.8	0	0	111.4	M53 L145 E146 A147 V151 S152 E153	M53-Q149 HydrophobicContact CE-CG 3.57Å; M53-Q149 HydrophobicContact SD-CG 4.34Å; L145-Q149 WeakPolarHBondContact O-CG 3.28Å; L145-Q149 PolarHBondContact O-N 3.3Å; E146-Q149 WeakPolarHBondContact O-CB 2.99Å; E146-Q149 PolarHBondContact O-N 3.3Å; A147-Q149 VanDerWaalsContact C-N 3.34Å; A147-Q149 PolarHBondContact O-N 2.72Å; Q149-V151 VanDerWaalsContact C-N 3.34Å; Q149-V151 PolarHBondContact O-N 3.49Å; Q149-S152 WeakPolarHBondContact O-CB 3.17Å; Q149-S152 PolarHBondContact O-N 2.63Å; Q149-E153 PolarHBondContact O-N 2.93Å
150	R	98	Very high	96.6	Very high	66 Å²	66	45 Å²	45	25%	0.249	21%	0.213	C	C	.	.	H	α-helix	trans	-63.8	-38.1	174.4	-65.8	178.2	-176.6	-79.9	-2.9	112.4	Y65 F67 Y140 E146 A147 L148 E153 V154	Y65-R150 WeakPolarHBondContact OH-CD 2.94Å; Y65-R150 PolarHBondContact OH-NE 3.49Å; F67-R150 HydrophobicContact CD1-CB 4.13Å; F67-R150 HydrophobicContact CE1-CB 3.79Å; F67-R150 HydrophobicContact CZ-CB 4.09Å; Y140-R150 VanDerWaalsContact CZ-CZ 3.41Å; Y140-R150 PolarHBondContact OH-NH1 3.21Å; E146-R150 PolarHBondContact O-N 2.89Å; A147-R150 PolarHBondContact O-N 3.43Å; L148-R150 VanDerWaalsContact C-N 3.33Å; R150-E153 PolarHBondContact O-N 3.29Å; R150-V154 WeakPolarHBondContact O-CG2 3.09Å; R150-V154 PolarHBondContact O-N 3.43Å; R150-V154 VanDerWaalsContact O-N 3.14Å
151	V	98.3	Very high	96.5	Very high	1 Å²	1	45 Å²	45	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-48.6	171.7	177.3	0	0	0	0	110.6	V49 I86 L89 A147 L148 Q149 E153 V154 L155	V49-V151 HydrophobicContact CG1-CG1 4.48Å; V49-V151 HydrophobicContact CG2-CG1 4.42Å; I86-V151 HydrophobicContact CD1-CG1 4.41Å; I86-V151 HydrophobicContact CG1-CG2 4.23Å; I86-V151 HydrophobicContact CG2-CB 4.37Å; I86-V151 HydrophobicContact CG2-CG1 3.68Å; I86-V151 HydrophobicContact CG2-CG2 3.91Å; L89-V151 HydrophobicContact CD2-CG2 3.8Å; A147-V151 PolarHBondContact O-N 3.41Å; L148-V151 WeakPolarHBondContact O-CB 3.37Å; L148-V151 PolarHBondContact O-N 3.47Å; Q149-V151 VanDerWaalsContact C-N 3.34Å; Q149-V151 PolarHBondContact O-N 3.49Å; V151-E153 VanDerWaalsContact C-N 3.31Å; V151-E153 PolarHBondContact O-N 3.35Å; V151-V154 PolarHBondContact O-N 3.19Å; V151-L155 HydrophobicContact CG1-CD1 4.07Å; V151-L155 HydrophobicContact CG1-CG 4.44Å; V151-L155 WeakPolarHBondContact O-CG 3.24Å; V151-L155 PolarHBondContact O-N 3.15Å; V151-L155 VanDerWaalsContact O-N 3.11Å
152	S	98.2	Very high	96.1	Very high	24 Å²	24	36.7 Å²	36.7	17%	0.168	19%	0.185	C	C	.	.	H	α-helix	trans	-59.1	-41.8	178.9	-170.3	0	0	0	0	112.3	L148 Q149 S156	L148-S152 PolarHBondContact O-N 3.36Å; Q149-S152 WeakPolarHBondContact O-CB 3.17Å; Q149-S152 PolarHBondContact O-N 2.63Å; S152-S156 VanDerWaalsContact O-CB 3.3Å; S152-S156 WeakPolarHBondContact O-CB 3.28Å; S152-S156 PolarHBondContact O-N 3.38Å; S152-S156 PolarHBondContact O-OG 3.35Å
153	E	97.9	Very high	95.9	Very high	88 Å²	88	38.4 Å²	38.4	41%	0.411	20%	0.195	S	C	.	.	H	α-helix	trans	-59	-54.6	177.1	179.5	178.7	-162.6	0	0	111.4	Q149 R150 V151 L155 S156 V157	Q149-E153 PolarHBondContact O-N 2.93Å; R150-E153 PolarHBondContact O-N 3.29Å; V151-E153 VanDerWaalsContact C-N 3.31Å; V151-E153 PolarHBondContact O-N 3.35Å; E153-L155 PolarHBondContact O-N 3.36Å; E153-S156 WeakPolarHBondContact O-CB 3.35Å; E153-S156 PolarHBondContact O-N 3.44Å; E153-S156 VanDerWaalsContact O-N 3.11Å; E153-V157 WeakPolarHBondContact O-CG2 3.49Å; E153-V157 PolarHBondContact O-N 3.01Å
154	V	98.4	Very high	95.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.6	-45.4	-179.2	173.4	0	0	0	0	111.7	F67 F78 V79 A82 I86 R150 V151 S156 V157 Y158	F67-V154 HydrophobicContact CE1-CG2 3.92Å; F67-V154 HydrophobicContact CZ-CG2 3.99Å; F78-V154 HydrophobicContact CE1-CG2 3.7Å; F78-V154 HydrophobicContact CE2-CG2 4.37Å; F78-V154 HydrophobicContact CZ-CG2 3.55Å; V79-V154 HydrophobicContact CG1-CG1 4.44Å; V79-V154 HydrophobicContact CG2-CG1 4.26Å; A82-V154 HydrophobicContact CB-CB 4.48Å; A82-V154 HydrophobicContact CB-CG1 3.98Å; A82-V154 HydrophobicContact CB-CG2 3.63Å; I86-V154 HydrophobicContact CD1-CB 3.66Å; I86-V154 HydrophobicContact CD1-CG1 3.56Å; I86-V154 HydrophobicContact CD1-CG2 4.12Å; R150-V154 WeakPolarHBondContact O-CG2 3.09Å; R150-V154 PolarHBondContact O-N 3.43Å; R150-V154 VanDerWaalsContact O-N 3.14Å; V151-V154 PolarHBondContact O-N 3.19Å; V154-S156 VanDerWaalsContact C-N 3.27Å; V154-S156 PolarHBondContact O-N 2.96Å; V154-V157 PolarHBondContact O-N 2.84Å; V154-Y158 PolarHBondContact O-N 2.74Å
155	L	97.9	Very high	94.6	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-66.1	-32	179.1	-63	-178.5	0	0	0	111.9	I41 L46 V49 L83 L109 V151 E153 W159	I41-L155 HydrophobicContact CD1-CB 4.02Å; I41-L155 HydrophobicContact CD1-CD2 3.67Å; I41-L155 HydrophobicContact CD1-CG 4.34Å; L46-L155 HydrophobicContact CD2-CB 3.79Å; V49-L155 HydrophobicContact CG2-CD1 3.9Å; L83-L155 HydrophobicContact CD2-CD2 4.32Å; L109-L155 HydrophobicContact CD2-CD1 4.37Å; V151-L155 HydrophobicContact CG1-CD1 4.07Å; V151-L155 HydrophobicContact CG1-CG 4.44Å; V151-L155 WeakPolarHBondContact O-CG 3.24Å; V151-L155 PolarHBondContact O-N 3.15Å; V151-L155 VanDerWaalsContact O-N 3.11Å; E153-L155 PolarHBondContact O-N 3.36Å; L155-W159 WeakPolarHBondContact O-CB 3.3Å; L155-W159 PolarHBondContact O-N 3.5Å
156	S	96.6	Very high	93.7	Very high	44 Å²	44	47.8 Å²	47.8	31%	0.308	25%	0.248	S	C	.	.	H	α-helix	trans	-70.8	-42.4	174.9	-59.7	0	0	0	0	111.8	S152 E153 V154 Y158 W159 E160	S152-S156 VanDerWaalsContact O-CB 3.3Å; S152-S156 WeakPolarHBondContact O-CB 3.28Å; S152-S156 PolarHBondContact O-N 3.38Å; S152-S156 PolarHBondContact O-OG 3.35Å; E153-S156 WeakPolarHBondContact O-CB 3.35Å; E153-S156 PolarHBondContact O-N 3.44Å; E153-S156 VanDerWaalsContact O-N 3.11Å; V154-S156 VanDerWaalsContact C-N 3.27Å; V154-S156 PolarHBondContact O-N 2.96Å; S156-Y158 VanDerWaalsContact C-N 3.35Å; S156-W159 PolarHBondContact O-N 3.07Å; S156-E160 PolarHBondContact O-N 3.38Å
157	V	96.9	Very high	93	Very high	18 Å²	18	47 Å²	47	11%	0.109	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-44.5	174.4	174	0	0	0	0	110.6	K75 F78 V79 E153 V154 W159 E160 L161	K75-V157 HydrophobicContact CB-CG1 3.69Å; K75-V157 HydrophobicContact CD-CG1 4.2Å; K75-V157 HydrophobicContact CG-CG1 3.96Å; F78-V157 HydrophobicContact CE1-CG2 4.5Å; V79-V157 HydrophobicContact CG2-CB 4.01Å; V79-V157 HydrophobicContact CG2-CG1 3.67Å; E153-V157 WeakPolarHBondContact O-CG2 3.49Å; E153-V157 PolarHBondContact O-N 3.01Å; V154-V157 PolarHBondContact O-N 2.84Å; V157-W159 PolarHBondContact O-N 3.4Å; V157-E160 PolarHBondContact O-N 3.36Å; V157-L161 HydrophobicContact CG1-CD1 4.29Å; V157-L161 WeakPolarHBondContact O-CG 3.44Å; V157-L161 PolarHBondContact O-N 3.49Å
158	Y	96.3	Very high	92.5	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.8	-48.1	173.5	173.8	-94	0	0	0	111.8	S40 I41 V79 M116 C121 V122 V154 S156 E160 L161 V162 W171	S40-Y158 VanDerWaalsContact OG-CE1 3.24Å; S40-Y158 WeakPolarHBondContact OG-CE1 3.24Å; S40-Y158 PolarHBondContact OG-OH 2.71Å; I41-Y158 HydrophobicContact CB-CD1 4.23Å; I41-Y158 HydrophobicContact CB-CE1 4.24Å; I41-Y158 HydrophobicContact CD1-CD1 3.38Å; I41-Y158 HydrophobicContact CD1-CE1 3.91Å; I41-Y158 HydrophobicContact CD1-CG 4.25Å; I41-Y158 HydrophobicContact CG1-CD1 3.67Å; I41-Y158 HydrophobicContact CG1-CE1 3.68Å; V79-Y158 HydrophobicContact CG1-CD2 3.97Å; V79-Y158 HydrophobicContact CG1-CG 4.38Å; M116-Y158 HydrophobicContact CE-CD1 3.82Å; M116-Y158 HydrophobicContact CE-CD2 3.6Å; M116-Y158 HydrophobicContact CE-CE1 3.73Å; M116-Y158 HydrophobicContact CE-CE2 3.52Å; M116-Y158 HydrophobicContact CE-CG 3.72Å; C121-Y158 VanDerWaalsContact CB-OH 3.28Å; C121-Y158 WeakPolarHBondContact CB-OH 3.47Å; V122-Y158 HydrophobicContact CG2-CD2 3.89Å; V122-Y158 HydrophobicContact CG2-CE2 3.51Å; V154-Y158 PolarHBondContact O-N 2.74Å; S156-Y158 VanDerWaalsContact C-N 3.35Å; Y158-E160 VanDerWaalsContact C-N 3.3Å; Y158-E160 PolarHBondContact O-N 2.91Å; Y158-L161 WeakPolarHBondContact O-CB 3.36Å; Y158-L161 PolarHBondContact O-N 2.96Å; Y158-V162 HydrophobicContact CD1-CG2 4.29Å; Y158-V162 HydrophobicContact CD2-CG1 4.12Å; Y158-V162 HydrophobicContact CE1-CG1 4.03Å; Y158-V162 HydrophobicContact CE1-CG2 3.88Å; Y158-V162 HydrophobicContact CE2-CG1 3.55Å; Y158-V162 WeakPolarHBondContact O-CG2 3.43Å; Y158-V162 PolarHBondContact O-N 3.23Å; Y158-V162 VanDerWaalsContact O-N 3.07Å; Y158-W171 HydrophobicContact CD2-CH2 4.11Å; Y158-W171 HydrophobicContact CE2-CH2 4.27Å; Y158-W171 HydrophobicContact CE2-CZ2 4.27Å
159	W	94	Very high	92.1	Very high	82 Å²	82	53.7 Å²	53.7	31%	0.311	30%	0.296	S	S	.	.	H	α-helix	trans	-59.1	-42.7	-180	179.5	49.6	0	0	0	111.5	I41 R43 L46 L155 S156 V157 V162 T163	I41-W159 HydrophobicContact CG2-CB 4.4Å; R43-W159 HydrophobicContact CG-CZ2 4.47Å; L46-W159 HydrophobicContact CD1-CD2 4.25Å; L46-W159 HydrophobicContact CD1-CE3 3.83Å; L46-W159 HydrophobicContact CD1-CZ3 4.29Å; L155-W159 WeakPolarHBondContact O-CB 3.3Å; L155-W159 PolarHBondContact O-N 3.5Å; S156-W159 PolarHBondContact O-N 3.07Å; V157-W159 PolarHBondContact O-N 3.4Å; W159-V162 PolarHBondContact O-N 2.8Å; W159-T163 HydrophobicContact CG-CG2 4.47Å; W159-T163 WeakPolarHBondContact O-CB 3.45Å; W159-T163 WeakPolarHBondContact O-CG2 3.36Å; W159-T163 PolarHBondContact O-N 3.18Å; W159-T163 VanDerWaalsContact O-N 3.09Å; W159-T163 PolarHBondContact O-OG1 3.01Å
160	E	93.4	Very high	91.9	Very high	83 Å²	83	53.2 Å²	53.2	39%	0.388	30%	0.296	S	S	.	.	H	α-helix	trans	-59.3	-48.3	174.4	-170.8	-164.9	163.3	0	0	111.7	K75 S156 V157 Y158 V162 T163 T164	K75-E160 IonicContact NZ-OE1 2.71Å; K75-E160 PolarHBondContact NZ-OE1 2.65Å; K75-E160 IonicContact NZ-OE2 2.74Å; K75-E160 PolarHBondContact NZ-OE2 3.09Å; S156-E160 PolarHBondContact O-N 3.38Å; V157-E160 PolarHBondContact O-N 3.36Å; Y158-E160 VanDerWaalsContact C-N 3.3Å; Y158-E160 PolarHBondContact O-N 2.91Å; E160-V162 PolarHBondContact O-N 2.73Å; E160-T163 PolarHBondContact O-N 3.33Å; E160-T164 WeakPolarHBondContact O-CB 3.36Å; E160-T164 PolarHBondContact O-N 3.18Å; E160-T164 PolarHBondContact O-OG1 2.66Å
161	L	93.1	Very high	91.7	Very high	33 Å²	33	51.7 Å²	51.7	17%	0.173	29%	0.291	C	S	.	.	H	α-helix	trans	-56.3	-47.9	-179.9	-77.3	168.2	0	0	0	112.1	K75 C76 V79 V157 Y158 S165 V169 W171	K75-L161 HydrophobicContact CB-CD1 4.06Å; K75-L161 HydrophobicContact CB-CD2 3.91Å; K75-L161 HydrophobicContact CB-CG 4.17Å; C76-L161 HydrophobicContact CB-CD1 4.17Å; V79-L161 HydrophobicContact CG2-CD1 4.22Å; V157-L161 HydrophobicContact CG1-CD1 4.29Å; V157-L161 WeakPolarHBondContact O-CG 3.44Å; V157-L161 PolarHBondContact O-N 3.49Å; Y158-L161 WeakPolarHBondContact O-CB 3.36Å; Y158-L161 PolarHBondContact O-N 2.96Å; L161-S165 WeakPolarHBondContact O-CB 3.37Å; L161-V169 HydrophobicContact CB-CG2 4.25Å; L161-W171 HydrophobicContact CD1-CH2 4.47Å
162	V	90.2	Very high	91.5	Very high	17 Å²	17	61 Å²	61	10%	0.103	33%	0.325	C	S	.	.	H	α-helix	trans	-83.8	-16.1	-173	-57.6	0	0	0	0	113.9	R38 Y158 W159 E160 V169	R38-V162 WeakPolarHBondContact CG-O 3.3Å; Y158-V162 HydrophobicContact CD1-CG2 4.29Å; Y158-V162 HydrophobicContact CD2-CG1 4.12Å; Y158-V162 HydrophobicContact CE1-CG1 4.03Å; Y158-V162 HydrophobicContact CE1-CG2 3.88Å; Y158-V162 HydrophobicContact CE2-CG1 3.55Å; Y158-V162 WeakPolarHBondContact O-CG2 3.43Å; Y158-V162 PolarHBondContact O-N 3.23Å; Y158-V162 VanDerWaalsContact O-N 3.07Å; W159-V162 PolarHBondContact O-N 2.8Å; E160-V162 PolarHBondContact O-N 2.73Å; V162-V169 HydrophobicContact CG1-CG2 4.42Å
163	T	89	Confident	91.3	Very high	42 Å²	42	59.8 Å²	59.8	26%	0.258	32%	0.317	S	S	.	.	H	α-helix	trans	-98.4	-29.7	179.4	55.9	0	0	0	0	114.1	R38 W159 E160	R38-T163 HydrophobicContact CG-CG2 4.49Å; W159-T163 HydrophobicContact CG-CG2 4.47Å; W159-T163 WeakPolarHBondContact O-CB 3.45Å; W159-T163 WeakPolarHBondContact O-CG2 3.36Å; W159-T163 PolarHBondContact O-N 3.18Å; W159-T163 VanDerWaalsContact O-N 3.09Å; W159-T163 PolarHBondContact O-OG1 3.01Å; E160-T163 PolarHBondContact O-N 3.33Å
164	T	87.1	Confident	91.1	Very high	103 Å²	103	60.8 Å²	60.8	63%	0.632	32%	0.322	S	S	*	.	H	α-helix	trans	-88.5	-28.7	-176.1	-48.7	0	0	0	0	112.9	E160	E160-T164 WeakPolarHBondContact O-CB 3.36Å; E160-T164 PolarHBondContact O-N 3.18Å; E160-T164 PolarHBondContact O-OG1 2.66Å
165	S	77.1	Confident	90.7	Very high	45 Å²	45	67.9 Å²	67.9	32%	0.315	36%	0.355	S	S	.	.			trans	-85.5	126.6	-176.6	-176.7	0	0	0	0	112	L161 S167	L161-S165 WeakPolarHBondContact O-CB 3.37Å; S165-S167 VanDerWaalsContact C-N 3.28Å; S165-S167 WeakPolarHBondContact CB-O 3.32Å; S165-S167 PolarHBondContact OG-N 3.24Å; S165-S167 PolarHBondContact OG-O 3.26Å; S165-S167 PolarHBondContact OG-OG 2.61Å; S165-S167 VanDerWaalsContact OG-OG 3.13Å
166	D	77.4	Confident	90.5	Very high	171 Å²	171	69.9 Å²	69.9	91%	0.914	37%	0.365	S	S	*	.	S	Bend	trans	-78.8	-13.9	168.9	-73.6	-34.2	0	0	0	112.5
167	S	81.8	Confident	90.3	Very high	76 Å²	76	68 Å²	68	53%	0.531	35%	0.351	S	S	.	.	S	Bend	trans	-102.6	155.2	174.3	47.4	0	0	0	0	111.9	S165	S165-S167 VanDerWaalsContact C-N 3.28Å; S165-S167 WeakPolarHBondContact CB-O 3.32Å; S165-S167 PolarHBondContact OG-N 3.24Å; S165-S167 PolarHBondContact OG-O 3.26Å; S165-S167 PolarHBondContact OG-OG 2.61Å; S165-S167 VanDerWaalsContact OG-OG 3.13Å
168	P	85.8	Confident	89.8	Confident	109 Å²	109	70.3 Å²	70.3	71%	0.708	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-53.6	141.7	167.4	-23	33.6	0	0	0	111.2
169	V	90.4	Very high	88.9	Confident	32 Å²	32	74.3 Å²	74.3	19%	0.194	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-67.7	133	174.7	-179.3	0	0	0	0	108.9	C76 L161 V162 W171	C76-V169 HydrophobicContact CB-CG1 3.67Å; L161-V169 HydrophobicContact CB-CG2 4.25Å; V162-V169 HydrophobicContact CG1-CG2 4.42Å; V169-W171 HydrophobicContact CB-CD2 4.49Å; V169-W171 HydrophobicContact CB-CZ2 3.91Å; V169-W171 HydrophobicContact CG1-CD2 3.91Å; V169-W171 HydrophobicContact CG1-CE3 4.29Å; V169-W171 HydrophobicContact CG1-CG 4.48Å; V169-W171 HydrophobicContact CG1-CH2 4.05Å; V169-W171 HydrophobicContact CG1-CZ2 3.65Å; V169-W171 HydrophobicContact CG1-CZ3 4.36Å; V169-W171 HydrophobicContact CG2-CZ2 4.38Å; V169-W171 VanDerWaalsContact O-CD1 3.29Å
170	D	91.9	Very high	87.5	Confident	82 Å²	82	75.3 Å²	75.3	44%	0.439	41%	0.406	S	S	.	.			trans	-84.1	113.8	174.3	-170.2	1.7	0	0	0	109.6	C76 R172	C76-D170 PolarHBondContact SG-O 3.07Å; D170-R172 WeakPolarHBondContact OD1-CG 3.3Å; D170-R172 IonicContact OD1-CZ 2.8Å; D170-R172 PolarHBondContact OD1-N 2.78Å; D170-R172 IonicContact OD1-NE 2.69Å; D170-R172 PolarHBondContact OD1-NE 3.2Å; D170-R172 IonicContact OD1-NH2 3.43Å; D170-R172 IonicContact OD2-CZ 2.67Å; D170-R172 IonicContact OD2-NE 3.67Å; D170-R172 PolarHBondContact OD2-NE 3.13Å; D170-R172 IonicContact OD2-NH2 2.68Å; D170-R172 PolarHBondContact OD2-NH2 3.5Å
171	W	93.7	Very high	85.9	Confident	35 Å²	35	74.8 Å²	74.8	13%	0.133	40%	0.402	C	S	.	.			trans	-103.4	18.3	-175.1	-62.4	108.8	0	0	0	113.6	C76 V79 K80 C121 V122 P123 Y158 L161 V169 C173	C76-W171 HydrophobicContact CB-CE3 3.76Å; C76-W171 HydrophobicContact CB-CH2 4.46Å; C76-W171 HydrophobicContact CB-CZ3 3.75Å; C76-W171 VanDerWaalsContact O-CZ3 3.24Å; C76-W171 WeakPolarHBondContact O-CZ3 3.29Å; V79-W171 HydrophobicContact CB-CZ3 4.36Å; V79-W171 HydrophobicContact CG1-CH2 4.27Å; V79-W171 HydrophobicContact CG1-CZ3 4.3Å; K80-W171 HydrophobicContact CB-CE3 4.12Å; K80-W171 HydrophobicContact CB-CZ3 4.29Å; K80-W171 PolarHBondContact NZ-O 3.03Å; C121-W171 WeakPolarHBondContact O-CZ2 3.42Å; C121-W171 PolarHBondContact O-NE1 3.13Å; V122-W171 HydrophobicContact CB-CH2 4.49Å; V122-W171 HydrophobicContact CG1-CE3 4.13Å; V122-W171 HydrophobicContact CG1-CH2 4.19Å; V122-W171 HydrophobicContact CG1-CZ3 3.95Å; V122-W171 HydrophobicContact CG2-CH2 3.75Å; V122-W171 HydrophobicContact CG2-CZ2 3.87Å; V122-W171 HydrophobicContact CG2-CZ3 4.34Å; P123-W171 VanDerWaalsContact CD-CG 3.43Å; P123-W171 HydrophobicContact CG-CB 3.45Å; P123-W171 VanDerWaalsContact CG-CB 3.45Å; P123-W171 HydrophobicContact CG-CD2 4.47Å; P123-W171 HydrophobicContact CG-CG 3.77Å; Y158-W171 HydrophobicContact CD2-CH2 4.11Å; Y158-W171 HydrophobicContact CE2-CH2 4.27Å; Y158-W171 HydrophobicContact CE2-CZ2 4.27Å; L161-W171 HydrophobicContact CD1-CH2 4.47Å; V169-W171 HydrophobicContact CB-CD2 4.49Å; V169-W171 HydrophobicContact CB-CZ2 3.91Å; V169-W171 HydrophobicContact CG1-CD2 3.91Å; V169-W171 HydrophobicContact CG1-CE3 4.29Å; V169-W171 HydrophobicContact CG1-CG 4.48Å; V169-W171 HydrophobicContact CG1-CH2 4.05Å; V169-W171 HydrophobicContact CG1-CZ2 3.65Å; V169-W171 HydrophobicContact CG1-CZ3 4.36Å; V169-W171 HydrophobicContact CG2-CZ2 4.38Å; V169-W171 VanDerWaalsContact O-CD1 3.29Å; W171-C173 PolarHBondContact O-N 3.37Å
172	R	93.6	Very high	83.8	Confident	195 Å²	195	76 Å²	76	74%	0.736	42%	0.423	S	S	*	.			trans	-81.1	102	179.1	-67.7	177.6	-67	163.9	5	109.8	D170	D170-R172 WeakPolarHBondContact OD1-CG 3.3Å; D170-R172 IonicContact OD1-CZ 2.8Å; D170-R172 PolarHBondContact OD1-N 2.78Å; D170-R172 IonicContact OD1-NE 2.69Å; D170-R172 PolarHBondContact OD1-NE 3.2Å; D170-R172 IonicContact OD1-NH2 3.43Å; D170-R172 IonicContact OD2-CZ 2.67Å; D170-R172 IonicContact OD2-NE 3.67Å; D170-R172 PolarHBondContact OD2-NE 3.13Å; D170-R172 IonicContact OD2-NH2 2.68Å; D170-R172 PolarHBondContact OD2-NH2 3.5Å
173	C	94.7	Very high	81.4	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	45%	0.453	C	S	.	.			trans	-111.7	0.8	-171.9	-62.6	0	0	0	0	114.4	C77 E130 W171 Q175 E176 Y177	C77-C173 WeakPolarHBondContact CA-SG 3.3Å; C77-C173 HydrophobicContact CB-CB 3.78Å; C77-C173 WeakPolarHBondContact CB-SG 3.39Å; C77-C173 WeakPolarHBondContact SG-CA 3.38Å; C77-C173 WeakPolarHBondContact SG-CB 3.36Å; C77-C173 CovalentContact SG-SG 2.04Å; C77-C173 PolarHBondContact SG-SG 3.45Å; E130-C173 PolarHBondContact OE1-N 3.01Å; W171-C173 PolarHBondContact O-N 3.37Å; C173-Q175 VanDerWaalsContact C-N 3.29Å; C173-Q175 PolarHBondContact O-N 3.24Å; C173-E176 PolarHBondContact O-N 2.96Å; C173-E176 VanDerWaalsContact O-N 3.09Å; C173-Y177 HydrophobicContact CB-CD1 4.17Å; C173-Y177 HydrophobicContact CB-CD2 3.9Å; C173-Y177 HydrophobicContact CB-CE1 3.8Å; C173-Y177 HydrophobicContact CB-CE2 3.48Å; C173-Y177 VanDerWaalsContact CB-CE2 3.48Å; C173-Y177 HydrophobicContact CB-CG 4.21Å; C173-Y177 VanDerWaalsContact CB-CZ 3.42Å; C173-Y177 PolarHBondContact O-N 3.09Å
174	Q	93.4	Very high	78.9	Confident	108 Å²	108	84 Å²	84	51%	0.505	48%	0.481	S	S	.	.	H	α-helix	trans	-47.1	-48	-177.9	179.1	175.3	15.7	0	0	113.5	V129 E130 S178	V129-Q174 VanDerWaalsContact O-CD 3.24Å; V129-Q174 VanDerWaalsContact O-CG 3.26Å; V129-Q174 WeakPolarHBondContact O-CG 3.41Å; V129-Q174 PolarHBondContact O-NE2 3.18Å; V129-Q174 VanDerWaalsContact O-NE2 3.08Å; E130-Q174 HydrophobicContact CG-CB 4.2Å; Q174-S178 PolarHBondContact O-N 3.22Å; Q174-S178 PolarHBondContact O-OG 3.41Å
175	Q	91.1	Very high	76.5	Confident	149 Å²	149	84.7 Å²	84.7	70%	0.696	49%	0.486	S	S	*	.	H	α-helix	trans	-66.4	-46.6	-178.7	-175.2	176.7	-6.2	0	0	111.6	C173 Y177 S178	C173-Q175 VanDerWaalsContact C-N 3.29Å; C173-Q175 PolarHBondContact O-N 3.24Å; Q175-Y177 VanDerWaalsContact C-N 3.34Å; Q175-Y177 PolarHBondContact O-N 3.38Å; Q175-S178 PolarHBondContact O-N 2.8Å; Q175-S178 PolarHBondContact O-OG 3.44Å
176	E	92.8	Very high	74.4	Confident	44 Å²	44	91.5 Å²	91.5	21%	0.206	51%	0.513	C	S	.	.	H	α-helix	trans	-65.5	-37.2	-178.9	-63.8	-175.8	-144.2	0	0	112	L73 S74 C77 F136 C173 S178 E179	L73-E176 WeakPolarHBondContact CA-OE2 3.44Å; L73-E176 HydrophobicContact CD2-CB 3.97Å; S74-E176 WeakPolarHBondContact CB-OE1 3.21Å; S74-E176 PolarHBondContact N-OE2 3.11Å; S74-E176 VanDerWaalsContact OG-CD 3.3Å; S74-E176 PolarHBondContact OG-OE1 3.11Å; S74-E176 PolarHBondContact OG-OE2 2.93Å; S74-E176 VanDerWaalsContact OG-OE2 3.09Å; C77-E176 WeakPolarHBondContact CB-OE2 3.4Å; F136-E176 WeakPolarHBondContact CE2-O 3.09Å; F136-E176 WeakPolarHBondContact CZ-O 3.45Å; C173-E176 PolarHBondContact O-N 2.96Å; C173-E176 VanDerWaalsContact O-N 3.09Å; E176-S178 VanDerWaalsContact C-N 3.33Å; E176-S178 PolarHBondContact O-N 3.01Å; E176-E179 PolarHBondContact O-N 3.34Å
177	Y	92.3	Very high	72.2	Confident	5 Å²	5	91.3 Å²	91.3	2%	0.02	51%	0.511	C	S	.	.	H	α-helix	trans	-72.5	-26.4	178.6	-63.2	-14.5	0	0	0	113.2	L73 C77 A81 E130 D131 P133 F136 C173 Q175 E179	L73-Y177 HydrophobicContact CD2-CD1 3.86Å; L73-Y177 HydrophobicContact CD2-CE1 3.85Å; C77-Y177 HydrophobicContact CB-CE1 3.9Å; C77-Y177 PolarHBondContact O-OH 3.13Å; A81-Y177 HydrophobicContact CB-CE1 4.14Å; A81-Y177 PolarHBondContact N-OH 2.62Å; E130-Y177 HydrophobicContact CB-CD2 4.1Å; D131-Y177 VanDerWaalsContact O-CB 3.31Å; D131-Y177 WeakPolarHBondContact O-CB 3.49Å; P133-Y177 HydrophobicContact CB-CD1 3.84Å; P133-Y177 HydrophobicContact CB-CD2 4.26Å; P133-Y177 HydrophobicContact CB-CE1 3.96Å; P133-Y177 HydrophobicContact CB-CE2 4.4Å; P133-Y177 HydrophobicContact CB-CG 4.01Å; P133-Y177 HydrophobicContact CG-CE2 4.4Å; F136-Y177 HydrophobicContact CE2-CD1 4.5Å; C173-Y177 HydrophobicContact CB-CD1 4.17Å; C173-Y177 HydrophobicContact CB-CD2 3.9Å; C173-Y177 HydrophobicContact CB-CE1 3.8Å; C173-Y177 HydrophobicContact CB-CE2 3.48Å; C173-Y177 VanDerWaalsContact CB-CE2 3.48Å; C173-Y177 HydrophobicContact CB-CG 4.21Å; C173-Y177 VanDerWaalsContact CB-CZ 3.42Å; C173-Y177 PolarHBondContact O-N 3.09Å; Q175-Y177 VanDerWaalsContact C-N 3.34Å; Q175-Y177 PolarHBondContact O-N 3.38Å; Y177-E179 VanDerWaalsContact C-N 3.26Å; Y177-E179 PolarHBondContact O-N 3.43Å
178	S	86.6	Confident	70.2	Confident	66 Å²	66	93.3 Å²	93.3	46%	0.462	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-11.8	175.5	71	0	0	0	0	114.1	Q174 Q175 E176 S180	Q174-S178 PolarHBondContact O-N 3.22Å; Q174-S178 PolarHBondContact O-OG 3.41Å; Q175-S178 PolarHBondContact O-N 2.8Å; Q175-S178 PolarHBondContact O-OG 3.44Å; E176-S178 VanDerWaalsContact C-N 3.33Å; E176-S178 PolarHBondContact O-N 3.01Å; S178-S180 PolarHBondContact O-N 3.32Å; S178-S180 VanDerWaalsContact O-N 3.09Å
179	E	78	Confident	67.6	Low	83 Å²	83	93.1 Å²	93.1	39%	0.388	53%	0.529	S	S	.	.			trans	-72	104	177	-67.9	-176.4	-177.5	0	0	110.2	E176 Y177 F181	E176-E179 PolarHBondContact O-N 3.34Å; Y177-E179 VanDerWaalsContact C-N 3.26Å; Y177-E179 PolarHBondContact O-N 3.43Å; E179-F181 HydrophobicContact CB-CE2 4.11Å; E179-F181 HydrophobicContact CB-CZ 4.4Å; E179-F181 PolarHBondContact O-N 3.28Å
180	S	63.5	Low	64.7	Low	104 Å²	104	95.1 Å²	95.1	73%	0.727	56%	0.557	S	S	*	*			trans	-78.2	109	174.8	171.5	0	0	0	0	110.5	S178 G182	S178-S180 PolarHBondContact O-N 3.32Å; S178-S180 VanDerWaalsContact O-N 3.09Å; S180-G182 PolarHBondContact O-N 3.38Å
181	F	61.1	Low	61.7	Low	71 Å²	71	96.7 Å²	96.7	31%	0.311	57%	0.574	S	S	.	*			trans	-78.7	108.1	164	-65.6	-79.5	0	0	0	108.9	T72 F136 E179 S183	T72-F181 HydrophobicContact CG2-CE1 3.82Å; T72-F181 HydrophobicContact CG2-CE2 4.45Å; T72-F181 HydrophobicContact CG2-CZ 3.49Å; T72-F181 VanDerWaalsContact CG2-CZ 3.49Å; T72-F181 VanDerWaalsContact OG1-CE2 3.29Å; T72-F181 WeakPolarHBondContact OG1-CE2 3.24Å; T72-F181 WeakPolarHBondContact OG1-CZ 3.33Å; F136-F181 AromaticContact CE1-CD2 3.84Å; F136-F181 HydrophobicContact CE1-CD2 3.84Å; F136-F181 AromaticContact CE1-CE2 3.47Å; F136-F181 HydrophobicContact CE1-CE2 3.47Å; F136-F181 VanDerWaalsContact CE1-CE2 3.47Å; F136-F181 AromaticContact CZ-CD2 4Å; F136-F181 HydrophobicContact CZ-CD2 4Å; F136-F181 AromaticContact CZ-CE2 3.52Å; F136-F181 HydrophobicContact CZ-CE2 3.52Å; E179-F181 HydrophobicContact CB-CE2 4.11Å; E179-F181 HydrophobicContact CB-CZ 4.4Å; E179-F181 PolarHBondContact O-N 3.28Å; F181-S183 PolarHBondContact O-N 3.44Å
182	G	48.3	Very low	58.5	Low	58 Å²	58	100.8 Å²	100.8	60%	0.598	60%	0.603	S	S	*	*			trans	-51.8	137.3	172.7	0	0	0	0	0	110.8	S180 S184	S180-G182 PolarHBondContact O-N 3.38Å; G182-S184 VanDerWaalsContact C-N 3.32Å; G182-S184 PolarHBondContact O-N 3.26Å
183	S	39.9	Very low	55.8	Low	107 Å²	107	95.7 Å²	95.7	75%	0.748	60%	0.603	S	S	*	*			trans	-61.6	92.5	170.6	174.5	0	0	0	0	109.3	F181 T185	F181-S183 PolarHBondContact O-N 3.44Å; S183-T185 PolarHBondContact O-N 3.31Å; S183-T185 PolarHBondContact OG-OG1 3.47Å
184	S	37.6	Very low	52.7	Low	121 Å²	121	103.6 Å²	103.6	85%	0.846	64%	0.639	S	S	*	*			trans	-75.7	76.6	164.9	-72.8	0	0	0	0	108.7	G182 E186	G182-S184 VanDerWaalsContact C-N 3.32Å; G182-S184 PolarHBondContact O-N 3.26Å; S184-E186 VanDerWaalsContact C-N 3.27Å; S184-E186 PolarHBondContact O-N 3.48Å
185	T	36.7	Very low	49.6	Very low	118 Å²	118	108.9 Å²	108.9	72%	0.724	66%	0.656	S	S	*	*			trans	-79.5	82.2	155.4	-58.1	0	0	0	0	107.5	S183	S183-T185 PolarHBondContact O-N 3.31Å; S183-T185 PolarHBondContact OG-OG1 3.47Å
186	E	32.7	Very low	46.6	Very low	188 Å²	188	109.6 Å²	109.6	88%	0.879	66%	0.657	S	S	*	*			trans	-134.9	115.3	156.4	-76	-165.1	156.2	0	0	108.7	S184	S184-E186 VanDerWaalsContact C-N 3.27Å; S184-E186 PolarHBondContact O-N 3.48Å
187	L	30.7	Very low	43.9	Very low	167 Å²	167	113.3 Å²	113.3	87%	0.874	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-66.6	151.8	171.9	-92.3	150.1	0	0	0	110.4
188	P	38.5	Very low	40.7	Very low	118 Å²	118	118.5 Å²	118.5	77%	0.766	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-83.5	126.7	-161.5	31.6	-32.1	0	0	0	112.8
189	A	31.9	Very low	38.1	Very low	105 Å²	105	120.5 Å²	120.5	87%	0.868	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-95.6	124.7	154.5	0	0	0	0	0	108.3
190	G	30.2	Very low	35.8	Very low	74 Å²	74	126.4 Å²	126.4	76%	0.763	75%	0.745	S	S	*	*			trans	-77.2	175.1	-162.4	0	0	0	0	0	117.7
191	S	28.3	Very low	34.1	Very low	114 Å²	114	127.2 Å²	127.2	80%	0.797	74%	0.742	S	S	*	*			trans	67.4	119.3	166.9	-162.6	0	0	0	0	115.1
192	T	27	Very low	32.4	Very low	122 Å²	122	134.4 Å²	134.4	75%	0.748	77%	0.767	S	S	*	*				-167.7	147.9	62.7	-55.6	0	0	0	0	109.6	Q194	T192-Q194 PolarHBondContact O-N 3.3Å
193	A	37.3	Very low	31.6	Very low	88 Å²	88	138.1 Å²	138.1	73%	0.727	77%	0.773	S	S	*	*			trans	-51.6	129.9	173.7	0	0	0	0	0	112.8
194	Q	28	Very low	31.1	Very low	166 Å²	166	136.6 Å²	136.6	78%	0.776	76%	0.763	S	S	*	*			trans	-142.9	108.5	156.9	-108.5	171	-25.2	0	0	109.4	T192 F196	T192-Q194 PolarHBondContact O-N 3.3Å; Q194-F196 HydrophobicContact CB-CD2 4.37Å; Q194-F196 HydrophobicContact CB-CE2 4.35Å; Q194-F196 HydrophobicContact CG-CE2 4.28Å; Q194-F196 PolarHBondContact O-N 3.3Å
195	Y	29	Very low	31	Very low	218 Å²	218	135.7 Å²	135.7	86%	0.855	76%	0.762	S	S	*	*			trans	-52.8	125.5	159	-83.5	-100.9	0	0	0	109.4
196	F	28.6	Very low	30.7	Very low	165 Å²	165	139.1 Å²	139.1	72%	0.724	77%	0.767	S	S	*	*			trans	-140.2	97.5	153.8	-84.2	-76.8	0	0	0	109.4	Q194	Q194-F196 HydrophobicContact CB-CD2 4.37Å; Q194-F196 HydrophobicContact CB-CE2 4.35Å; Q194-F196 HydrophobicContact CG-CE2 4.28Å; Q194-F196 PolarHBondContact O-N 3.3Å
197	T	35.2	Very low	31.1	Very low	122 Å²	122	135.4 Å²	135.4	75%	0.748	77%	0.769	S	S	*	*			trans	-59.2	128.8	145.8	27.1	0	0	0	0	109.6
198	D	25.9	Very low	31.2	Very low	114 Å²	114	132.2 Å²	132.2	61%	0.61	76%	0.76	S	S	*	*			trans	-166	96.6	150	-89.5	-25.4	0	0	0	105.7	Y200	D198-Y200 HydrophobicContact CB-CE2 4.11Å
199	S	31.5	Very low	31.3	Very low	108 Å²	108	135.8 Å²	135.8	76%	0.755	77%	0.767	S	S	*	*				40.9	82.8	81.4	-177	0	0	0	0	113.4
200	Y	29.3	Very low	31.6	Very low	206 Å²	206	139.8 Å²	139.8	81%	0.808	77%	0.765	S	S	*	*			trans	-115.2	95.6	155.3	-69.3	-78.8	0	0	0	109.4	D198 W202	D198-Y200 HydrophobicContact CB-CE2 4.11Å; Y200-W202 PolarHBondContact O-N 3.32Å
201	D	27.6	Very low	32.5	Very low	122 Å²	122	142.8 Å²	142.8	65%	0.652	76%	0.756	S	S	*	*			trans	-63.3	113	159.4	-174.9	33.1	0	0	0	108.3	N203	D201-N203 VanDerWaalsContact CG-ND2 3.34Å; D201-N203 PolarHBondContact OD1-ND2 3.46Å; D201-N203 VanDerWaalsContact OD1-ND2 3.08Å; D201-N203 PolarHBondContact OD2-ND2 3.38Å
202	W	27	Very low	33.3	Very low	222 Å²	222	141 Å²	141	84%	0.841	74%	0.742	S	S	*	*			trans	-106.9	77.8	170.4	-166.4	-92.4	0	0	0	109.7	Y200 S204	Y200-W202 PolarHBondContact O-N 3.32Å; W202-S204 PolarHBondContact O-N 2.9Å
203	N	30.8	Very low	34.4	Very low	136 Å²	136	139.4 Å²	139.4	73%	0.727	73%	0.732	S	S	*	*			trans	-78.9	101.6	159.1	-79.3	-52.6	0	0	0	108.9	D201	D201-N203 VanDerWaalsContact CG-ND2 3.34Å; D201-N203 PolarHBondContact OD1-ND2 3.46Å; D201-N203 VanDerWaalsContact OD1-ND2 3.08Å; D201-N203 PolarHBondContact OD2-ND2 3.38Å
204	S	29.7	Very low	34.9	Very low	75 Å²	75	143.6 Å²	143.6	52%	0.524	73%	0.729	S	S	.	*			trans	-140.4	96.4	156.7	-157.8	0	0	0	0	110.6	W202 K206	W202-S204 PolarHBondContact O-N 2.9Å; S204-K206 PolarHBondContact O-N 3.08Å; S204-K206 VanDerWaalsContact O-N 3.09Å
205	A	35.3	Very low	36	Very low	102 Å²	102	139.1 Å²	139.1	84%	0.843	71%	0.711	S	S	*	*			trans	-54.3	108.1	159.5	0	0	0	0	0	109.8
206	K	30.6	Very low	37.2	Very low	189 Å²	189	133.5 Å²	133.5	82%	0.822	70%	0.699	S	S	*	*			trans	-125.3	97.6	147	-80.6	-167.1	177.9	177.6	0	108.4	S204 S208	S204-K206 PolarHBondContact O-N 3.08Å; S204-K206 VanDerWaalsContact O-N 3.09Å; K206-S208 PolarHBondContact O-N 2.93Å
207	A	40	Very low	38.4	Very low	110 Å²	110	133.9 Å²	133.9	91%	0.909	70%	0.697	S	S	*	*			trans	-50.6	102.3	158.5	0	0	0	0	0	108.6
208	S	32.6	Very low	39.3	Very low	100 Å²	100	135 Å²	135	70%	0.699	69%	0.691	S	S	*	*			trans	-109	104.3	167.1	-171.9	0	0	0	0	106.8	K206 K210	K206-S208 PolarHBondContact O-N 2.93Å; S208-K210 PolarHBondContact O-N 2.79Å
209	Q	40.7	Very low	40.9	Very low	194 Å²	194	136.5 Å²	136.5	91%	0.907	69%	0.693	S	S	*	*			trans	-54.4	101.7	169.6	-71.5	-170.5	-11.9	0	0	109.6
210	K	38.7	Very low	42.1	Very low	189 Å²	189	133.3 Å²	133.3	82%	0.822	68%	0.677	S	S	*	*			trans	-138.4	70.6	161.2	-103.6	-176.3	-179.9	178.3	0	110	S208	S208-K210 PolarHBondContact O-N 2.79Å
211	K	49.4	Very low	43.7	Very low	136 Å²	136	130.9 Å²	130.9	59%	0.591	67%	0.671	S	S	*	*			trans	-121	86.8	158.8	-159.8	-176.1	-177.2	-169.2	0	108.9
212	P	45.6	Very low	45.4	Very low	76 Å²	76	129.1 Å²	129.1	49%	0.494	66%	0.66	S	S	.	*	S	Bend	trans	-129.9	-0.6	154.7	39.1	-29.3	0	0	0	113.4	V216	P212-V216 WeakPolarHBondContact O-CG2 3.36Å
213	V	49.4	Very low	47.1	Very low	90 Å²	90	122.9 Å²	122.9	55%	0.545	65%	0.647	S	S	.	*	H	α-helix	trans	-88.2	-43.1	-169.4	-179.7	0	0	0	0	111.9	D215 V216 Y217	V213-D215 VanDerWaalsContact C-N 3.34Å; V213-D215 PolarHBondContact O-N 2.95Å; V213-V216 PolarHBondContact O-N 3.38Å; V213-Y217 HydrophobicContact CG1-CD2 4.03Å; V213-Y217 HydrophobicContact CG1-CE2 3.43Å; V213-Y217 VanDerWaalsContact CG1-CE2 3.43Å; V213-Y217 WeakPolarHBondContact O-CD2 3.48Å; V213-Y217 PolarHBondContact O-N 3.44Å
214	R	48.9	Very low	48.7	Very low	175 Å²	175	119.1 Å²	119.1	66%	0.66	63%	0.634	S	S	*	*	H	α-helix	trans	-67.2	-32.6	-177.2	-164.9	171.3	71.6	-169.6	7.9	113.7	K218	R214-K218 PolarHBondContact O-N 3.39Å
215	D	49.7	Very low	50.4	Low	73 Å²	73	119 Å²	119	39%	0.39	63%	0.633	S	S	.	*	H	α-helix	trans	-77.4	-29.1	-178.2	-66.5	-36.4	0	0	0	111.7	V213 F219	V213-D215 VanDerWaalsContact C-N 3.34Å; V213-D215 PolarHBondContact O-N 2.95Å; D215-F219 WeakPolarHBondContact O-CB 3.18Å; D215-F219 PolarHBondContact O-N 3.49Å
216	V	54	Low	51.9	Low	100 Å²	100	118.3 Å²	118.3	61%	0.606	62%	0.619	S	S	*	*	H	α-helix	trans	-68.3	-40.1	175.6	175.1	0	0	0	0	111.7	P212 V213 G220	P212-V216 WeakPolarHBondContact O-CG2 3.36Å; V213-V216 PolarHBondContact O-N 3.38Å; V216-G220 PolarHBondContact O-N 3.35Å
217	Y	55.6	Low	53.5	Low	172 Å²	172	112.4 Å²	112.4	68%	0.675	60%	0.601	S	S	*	*	H	α-helix	trans	-70.4	-37.7	177.2	-68.7	-68.2	0	0	0	113	V213 G220 F221	V213-Y217 HydrophobicContact CG1-CD2 4.03Å; V213-Y217 HydrophobicContact CG1-CE2 3.43Å; V213-Y217 VanDerWaalsContact CG1-CE2 3.43Å; V213-Y217 WeakPolarHBondContact O-CD2 3.48Å; V213-Y217 PolarHBondContact O-N 3.44Å; Y217-G220 PolarHBondContact O-N 2.93Å; Y217-F221 WeakPolarHBondContact O-CB 3.2Å; Y217-F221 PolarHBondContact O-N 3.36Å
218	K	53.8	Low	54.7	Low	147 Å²	147	108.7 Å²	108.7	64%	0.639	57%	0.574	S	S	*	*	H	α-helix	trans	-68.1	-41.3	176.1	-161.3	176.2	-178.9	-177.5	0	111	R214 I222	R214-K218 PolarHBondContact O-N 3.39Å; K218-I222 HydrophobicContact CG-CD1 4.22Å; K218-I222 WeakPolarHBondContact O-CB 3.39Å; K218-I222 WeakPolarHBondContact O-CD1 3.2Å; K218-I222 WeakPolarHBondContact O-CG1 3.43Å; K218-I222 PolarHBondContact O-N 2.99Å
219	F	58.3	Low	56.4	Low	145 Å²	145	105.4 Å²	105.4	64%	0.636	56%	0.555	S	S	*	*	H	α-helix	trans	-63.5	-43.1	170.8	-101.5	-85.9	0	0	0	112	D215 F221 I222 V223	D215-F219 WeakPolarHBondContact O-CB 3.18Å; D215-F219 PolarHBondContact O-N 3.49Å; F219-F221 PolarHBondContact O-N 2.9Å; F219-I222 PolarHBondContact O-N 3.46Å; F219-V223 WeakPolarHBondContact O-CB 3.35Å; F219-V223 WeakPolarHBondContact O-CG2 3.38Å; F219-V223 PolarHBondContact O-N 2.83Å
220	G	58	Low	57.9	Low	41 Å²	41	100.8 Å²	100.8	42%	0.423	54%	0.536	S	S	.	.	H	α-helix	trans	-59.8	-43.3	177.8	0	0	0	0	0	112.6	V216 Y217 A224	V216-G220 PolarHBondContact O-N 3.35Å; Y217-G220 PolarHBondContact O-N 2.93Å; G220-A224 WeakPolarHBondContact O-CB 3.31Å; G220-A224 PolarHBondContact O-N 2.89Å
221	F	61.3	Low	59.4	Low	154 Å²	154	95.1 Å²	95.1	68%	0.675	52%	0.517	S	S	*	.	H	α-helix	trans	-67.2	-41.9	176.1	-172	-95.7	0	0	0	112.5	Y217 F219 S225	Y217-F221 WeakPolarHBondContact O-CB 3.2Å; Y217-F221 PolarHBondContact O-N 3.36Å; F219-F221 PolarHBondContact O-N 2.9Å; F221-S225 WeakPolarHBondContact O-CB 3.18Å; F221-S225 PolarHBondContact O-N 3.28Å
222	I	63.8	Low	60.5	Low	86 Å²	86	94 Å²	94	44%	0.441	52%	0.517	S	S	.	.	H	α-helix	trans	-64.8	-45.8	176.9	-67.7	164.9	0	0	0	110.3	K218 F219 S225 V226	K218-I222 HydrophobicContact CG-CD1 4.22Å; K218-I222 WeakPolarHBondContact O-CB 3.39Å; K218-I222 WeakPolarHBondContact O-CD1 3.2Å; K218-I222 WeakPolarHBondContact O-CG1 3.43Å; K218-I222 PolarHBondContact O-N 2.99Å; F219-I222 PolarHBondContact O-N 3.46Å; I222-S225 PolarHBondContact O-N 3.05Å; I222-V226 HydrophobicContact CG2-CG2 4.25Å; I222-V226 WeakPolarHBondContact O-CB 3.49Å; I222-V226 WeakPolarHBondContact O-CG2 3.24Å; I222-V226 PolarHBondContact O-N 2.89Å
223	V	63.4	Low	61.9	Low	91 Å²	91	95.9 Å²	95.9	55%	0.552	52%	0.522	S	S	*	.	H	α-helix	trans	-63.8	-45.7	178.9	172.3	0	0	0	0	110.6	F219 V226 S227	F219-V223 WeakPolarHBondContact O-CB 3.35Å; F219-V223 WeakPolarHBondContact O-CG2 3.38Å; F219-V223 PolarHBondContact O-N 2.83Å; V223-V226 PolarHBondContact O-N 3.5Å; V223-S227 VanDerWaalsContact O-CB 3.31Å; V223-S227 WeakPolarHBondContact O-CB 3.34Å; V223-S227 PolarHBondContact O-N 2.88Å; V223-S227 PolarHBondContact O-OG 2.87Å
224	A	63	Low	62.9	Low	56 Å²	56	96.1 Å²	96.1	46%	0.463	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-42.6	177.7	0	0	0	0	0	112.1	G220 S227 G228	G220-A224 WeakPolarHBondContact O-CB 3.31Å; G220-A224 PolarHBondContact O-N 2.89Å; A224-S227 WeakPolarHBondContact CA-OG 3.13Å; A224-S227 PolarHBondContact O-N 3.2Å; A224-S227 PolarHBondContact O-OG 3.06Å; A224-G228 PolarHBondContact O-N 2.81Å
225	S	65.9	Low	63.9	Low	73 Å²	73	90.6 Å²	90.6	51%	0.51	51%	0.505	S	S	.	.	H	α-helix	trans	-66.2	-44.9	178.4	-179.5	0	0	0	0	112.3	F221 I222 G228 G229	F221-S225 WeakPolarHBondContact O-CB 3.18Å; F221-S225 PolarHBondContact O-N 3.28Å; I222-S225 PolarHBondContact O-N 3.05Å; S225-G228 PolarHBondContact O-N 3.48Å; S225-G229 PolarHBondContact O-N 3.36Å
226	V	67	Low	65.1	Low	88 Å²	88	92.1 Å²	92.1	53%	0.533	51%	0.513	S	S	.	.	H	α-helix	trans	-65.1	-42.7	176.5	172.9	0	0	0	0	110.3	I222 V223 L230	I222-V226 HydrophobicContact CG2-CG2 4.25Å; I222-V226 WeakPolarHBondContact O-CB 3.49Å; I222-V226 WeakPolarHBondContact O-CG2 3.24Å; I222-V226 PolarHBondContact O-N 2.89Å; V223-V226 PolarHBondContact O-N 3.5Å; V226-L230 WeakPolarHBondContact O-CB 3.43Å; V226-L230 PolarHBondContact O-N 3.44Å
227	S	63.8	Low	66	Low	64 Å²	64	94.4 Å²	94.4	45%	0.448	51%	0.512	S	S	.	.	H	α-helix	trans	-66.7	-39.5	176.9	64.5	0	0	0	0	112.9	V223 A224 L230 V231	V223-S227 VanDerWaalsContact O-CB 3.31Å; V223-S227 WeakPolarHBondContact O-CB 3.34Å; V223-S227 PolarHBondContact O-N 2.88Å; V223-S227 PolarHBondContact O-OG 2.87Å; A224-S227 WeakPolarHBondContact CA-OG 3.13Å; A224-S227 PolarHBondContact O-N 3.2Å; A224-S227 PolarHBondContact O-OG 3.06Å; S227-L230 PolarHBondContact O-N 3.41Å; S227-V231 VanDerWaalsContact O-CG2 3.24Å; S227-V231 WeakPolarHBondContact O-CG2 3.27Å; S227-V231 PolarHBondContact O-N 3.05Å
228	G	65.6	Low	66.6	Low	33 Å²	33	90 Å²	90	34%	0.34	51%	0.505	S	S	.	.	H	α-helix	trans	-67.5	-42.5	178	0	0	0	0	0	112.1	A224 S225 V231 L232	A224-G228 PolarHBondContact O-N 2.81Å; S225-G228 PolarHBondContact O-N 3.48Å; G228-V231 PolarHBondContact O-N 2.92Å; G228-L232 PolarHBondContact O-N 3.44Å
229	G	69.3	Low	67.4	Low	30 Å²	30	88.6 Å²	88.6	31%	0.309	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-42.3	174.7	0	0	0	0	0	112.7	S225 V231 L232 I233	S225-G229 PolarHBondContact O-N 3.36Å; G229-V231 PolarHBondContact O-N 3.41Å; G229-L232 PolarHBondContact O-N 3.49Å; G229-I233 VanDerWaalsContact O-CG1 3.27Å; G229-I233 WeakPolarHBondContact O-CG1 3.18Å; G229-I233 PolarHBondContact O-N 2.94Å
230	L	70.9	Confident	68	Low	97 Å²	97	87 Å²	87	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-37.9	177.8	-124.3	140.9	0	0	0	112.3	V226 S227 I233 L234	V226-L230 WeakPolarHBondContact O-CB 3.43Å; V226-L230 PolarHBondContact O-N 3.44Å; S227-L230 PolarHBondContact O-N 3.41Å; L230-I233 PolarHBondContact O-N 3.45Å; L230-L234 HydrophobicContact CD2-CD1 3.92Å; L230-L234 HydrophobicContact CD2-CG 4.39Å; L230-L234 WeakPolarHBondContact O-CB 3.39Å; L230-L234 VanDerWaalsContact O-CG 3.27Å; L230-L234 WeakPolarHBondContact O-CG 3.34Å; L230-L234 PolarHBondContact O-N 3.05Å
231	V	71.5	Confident	68.4	Low	70 Å²	70	87.6 Å²	87.6	42%	0.424	50%	0.496	S	S	.	.	H	α-helix	trans	-66.7	-39.1	175.7	171.6	0	0	0	0	111.3	S227 G228 G229 L234 T235	S227-V231 VanDerWaalsContact O-CG2 3.24Å; S227-V231 WeakPolarHBondContact O-CG2 3.27Å; S227-V231 PolarHBondContact O-N 3.05Å; G228-V231 PolarHBondContact O-N 2.92Å; G229-V231 PolarHBondContact O-N 3.41Å; V231-L234 PolarHBondContact O-N 2.7Å; V231-T235 WeakPolarHBondContact O-CB 3.27Å; V231-T235 WeakPolarHBondContact O-CG2 3.36Å; V231-T235 PolarHBondContact O-N 3.45Å; V231-T235 PolarHBondContact O-OG1 2.94Å
232	L	71.5	Confident	68.2	Low	113 Å²	113	85.9 Å²	85.9	59%	0.592	49%	0.49	S	S	*	.	H	α-helix	trans	-66.2	-42.6	174.9	-75.9	170.7	0	0	0	112.3	G228 G229 T235 L236	G228-L232 PolarHBondContact O-N 3.44Å; G229-L232 PolarHBondContact O-N 3.49Å; L232-T235 VanDerWaalsContact CA-OG1 3.27Å; L232-T235 WeakPolarHBondContact CA-OG1 3.43Å; L232-T235 PolarHBondContact O-N 3.25Å; L232-T235 PolarHBondContact O-OG1 3.28Å; L232-L236 WeakPolarHBondContact O-CB 3.46Å; L232-L236 WeakPolarHBondContact O-CG 3.28Å; L232-L236 PolarHBondContact O-N 3.34Å
233	I	75.1	Confident	67.9	Low	116 Å²	116	89 Å²	89	60%	0.595	50%	0.501	S	S	*	.	H	α-helix	trans	-64.6	-43.3	177.1	-67.3	165.9	0	0	0	110.6	G229 L230 L236 Y237	G229-I233 VanDerWaalsContact O-CG1 3.27Å; G229-I233 WeakPolarHBondContact O-CG1 3.18Å; G229-I233 PolarHBondContact O-N 2.94Å; L230-I233 PolarHBondContact O-N 3.45Å; I233-L236 PolarHBondContact O-N 2.97Å; I233-Y237 VanDerWaalsContact O-CB 3.31Å; I233-Y237 WeakPolarHBondContact O-CB 3.27Å; I233-Y237 PolarHBondContact O-N 3.31Å
234	L	70.4	Confident	67.4	Low	95 Å²	95	90 Å²	90	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-66.7	-38.7	178.3	-75.2	169.2	0	0	0	112.6	L230 V231 Y237 C238	L230-L234 HydrophobicContact CD2-CD1 3.92Å; L230-L234 HydrophobicContact CD2-CG 4.39Å; L230-L234 WeakPolarHBondContact O-CB 3.39Å; L230-L234 VanDerWaalsContact O-CG 3.27Å; L230-L234 WeakPolarHBondContact O-CG 3.34Å; L230-L234 PolarHBondContact O-N 3.05Å; V231-L234 PolarHBondContact O-N 2.7Å; L234-Y237 PolarHBondContact O-N 2.93Å; L234-C238 WeakPolarHBondContact O-CB 3.37Å; L234-C238 PolarHBondContact O-N 2.96Å; L234-C238 PolarHBondContact O-SG 2.89Å
235	T	69.3	Low	67	Low	58 Å²	58	92.5 Å²	92.5	36%	0.356	51%	0.507	S	S	.	.	H	α-helix	trans	-67.9	-42.5	176	41.1	0	0	0	0	111.7	V231 L232 C238 L239	V231-T235 WeakPolarHBondContact O-CB 3.27Å; V231-T235 WeakPolarHBondContact O-CG2 3.36Å; V231-T235 PolarHBondContact O-N 3.45Å; V231-T235 PolarHBondContact O-OG1 2.94Å; L232-T235 VanDerWaalsContact CA-OG1 3.27Å; L232-T235 WeakPolarHBondContact CA-OG1 3.43Å; L232-T235 PolarHBondContact O-N 3.25Å; L232-T235 PolarHBondContact O-OG1 3.28Å; T235-C238 PolarHBondContact O-N 2.94Å; T235-L239 WeakPolarHBondContact O-CG 3.42Å; T235-L239 PolarHBondContact O-N 3.05Å
236	L	74.7	Confident	66.3	Low	105 Å²	105	97.2 Å²	97.2	55%	0.55	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-44.4	172.3	-79.2	162	0	0	0	112	L232 I233 C238 L239 I240	L232-L236 WeakPolarHBondContact O-CB 3.46Å; L232-L236 WeakPolarHBondContact O-CG 3.28Å; L232-L236 PolarHBondContact O-N 3.34Å; I233-L236 PolarHBondContact O-N 2.97Å; L236-C238 PolarHBondContact O-N 2.94Å; L236-L239 PolarHBondContact O-N 3.43Å; L236-I240 VanDerWaalsContact O-CG1 3.26Å; L236-I240 WeakPolarHBondContact O-CG1 3.4Å; L236-I240 PolarHBondContact O-N 2.9Å
237	Y	74.1	Confident	65.4	Low	149 Å²	149	96.8 Å²	96.8	58%	0.584	52%	0.515	S	S	*	.	H	α-helix	trans	-60.7	-44.7	175.8	-179.1	-100.4	0	0	0	111.8	I233 L234 L239 I240 V241	I233-Y237 VanDerWaalsContact O-CB 3.31Å; I233-Y237 WeakPolarHBondContact O-CB 3.27Å; I233-Y237 PolarHBondContact O-N 3.31Å; L234-Y237 PolarHBondContact O-N 2.93Å; Y237-L239 VanDerWaalsContact C-N 3.35Å; Y237-L239 PolarHBondContact O-N 3.48Å; Y237-I240 PolarHBondContact O-N 3.48Å; Y237-V241 HydrophobicContact CD1-CG2 4.27Å; Y237-V241 HydrophobicContact CE1-CG2 3.88Å; Y237-V241 HydrophobicContact CE2-CG2 4.2Å; Y237-V241 WeakPolarHBondContact O-CG2 3.34Å; Y237-V241 PolarHBondContact O-N 3.45Å
238	C	68.3	Low	64.4	Low	79 Å²	79	100.8 Å²	100.8	53%	0.534	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-38.7	175.7	-74.6	0	0	0	0	112.6	L234 T235 L236 H242	L234-C238 WeakPolarHBondContact O-CB 3.37Å; L234-C238 PolarHBondContact O-N 2.96Å; L234-C238 PolarHBondContact O-SG 2.89Å; T235-C238 PolarHBondContact O-N 2.94Å; L236-C238 PolarHBondContact O-N 2.94Å; C238-H242 VanDerWaalsContact O-CB 3.28Å; C238-H242 WeakPolarHBondContact O-CB 3.26Å; C238-H242 PolarHBondContact O-N 3.47Å
239	L	69.8	Low	63.2	Low	118 Å²	118	105.8 Å²	105.8	62%	0.618	54%	0.54	S	S	*	.	H	α-helix	trans	-66.3	-40.2	175.7	-74.1	170.7	0	0	0	112.2	T235 L236 Y237 H242 K243	T235-L239 WeakPolarHBondContact O-CG 3.42Å; T235-L239 PolarHBondContact O-N 3.05Å; L236-L239 PolarHBondContact O-N 3.43Å; Y237-L239 VanDerWaalsContact C-N 3.35Å; Y237-L239 PolarHBondContact O-N 3.48Å; L239-H242 PolarHBondContact O-N 3.47Å; L239-K243 WeakPolarHBondContact O-CB 3.31Å; L239-K243 PolarHBondContact O-N 2.88Å
240	I	70.2	Confident	61.7	Low	111 Å²	111	106.8 Å²	106.8	57%	0.569	55%	0.551	S	S	*	*	H	α-helix	trans	-65.1	-45.2	176.4	-67.8	164.5	0	0	0	110.6	L236 Y237 K243 N244	L236-I240 VanDerWaalsContact O-CG1 3.26Å; L236-I240 WeakPolarHBondContact O-CG1 3.4Å; L236-I240 PolarHBondContact O-N 2.9Å; Y237-I240 PolarHBondContact O-N 3.48Å; I240-K243 PolarHBondContact O-N 3.2Å; I240-N244 WeakPolarHBondContact O-CB 3.31Å; I240-N244 PolarHBondContact O-N 2.94Å
241	V	66.4	Low	60.3	Low	53 Å²	53	105.9 Å²	105.9	32%	0.321	55%	0.553	S	S	.	*	H	α-helix	trans	-65.4	-41.4	177.3	172.5	0	0	0	0	111.3	Y237 K243 N244 I245	Y237-V241 HydrophobicContact CD1-CG2 4.27Å; Y237-V241 HydrophobicContact CE1-CG2 3.88Å; Y237-V241 HydrophobicContact CE2-CG2 4.2Å; Y237-V241 WeakPolarHBondContact O-CG2 3.34Å; Y237-V241 PolarHBondContact O-N 3.45Å; V241-K243 VanDerWaalsContact C-N 3.35Å; V241-K243 PolarHBondContact O-N 2.95Å; V241-N244 PolarHBondContact O-N 3.31Å; V241-I245 HydrophobicContact CG1-CD1 3.75Å; V241-I245 HydrophobicContact CG1-CG1 4.39Å; V241-I245 VanDerWaalsContact O-CG1 3.31Å; V241-I245 WeakPolarHBondContact O-CG1 3.46Å; V241-I245 PolarHBondContact O-N 2.94Å
242	H	57.2	Low	58.6	Low	119 Å²	119	112.4 Å²	112.4	55%	0.551	57%	0.57	S	S	*	*	H	α-helix	trans	-63	-41.2	176	-169.2	-86.7	0	0	0	111.8	C238 L239 N244 I245 Y246	C238-H242 VanDerWaalsContact O-CB 3.28Å; C238-H242 WeakPolarHBondContact O-CB 3.26Å; C238-H242 PolarHBondContact O-N 3.47Å; L239-H242 PolarHBondContact O-N 3.47Å; H242-N244 VanDerWaalsContact C-N 3.33Å; H242-N244 PolarHBondContact O-N 3.48Å; H242-I245 PolarHBondContact O-N 3.35Å; H242-Y246 PolarHBondContact O-N 2.93Å
243	K	59.2	Low	57.1	Low	151 Å²	151	113.5 Å²	113.5	66%	0.657	58%	0.575	S	S	*	*	H	α-helix	trans	-61.8	-40.9	173.4	-174.7	176.1	174.8	174.7	0	111.6	L239 I240 V241 Y246 C247	L239-K243 WeakPolarHBondContact O-CB 3.31Å; L239-K243 PolarHBondContact O-N 2.88Å; I240-K243 PolarHBondContact O-N 3.2Å; V241-K243 VanDerWaalsContact C-N 3.35Å; V241-K243 PolarHBondContact O-N 2.95Å; K243-Y246 PolarHBondContact O-N 3.09Å; K243-C247 PolarHBondContact O-N 3.21Å; K243-C247 PolarHBondContact O-SG 3.34Å; K243-C247 VanDerWaalsContact O-SG 3.38Å
244	N	53.1	Low	55.3	Low	111 Å²	111	115.1 Å²	115.1	59%	0.594	59%	0.585	S	S	*	*	H	α-helix	trans	-69.4	-36.9	-179.8	-148.3	11.9	0	0	0	112.5	I240 V241 H242 C247 H248	I240-N244 WeakPolarHBondContact O-CB 3.31Å; I240-N244 PolarHBondContact O-N 2.94Å; V241-N244 PolarHBondContact O-N 3.31Å; H242-N244 VanDerWaalsContact C-N 3.33Å; H242-N244 PolarHBondContact O-N 3.48Å; N244-C247 PolarHBondContact O-N 3.45Å; N244-H248 PolarHBondContact O-N 3.39Å; N244-H248 VanDerWaalsContact O-N 3.09Å
245	I	54.6	Low	53.8	Low	110 Å²	110	116 Å²	116	56%	0.564	60%	0.595	S	S	*	*	H	α-helix	trans	-67.9	-37.8	174.8	-67.3	166.5	0	0	0	111.2	V241 H242 H248 H249	V241-I245 HydrophobicContact CG1-CD1 3.75Å; V241-I245 HydrophobicContact CG1-CG1 4.39Å; V241-I245 VanDerWaalsContact O-CG1 3.31Å; V241-I245 WeakPolarHBondContact O-CG1 3.46Å; V241-I245 PolarHBondContact O-N 2.94Å; H242-I245 PolarHBondContact O-N 3.35Å; I245-H248 PolarHBondContact O-N 3.38Å; I245-H249 PolarHBondContact O-N 3.48Å
246	Y	50.8	Low	52.1	Low	172 Å²	172	120.6 Å²	120.6	68%	0.675	62%	0.617	S	S	*	*	H	α-helix	trans	-67.9	-37.9	176.1	-130.1	-93.2	0	0	0	112.2	H242 K243 H248 H249 G250	H242-Y246 PolarHBondContact O-N 2.93Å; K243-Y246 PolarHBondContact O-N 3.09Å; Y246-H248 VanDerWaalsContact C-N 3.33Å; Y246-H248 PolarHBondContact O-N 3.42Å; Y246-H249 PolarHBondContact O-N 3.33Å; Y246-G250 PolarHBondContact O-N 3.42Å; Y246-G250 VanDerWaalsContact O-N 3.15Å
247	C	46.9	Very low	50.3	Low	79 Å²	79	123.8 Å²	123.8	53%	0.534	63%	0.634	S	S	.	*	H	α-helix	trans	-67.3	-31.5	173.9	-71.3	0	0	0	0	113	K243 N244 H249 S251	K243-C247 PolarHBondContact O-N 3.21Å; K243-C247 PolarHBondContact O-SG 3.34Å; K243-C247 VanDerWaalsContact O-SG 3.38Å; N244-C247 PolarHBondContact O-N 3.45Å; C247-H249 VanDerWaalsContact C-N 3.33Å; C247-S251 PolarHBondContact O-OG 3.05Å
248	H	43.1	Very low	48.4	Very low	147 Å²	147	124.2 Å²	124.2	68%	0.681	65%	0.646	S	S	*	*	H	α-helix	trans	-77.4	-18.3	177.1	-133.3	-54.8	0	0	0	113.6	N244 I245 Y246 S251	N244-H248 PolarHBondContact O-N 3.39Å; N244-H248 VanDerWaalsContact O-N 3.09Å; I245-H248 PolarHBondContact O-N 3.38Å; Y246-H248 VanDerWaalsContact C-N 3.33Å; Y246-H248 PolarHBondContact O-N 3.42Å; H248-S251 PolarHBondContact O-OG 3.15Å
249	H	41	Very low	47.1	Very low	138 Å²	138	127.6 Å²	127.6	64%	0.639	66%	0.658	S	S	*	*	H	α-helix	trans	-90.3	-26.7	174.4	-131	15.2	0	0	0	113.1	I245 Y246 C247 S251	I245-H249 PolarHBondContact O-N 3.48Å; Y246-H249 PolarHBondContact O-N 3.33Å; C247-H249 VanDerWaalsContact C-N 3.33Å; H249-S251 VanDerWaalsContact C-N 3.27Å; H249-S251 PolarHBondContact O-N 3Å
250	G	38.5	Very low	45.4	Very low	51 Å²	51	129.3 Å²	129.3	53%	0.526	67%	0.668	S	S	.	*	H	α-helix	trans	-70.2	-18.3	172	0	0	0	0	0	114.7	Y246	Y246-G250 PolarHBondContact O-N 3.42Å; Y246-G250 VanDerWaalsContact O-N 3.15Å
251	S	40.4	Very low	43.9	Very low	79 Å²	79	133.4 Å²	133.4	55%	0.552	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	0.4	179.5	35.6	0	0	0	0	114.1	C247 H248 H249	C247-S251 PolarHBondContact O-OG 3.05Å; H248-S251 PolarHBondContact O-OG 3.15Å; H249-S251 VanDerWaalsContact C-N 3.27Å; H249-S251 PolarHBondContact O-N 3Å
252	R	36.9	Very low	42.4	Very low	207 Å²	207	139.1 Å²	139.1	78%	0.781	71%	0.707	S	S	*	*	S	Bend	trans	-109.9	2.2	179.4	-151.1	177	177.8	174.5	-0.4	114
253	L	38.8	Very low	41.3	Very low	135 Å²	135	140.3 Å²	140.3	71%	0.707	72%	0.718	S	S	*	*	S	Bend	trans	-98.7	-8.6	-179.9	-106.6	140.6	0	0	0	114.2
254	D	38.6	Very low	40.2	Very low	150 Å²	150	141.4 Å²	141.4	80%	0.802	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	12.8	-177.9	-79.1	-27.7	0	0	0	115.3
255	T	37.2	Very low	39.4	Very low	115 Å²	115	144.7 Å²	144.7	71%	0.706	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	11.5	-177.9	-28.3	0	0	0	0	114.7
256	N	33.8	Very low	38.4	Very low	154 Å²	154	148.4 Å²	148.4	82%	0.824	76%	0.758	S	S	*	*	S	Bend	trans	-130.2	22.2	-176.8	-97.3	-42.6	0	0	0	115.7
257	L	36.8	Very low	37.6	Very low	171 Å²	171	148.5 Å²	148.5	90%	0.895	77%	0.765	S	S	*	*	S	Bend	trans	-124.1	33	175.9	-91.3	164	0	0	0	113.2
258	N	35.1	Very low	37.3	Very low	158 Å²	158	149.5 Å²	149.5	85%	0.845	77%	0.77	S	S	*	*			trans	-136.4	42.4	177.1	-151.2	15.6	0	0	0	114.3
259	I	40.8	Very low	36.8	Very low	151 Å²	151	155.4 Å²	155.4	77%	0.774	80%	0.798	S	S	*	*	S	Bend	trans	-138.2	88.6	166.2	-55.9	177.7	0	0	0	107.3
260	N	34.7	Very low	36.6	Very low	154 Å²	154	156.3 Å²	156.3	82%	0.824	81%	0.806	S	S	*	*	S	Bend	trans	153.7	65.8	151	-81.9	-21.6	0	0	0	110.8
261	Q	37.6	Very low	36.5	Very low	196 Å²	196	161.8 Å²	161.8	92%	0.916	82%	0.821	S	S	*	*			trans	-159.6	80.3	151.2	-156	140.7	-10.7	0	0	110.6
262	Q	35.2	Very low	36.3	Very low	174 Å²	174	166.4 Å²	166.4	81%	0.813	84%	0.835	S	S	*	*			trans	-138.1	126	160	-106.6	173.7	-6	0	0	109
263	D	33.4	Very low	36.2	Very low	143 Å²	143	164 Å²	164	77%	0.765	84%	0.839	S	S	*	*			trans	81.5	90.3	149.7	-47.6	-26.3	0	0	0	119
264	I	36.8	Very low	36.1	Very low	175 Å²	175	165.8 Å²	165.8	90%	0.897	85%	0.847	S	S	*	*			trans	-116.2	107.7	140.7	-61.3	179	0	0	0	107.5
265	E	35.7	Very low	35.9	Very low	180 Å²	180	166.9 Å²	166.9	84%	0.841	85%	0.85	S	S	*	*			trans	-55	139.5	173.3	-163.9	171	-159.2	0	0	112.3
266	M	34	Very low	35.8	Very low	188 Å²	188	170.6 Å²	170.6	93%	0.926	86%	0.86	S	S	*	*			trans	-143.8	101	162.6	-147	-175.4	-62.3	0	0	109.2
267	E	35.1	Very low	36	Very low	174 Å²	174	171.8 Å²	171.8	81%	0.813	86%	0.863	S	S	*	*			trans	-113.9	166.9	149.2	-124.6	-148	124.6	0	0	106.1
268	P	39.8	Very low	35.9	Very low	99 Å²	99	171.9 Å²	171.9	64%	0.643	86%	0.86	S	S	*	*			cis	-134.2	165.1	-3.7	38.4	-21.4	0	0	0	114.5
269	Q	32.5	Very low	36	Very low	271 Å²	271	173.2 Å²	173.2	100%	1.266	86%	0.862	S	S	*	*			trans	-165.7	0	133.3	-107.6	-177.2	15.2	0	0	110.7

Retrieved 269 of 269 residues in 460.9 ms (Link to these results)

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