A0A077Z3I4_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z3I4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,003 aa.

						>A0A077Z3I4_TRITR|A0A077Z3I4
MNSPSDTNGHGVVPVKVHTKPALECPLQKFSTFQSGSQVEAVERRPVASISSSMRETIQRSVETSRKVYETAKSLLTAIKQASMMKTYISLETNLRSDLAMDTAIDEPHVDELEVENLIDIDRHIGFACRYFGMNVGPPAEKSVSVASLRNRIDAQIDFLLDCLRKVDPTWADKMNDCAKDIHLSKVIETLLIDVGNAHRAAADSKAALQASRAKFFTTADTIEKTILWIYQVDQTASKRREQEVERRKNKLGLSPVDLKELHTQLSWFYQAAIELARERRRFIEICNLHLDIVKEVRLQRYDPENVVVRLNRRTPSTGMLVDHATVLFSTFWDELMERITQMRIVADEVRRLADNWKRDKQQCAAIMAECDELAKTKHPRKKALESLKQLLESDRAASKELIETFEAIIGPLQKTTAQLQEQCAQRERAKAEAMKKGAAAAFDPVLDDAVLTEIQKKEDHLQDVLLRRHDARVSRAEALENLQHSLCHKEKELEQLMKNCDNLISELTEIKEEMETAEQDNRNLKEGDGGGGAGASGGNKDGKEPPALPEEEVQEEMKMLQEEAALKNEIKNRKRHLDHLAIERSNTKLKIQCLERQKTIIDAASEEKLKTIREFEKHIADSKRAVDDRRRYKVTDPLPDTHGKQKIEELKASNKCTAEMLNTLLTELEICLKKHADVSTANLQRMDAHRTWCHKNAAKEMEVDWNKLQLRKLECEKGIATKCHLLKTIDEEAISTPIRNVGQSPVILYHELSSPDRANLLKEKTTETREGYEGIYSPTIAHPPRQEERSSWPPGMQTPRSTFYQVREEERSAYPGGMQTPRATFEQFGPGGEEPEIMYTVEETKEVTRRTYTSYHPAGRKKWKTTFGPTGQPQLVSMPSPIVAGRTQDSSPTQFDTRTPQPSGTDDFKKQMVQTAPSDVTTMISVVTERASPKGQEAYPARQEKRESAGTLSHLPSSEPKGEPPGGPTDGPITKEMRKEDDKQKKYPPENMPGGSGTQSKQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	33	Very low	237 Å²	237	140.5 Å²	140.5	100%	1.167	85%	0.849	S	S	*	*				0	110.5	0	-73.1	-175.7	166.4	0	0	106.7
2	N	28.9	Very low	33	Very low	164 Å²	164	140.7 Å²	140.7	88%	0.877	85%	0.85	S	S	*	*			trans	-94.6	125.1	179	-74	-7.3	0	0	0	108.5
3	S	33.8	Very low	32.5	Very low	110 Å²	110	139.5 Å²	139.5	77%	0.769	84%	0.843	S	S	*	*			trans	-149.7	108.4	167.5	-51.4	0	0	0	0	109.3
4	P	35.4	Very low	32.5	Very low	131 Å²	131	138.1 Å²	138.1	85%	0.851	84%	0.839	S	S	*	*			trans	-98.7	113.7	164.7	31.6	-20.4	0	0	0	109.4
5	S	37.6	Very low	32.1	Very low	97 Å²	97	137.5 Å²	137.5	68%	0.678	84%	0.835	S	S	*	*			trans	-150.9	111.8	169.1	54.4	0	0	0	0	108.4
6	D	35.6	Very low	31.9	Very low	166 Å²	166	141.2 Å²	141.2	89%	0.888	84%	0.836	S	S	*	*			trans	173.2	86.2	133.3	-86.6	-15.1	0	0	0	109.8
7	T	36.4	Very low	31.7	Very low	132 Å²	132	139.6 Å²	139.6	81%	0.81	83%	0.828	S	S	*	*			trans	-110.9	101.5	160.4	44.3	0	0	0	0	107.2
8	N	33.5	Very low	31.3	Very low	176 Å²	176	141.8 Å²	141.8	94%	0.941	83%	0.828	S	S	*	*			trans	173.3	121.3	147.7	-92.7	-14.7	0	0	0	111.3
9	G	28.9	Very low	31.4	Very low	64 Å²	64	141.4 Å²	141.4	66%	0.66	83%	0.827	S	S	*	*			trans	-174.9	83.7	174.3	0	0	0	0	0	114
10	H	31.2	Very low	31.2	Very low	190 Å²	190	144.5 Å²	144.5	88%	0.88	83%	0.83	S	S	*	*			trans	65.8	108.9	149.1	-56.3	-60.7	0	0	0	121.3
11	G	27.2	Very low	31.1	Very low	79 Å²	79	143.7 Å²	143.7	81%	0.814	83%	0.83	S	S	*	*			trans	-73.5	148.6	158.4	0	0	0	0	0	112.8
12	V	32.4	Very low	31	Very low	142 Å²	142	136.9 Å²	136.9	86%	0.861	81%	0.812	S	S	*	*			trans	-114.9	129	175.1	178.7	0	0	0	0	108.4
13	V	26.7	Very low	31.1	Very low	125 Å²	125	136.6 Å²	136.6	76%	0.758	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-79	135.7	-171.8	175.3	0	0	0	0	111.3
14	P	32.8	Very low	30.7	Very low	121 Å²	121	140.2 Å²	140.2	79%	0.786	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-76.9	127.2	179.5	27.8	-32.1	0	0	0	112.9
15	V	25.9	Very low	30.3	Very low	129 Å²	129	140.1 Å²	140.1	78%	0.782	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-92.4	120	175.6	178.5	0	0	0	0	109.5	V17	V15-V17 HydrophobicContact CG1-CG2 3.99Å
16	K	29.1	Very low	29.9	Very low	196 Å²	196	141.4 Å²	141.4	85%	0.852	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-83.4	123.8	169	-80.2	179.8	174.7	179.9	0	109.4
17	V	29.1	Very low	29.5	Very low	115 Å²	115	141.9 Å²	141.9	70%	0.697	82%	0.822	S	S	*	*			trans	-118.4	114.1	170.2	-167.9	0	0	0	0	108.3	V15	V15-V17 HydrophobicContact CG1-CG2 3.99Å
18	H	24.1	Very low	29.1	Very low	179 Å²	179	144.9 Å²	144.9	83%	0.829	83%	0.827	S	S	*	*			trans	-91.9	119.3	169.2	-83	-64.9	0	0	0	108.6
19	T	32.3	Very low	28.9	Very low	133 Å²	133	145 Å²	145	82%	0.816	82%	0.819	S	S	*	*			trans	-134.3	128	161.9	36.9	0	0	0	0	108.8
20	K	27.9	Very low	28.8	Very low	203 Å²	203	151.3 Å²	151.3	88%	0.883	83%	0.829	S	S	*	*			trans	-79.8	160.1	-178	-79.4	-180	174.4	-177.9	0	111.2
21	P	29.9	Very low	28.5	Very low	129 Å²	129	147.2 Å²	147.2	84%	0.838	82%	0.822	S	S	*	*			trans	-83.3	138.8	-172.6	4.3	14.9	0	0	0	111.8
22	A	33	Very low	28.8	Very low	94 Å²	94	149 Å²	149	78%	0.777	82%	0.818	S	S	*	*			trans	-115.3	109.2	172.1	0	0	0	0	0	109.8
23	L	30.6	Very low	28.5	Very low	158 Å²	158	152.8 Å²	152.8	83%	0.827	82%	0.823	S	S	*	*			trans	25	108.7	144.5	-76	137.9	0	0	0	119.2
24	E	25.5	Very low	28.7	Very low	186 Å²	186	154.4 Å²	154.4	87%	0.869	82%	0.822	S	S	*	*				15.3	115.8	130	-64.2	176.4	173.4	0	0	118.3
25	C	26.3	Very low	28.5	Very low	129 Å²	129	154.1 Å²	154.1	87%	0.872	82%	0.823	S	S	*	*			trans	-135.8	123.3	152.7	-135.8	0	0	0	0	108.6
26	P	30.4	Very low	28.6	Very low	124 Å²	124	151.6 Å²	151.6	81%	0.805	82%	0.823	S	S	*	*			trans	-82.9	146.1	-160.7	30.7	-34.9	0	0	0	114.8	Q28	P26-Q28 PolarHBondContact O-N 3.42Å
27	L	26.4	Very low	28.7	Very low	175 Å²	175	147.4 Å²	147.4	92%	0.916	82%	0.818	S	S	*	*			trans	-45.2	95.3	176.3	-66.5	155.1	0	0	0	114.3
28	Q	28	Very low	28.6	Very low	196 Å²	196	150.1 Å²	150.1	92%	0.916	82%	0.823	S	S	*	*			trans	-93.4	100.3	162.1	-132.3	173.4	9.8	0	0	109.7	P26 F30	P26-Q28 PolarHBondContact O-N 3.42Å; Q28-F30 PolarHBondContact O-N 3.44Å
29	K	28.5	Very low	28.9	Very low	177 Å²	177	148.4 Å²	148.4	77%	0.77	83%	0.825	S	S	*	*			trans	-42.1	131.3	165.7	-62	168.5	-179.9	175.9	0	109.5
30	F	26.9	Very low	28.9	Very low	197 Å²	197	149 Å²	149	86%	0.864	82%	0.819	S	S	*	*			trans	152.4	126.8	136.3	-83.6	-69.2	0	0	0	110.9	Q28	Q28-F30 PolarHBondContact O-N 3.44Å
31	S	26.6	Very low	29.2	Very low	105 Å²	105	143.6 Å²	143.6	73%	0.734	81%	0.812	S	S	*	*			trans	69.7	92.7	146.7	-176.3	0	0	0	0	117.6
32	T	32	Very low	29.4	Very low	117 Å²	117	144 Å²	144	72%	0.718	81%	0.811	S	S	*	*				-174.6	98.8	119.5	17.5	0	0	0	0	110.6	Q34	T32-Q34 PolarHBondContact O-N 2.8Å; T32-Q34 VanDerWaalsContact O-N 3.09Å
33	F	27.1	Very low	29.3	Very low	221 Å²	221	146 Å²	146	97%	0.969	81%	0.805	S	S	*	*			trans	-74.1	81.5	152.6	-88.2	-92.2	0	0	0	107.2
34	Q	30.2	Very low	29.4	Very low	158 Å²	158	150 Å²	150	74%	0.738	81%	0.809	S	S	*	*			trans	-136.8	108.8	165.2	-83.6	-168.6	-2	0	0	110.4	T32	T32-Q34 PolarHBondContact O-N 2.8Å; T32-Q34 VanDerWaalsContact O-N 3.09Å
35	S	29.7	Very low	29.6	Very low	115 Å²	115	150.3 Å²	150.3	80%	0.804	80%	0.802	S	S	*	*			trans	50.9	108.8	142.8	61.5	0	0	0	0	118.6
36	G	27	Very low	30.1	Very low	76 Å²	76	150 Å²	150	78%	0.784	80%	0.798	S	S	*	*				90.8	132.2	123	0	0	0	0	0	116.7
37	S	31.1	Very low	30.4	Very low	109 Å²	109	150.6 Å²	150.6	76%	0.762	80%	0.8	S	S	*	*			trans	74.1	71.4	155.4	-176	0	0	0	0	117
38	Q	28.2	Very low	31.1	Very low	171 Å²	171	146.4 Å²	146.4	80%	0.799	79%	0.79	S	S	*	*			trans	-121.6	86.6	131.8	-91.5	-177.3	-15.9	0	0	109	E40	Q38-E40 PolarHBondContact O-N 3.41Å; Q38-E40 VanDerWaalsContact O-N 3.14Å
39	V	30.1	Very low	31.7	Very low	143 Å²	143	142 Å²	142	87%	0.867	78%	0.782	S	S	*	*			trans	-75.5	78.2	156.9	179.3	0	0	0	0	105.4
40	E	31	Very low	32.3	Very low	146 Å²	146	136.9 Å²	136.9	68%	0.682	76%	0.762	S	S	*	*			trans	-121.3	110.6	176.9	-125.4	172.4	179.1	0	0	109	Q38 V42	Q38-E40 PolarHBondContact O-N 3.41Å; Q38-E40 VanDerWaalsContact O-N 3.14Å; E40-V42 PolarHBondContact O-N 3.18Å
41	A	34.9	Very low	33.5	Very low	90 Å²	90	130.2 Å²	130.2	74%	0.744	74%	0.74	S	S	*	*			trans	48.6	60.2	158.8	0	0	0	0	0	116.5	E43	A41-E43 PolarHBondContact O-N 3.07Å
42	V	34.7	Very low	35.1	Very low	136 Å²	136	129.9 Å²	129.9	82%	0.824	74%	0.737	S	S	*	*			trans	-64.5	88.6	142	179.9	0	0	0	0	105.2	E40 R44	E40-V42 PolarHBondContact O-N 3.18Å; V42-R44 PolarHBondContact O-N 3.24Å
43	E	30	Very low	36	Very low	137 Å²	137	127.6 Å²	127.6	64%	0.64	73%	0.726	S	S	*	*			trans	-39.1	115.5	157.2	-75.6	-173.2	150	0	0	105.8	A41 R45	A41-E43 PolarHBondContact O-N 3.07Å; E43-R45 PolarHBondContact O-N 3.44Å
44	R	32.7	Very low	37.1	Very low	242 Å²	242	121.7 Å²	121.7	91%	0.913	70%	0.703	S	S	*	*			trans	-65.4	70.3	170.8	-66.6	-179.4	179.8	178	0.3	107	V42 P46	V42-R44 PolarHBondContact O-N 3.24Å; R44-P46 WeakPolarHBondContact O-CD 3.35Å; R44-P46 VanDerWaalsContact O-N 3.16Å
45	R	30.8	Very low	38.2	Very low	192 Å²	192	121.3 Å²	121.3	73%	0.725	69%	0.694	S	S	*	*			trans	-56.4	121	158.7	-72.7	-172.1	-177.7	-176.6	1.6	103.8	E43 V47	E43-R45 PolarHBondContact O-N 3.44Å; R45-V47 PolarHBondContact O-N 3.05Å
46	P	36.5	Very low	39.3	Very low	122 Å²	122	120.7 Å²	120.7	79%	0.792	68%	0.679	S	S	*	*			trans	-52.9	115.6	179.9	19.6	-29.8	0	0	0	106.6	R44 A48	R44-P46 WeakPolarHBondContact O-CD 3.35Å; R44-P46 VanDerWaalsContact O-N 3.16Å; P46-A48 PolarHBondContact O-N 2.92Å
47	V	35.8	Very low	40.4	Very low	137 Å²	137	121.3 Å²	121.3	83%	0.83	67%	0.667	S	S	*	*			trans	-47.5	113	172.1	176.8	0	0	0	0	104.6	R45 S49	R45-V47 PolarHBondContact O-N 3.05Å; V47-S49 PolarHBondContact O-N 3.01Å
48	A	42.4	Very low	41.2	Very low	87 Å²	87	120.2 Å²	120.2	72%	0.719	65%	0.652	S	S	*	*			trans	-44.4	111.4	-171.9	0	0	0	0	0	107.5	P46 I50	P46-A48 PolarHBondContact O-N 2.92Å; A48-I50 PolarHBondContact O-N 3.15Å
49	S	39.7	Very low	42.6	Very low	105 Å²	105	117.6 Å²	117.6	73%	0.734	64%	0.64	S	S	*	*			trans	-62.6	110.1	-170.6	58.5	0	0	0	0	106.8	V47 S51	V47-S49 PolarHBondContact O-N 3.01Å; S49-S51 PolarHBondContact O-N 3.27Å
50	I	40.9	Very low	43.4	Very low	69 Å²	69	117.5 Å²	117.5	35%	0.354	62%	0.624	S	S	.	*			trans	-55.5	119.2	175.7	-63.1	176.3	0	0	0	106.2	A48 M54 R55	A48-I50 PolarHBondContact O-N 3.15Å; I50-M54 HydrophobicContact CB-CE 4.2Å; I50-M54 HydrophobicContact CG1-CE 4Å; I50-M54 HydrophobicContact CG2-CB 3.66Å; I50-M54 HydrophobicContact CG2-CE 3.71Å; I50-M54 HydrophobicContact CG2-CG 3.84Å; I50-R55 HydrophobicContact CB-CG 4.46Å; I50-R55 HydrophobicContact CG2-CB 4.32Å; I50-R55 HydrophobicContact CG2-CG 3.93Å; I50-R55 PolarHBondContact O-NE 3.48Å; I50-R55 PolarHBondContact O-NH2 3.24Å
51	S	53.3	Low	44.3	Very low	57 Å²	57	113.7 Å²	113.7	40%	0.399	61%	0.614	S	S	.	*			trans	-53.1	149.4	179.5	63.7	0	0	0	0	109.6	S49 S53 M54 R55	S49-S51 PolarHBondContact O-N 3.27Å; S51-S53 PolarHBondContact O-N 3.48Å; S51-S53 VanDerWaalsContact O-N 3.16Å; S51-S53 PolarHBondContact OG-OG 3.08Å; S51-M54 PolarHBondContact O-N 2.99Å; S51-M54 WeakPolarHBondContact OG-CB 3.5Å; S51-M54 PolarHBondContact OG-N 3.34Å; S51-M54 VanDerWaalsContact OG-N 3.16Å; S51-R55 PolarHBondContact O-N 3.32Å
52	S	58.4	Low	44.9	Very low	97 Å²	97	113.7 Å²	113.7	68%	0.678	60%	0.604	S	S	*	*	H	α-helix	trans	-52.2	-37	174.7	52.3	0	0	0	0	111.6	R55 E56	S52-R55 PolarHBondContact O-N 2.91Å; S52-E56 WeakPolarHBondContact O-CB 3.44Å; S52-E56 PolarHBondContact O-N 2.94Å
53	S	52.5	Low	46	Very low	70 Å²	70	111.8 Å²	111.8	49%	0.49	59%	0.586	S	S	.	*	H	α-helix	trans	-60.6	-46.7	174.9	64	0	0	0	0	112.6	S51 E56 T57	S51-S53 PolarHBondContact O-N 3.48Å; S51-S53 VanDerWaalsContact O-N 3.16Å; S51-S53 PolarHBondContact OG-OG 3.08Å; S53-E56 PolarHBondContact O-N 3.27Å; S53-T57 PolarHBondContact O-N 3.29Å; S53-T57 PolarHBondContact O-OG1 2.97Å
54	M	49.3	Very low	46.8	Very low	97 Å²	97	108.8 Å²	108.8	48%	0.478	58%	0.578	S	S	.	*	H	α-helix	trans	-72.1	-33.7	-179.3	-170.7	158.9	82.5	0	0	111.6	I50 S51 T57 I58	I50-M54 HydrophobicContact CB-CE 4.2Å; I50-M54 HydrophobicContact CG1-CE 4Å; I50-M54 HydrophobicContact CG2-CB 3.66Å; I50-M54 HydrophobicContact CG2-CE 3.71Å; I50-M54 HydrophobicContact CG2-CG 3.84Å; S51-M54 PolarHBondContact O-N 2.99Å; S51-M54 WeakPolarHBondContact OG-CB 3.5Å; S51-M54 PolarHBondContact OG-N 3.34Å; S51-M54 VanDerWaalsContact OG-N 3.16Å; M54-T57 PolarHBondContact O-N 2.9Å; M54-I58 HydrophobicContact CG-CD1 4.18Å; M54-I58 WeakPolarHBondContact O-CB 3.3Å; M54-I58 VanDerWaalsContact O-CG1 3.24Å; M54-I58 WeakPolarHBondContact O-CG1 3.5Å; M54-I58 PolarHBondContact O-N 3.09Å
55	R	52.8	Low	47.4	Very low	149 Å²	149	100.6 Å²	100.6	56%	0.562	56%	0.557	S	S	*	*	H	α-helix	trans	-61.8	-45.6	170.6	-107.8	-179.2	-83.5	-143.9	-0.4	111.8	I50 S51 S52 I58 Q59	I50-R55 HydrophobicContact CB-CG 4.46Å; I50-R55 HydrophobicContact CG2-CB 4.32Å; I50-R55 HydrophobicContact CG2-CG 3.93Å; I50-R55 PolarHBondContact O-NE 3.48Å; I50-R55 PolarHBondContact O-NH2 3.24Å; S51-R55 PolarHBondContact O-N 3.32Å; S52-R55 PolarHBondContact O-N 2.91Å; R55-I58 PolarHBondContact O-N 2.91Å; R55-Q59 WeakPolarHBondContact O-CB 3.33Å; R55-Q59 PolarHBondContact O-N 2.85Å
56	E	52.5	Low	48	Very low	103 Å²	103	99.9 Å²	99.9	48%	0.481	56%	0.555	S	S	.	*	H	α-helix	trans	-64.3	-40.8	173.6	-86.6	-172.6	169.5	0	0	112.2	S52 S53 Q59 R60	S52-E56 WeakPolarHBondContact O-CB 3.44Å; S52-E56 PolarHBondContact O-N 2.94Å; S53-E56 PolarHBondContact O-N 3.27Å; E56-Q59 PolarHBondContact O-N 3.45Å; E56-R60 VanDerWaalsContact O-CB 3.3Å; E56-R60 WeakPolarHBondContact O-CB 3.37Å; E56-R60 VanDerWaalsContact O-CG 3.24Å; E56-R60 WeakPolarHBondContact O-CG 3.41Å; E56-R60 PolarHBondContact O-N 3.24Å; E56-R60 IonicContact OE2-CZ 2.93Å; E56-R60 IonicContact OE2-NH2 3.38Å; E56-R60 PolarHBondContact OE2-NH2 3Å
57	T	51.4	Low	48.7	Very low	88 Å²	88	101.3 Å²	101.3	54%	0.54	55%	0.548	S	S	.	.	H	α-helix	trans	-61.6	-44.5	176.4	-55.5	0	0	0	0	111.2	S53 M54 S61	S53-T57 PolarHBondContact O-N 3.29Å; S53-T57 PolarHBondContact O-OG1 2.97Å; M54-T57 PolarHBondContact O-N 2.9Å; T57-S61 VanDerWaalsContact O-CB 3.25Å; T57-S61 WeakPolarHBondContact O-CB 3.3Å; T57-S61 PolarHBondContact O-N 2.97Å
58	I	46.6	Very low	49.1	Very low	86 Å²	86	99.3 Å²	99.3	44%	0.441	54%	0.536	S	S	.	.	H	α-helix	trans	-64.4	-47.8	176.6	-68	165.4	0	0	0	110.1	M54 R55 R60 S61 V62	M54-I58 HydrophobicContact CG-CD1 4.18Å; M54-I58 WeakPolarHBondContact O-CB 3.3Å; M54-I58 VanDerWaalsContact O-CG1 3.24Å; M54-I58 WeakPolarHBondContact O-CG1 3.5Å; M54-I58 PolarHBondContact O-N 3.09Å; R55-I58 PolarHBondContact O-N 2.91Å; I58-R60 VanDerWaalsContact C-N 3.35Å; I58-R60 PolarHBondContact O-N 2.97Å; I58-S61 PolarHBondContact O-N 2.94Å; I58-V62 HydrophobicContact CG2-CG2 4.36Å; I58-V62 VanDerWaalsContact O-CG2 3.3Å; I58-V62 WeakPolarHBondContact O-CG2 3.5Å; I58-V62 PolarHBondContact O-N 2.97Å
59	Q	59.1	Low	49.3	Very low	117 Å²	117	102.1 Å²	102.1	55%	0.547	53%	0.529	S	S	.	.	H	α-helix	trans	-60.5	-44.2	179.6	-174.4	173.9	-10.1	0	0	111.7	R55 E56 V62 E63	R55-Q59 WeakPolarHBondContact O-CB 3.33Å; R55-Q59 PolarHBondContact O-N 2.85Å; E56-Q59 PolarHBondContact O-N 3.45Å; Q59-V62 PolarHBondContact O-N 3.27Å; Q59-E63 PolarHBondContact NE2-OE1 2.8Å; Q59-E63 WeakPolarHBondContact O-CB 3.37Å; Q59-E63 WeakPolarHBondContact O-CG 3.47Å; Q59-E63 PolarHBondContact O-N 3.43Å
60	R	47.3	Very low	49.4	Very low	140 Å²	140	101.5 Å²	101.5	53%	0.528	52%	0.515	S	S	.	.	H	α-helix	trans	-65.8	-40.1	175.7	-71.5	-176.2	-130.8	160.5	-0.8	111.9	E56 I58 E63 T64	E56-R60 VanDerWaalsContact O-CB 3.3Å; E56-R60 WeakPolarHBondContact O-CB 3.37Å; E56-R60 VanDerWaalsContact O-CG 3.24Å; E56-R60 WeakPolarHBondContact O-CG 3.41Å; E56-R60 PolarHBondContact O-N 3.24Å; E56-R60 IonicContact OE2-CZ 2.93Å; E56-R60 IonicContact OE2-NH2 3.38Å; E56-R60 PolarHBondContact OE2-NH2 3Å; I58-R60 VanDerWaalsContact C-N 3.35Å; I58-R60 PolarHBondContact O-N 2.97Å; R60-E63 PolarHBondContact O-N 3.19Å; R60-T64 WeakPolarHBondContact O-CB 3.46Å; R60-T64 PolarHBondContact O-N 3.02Å; R60-T64 PolarHBondContact O-OG1 2.97Å
61	S	48.6	Very low	49.5	Very low	67 Å²	67	102.2 Å²	102.2	47%	0.469	52%	0.522	S	S	.	.	H	α-helix	trans	-61.6	-43.6	175.2	176.6	0	0	0	0	111.4	T57 I58 T64 S65	T57-S61 VanDerWaalsContact O-CB 3.25Å; T57-S61 WeakPolarHBondContact O-CB 3.3Å; T57-S61 PolarHBondContact O-N 2.97Å; I58-S61 PolarHBondContact O-N 2.94Å; S61-T64 PolarHBondContact O-N 3.3Å; S61-S65 WeakPolarHBondContact O-CB 3.39Å; S61-S65 PolarHBondContact O-N 3.33Å; S61-S65 PolarHBondContact O-OG 3.02Å
62	V	48.3	Very low	48.9	Very low	90 Å²	90	102.1 Å²	102.1	55%	0.545	53%	0.525	S	S	.	.	H	α-helix	trans	-63.9	-43.5	175.1	172.3	0	0	0	0	111.1	I58 Q59 T64 S65 R66	I58-V62 HydrophobicContact CG2-CG2 4.36Å; I58-V62 VanDerWaalsContact O-CG2 3.3Å; I58-V62 WeakPolarHBondContact O-CG2 3.5Å; I58-V62 PolarHBondContact O-N 2.97Å; Q59-V62 PolarHBondContact O-N 3.27Å; V62-T64 PolarHBondContact O-N 3.48Å; V62-S65 PolarHBondContact O-N 2.89Å; V62-R66 VanDerWaalsContact O-CB 3.29Å; V62-R66 WeakPolarHBondContact O-CB 3.43Å; V62-R66 PolarHBondContact O-N 3.27Å
63	E	57.8	Low	48.3	Very low	95 Å²	95	102.4 Å²	102.4	44%	0.444	51%	0.514	S	S	.	.	H	α-helix	trans	-65	-37.7	176.1	-80.5	168.1	-174.1	0	0	112.7	Q59 R60 R66 K67	Q59-E63 PolarHBondContact NE2-OE1 2.8Å; Q59-E63 WeakPolarHBondContact O-CB 3.37Å; Q59-E63 WeakPolarHBondContact O-CG 3.47Å; Q59-E63 PolarHBondContact O-N 3.43Å; R60-E63 PolarHBondContact O-N 3.19Å; E63-R66 PolarHBondContact O-N 3.29Å; E63-K67 WeakPolarHBondContact O-CB 3.45Å; E63-K67 WeakPolarHBondContact O-CG 3.47Å; E63-K67 PolarHBondContact O-N 2.91Å
64	T	46.4	Very low	47.8	Very low	75 Å²	75	102.8 Å²	102.8	46%	0.46	52%	0.517	S	S	.	.	H	α-helix	trans	-67.6	-45.8	176.7	-44.8	0	0	0	0	110.2	R60 S61 V62 R66 K67 V68	R60-T64 WeakPolarHBondContact O-CB 3.46Å; R60-T64 PolarHBondContact O-N 3.02Å; R60-T64 PolarHBondContact O-OG1 2.97Å; S61-T64 PolarHBondContact O-N 3.3Å; V62-T64 PolarHBondContact O-N 3.48Å; T64-R66 VanDerWaalsContact C-N 3.3Å; T64-R66 PolarHBondContact O-N 3.41Å; T64-K67 PolarHBondContact O-N 3.15Å; T64-V68 WeakPolarHBondContact O-CG2 3.47Å; T64-V68 PolarHBondContact O-N 3.39Å
65	S	44.2	Very low	47.4	Very low	70 Å²	70	102.9 Å²	102.9	49%	0.49	52%	0.519	S	S	.	.	H	α-helix	trans	-61.1	-40.4	176	-53.9	0	0	0	0	111.2	S61 V62 V68 Y69	S61-S65 WeakPolarHBondContact O-CB 3.39Å; S61-S65 PolarHBondContact O-N 3.33Å; S61-S65 PolarHBondContact O-OG 3.02Å; V62-S65 PolarHBondContact O-N 2.89Å; S65-V68 PolarHBondContact O-N 2.88Å; S65-Y69 VanDerWaalsContact O-CB 3.25Å; S65-Y69 WeakPolarHBondContact O-CB 3.48Å; S65-Y69 PolarHBondContact O-N 2.95Å
66	R	44.9	Very low	46.7	Very low	177 Å²	177	100.5 Å²	100.5	67%	0.668	52%	0.517	S	S	*	.	H	α-helix	trans	-66.7	-41.2	176.2	-162.7	178.1	-171	-178.4	4.1	112.1	V62 E63 T64 Y69 E70	V62-R66 VanDerWaalsContact O-CB 3.29Å; V62-R66 WeakPolarHBondContact O-CB 3.43Å; V62-R66 PolarHBondContact O-N 3.27Å; E63-R66 PolarHBondContact O-N 3.29Å; T64-R66 VanDerWaalsContact C-N 3.3Å; T64-R66 PolarHBondContact O-N 3.41Å; R66-Y69 PolarHBondContact O-N 3.14Å; R66-E70 WeakPolarHBondContact O-CG 3.34Å; R66-E70 PolarHBondContact O-N 3.01Å
67	K	51.1	Low	46.2	Very low	151 Å²	151	98.8 Å²	98.8	66%	0.657	51%	0.513	S	S	*	.	H	α-helix	trans	-64.5	-44.2	174.6	-78.8	-179.4	179.8	178.9	0	111.8	E63 T64 Y69 E70 T71	E63-K67 WeakPolarHBondContact O-CB 3.45Å; E63-K67 WeakPolarHBondContact O-CG 3.47Å; E63-K67 PolarHBondContact O-N 2.91Å; T64-K67 PolarHBondContact O-N 3.15Å; K67-Y69 VanDerWaalsContact C-N 3.32Å; K67-Y69 PolarHBondContact O-N 2.9Å; K67-E70 PolarHBondContact O-N 3.39Å; K67-T71 PolarHBondContact O-N 3.47Å; K67-T71 PolarHBondContact O-OG1 3.1Å
68	V	43.7	Very low	45.7	Very low	95 Å²	95	97 Å²	97	58%	0.576	51%	0.507	S	S	*	.	H	α-helix	trans	-62	-42.6	175.4	173.6	0	0	0	0	110.4	T64 S65 T71 A72	T64-V68 WeakPolarHBondContact O-CG2 3.47Å; T64-V68 PolarHBondContact O-N 3.39Å; S65-V68 PolarHBondContact O-N 2.88Å; V68-T71 PolarHBondContact O-N 3.47Å; V68-A72 VanDerWaalsContact O-CB 3.24Å; V68-A72 WeakPolarHBondContact O-CB 3.44Å; V68-A72 PolarHBondContact O-N 2.95Å
69	Y	45.8	Very low	45.2	Very low	146 Å²	146	97.7 Å²	97.7	57%	0.573	51%	0.511	S	S	*	.	H	α-helix	trans	-61.8	-44.8	175.3	178.8	-96.9	0	0	0	112.7	S65 R66 K67 A72 K73	S65-Y69 VanDerWaalsContact O-CB 3.25Å; S65-Y69 WeakPolarHBondContact O-CB 3.48Å; S65-Y69 PolarHBondContact O-N 2.95Å; R66-Y69 PolarHBondContact O-N 3.14Å; K67-Y69 VanDerWaalsContact C-N 3.32Å; K67-Y69 PolarHBondContact O-N 2.9Å; Y69-A72 PolarHBondContact O-N 3.36Å; Y69-K73 HydrophobicContact CE1-CD 4.36Å; Y69-K73 WeakPolarHBondContact O-CB 3.44Å; Y69-K73 PolarHBondContact O-N 3.2Å
70	E	43.2	Very low	44.4	Very low	93 Å²	93	98.5 Å²	98.5	44%	0.435	51%	0.513	S	S	.	.	H	α-helix	trans	-65.8	-40	176.3	-72.1	-64.9	161	0	0	112	R66 K67 K73 S74	R66-E70 WeakPolarHBondContact O-CG 3.34Å; R66-E70 PolarHBondContact O-N 3.01Å; K67-E70 PolarHBondContact O-N 3.39Å; E70-K73 PolarHBondContact O-N 2.89Å; E70-S74 WeakPolarHBondContact O-CB 3.38Å; E70-S74 PolarHBondContact O-N 3.39Å
71	T	43.4	Very low	44.1	Very low	83 Å²	83	96.7 Å²	96.7	51%	0.509	51%	0.51	S	S	.	.	H	α-helix	trans	-65.4	-44.1	174.6	-54.2	0	0	0	0	111.4	K67 V68 K73 S74 L75	K67-T71 PolarHBondContact O-N 3.47Å; K67-T71 PolarHBondContact O-OG1 3.1Å; V68-T71 PolarHBondContact O-N 3.47Å; T71-K73 VanDerWaalsContact C-N 3.33Å; T71-K73 PolarHBondContact O-N 3.17Å; T71-S74 WeakPolarHBondContact O-CB 3.07Å; T71-S74 PolarHBondContact O-N 2.92Å; T71-L75 HydrophobicContact CG2-CD1 4.25Å; T71-L75 WeakPolarHBondContact O-CB 3.47Å; T71-L75 PolarHBondContact O-N 3.46Å
72	A	39.1	Very low	43.6	Very low	55 Å²	55	96.4 Å²	96.4	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-63.7	-39.1	176	0	0	0	0	0	111.5	V68 Y69 L75 L76	V68-A72 VanDerWaalsContact O-CB 3.24Å; V68-A72 WeakPolarHBondContact O-CB 3.44Å; V68-A72 PolarHBondContact O-N 2.95Å; Y69-A72 PolarHBondContact O-N 3.36Å; A72-L75 PolarHBondContact O-N 3.43Å; A72-L76 VanDerWaalsContact O-CB 3.26Å; A72-L76 WeakPolarHBondContact O-CB 3.45Å; A72-L76 PolarHBondContact O-N 3.34Å
73	K	46.7	Very low	42.9	Very low	103 Å²	103	95.2 Å²	95.2	45%	0.448	51%	0.508	S	S	.	.	H	α-helix	trans	-64.7	-44.1	174	-173.6	-177.9	176.1	-168.8	0	111.4	Y69 E70 T71 L76 T77	Y69-K73 HydrophobicContact CE1-CD 4.36Å; Y69-K73 WeakPolarHBondContact O-CB 3.44Å; Y69-K73 PolarHBondContact O-N 3.2Å; E70-K73 PolarHBondContact O-N 2.89Å; T71-K73 VanDerWaalsContact C-N 3.33Å; T71-K73 PolarHBondContact O-N 3.17Å; K73-L76 PolarHBondContact O-N 3.47Å; K73-T77 WeakPolarHBondContact O-CB 3.49Å; K73-T77 PolarHBondContact O-N 3.05Å; K73-T77 PolarHBondContact O-OG1 2.79Å
74	S	41.3	Very low	41.9	Very low	78 Å²	78	95.6 Å²	95.6	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-58.5	-48.8	173.7	172	0	0	0	0	111.4	E70 T71 L76 T77 A78	E70-S74 WeakPolarHBondContact O-CB 3.38Å; E70-S74 PolarHBondContact O-N 3.39Å; T71-S74 WeakPolarHBondContact O-CB 3.07Å; T71-S74 PolarHBondContact O-N 2.92Å; S74-L76 PolarHBondContact O-N 2.92Å; S74-T77 WeakPolarHBondContact O-CB 3.42Å; S74-T77 PolarHBondContact O-N 2.94Å; S74-T77 VanDerWaalsContact O-N 3.14Å; S74-A78 PolarHBondContact O-N 2.95Å
75	L	40.3	Very low	41.5	Very low	100 Å²	100	98.3 Å²	98.3	52%	0.524	52%	0.52	S	S	.	.	H	α-helix	trans	-61.5	-44.7	176	-113.3	121.7	0	0	0	112.2	T71 A72 T77 A78 I79	T71-L75 HydrophobicContact CG2-CD1 4.25Å; T71-L75 WeakPolarHBondContact O-CB 3.47Å; T71-L75 PolarHBondContact O-N 3.46Å; A72-L75 PolarHBondContact O-N 3.43Å; L75-T77 PolarHBondContact O-N 3.32Å; L75-A78 PolarHBondContact O-N 3.27Å; L75-I79 HydrophobicContact CD2-CD1 4.29Å; L75-I79 WeakPolarHBondContact O-CB 3.31Å; L75-I79 VanDerWaalsContact O-CG1 3.25Å; L75-I79 WeakPolarHBondContact O-CG1 3.45Å; L75-I79 PolarHBondContact O-N 3.21Å
76	L	39.1	Very low	41	Very low	99 Å²	99	102.8 Å²	102.8	52%	0.518	53%	0.53	S	S	.	.	H	α-helix	trans	-62	-34.7	176.2	-168	75.5	0	0	0	111.3	A72 K73 S74 K80	A72-L76 VanDerWaalsContact O-CB 3.26Å; A72-L76 WeakPolarHBondContact O-CB 3.45Å; A72-L76 PolarHBondContact O-N 3.34Å; K73-L76 PolarHBondContact O-N 3.47Å; S74-L76 PolarHBondContact O-N 2.92Å; L76-K80 VanDerWaalsContact O-CB 3.31Å; L76-K80 WeakPolarHBondContact O-CB 3.41Å; L76-K80 WeakPolarHBondContact O-CG 3.45Å; L76-K80 PolarHBondContact O-N 3.47Å
77	T	42.7	Very low	40.6	Very low	67 Å²	67	98 Å²	98	41%	0.411	52%	0.52	S	S	.	.	H	α-helix	trans	-69.8	-43.2	175.9	-45.4	0	0	0	0	110.7	K73 S74 L75 K80 Q81	K73-T77 WeakPolarHBondContact O-CB 3.49Å; K73-T77 PolarHBondContact O-N 3.05Å; K73-T77 PolarHBondContact O-OG1 2.79Å; S74-T77 WeakPolarHBondContact O-CB 3.42Å; S74-T77 PolarHBondContact O-N 2.94Å; S74-T77 VanDerWaalsContact O-N 3.14Å; L75-T77 PolarHBondContact O-N 3.32Å; T77-K80 PolarHBondContact O-N 3.1Å; T77-Q81 WeakPolarHBondContact O-CB 3.49Å; T77-Q81 VanDerWaalsContact O-CG 3.32Å; T77-Q81 WeakPolarHBondContact O-CG 3.28Å; T77-Q81 PolarHBondContact O-N 2.85Å
78	A	39.6	Very low	40.1	Very low	50 Å²	50	98.6 Å²	98.6	41%	0.413	52%	0.52	S	S	.	.	H	α-helix	trans	-64	-40.2	174.2	0	0	0	0	0	112.2	S74 L75 Q81 A82	S74-A78 PolarHBondContact O-N 2.95Å; L75-A78 PolarHBondContact O-N 3.27Å; A78-Q81 PolarHBondContact O-N 3.44Å; A78-A82 WeakPolarHBondContact O-CB 3.41Å; A78-A82 PolarHBondContact O-N 3.49Å
79	I	37.4	Very low	39.8	Very low	100 Å²	100	98.7 Å²	98.7	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-65.6	-43.4	174.2	-68.7	165.2	0	0	0	110.3	L75 Q81 A82 S83	L75-I79 HydrophobicContact CD2-CD1 4.29Å; L75-I79 WeakPolarHBondContact O-CB 3.31Å; L75-I79 VanDerWaalsContact O-CG1 3.25Å; L75-I79 WeakPolarHBondContact O-CG1 3.45Å; L75-I79 PolarHBondContact O-N 3.21Å; I79-Q81 VanDerWaalsContact C-N 3.33Å; I79-Q81 PolarHBondContact O-N 3.07Å; I79-A82 PolarHBondContact O-N 3.04Å; I79-S83 WeakPolarHBondContact O-CB 3.34Å; I79-S83 PolarHBondContact O-N 3.19Å
80	K	40.9	Very low	39.5	Very low	135 Å²	135	94.4 Å²	94.4	59%	0.587	51%	0.508	S	S	*	.	H	α-helix	trans	-61.2	-40.6	172.9	-82.9	-176.2	175.8	-174.9	0	111.6	L76 T77 S83 M84	L76-K80 VanDerWaalsContact O-CB 3.31Å; L76-K80 WeakPolarHBondContact O-CB 3.41Å; L76-K80 WeakPolarHBondContact O-CG 3.45Å; L76-K80 PolarHBondContact O-N 3.47Å; T77-K80 PolarHBondContact O-N 3.1Å; K80-S83 PolarHBondContact O-N 3.43Å; K80-M84 WeakPolarHBondContact O-CB 3.28Å; K80-M84 VanDerWaalsContact O-CG 3.28Å; K80-M84 WeakPolarHBondContact O-CG 3.46Å; K80-M84 PolarHBondContact O-N 2.65Å
81	Q	41.2	Very low	39.2	Very low	101 Å²	101	94.6 Å²	94.6	47%	0.472	51%	0.511	S	S	.	.	H	α-helix	trans	-65.1	-46.5	175.8	-77.5	174.3	-15.1	0	0	111.6	T77 A78 I79 S83 M84 M85	T77-Q81 WeakPolarHBondContact O-CB 3.49Å; T77-Q81 VanDerWaalsContact O-CG 3.32Å; T77-Q81 WeakPolarHBondContact O-CG 3.28Å; T77-Q81 PolarHBondContact O-N 2.85Å; A78-Q81 PolarHBondContact O-N 3.44Å; I79-Q81 VanDerWaalsContact C-N 3.33Å; I79-Q81 PolarHBondContact O-N 3.07Å; Q81-S83 PolarHBondContact O-N 3.32Å; Q81-M84 PolarHBondContact O-N 2.88Å; Q81-M85 VanDerWaalsContact O-CB 3.31Å; Q81-M85 WeakPolarHBondContact O-CB 3.49Å; Q81-M85 PolarHBondContact O-N 2.95Å
82	A	37.6	Very low	38.8	Very low	61 Å²	61	95.3 Å²	95.3	50%	0.504	51%	0.509	S	S	.	.	H	α-helix	trans	-64	-39.6	175.9	0	0	0	0	0	112.1	A78 I79 M85 K86	A78-A82 WeakPolarHBondContact O-CB 3.41Å; A78-A82 PolarHBondContact O-N 3.49Å; I79-A82 PolarHBondContact O-N 3.04Å; A82-M85 PolarHBondContact O-N 3.24Å; A82-K86 WeakPolarHBondContact O-CB 3.47Å; A82-K86 PolarHBondContact O-N 2.92Å
83	S	35.2	Very low	38.9	Very low	66 Å²	66	96.5 Å²	96.5	46%	0.462	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-49.6	172.2	165.1	0	0	0	0	110.9	I79 K80 Q81 M85 K86 T87	I79-S83 WeakPolarHBondContact O-CB 3.34Å; I79-S83 PolarHBondContact O-N 3.19Å; K80-S83 PolarHBondContact O-N 3.43Å; Q81-S83 PolarHBondContact O-N 3.32Å; S83-M85 VanDerWaalsContact C-N 3.29Å; S83-M85 PolarHBondContact O-N 2.94Å; S83-K86 PolarHBondContact O-N 3.33Å; S83-T87 PolarHBondContact O-N 3.41Å; S83-T87 PolarHBondContact O-OG1 3.49Å
84	M	36.7	Very low	38.4	Very low	102 Å²	102	95.6 Å²	95.6	50%	0.502	51%	0.511	S	S	.	.	H	α-helix	trans	-59.7	-41.1	174.9	-76.2	-161.4	-49.1	0	0	111	K80 Q81 K86 T87 Y88	K80-M84 WeakPolarHBondContact O-CB 3.28Å; K80-M84 VanDerWaalsContact O-CG 3.28Å; K80-M84 WeakPolarHBondContact O-CG 3.46Å; K80-M84 PolarHBondContact O-N 2.65Å; Q81-M84 PolarHBondContact O-N 2.88Å; M84-K86 PolarHBondContact O-N 2.65Å; M84-T87 CarbonylContact O-C 3.53Å; M84-T87 WeakPolarHBondContact O-CA 3.34Å; M84-T87 WeakPolarHBondContact O-CB 3.47Å; M84-T87 PolarHBondContact O-N 3.26Å; M84-T87 VanDerWaalsContact O-N 3.08Å; M84-Y88 HydrophobicContact CB-CD2 4.36Å; M84-Y88 WeakPolarHBondContact O-CB 3.45Å; M84-Y88 WeakPolarHBondContact O-CD2 3.44Å; M84-Y88 PolarHBondContact O-N 3.37Å
85	M	36.8	Very low	38.1	Very low	132 Å²	132	96.4 Å²	96.4	65%	0.65	51%	0.508	S	S	*	.	H	α-helix	trans	-63.4	-41.8	178	-156.4	166.3	172	0	0	111.1	Q81 A82 S83 T87 Y88 I89	Q81-M85 VanDerWaalsContact O-CB 3.31Å; Q81-M85 WeakPolarHBondContact O-CB 3.49Å; Q81-M85 PolarHBondContact O-N 2.95Å; A82-M85 PolarHBondContact O-N 3.24Å; S83-M85 VanDerWaalsContact C-N 3.29Å; S83-M85 PolarHBondContact O-N 2.94Å; M85-T87 VanDerWaalsContact C-N 3.31Å; M85-T87 PolarHBondContact O-N 2.98Å; M85-Y88 PolarHBondContact O-N 3.33Å; M85-I89 WeakPolarHBondContact O-CB 3.44Å; M85-I89 WeakPolarHBondContact O-CD1 3.44Å; M85-I89 WeakPolarHBondContact O-CG1 3.49Å; M85-I89 PolarHBondContact O-N 3.17Å
86	K	35	Very low	37.9	Very low	165 Å²	165	99 Å²	99	72%	0.717	51%	0.511	S	S	*	.	H	α-helix	trans	-63.8	-36.8	171.1	-165.2	177.2	-177	178.5	0	112.1	A82 S83 M84 S90	A82-K86 WeakPolarHBondContact O-CB 3.47Å; A82-K86 PolarHBondContact O-N 2.92Å; S83-K86 PolarHBondContact O-N 3.33Å; M84-K86 PolarHBondContact O-N 2.65Å; K86-S90 VanDerWaalsContact O-CB 3.31Å; K86-S90 WeakPolarHBondContact O-CB 3.38Å; K86-S90 PolarHBondContact O-N 2.93Å
87	T	36.8	Very low	37.9	Very low	75 Å²	75	97 Å²	97	46%	0.46	51%	0.505	S	S	.	.	H	α-helix	trans	-70.2	-40.1	176.2	-33.8	0	0	0	0	110.9	S83 M84 M85 S90 L91	S83-T87 PolarHBondContact O-N 3.41Å; S83-T87 PolarHBondContact O-OG1 3.49Å; M84-T87 CarbonylContact O-C 3.53Å; M84-T87 WeakPolarHBondContact O-CA 3.34Å; M84-T87 WeakPolarHBondContact O-CB 3.47Å; M84-T87 PolarHBondContact O-N 3.26Å; M84-T87 VanDerWaalsContact O-N 3.08Å; M85-T87 VanDerWaalsContact C-N 3.31Å; M85-T87 PolarHBondContact O-N 2.98Å; T87-S90 CarbonylContact O-C 3.6Å; T87-S90 WeakPolarHBondContact O-CB 3.38Å; T87-S90 PolarHBondContact O-N 3.44Å; T87-L91 VanDerWaalsContact O-CB 3.29Å; T87-L91 WeakPolarHBondContact O-CB 3.5Å; T87-L91 PolarHBondContact O-N 3.12Å
88	Y	39.4	Very low	37.6	Very low	164 Å²	164	98.4 Å²	98.4	64%	0.643	51%	0.51	S	S	*	.	H	α-helix	trans	-65.8	-42.6	174.8	-90.4	-72.7	0	0	0	111	M84 M85 S90 L91 E92	M84-Y88 HydrophobicContact CB-CD2 4.36Å; M84-Y88 WeakPolarHBondContact O-CB 3.45Å; M84-Y88 WeakPolarHBondContact O-CD2 3.44Å; M84-Y88 PolarHBondContact O-N 3.37Å; M85-Y88 PolarHBondContact O-N 3.33Å; Y88-S90 VanDerWaalsContact C-N 3.33Å; Y88-S90 PolarHBondContact O-N 3.19Å; Y88-L91 CarbonylContact O-C 3.6Å; Y88-L91 PolarHBondContact O-N 2.94Å; Y88-E92 VanDerWaalsContact O-CB 3.23Å; Y88-E92 WeakPolarHBondContact O-CB 3.47Å; Y88-E92 PolarHBondContact O-N 3Å
89	I	37.1	Very low	37.3	Very low	97 Å²	97	101.4 Å²	101.4	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-61.9	-43.3	173.6	-67.8	161.8	0	0	0	110.2	M85 E92 T93	M85-I89 WeakPolarHBondContact O-CB 3.44Å; M85-I89 WeakPolarHBondContact O-CD1 3.44Å; M85-I89 WeakPolarHBondContact O-CG1 3.49Å; M85-I89 PolarHBondContact O-N 3.17Å; I89-E92 PolarHBondContact O-N 3.34Å; I89-T93 WeakPolarHBondContact O-CB 3.37Å; I89-T93 PolarHBondContact O-N 3Å; I89-T93 PolarHBondContact O-OG1 3.44Å
90	S	40.5	Very low	37.2	Very low	56 Å²	56	99.3 Å²	99.3	39%	0.392	52%	0.516	S	S	.	.	H	α-helix	trans	-62.8	-42.9	173.9	177.2	0	0	0	0	112	K86 T87 Y88 E92 T93 N94	K86-S90 VanDerWaalsContact O-CB 3.31Å; K86-S90 WeakPolarHBondContact O-CB 3.38Å; K86-S90 PolarHBondContact O-N 2.93Å; T87-S90 CarbonylContact O-C 3.6Å; T87-S90 WeakPolarHBondContact O-CB 3.38Å; T87-S90 PolarHBondContact O-N 3.44Å; Y88-S90 VanDerWaalsContact C-N 3.33Å; Y88-S90 PolarHBondContact O-N 3.19Å; S90-E92 VanDerWaalsContact C-N 3.35Å; S90-T93 VanDerWaalsContact CA-OG1 3.24Å; S90-T93 WeakPolarHBondContact CA-OG1 3.49Å; S90-T93 PolarHBondContact O-N 3.47Å; S90-T93 PolarHBondContact O-OG1 3.4Å; S90-N94 VanDerWaalsContact O-CB 3.31Å; S90-N94 WeakPolarHBondContact O-CB 3.1Å; S90-N94 PolarHBondContact O-N 2.83Å; S90-N94 PolarHBondContact O-ND2 3.08Å
91	L	36.5	Very low	36.9	Very low	97 Å²	97	99.5 Å²	99.5	51%	0.508	52%	0.521	S	S	.	.	H	α-helix	trans	-69.5	-35.1	179	-141.6	115.5	0	0	0	111.3	T87 Y88 L95	T87-L91 VanDerWaalsContact O-CB 3.29Å; T87-L91 WeakPolarHBondContact O-CB 3.5Å; T87-L91 PolarHBondContact O-N 3.12Å; Y88-L91 CarbonylContact O-C 3.6Å; Y88-L91 PolarHBondContact O-N 2.94Å; L91-L95 HydrophobicContact CD2-CD1 4Å; L91-L95 WeakPolarHBondContact O-CB 3.4Å; L91-L95 WeakPolarHBondContact O-CG 3.39Å; L91-L95 PolarHBondContact O-N 3.36Å
92	E	35.8	Very low	36.5	Very low	99 Å²	99	100.5 Å²	100.5	46%	0.463	53%	0.53	S	S	.	.	H	α-helix	trans	-72.9	-38.1	175.8	-157.3	-166	168.9	0	0	110.9	Y88 I89 S90 R96	Y88-E92 VanDerWaalsContact O-CB 3.23Å; Y88-E92 WeakPolarHBondContact O-CB 3.47Å; Y88-E92 PolarHBondContact O-N 3Å; I89-E92 PolarHBondContact O-N 3.34Å; S90-E92 VanDerWaalsContact C-N 3.35Å; E92-R96 VanDerWaalsContact O-CB 3.29Å; E92-R96 WeakPolarHBondContact O-CB 3.49Å; E92-R96 WeakPolarHBondContact O-CG 3.41Å; E92-R96 PolarHBondContact O-N 2.89Å; E92-R96 IonicContact OE1-CZ 3.84Å; E92-R96 IonicContact OE1-NE 3.77Å; E92-R96 IonicContact OE1-NH2 2.71Å; E92-R96 PolarHBondContact OE1-NH2 2.74Å
93	T	40	Very low	36.1	Very low	79 Å²	79	102.8 Å²	102.8	49%	0.485	54%	0.537	S	S	.	.	H	α-helix	trans	-68.3	-39.2	172.4	37.5	0	0	0	0	112	I89 S90 R96 S97	I89-T93 WeakPolarHBondContact O-CB 3.37Å; I89-T93 PolarHBondContact O-N 3Å; I89-T93 PolarHBondContact O-OG1 3.44Å; S90-T93 VanDerWaalsContact CA-OG1 3.24Å; S90-T93 WeakPolarHBondContact CA-OG1 3.49Å; S90-T93 PolarHBondContact O-N 3.47Å; S90-T93 PolarHBondContact O-OG1 3.4Å; T93-R96 CarbonylContact O-C 3.57Å; T93-R96 PolarHBondContact O-N 2.87Å; T93-S97 PolarHBondContact O-N 3.34Å
94	N	37.7	Very low	35.8	Very low	85 Å²	85	103.3 Å²	103.3	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-68.2	-43.2	172.4	-70.4	-15.3	0	0	0	111.7	S90 R96 S97 D98	S90-N94 VanDerWaalsContact O-CB 3.31Å; S90-N94 WeakPolarHBondContact O-CB 3.1Å; S90-N94 PolarHBondContact O-N 2.83Å; S90-N94 PolarHBondContact O-ND2 3.08Å; N94-R96 PolarHBondContact O-N 3.18Å; N94-S97 WeakPolarHBondContact CA-OG 3.41Å; N94-S97 CarbonylContact O-C 3.58Å; N94-S97 PolarHBondContact O-N 2.97Å; N94-S97 VanDerWaalsContact O-N 3.13Å; N94-S97 PolarHBondContact O-OG 3.37Å; N94-D98 VanDerWaalsContact O-CB 3.31Å; N94-D98 WeakPolarHBondContact O-CB 2.96Å; N94-D98 PolarHBondContact O-N 3.17Å
95	L	35	Very low	35.4	Very low	95 Å²	95	104 Å²	104	50%	0.497	55%	0.55	S	S	.	.	H	α-helix	trans	-60.8	-34.1	173.1	-83.8	166.4	0	0	0	111.2	L91 L99	L91-L95 HydrophobicContact CD2-CD1 4Å; L91-L95 WeakPolarHBondContact O-CB 3.4Å; L91-L95 WeakPolarHBondContact O-CG 3.39Å; L91-L95 PolarHBondContact O-N 3.36Å; L95-L99 VanDerWaalsContact O-CB 3.25Å; L95-L99 WeakPolarHBondContact O-CB 3.49Å; L95-L99 PolarHBondContact O-N 3.17Å
96	R	36	Very low	35.2	Very low	155 Å²	155	104.3 Å²	104.3	59%	0.585	55%	0.554	S	S	*	*	H	α-helix	trans	-74.8	-34.7	174	-76	176.9	-169.3	-157.9	6.5	112.3	E92 T93 N94 D98 A100	E92-R96 VanDerWaalsContact O-CB 3.29Å; E92-R96 WeakPolarHBondContact O-CB 3.49Å; E92-R96 WeakPolarHBondContact O-CG 3.41Å; E92-R96 PolarHBondContact O-N 2.89Å; E92-R96 IonicContact OE1-CZ 3.84Å; E92-R96 IonicContact OE1-NE 3.77Å; E92-R96 IonicContact OE1-NH2 2.71Å; E92-R96 PolarHBondContact OE1-NH2 2.74Å; T93-R96 CarbonylContact O-C 3.57Å; T93-R96 PolarHBondContact O-N 2.87Å; N94-R96 PolarHBondContact O-N 3.18Å; R96-D98 VanDerWaalsContact C-N 3.35Å; R96-A100 WeakPolarHBondContact O-CB 3.42Å; R96-A100 PolarHBondContact O-N 3.41Å
97	S	37.9	Very low	34.9	Very low	56 Å²	56	105.3 Å²	105.3	39%	0.392	56%	0.562	S	S	.	*	H	α-helix	trans	-67.8	-39.1	171.8	71.4	0	0	0	0	111.2	T93 N94 A100 M101	T93-S97 PolarHBondContact O-N 3.34Å; N94-S97 WeakPolarHBondContact CA-OG 3.41Å; N94-S97 CarbonylContact O-C 3.58Å; N94-S97 PolarHBondContact O-N 2.97Å; N94-S97 VanDerWaalsContact O-N 3.13Å; N94-S97 PolarHBondContact O-OG 3.37Å; S97-A100 PolarHBondContact O-N 3.16Å; S97-M101 WeakPolarHBondContact O-CB 3.41Å; S97-M101 WeakPolarHBondContact O-CG 3.19Å; S97-M101 PolarHBondContact O-N 2.9Å
98	D	35.8	Very low	34.8	Very low	96 Å²	96	106.8 Å²	106.8	51%	0.513	57%	0.573	S	S	.	*	H	α-helix	trans	-70.6	-40.3	176.5	-74.6	-6.5	0	0	0	110.3	N94 R96 A100 M101 D102	N94-D98 VanDerWaalsContact O-CB 3.31Å; N94-D98 WeakPolarHBondContact O-CB 2.96Å; N94-D98 PolarHBondContact O-N 3.17Å; R96-D98 VanDerWaalsContact C-N 3.35Å; D98-A100 VanDerWaalsContact C-N 3.33Å; D98-A100 PolarHBondContact O-N 3Å; D98-M101 PolarHBondContact O-N 2.92Å; D98-D102 PolarHBondContact O-N 3.32Å
99	L	33.3	Very low	34.7	Very low	114 Å²	114	107 Å²	107	60%	0.597	58%	0.579	S	S	*	*	H	α-helix	trans	-63.8	-39.8	171.1	-121	81.9	0	0	0	111.4	L95 M101 D102 T103	L95-L99 VanDerWaalsContact O-CB 3.25Å; L95-L99 WeakPolarHBondContact O-CB 3.49Å; L95-L99 PolarHBondContact O-N 3.17Å; L99-M101 VanDerWaalsContact C-N 3.27Å; L99-M101 PolarHBondContact O-N 3.33Å; L99-D102 PolarHBondContact O-N 3.33Å; L99-T103 PolarHBondContact O-N 3.27Å; L99-T103 PolarHBondContact O-OG1 3.01Å
100	A	36.2	Very low	34.8	Very low	56 Å²	56	106.2 Å²	106.2	46%	0.463	58%	0.579	S	S	.	*	H	α-helix	trans	-63.9	-36.8	176.9	0	0	0	0	0	110.9	R96 S97 D98 T103 A104	R96-A100 WeakPolarHBondContact O-CB 3.42Å; R96-A100 PolarHBondContact O-N 3.41Å; S97-A100 PolarHBondContact O-N 3.16Å; D98-A100 VanDerWaalsContact C-N 3.33Å; D98-A100 PolarHBondContact O-N 3Å; A100-T103 WeakPolarHBondContact CA-OG1 3.47Å; A100-T103 PolarHBondContact O-N 3Å; A100-T103 PolarHBondContact O-OG1 3.36Å; A100-A104 PolarHBondContact O-N 3.42Å; A100-A104 VanDerWaalsContact O-N 3.09Å
101	M	34	Very low	35	Very low	138 Å²	138	108.8 Å²	108.8	68%	0.68	59%	0.588	S	S	*	*	H	α-helix	trans	-71.1	-38.7	174.4	-69.6	-92.8	-102	0	0	112.1	S97 D98 L99 T103 A104	S97-M101 WeakPolarHBondContact O-CB 3.41Å; S97-M101 WeakPolarHBondContact O-CG 3.19Å; S97-M101 PolarHBondContact O-N 2.9Å; D98-M101 PolarHBondContact O-N 2.92Å; L99-M101 VanDerWaalsContact C-N 3.27Å; L99-M101 PolarHBondContact O-N 3.33Å; M101-T103 VanDerWaalsContact C-N 3.29Å; M101-T103 PolarHBondContact O-N 2.92Å; M101-A104 WeakPolarHBondContact O-CB 3.35Å; M101-A104 PolarHBondContact O-N 3.19Å
102	D	32.7	Very low	35.7	Very low	123 Å²	123	112 Å²	112	66%	0.658	60%	0.601	S	S	*	*	H	α-helix	trans	-68.3	-29.2	173.7	-92.7	-7.8	0	0	0	112	D98 L99 A104	D98-D102 PolarHBondContact O-N 3.32Å; L99-D102 PolarHBondContact O-N 3.33Å; D102-A104 VanDerWaalsContact C-N 3.31Å
103	T	30.1	Very low	36.1	Very low	109 Å²	109	112.8 Å²	112.8	67%	0.669	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-5.5	169.4	52.7	0	0	0	0	114.2	L99 A100 M101 I105	L99-T103 PolarHBondContact O-N 3.27Å; L99-T103 PolarHBondContact O-OG1 3.01Å; A100-T103 WeakPolarHBondContact CA-OG1 3.47Å; A100-T103 PolarHBondContact O-N 3Å; A100-T103 PolarHBondContact O-OG1 3.36Å; M101-T103 VanDerWaalsContact C-N 3.29Å; M101-T103 PolarHBondContact O-N 2.92Å; T103-I105 PolarHBondContact O-N 3.04Å
104	A	28.3	Very low	36.5	Very low	77 Å²	77	112.5 Å²	112.5	64%	0.636	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	2.9	172.8	0	0	0	0	0	112.6	A100 M101 D102	A100-A104 PolarHBondContact O-N 3.42Å; A100-A104 VanDerWaalsContact O-N 3.09Å; M101-A104 WeakPolarHBondContact O-CB 3.35Å; M101-A104 PolarHBondContact O-N 3.19Å; D102-A104 VanDerWaalsContact C-N 3.31Å
105	I	29.6	Very low	37.2	Very low	115 Å²	115	110.1 Å²	110.1	59%	0.59	59%	0.589	S	S	*	*	S	Bend	trans	-87.3	111.8	166.2	-54.3	178.2	0	0	0	107.1	T103	T103-I105 PolarHBondContact O-N 3.04Å
106	D	31.4	Very low	38.1	Very low	139 Å²	139	111.5 Å²	111.5	74%	0.743	59%	0.593	S	S	*	*			trans	93.1	70.3	169.2	-52.8	-26.8	0	0	0	117.7
107	E	28.7	Very low	39	Very low	186 Å²	186	107.6 Å²	107.6	87%	0.869	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.8	126.9	133.6	-81.4	176.5	139.3	0	0	107.8
108	P	35.8	Very low	39.9	Very low	107 Å²	107	105.9 Å²	105.9	70%	0.695	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn		-150.5	34.8	50.5	38.9	-15.3	0	0	0	114.6
109	H	36.6	Very low	41.3	Very low	167 Å²	167	103.1 Å²	103.1	77%	0.773	56%	0.555	S	S	*	*			trans	-107.3	67.1	172.6	-76	18.9	0	0	0	109.3	D111	H109-D111 VanDerWaalsContact C-N 3.29Å; H109-D111 PolarHBondContact O-N 3.03Å
110	V	38.8	Very low	42.3	Very low	82 Å²	82	101.3 Å²	101.3	50%	0.497	55%	0.546	S	S	.	.			trans	-65	101.5	163.8	179	0	0	0	0	105.5	E112 V115 V146	V110-E112 PolarHBondContact O-N 3.44Å; V110-V115 HydrophobicContact CG1-CG2 3.88Å; V110-V146 HydrophobicContact CG1-CB 4.37Å; V110-V146 HydrophobicContact CG1-CG2 3.34Å
111	D	45.9	Very low	43	Very low	110 Å²	110	101.2 Å²	101.2	59%	0.588	54%	0.537	S	S	*	.			trans	-42.4	117.7	-178.4	-87.3	-36.1	0	0	0	108.8	H109 L113 E114 V115	H109-D111 VanDerWaalsContact C-N 3.29Å; H109-D111 PolarHBondContact O-N 3.03Å; D111-L113 HydrophobicContact CB-CB 4.37Å; D111-L113 PolarHBondContact O-N 2.92Å; D111-E114 HydrophobicContact CB-CB 4.26Å; D111-E114 PolarHBondContact O-N 2.8Å; D111-V115 PolarHBondContact O-N 3.25Å
112	E	49.4	Very low	44.4	Very low	165 Å²	165	94.7 Å²	94.7	77%	0.771	51%	0.505	S	S	*	.	H	α-helix	trans	-50.7	-29.5	173.5	-69.8	179.3	154.7	0	0	110.4	V110 V115 E116	V110-E112 PolarHBondContact O-N 3.44Å; E112-V115 PolarHBondContact O-N 3.04Å; E112-E116 WeakPolarHBondContact O-CB 3.38Å; E112-E116 WeakPolarHBondContact O-CG 3.33Å; E112-E116 PolarHBondContact O-N 2.89Å
113	L	44.9	Very low	45.8	Very low	115 Å²	115	94.7 Å²	94.7	60%	0.602	50%	0.496	S	S	*	.	H	α-helix	trans	-64.1	-37.1	173.9	-158.9	79.1	0	0	0	113.7	D111 N117	D111-L113 HydrophobicContact CB-CB 4.37Å; D111-L113 PolarHBondContact O-N 2.92Å; L113-N117 VanDerWaalsContact O-CB 3.26Å; L113-N117 WeakPolarHBondContact O-CB 3.48Å; L113-N117 PolarHBondContact O-N 2.7Å; L113-N117 PolarHBondContact O-ND2 3.38Å
114	E	48.3	Very low	46.8	Very low	72 Å²	72	93.4 Å²	93.4	34%	0.336	48%	0.482	S	S	.	.	H	α-helix	trans	-71.6	-40.3	176.5	-164.8	-177.4	179.4	0	0	110.6	D111 N117 L118 R150	D111-E114 HydrophobicContact CB-CB 4.26Å; D111-E114 PolarHBondContact O-N 2.8Å; E114-N117 PolarHBondContact O-N 2.93Å; E114-L118 HydrophobicContact CG-CD1 4.17Å; E114-L118 WeakPolarHBondContact O-CB 3.25Å; E114-L118 VanDerWaalsContact O-CG 3.25Å; E114-L118 WeakPolarHBondContact O-CG 3.44Å; E114-L118 PolarHBondContact O-N 3.05Å; E114-R150 IonicContact OE1-CZ 3.6Å; E114-R150 IonicContact OE1-NE 2.76Å; E114-R150 IonicContact OE1-NH2 3.56Å; E114-R150 PolarHBondContact OE1-NH2 2.81Å
115	V	52.8	Low	47.7	Very low	36 Å²	36	90.9 Å²	90.9	22%	0.218	46%	0.458	C	S	.	.	H	α-helix	trans	-63	-47.3	174.4	-178.7	0	0	0	0	110.7	V110 D111 E112 L118 I119 V146 L149	V110-V115 HydrophobicContact CG1-CG2 3.88Å; D111-V115 PolarHBondContact O-N 3.25Å; E112-V115 PolarHBondContact O-N 3.04Å; V115-L118 PolarHBondContact O-N 2.84Å; V115-I119 HydrophobicContact CG1-CD1 3.8Å; V115-I119 HydrophobicContact CG1-CG1 4.36Å; V115-I119 WeakPolarHBondContact O-CB 3.31Å; V115-I119 VanDerWaalsContact O-CG1 3.26Å; V115-I119 WeakPolarHBondContact O-CG1 3.4Å; V115-I119 PolarHBondContact O-N 3.15Å; V115-V146 HydrophobicContact CG2-CG2 3.57Å; V115-L149 HydrophobicContact CG1-CD1 4.12Å
116	E	54.6	Low	48.9	Very low	123 Å²	123	85.5 Å²	85.5	58%	0.575	43%	0.43	S	S	*	.	H	α-helix	trans	-60.3	-46.3	176.3	-81.1	-174.2	163	0	0	111.7	E112 L118 I119 D120	E112-E116 WeakPolarHBondContact O-CB 3.38Å; E112-E116 WeakPolarHBondContact O-CG 3.33Å; E112-E116 PolarHBondContact O-N 2.89Å; E116-L118 VanDerWaalsContact C-N 3.32Å; E116-L118 PolarHBondContact O-N 3.45Å; E116-I119 PolarHBondContact O-N 3.49Å; E116-D120 PolarHBondContact O-N 3.11Å
117	N	55	Low	49.9	Very low	74 Å²	74	83.1 Å²	83.1	40%	0.396	41%	0.413	S	S	.	.	H	α-helix	trans	-60.2	-42.3	176.6	-79.8	-45.4	0	0	0	111.8	L113 E114 D120 I121	L113-N117 VanDerWaalsContact O-CB 3.26Å; L113-N117 WeakPolarHBondContact O-CB 3.48Å; L113-N117 PolarHBondContact O-N 2.7Å; L113-N117 PolarHBondContact O-ND2 3.38Å; E114-N117 PolarHBondContact O-N 2.93Å; N117-D120 PolarHBondContact O-N 3.19Å; N117-I121 WeakPolarHBondContact O-CD1 3.4Å; N117-I121 WeakPolarHBondContact O-CG1 3.24Å; N117-I121 PolarHBondContact O-N 2.95Å
118	L	56.6	Low	50.8	Low	19 Å²	19	75.9 Å²	75.9	10%	0.099	39%	0.385	C	S	.	.	H	α-helix	trans	-69.9	-35.4	177.8	-72.4	169.3	0	0	0	112.2	E114 V115 E116 D120 I121 D122 V146 L149 R150 I153	E114-L118 HydrophobicContact CG-CD1 4.17Å; E114-L118 WeakPolarHBondContact O-CB 3.25Å; E114-L118 VanDerWaalsContact O-CG 3.25Å; E114-L118 WeakPolarHBondContact O-CG 3.44Å; E114-L118 PolarHBondContact O-N 3.05Å; V115-L118 PolarHBondContact O-N 2.84Å; E116-L118 VanDerWaalsContact C-N 3.32Å; E116-L118 PolarHBondContact O-N 3.45Å; L118-D120 VanDerWaalsContact C-N 3.32Å; L118-I121 HydrophobicContact CD2-CD1 4.42Å; L118-I121 PolarHBondContact O-N 3.27Å; L118-D122 VanDerWaalsContact O-CB 3.32Å; L118-D122 WeakPolarHBondContact O-CB 3.48Å; L118-D122 PolarHBondContact O-N 3.32Å; L118-V146 HydrophobicContact CD1-CB 4.41Å; L118-V146 HydrophobicContact CD1-CG1 3.65Å; L118-V146 HydrophobicContact CD1-CG2 4.27Å; L118-L149 HydrophobicContact CB-CB 4.27Å; L118-L149 HydrophobicContact CB-CD1 4.45Å; L118-R150 HydrophobicContact CD1-CG 3.98Å; L118-R150 HydrophobicContact CD2-CG 4.07Å; L118-I153 HydrophobicContact CB-CD1 4.3Å; L118-I153 HydrophobicContact CD2-CD1 3.75Å
119	I	63.4	Low	51.5	Low	39 Å²	39	70.8 Å²	70.8	20%	0.2	35%	0.352	C	S	.	.	H	α-helix	trans	-62.7	-42.4	172.9	-72	168.3	0	0	0	110.3	V115 E116 D122 R123 P139 L149	V115-I119 HydrophobicContact CG1-CD1 3.8Å; V115-I119 HydrophobicContact CG1-CG1 4.36Å; V115-I119 WeakPolarHBondContact O-CB 3.31Å; V115-I119 VanDerWaalsContact O-CG1 3.26Å; V115-I119 WeakPolarHBondContact O-CG1 3.4Å; V115-I119 PolarHBondContact O-N 3.15Å; E116-I119 PolarHBondContact O-N 3.49Å; I119-D122 PolarHBondContact O-N 3.31Å; I119-R123 WeakPolarHBondContact O-CB 3.29Å; I119-R123 PolarHBondContact O-N 2.9Å; I119-P139 HydrophobicContact CG2-CB 4.27Å; I119-L149 HydrophobicContact CG1-CD1 3.85Å; I119-L149 HydrophobicContact CG1-CD2 4Å
120	D	56.2	Low	52.4	Low	76 Å²	76	67.1 Å²	67.1	41%	0.406	33%	0.332	S	S	.	.	H	α-helix	trans	-64.5	-45.2	176.4	-83.1	-15.8	0	0	0	111.3	E116 N117 L118 D122 R123 H124	E116-D120 PolarHBondContact O-N 3.11Å; N117-D120 PolarHBondContact O-N 3.19Å; L118-D120 VanDerWaalsContact C-N 3.32Å; D120-D122 PolarHBondContact O-N 2.99Å; D120-R123 WeakPolarHBondContact O-CB 3.42Å; D120-R123 PolarHBondContact O-N 3.45Å; D120-R123 VanDerWaalsContact O-N 3.17Å; D120-H124 PolarHBondContact O-CD2 3.35Å; D120-H124 PolarHBondContact O-N 3.02Å
121	I	49.8	Very low	52.9	Low	54 Å²	54	72 Å²	72	28%	0.277	34%	0.343	S	S	.	.	H	α-helix	trans	-59.3	-48.8	175.1	-68.3	163.7	0	0	0	110.6	N117 L118 R123 H124 I125 I153	N117-I121 WeakPolarHBondContact O-CD1 3.4Å; N117-I121 WeakPolarHBondContact O-CG1 3.24Å; N117-I121 PolarHBondContact O-N 2.95Å; L118-I121 HydrophobicContact CD2-CD1 4.42Å; L118-I121 PolarHBondContact O-N 3.27Å; I121-R123 VanDerWaalsContact C-N 3.26Å; I121-R123 PolarHBondContact O-N 3.38Å; I121-H124 PolarHBondContact O-N 2.83Å; I121-H124 VanDerWaalsContact O-N 3.12Å; I121-I125 HydrophobicContact CG2-CD1 3.46Å; I121-I125 VanDerWaalsContact CG2-CD1 3.46Å; I121-I125 HydrophobicContact CG2-CG1 4.11Å; I121-I125 WeakPolarHBondContact O-CG1 3.32Å; I121-I125 PolarHBondContact O-N 3.48Å; I121-I153 HydrophobicContact CB-CD1 4.12Å; I121-I153 HydrophobicContact CG2-CD1 3.79Å; I121-I153 HydrophobicContact CG2-CG1 4.17Å; I121-I153 HydrophobicContact CG2-CG2 4.14Å
122	D	64.2	Low	52.9	Low	1 Å²	1	71.3 Å²	71.3	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-60.3	-36.1	176.5	177.3	64.6	0	0	0	112.1	L118 I119 D120 G126 L149 R152 I153 Q156	L118-D122 VanDerWaalsContact O-CB 3.32Å; L118-D122 WeakPolarHBondContact O-CB 3.48Å; L118-D122 PolarHBondContact O-N 3.32Å; I119-D122 PolarHBondContact O-N 3.31Å; D120-D122 PolarHBondContact O-N 2.99Å; D122-G126 WeakPolarHBondContact O-CA 3.48Å; D122-G126 PolarHBondContact O-N 3.46Å; D122-L149 HydrophobicContact CB-CD2 4.01Å; D122-R152 VanDerWaalsContact CG-NE 3.28Å; D122-R152 IonicContact OD1-CZ 3.68Å; D122-R152 IonicContact OD1-NE 3.08Å; D122-R152 PolarHBondContact OD1-NE 3.26Å; D122-R152 IonicContact OD1-NH2 3.84Å; D122-R152 PolarHBondContact OD1-NH2 3.23Å; D122-R152 IonicContact OD2-CZ 2.83Å; D122-R152 IonicContact OD2-NE 3.88Å; D122-R152 PolarHBondContact OD2-NE 3Å; D122-R152 VanDerWaalsContact OD2-NE 3.08Å; D122-R152 IonicContact OD2-NH2 3.22Å; D122-R152 PolarHBondContact OD2-NH2 3.16Å; D122-I153 HydrophobicContact CB-CD1 4.17Å; D122-I153 HydrophobicContact CB-CG1 3.87Å; D122-Q156 PolarHBondContact OD1-NE2 2.97Å
123	R	62	Low	53.1	Low	123 Å²	123	66.4 Å²	66.4	46%	0.464	33%	0.328	S	S	.	.	H	α-helix	trans	-66.1	-41	175.4	-163.8	-179.8	-150.6	165.6	12.1	111.4	I119 D120 I121 F127 P139	I119-R123 WeakPolarHBondContact O-CB 3.29Å; I119-R123 PolarHBondContact O-N 2.9Å; D120-R123 WeakPolarHBondContact O-CB 3.42Å; D120-R123 PolarHBondContact O-N 3.45Å; D120-R123 VanDerWaalsContact O-N 3.17Å; I121-R123 VanDerWaalsContact C-N 3.26Å; I121-R123 PolarHBondContact O-N 3.38Å; R123-F127 WeakPolarHBondContact O-CB 3.24Å; R123-F127 PolarHBondContact O-N 3.41Å; R123-F127 VanDerWaalsContact O-N 3.12Å; R123-P139 HydrophobicContact CB-CG 4.45Å; R123-P139 HydrophobicContact CG-CG 4.19Å
124	H	49.9	Very low	53.5	Low	82 Å²	82	63.4 Å²	63.4	38%	0.38	31%	0.311	S	S	.	.	H	α-helix	trans	-73.5	-49.6	-178.9	-71.3	-51	0	0	0	112.4	D120 I121 F127 A128 E189 I193	D120-H124 PolarHBondContact O-CD2 3.35Å; D120-H124 PolarHBondContact O-N 3.02Å; I121-H124 PolarHBondContact O-N 2.83Å; I121-H124 VanDerWaalsContact O-N 3.12Å; H124-F127 WeakPolarHBondContact O-CB 3.35Å; H124-F127 PolarHBondContact O-N 3.23Å; H124-A128 PolarHBondContact O-N 3.42Å; H124-E189 WeakPolarHBondContact CB-OE1 3.47Å; H124-E189 IonicContact CD2-OE1 3.45Å; H124-E189 IonicContact CG-OE1 2.66Å; H124-I193 HydrophobicContact CB-CD1 4.37Å
125	I	47.2	Very low	54	Low	24 Å²	24	68 Å²	68	12%	0.123	34%	0.338	C	S	.	.	H	α-helix	trans	-66.8	-43.1	177.4	-59.1	176.2	0	0	0	109.7	I121 F127 A128 C129 I153 Q156 I157 L160	I121-I125 HydrophobicContact CG2-CD1 3.46Å; I121-I125 VanDerWaalsContact CG2-CD1 3.46Å; I121-I125 HydrophobicContact CG2-CG1 4.11Å; I121-I125 WeakPolarHBondContact O-CG1 3.32Å; I121-I125 PolarHBondContact O-N 3.48Å; I125-F127 PolarHBondContact O-N 3.39Å; I125-F127 VanDerWaalsContact O-N 3.16Å; I125-A128 CarbonylContact O-C 3.57Å; I125-A128 WeakPolarHBondContact O-CA 3.47Å; I125-A128 WeakPolarHBondContact O-CB 3.39Å; I125-A128 PolarHBondContact O-N 3.06Å; I125-C129 PolarHBondContact O-N 2.82Å; I125-C129 PolarHBondContact O-SG 2.79Å; I125-I153 HydrophobicContact CD1-CG2 3.69Å; I125-Q156 HydrophobicContact CG2-CB 3.5Å; I125-Q156 VanDerWaalsContact CG2-CB 3.5Å; I125-Q156 HydrophobicContact CG2-CG 4.46Å; I125-I157 HydrophobicContact CD1-CD1 4.02Å; I125-I157 HydrophobicContact CD1-CG1 3.85Å; I125-I157 HydrophobicContact CG2-CG1 4.38Å; I125-L160 HydrophobicContact CG2-CD1 3.66Å
126	G	55.8	Low	54.2	Low	1 Å²	1	67 Å²	67	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-59.8	-29.5	175.1	0	0	0	0	0	112.8	D122 R130	D122-G126 WeakPolarHBondContact O-CA 3.48Å; D122-G126 PolarHBondContact O-N 3.46Å; G126-R130 WeakPolarHBondContact O-CB 3.3Å; G126-R130 WeakPolarHBondContact O-CG 3.47Å; G126-R130 PolarHBondContact O-N 2.93Å; G126-R130 VanDerWaalsContact O-N 3.1Å; G126-R130 PolarHBondContact O-NE 3.1Å
127	F	52.8	Low	54.3	Low	90 Å²	90	63 Å²	63	40%	0.395	32%	0.324	S	S	.	.	H	α-helix	trans	-67.9	-44.3	170.7	-173.3	-89.2	0	0	0	112.4	R123 H124 I125 R130 Y131	R123-F127 WeakPolarHBondContact O-CB 3.24Å; R123-F127 PolarHBondContact O-N 3.41Å; R123-F127 VanDerWaalsContact O-N 3.12Å; H124-F127 WeakPolarHBondContact O-CB 3.35Å; H124-F127 PolarHBondContact O-N 3.23Å; I125-F127 PolarHBondContact O-N 3.39Å; I125-F127 VanDerWaalsContact O-N 3.16Å; F127-R130 PolarHBondContact O-N 3.38Å; F127-Y131 PolarHBondContact O-N 3.2Å
128	A	45.9	Very low	54.4	Low	34 Å²	34	64.7 Å²	64.7	28%	0.281	34%	0.339	S	S	.	.	H	α-helix	trans	-64.1	-42	175.1	0	0	0	0	0	112	H124 I125 R130 Y131 F132 L160	H124-A128 PolarHBondContact O-N 3.42Å; I125-A128 CarbonylContact O-C 3.57Å; I125-A128 WeakPolarHBondContact O-CA 3.47Å; I125-A128 WeakPolarHBondContact O-CB 3.39Å; I125-A128 PolarHBondContact O-N 3.06Å; A128-R130 VanDerWaalsContact C-N 3.34Å; A128-R130 PolarHBondContact O-N 3.12Å; A128-Y131 VanDerWaalsContact O-CB 3.29Å; A128-Y131 WeakPolarHBondContact O-CB 3.25Å; A128-Y131 PolarHBondContact O-N 3.45Å; A128-Y131 VanDerWaalsContact O-N 3.11Å; A128-F132 WeakPolarHBondContact O-CD2 3.34Å; A128-F132 PolarHBondContact O-N 2.96Å; A128-L160 HydrophobicContact CB-CD1 3.97Å; A128-L160 HydrophobicContact CB-CD2 4.04Å
129	C	50.7	Low	54.4	Low	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-63.4	-38.6	176.7	-59.9	0	0	0	0	112.4	I125 Y131 F132 G133 M134 V136 Q156 F159	I125-C129 PolarHBondContact O-N 2.82Å; I125-C129 PolarHBondContact O-SG 2.79Å; C129-Y131 VanDerWaalsContact C-N 3.27Å; C129-Y131 PolarHBondContact O-N 3.01Å; C129-F132 CarbonylContact O-C 3.59Å; C129-F132 PolarHBondContact O-N 2.87Å; C129-G133 PolarHBondContact O-N 3.44Å; C129-M134 HydrophobicContact CB-CB 4.04Å; C129-M134 HydrophobicContact CB-CE 3.83Å; C129-M134 WeakPolarHBondContact O-CB 3.24Å; C129-M134 PolarHBondContact O-N 3.38Å; C129-V136 HydrophobicContact CB-CG2 3.62Å; C129-Q156 VanDerWaalsContact SG-CB 3.53Å; C129-Q156 PolarHBondContact SG-O 2.99Å; C129-Q156 VanDerWaalsContact SG-O 3.4Å; C129-F159 HydrophobicContact CB-CD1 3.96Å; C129-F159 HydrophobicContact CB-CE1 4.17Å
130	R	56.4	Low	53.9	Low	90 Å²	90	65.1 Å²	65.1	34%	0.34	35%	0.35	S	S	.	.	H	α-helix	trans	-61.3	-34.9	173	-79.7	-175.3	-68.1	-107.6	-2.9	112.6	G126 F127 A128 F132 G133 M134 V136	G126-R130 WeakPolarHBondContact O-CB 3.3Å; G126-R130 WeakPolarHBondContact O-CG 3.47Å; G126-R130 PolarHBondContact O-N 2.93Å; G126-R130 VanDerWaalsContact O-N 3.1Å; G126-R130 PolarHBondContact O-NE 3.1Å; F127-R130 PolarHBondContact O-N 3.38Å; A128-R130 VanDerWaalsContact C-N 3.34Å; A128-R130 PolarHBondContact O-N 3.12Å; R130-F132 VanDerWaalsContact C-N 3.34Å; R130-G133 PolarHBondContact O-N 3.09Å; R130-G133 VanDerWaalsContact O-N 3.13Å; R130-M134 WeakPolarHBondContact CA-O 3.47Å; R130-M134 WeakPolarHBondContact CG-O 3.48Å; R130-V136 HydrophobicContact CG-CB 4.24Å; R130-V136 PolarHBondContact NH1-O 3.03Å
131	Y	49.1	Very low	53.6	Low	185 Å²	185	68.1 Å²	68.1	73%	0.725	36%	0.362	S	S	*	.	H	α-helix	trans	-62.4	-40.4	174.6	178.7	-95.2	0	0	0	112.2	F127 A128 C129 G133	F127-Y131 PolarHBondContact O-N 3.2Å; A128-Y131 VanDerWaalsContact O-CB 3.29Å; A128-Y131 WeakPolarHBondContact O-CB 3.25Å; A128-Y131 PolarHBondContact O-N 3.45Å; A128-Y131 VanDerWaalsContact O-N 3.11Å; C129-Y131 VanDerWaalsContact C-N 3.27Å; C129-Y131 PolarHBondContact O-N 3.01Å; Y131-G133 PolarHBondContact O-N 3.43Å
132	F	45.8	Very low	53.7	Low	94 Å²	94	73.9 Å²	73.9	41%	0.412	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	9.4	174.8	-71.6	-74.4	0	0	0	114.1	A128 C129 R130 F159 L160 C163	A128-F132 WeakPolarHBondContact O-CD2 3.34Å; A128-F132 PolarHBondContact O-N 2.96Å; C129-F132 CarbonylContact O-C 3.59Å; C129-F132 PolarHBondContact O-N 2.87Å; R130-F132 VanDerWaalsContact C-N 3.34Å; F132-F159 HydrophobicContact CB-CE1 3.74Å; F132-F159 HydrophobicContact CB-CZ 4.04Å; F132-L160 HydrophobicContact CD2-CD2 3.49Å; F132-L160 VanDerWaalsContact CD2-CD2 3.49Å; F132-L160 HydrophobicContact CE2-CD2 3.81Å; F132-C163 HydrophobicContact CD1-CB 4.08Å; F132-C163 HydrophobicContact CE1-CB 4.36Å; F132-C163 HydrophobicContact CG-CB 4.16Å
133	G	54.3	Low	53.1	Low	62 Å²	62	80 Å²	80	64%	0.639	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.5	7.9	172.2	0	0	0	0	0	115.9	C129 R130 Y131	C129-G133 PolarHBondContact O-N 3.44Å; R130-G133 PolarHBondContact O-N 3.09Å; R130-G133 VanDerWaalsContact O-N 3.13Å; Y131-G133 PolarHBondContact O-N 3.43Å
134	M	52.5	Low	52.8	Low	52 Å²	52	76.1 Å²	76.1	26%	0.256	42%	0.417	S	S	.	.			trans	-79.1	126.5	172.4	-163.6	163.9	87.3	0	0	110.6	C129 R130 V136 Q156 F159	C129-M134 HydrophobicContact CB-CB 4.04Å; C129-M134 HydrophobicContact CB-CE 3.83Å; C129-M134 WeakPolarHBondContact O-CB 3.24Å; C129-M134 PolarHBondContact O-N 3.38Å; R130-M134 WeakPolarHBondContact CA-O 3.47Å; R130-M134 WeakPolarHBondContact CG-O 3.48Å; M134-V136 VanDerWaalsContact C-N 3.27Å; M134-V136 HydrophobicContact CB-CG2 4.2Å; M134-V136 HydrophobicContact CE-CG2 3.47Å; M134-V136 VanDerWaalsContact CE-CG2 3.47Å; M134-V136 HydrophobicContact CG-CG2 4.08Å; M134-V136 PolarHBondContact O-N 2.86Å; M134-Q156 HydrophobicContact CE-CB 4.39Å; M134-Q156 HydrophobicContact CE-CG 3.74Å; M134-F159 HydrophobicContact CB-CD1 4.02Å; M134-F159 HydrophobicContact CB-CE1 3.57Å; M134-F159 HydrophobicContact CB-CE2 4.13Å; M134-F159 HydrophobicContact CB-CG 4.46Å; M134-F159 HydrophobicContact CB-CZ 3.65Å; M134-F159 HydrophobicContact CE-CB 4.18Å; M134-F159 HydrophobicContact CE-CD1 4.25Å; M134-F159 HydrophobicContact CE-CG 4.21Å; M134-F159 HydrophobicContact CG-CE1 4.46Å; M134-F159 HydrophobicContact CG-CE2 4.48Å; M134-F159 HydrophobicContact CG-CZ 4.46Å; M134-F159 HydrophobicContact SD-CB 3.77Å; M134-F159 HydrophobicContact SD-CD1 3.75Å; M134-F159 HydrophobicContact SD-CD2 3.61Å; M134-F159 HydrophobicContact SD-CE1 4.24Å; M134-F159 HydrophobicContact SD-CE2 4.12Å; M134-F159 HydrophobicContact SD-CG 3.4Å; M134-F159 WeakPolarHBondContact SD-CG 3.49Å; M134-F159 HydrophobicContact SD-CZ 4.42Å
135	N	58.9	Low	53.4	Low	169 Å²	169	75.8 Å²	75.8	90%	0.904	42%	0.424	S	S	*	.			trans	-74.5	80	174.6	-91.4	-20.3	0	0	0	110.8
136	V	57.1	Low	53.9	Low	16 Å²	16	75.9 Å²	75.9	10%	0.097	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-86.9	116.3	172	-167.4	0	0	0	0	109.1	C129 R130 M134 Q156	C129-V136 HydrophobicContact CB-CG2 3.62Å; R130-V136 HydrophobicContact CG-CB 4.24Å; R130-V136 PolarHBondContact NH1-O 3.03Å; M134-V136 VanDerWaalsContact C-N 3.27Å; M134-V136 HydrophobicContact CB-CG2 4.2Å; M134-V136 HydrophobicContact CE-CG2 3.47Å; M134-V136 VanDerWaalsContact CE-CG2 3.47Å; M134-V136 HydrophobicContact CG-CG2 4.08Å; M134-V136 PolarHBondContact O-N 2.86Å; V136-Q156 VanDerWaalsContact CG1-NE2 3.26Å
137	G	56	Low	54.2	Low	39 Å²	39	78.8 Å²	78.8	40%	0.402	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-59.6	162.9	175	0	0	0	0	0	112.8	R152	G137-R152 PolarHBondContact O-NH2 3.05Å; G137-R152 VanDerWaalsContact O-NH2 3.12Å
138	P	57.8	Low	55	Low	108 Å²	108	77.3 Å²	77.3	70%	0.701	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-55.3	149.6	175.1	22.4	-30.6	0	0	0	111	A140	P138-A140 PolarHBondContact O-N 2.77Å
139	P	55.8	Low	55.8	Low	16 Å²	16	76.1 Å²	76.1	10%	0.104	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-55.6	133.3	173.6	23.9	-31.6	0	0	0	108.5	I119 R123 E141	I119-P139 HydrophobicContact CG2-CB 4.27Å; R123-P139 HydrophobicContact CB-CG 4.45Å; R123-P139 HydrophobicContact CG-CG 4.19Å; P139-E141 PolarHBondContact O-N 3.06Å
140	A	53.3	Low	56.5	Low	51 Å²	51	81.9 Å²	81.9	42%	0.421	46%	0.461	S	S	.	.			trans	-75	97.2	179.7	0	0	0	0	0	108.1	P138 K142 V144	P138-A140 PolarHBondContact O-N 2.77Å; A140-K142 PolarHBondContact O-N 3.29Å; A140-K142 VanDerWaalsContact O-N 3.07Å; A140-V144 HydrophobicContact CB-CG2 3.44Å; A140-V144 VanDerWaalsContact CB-CG2 3.44Å
141	E	49.9	Very low	57.1	Low	140 Å²	140	83 Å²	83	65%	0.654	47%	0.473	S	S	*	.			trans	-70.3	-0.5	-171.2	-71.2	-179.4	172.4	0	0	114.2	P139	P139-E141 PolarHBondContact O-N 3.06Å
142	K	51.5	Low	57.9	Low	175 Å²	175	77.5 Å²	77.5	76%	0.761	45%	0.452	S	S	*	.	S	Bend	trans	-143.8	122.2	-176.3	-60	-174.7	-177.4	-179.2	0	110.7	A140	A140-K142 PolarHBondContact O-N 3.29Å; A140-K142 VanDerWaalsContact O-N 3.07Å
143	S	52.8	Low	58.6	Low	129 Å²	129	73.5 Å²	73.5	90%	0.902	43%	0.434	S	S	*	.			trans	61.9	52.7	168.3	69.1	0	0	0	0	117.8
144	V	54.7	Low	59.1	Low	42 Å²	42	74.6 Å²	74.6	26%	0.255	43%	0.426	S	S	.	.			trans	-105.7	130.6	169.8	-171.8	0	0	0	0	110.1	A140 L149	A140-V144 HydrophobicContact CB-CG2 3.44Å; A140-V144 VanDerWaalsContact CB-CG2 3.44Å; V144-L149 HydrophobicContact CB-CD1 4.28Å; V144-L149 HydrophobicContact CB-CG 4.4Å; V144-L149 HydrophobicContact CG1-CD1 4.34Å; V144-L149 HydrophobicContact CG1-CG 4.01Å
145	S	63.9	Low	59.8	Low	75 Å²	75	74.9 Å²	74.9	52%	0.524	44%	0.436	S	S	.	.			trans	-63.9	144.1	172.2	62.5	0	0	0	0	111.1	A147 S148 L149	S145-A147 PolarHBondContact O-N 3.39Å; S145-A147 VanDerWaalsContact O-N 3.15Å; S145-S148 WeakPolarHBondContact O-CB 3.38Å; S145-S148 PolarHBondContact O-N 3.12Å; S145-S148 WeakPolarHBondContact OG-CB 3.39Å; S145-S148 PolarHBondContact OG-N 3.01Å; S145-L149 PolarHBondContact O-N 3.45Å
146	V	56.5	Low	59.9	Low	26 Å²	26	67 Å²	67	16%	0.158	39%	0.393	C	S	.	.	H	α-helix	trans	-50.1	-40.3	175	165.7	0	0	0	0	112.7	V110 V115 L118 S148 L149 R150	V110-V146 HydrophobicContact CG1-CB 4.37Å; V110-V146 HydrophobicContact CG1-CG2 3.34Å; V115-V146 HydrophobicContact CG2-CG2 3.57Å; L118-V146 HydrophobicContact CD1-CB 4.41Å; L118-V146 HydrophobicContact CD1-CG1 3.65Å; L118-V146 HydrophobicContact CD1-CG2 4.27Å; V146-S148 VanDerWaalsContact C-N 3.32Å; V146-S148 PolarHBondContact O-N 3.29Å; V146-L149 PolarHBondContact O-N 3Å; V146-L149 VanDerWaalsContact O-N 3.16Å; V146-R150 HydrophobicContact CG1-CG 4.27Å; V146-R150 PolarHBondContact O-N 3.2Å
147	A	63.4	Low	59.8	Low	61 Å²	61	69.1 Å²	69.1	50%	0.504	40%	0.404	S	S	.	.	H	α-helix	trans	-58.8	-42.1	177	0	0	0	0	0	112.6	S145 N151	S145-A147 PolarHBondContact O-N 3.39Å; S145-A147 VanDerWaalsContact O-N 3.15Å; A147-N151 WeakPolarHBondContact O-CB 3.21Å; A147-N151 PolarHBondContact O-N 2.05Å; A147-N151 PolarHBondContact O-ND2 2.93Å
148	S	68.6	Low	60.1	Low	59 Å²	59	71.8 Å²	71.8	41%	0.413	41%	0.409	S	S	.	.	H	α-helix	trans	-70.1	-32.5	177.1	179.3	0	0	0	0	112.9	S145 V146 R152	S145-S148 WeakPolarHBondContact O-CB 3.38Å; S145-S148 PolarHBondContact O-N 3.12Å; S145-S148 WeakPolarHBondContact OG-CB 3.39Å; S145-S148 PolarHBondContact OG-N 3.01Å; V146-S148 VanDerWaalsContact C-N 3.32Å; V146-S148 PolarHBondContact O-N 3.29Å; S148-R152 VanDerWaalsContact O-CB 3.31Å; S148-R152 WeakPolarHBondContact O-CB 3.46Å; S148-R152 PolarHBondContact O-N 3.46Å
149	L	62.7	Low	60.3	Low	9 Å²	9	69.2 Å²	69.2	5%	0.047	39%	0.387	C	S	.	.	H	α-helix	trans	-69.2	-47.6	174.3	-90.5	154.6	0	0	0	111	V115 L118 I119 D122 V144 S145 V146 R152 I153	V115-L149 HydrophobicContact CG1-CD1 4.12Å; L118-L149 HydrophobicContact CB-CB 4.27Å; L118-L149 HydrophobicContact CB-CD1 4.45Å; I119-L149 HydrophobicContact CG1-CD1 3.85Å; I119-L149 HydrophobicContact CG1-CD2 4Å; D122-L149 HydrophobicContact CB-CD2 4.01Å; V144-L149 HydrophobicContact CB-CD1 4.28Å; V144-L149 HydrophobicContact CB-CG 4.4Å; V144-L149 HydrophobicContact CG1-CD1 4.34Å; V144-L149 HydrophobicContact CG1-CG 4.01Å; S145-L149 PolarHBondContact O-N 3.45Å; V146-L149 PolarHBondContact O-N 3Å; V146-L149 VanDerWaalsContact O-N 3.16Å; L149-R152 PolarHBondContact O-N 2.86Å; L149-I153 WeakPolarHBondContact O-CG1 3.43Å; L149-I153 PolarHBondContact O-N 3.28Å
150	R	64.7	Low	60	Low	122 Å²	122	69.9 Å²	69.9	46%	0.46	39%	0.389	S	S	.	.	H	α-helix	trans	-60	-48.7	177.1	-73.1	-176.4	176.8	-148	5.5	111.9	E114 L118 V146 R152 I153 D154	E114-R150 IonicContact OE1-CZ 3.6Å; E114-R150 IonicContact OE1-NE 2.76Å; E114-R150 IonicContact OE1-NH2 3.56Å; E114-R150 PolarHBondContact OE1-NH2 2.81Å; L118-R150 HydrophobicContact CD1-CG 3.98Å; L118-R150 HydrophobicContact CD2-CG 4.07Å; V146-R150 HydrophobicContact CG1-CG 4.27Å; V146-R150 PolarHBondContact O-N 3.2Å; R150-R152 PolarHBondContact O-N 3.4Å; R150-I153 WeakPolarHBondContact O-CB 3.3Å; R150-I153 PolarHBondContact O-N 3.46Å; R150-I153 VanDerWaalsContact O-N 3.08Å; R150-D154 PolarHBondContact O-N 2.8Å
151	N	70.7	Confident	59.9	Low	112 Å²	112	68.3 Å²	68.3	60%	0.599	37%	0.374	S	S	*	.	H	α-helix	trans	-59.6	-34.4	177.6	-70.5	-12.8	0	0	0	112.7	A147 A155	A147-N151 WeakPolarHBondContact O-CB 3.21Å; A147-N151 PolarHBondContact O-N 2.05Å; A147-N151 PolarHBondContact O-ND2 2.93Å; N151-A155 WeakPolarHBondContact O-CB 3.4Å; N151-A155 PolarHBondContact O-N 3.39Å; N151-A155 VanDerWaalsContact O-N 3.15Å
152	R	65.1	Low	60.3	Low	71 Å²	71	65.4 Å²	65.4	27%	0.268	36%	0.363	S	S	.	.	H	α-helix	trans	-73.1	-39.8	176.8	-178.9	175.7	141.4	156.5	-0.7	111.7	D122 G137 S148 L149 R150 Q156	D122-R152 VanDerWaalsContact CG-NE 3.28Å; D122-R152 IonicContact OD1-CZ 3.68Å; D122-R152 IonicContact OD1-NE 3.08Å; D122-R152 PolarHBondContact OD1-NE 3.26Å; D122-R152 IonicContact OD1-NH2 3.84Å; D122-R152 PolarHBondContact OD1-NH2 3.23Å; D122-R152 IonicContact OD2-CZ 2.83Å; D122-R152 IonicContact OD2-NE 3.88Å; D122-R152 PolarHBondContact OD2-NE 3Å; D122-R152 VanDerWaalsContact OD2-NE 3.08Å; D122-R152 IonicContact OD2-NH2 3.22Å; D122-R152 PolarHBondContact OD2-NH2 3.16Å; G137-R152 PolarHBondContact O-NH2 3.05Å; G137-R152 VanDerWaalsContact O-NH2 3.12Å; S148-R152 VanDerWaalsContact O-CB 3.31Å; S148-R152 WeakPolarHBondContact O-CB 3.46Å; S148-R152 PolarHBondContact O-N 3.46Å; L149-R152 PolarHBondContact O-N 2.86Å; R150-R152 PolarHBondContact O-N 3.4Å; R152-Q156 VanDerWaalsContact O-CG 3.28Å; R152-Q156 WeakPolarHBondContact O-CG 3.41Å; R152-Q156 PolarHBondContact O-N 3.34Å; R152-Q156 VanDerWaalsContact O-N 3.13Å
153	I	60.3	Low	60.2	Low	10 Å²	10	57.8 Å²	57.8	5%	0.051	33%	0.331	C	S	.	.	H	α-helix	trans	-63.3	-46.4	173.6	-73.4	162.1	0	0	0	110.6	L118 I121 D122 I125 L149 R150 A155 Q156 I157	L118-I153 HydrophobicContact CB-CD1 4.3Å; L118-I153 HydrophobicContact CD2-CD1 3.75Å; I121-I153 HydrophobicContact CB-CD1 4.12Å; I121-I153 HydrophobicContact CG2-CD1 3.79Å; I121-I153 HydrophobicContact CG2-CG1 4.17Å; I121-I153 HydrophobicContact CG2-CG2 4.14Å; D122-I153 HydrophobicContact CB-CD1 4.17Å; D122-I153 HydrophobicContact CB-CG1 3.87Å; I125-I153 HydrophobicContact CD1-CG2 3.69Å; L149-I153 WeakPolarHBondContact O-CG1 3.43Å; L149-I153 PolarHBondContact O-N 3.28Å; R150-I153 WeakPolarHBondContact O-CB 3.3Å; R150-I153 PolarHBondContact O-N 3.46Å; R150-I153 VanDerWaalsContact O-N 3.08Å; I153-A155 VanDerWaalsContact C-N 3.34Å; I153-A155 PolarHBondContact O-N 3.19Å; I153-Q156 CarbonylContact O-C 3.33Å; I153-Q156 WeakPolarHBondContact O-CA 3.39Å; I153-Q156 WeakPolarHBondContact O-CB 3.35Å; I153-Q156 PolarHBondContact O-N 2.83Å; I153-I157 HydrophobicContact CG2-CD1 3.68Å; I153-I157 HydrophobicContact CG2-CG1 4.25Å; I153-I157 WeakPolarHBondContact O-CG1 3.5Å; I153-I157 PolarHBondContact O-N 3.16Å
154	D	64.4	Low	59.8	Low	85 Å²	85	53.8 Å²	53.8	46%	0.455	30%	0.299	S	S	.	.	H	α-helix	trans	-60.5	-45.1	179.6	-69.4	-23	0	0	0	110.9	R150 Q156 I157 D158	R150-D154 PolarHBondContact O-N 2.8Å; D154-Q156 VanDerWaalsContact C-N 3.26Å; D154-Q156 PolarHBondContact O-N 3.19Å; D154-I157 PolarHBondContact O-N 3.1Å; D154-D158 WeakPolarHBondContact O-CB 3.3Å; D154-D158 PolarHBondContact O-N 3.19Å
155	A	66.8	Low	59.5	Low	57 Å²	57	57 Å²	57	47%	0.471	31%	0.307	S	S	.	.	H	α-helix	trans	-61.4	-33.4	174.9	0	0	0	0	0	113.2	N151 I153 F159	N151-A155 WeakPolarHBondContact O-CB 3.4Å; N151-A155 PolarHBondContact O-N 3.39Å; N151-A155 VanDerWaalsContact O-N 3.15Å; I153-A155 VanDerWaalsContact C-N 3.34Å; I153-A155 PolarHBondContact O-N 3.19Å; A155-F159 PolarHBondContact O-N 2.77Å; A155-F159 VanDerWaalsContact O-N 3.13Å
156	Q	62.8	Low	58.7	Low	3 Å²	3	61.4 Å²	61.4	1%	0.014	32%	0.317	C	S	.	.	H	α-helix	trans	-74.3	-38.9	175.6	-75.3	173.3	18.1	0	0	112.7	D122 I125 C129 M134 V136 R152 I153 D154 F159 L160	D122-Q156 PolarHBondContact OD1-NE2 2.97Å; I125-Q156 HydrophobicContact CG2-CB 3.5Å; I125-Q156 VanDerWaalsContact CG2-CB 3.5Å; I125-Q156 HydrophobicContact CG2-CG 4.46Å; C129-Q156 VanDerWaalsContact SG-CB 3.53Å; C129-Q156 PolarHBondContact SG-O 2.99Å; C129-Q156 VanDerWaalsContact SG-O 3.4Å; M134-Q156 HydrophobicContact CE-CB 4.39Å; M134-Q156 HydrophobicContact CE-CG 3.74Å; V136-Q156 VanDerWaalsContact CG1-NE2 3.26Å; R152-Q156 VanDerWaalsContact O-CG 3.28Å; R152-Q156 WeakPolarHBondContact O-CG 3.41Å; R152-Q156 PolarHBondContact O-N 3.34Å; R152-Q156 VanDerWaalsContact O-N 3.13Å; I153-Q156 CarbonylContact O-C 3.33Å; I153-Q156 WeakPolarHBondContact O-CA 3.39Å; I153-Q156 WeakPolarHBondContact O-CB 3.35Å; I153-Q156 PolarHBondContact O-N 2.83Å; D154-Q156 VanDerWaalsContact C-N 3.26Å; D154-Q156 PolarHBondContact O-N 3.19Å; Q156-F159 PolarHBondContact O-N 2.68Å; Q156-L160 WeakPolarHBondContact O-CG 3.31Å; Q156-L160 PolarHBondContact O-N 3.44Å
157	I	53.7	Low	58	Low	62 Å²	62	65.8 Å²	65.8	32%	0.318	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-46.1	173.8	-69.3	171.9	0	0	0	109.6	I125 I153 D154 F159 L160 L161	I125-I157 HydrophobicContact CD1-CD1 4.02Å; I125-I157 HydrophobicContact CD1-CG1 3.85Å; I125-I157 HydrophobicContact CG2-CG1 4.38Å; I153-I157 HydrophobicContact CG2-CD1 3.68Å; I153-I157 HydrophobicContact CG2-CG1 4.25Å; I153-I157 WeakPolarHBondContact O-CG1 3.5Å; I153-I157 PolarHBondContact O-N 3.16Å; D154-I157 PolarHBondContact O-N 3.1Å; I157-F159 VanDerWaalsContact C-N 3.29Å; I157-F159 PolarHBondContact O-N 3.07Å; I157-L160 CarbonylContact O-C 3.52Å; I157-L160 PolarHBondContact O-N 3.4Å; I157-L160 VanDerWaalsContact O-N 3.09Å; I157-L161 HydrophobicContact CG2-CD1 3.83Å; I157-L161 HydrophobicContact CG2-CG 4.15Å; I157-L161 WeakPolarHBondContact O-CB 3.45Å; I157-L161 WeakPolarHBondContact O-CG 3.32Å; I157-L161 PolarHBondContact O-N 2.97Å
158	D	62.2	Low	56.9	Low	95 Å²	95	65.8 Å²	65.8	51%	0.508	34%	0.335	S	S	.	.	H	α-helix	trans	-58.7	-42.8	176.6	-78.8	-20.5	0	0	0	111.3	D154 L160 L161 D162	D154-D158 WeakPolarHBondContact O-CB 3.3Å; D154-D158 PolarHBondContact O-N 3.19Å; D158-L160 PolarHBondContact O-N 3.16Å; D158-L161 PolarHBondContact O-N 3.05Å; D158-D162 WeakPolarHBondContact O-CB 3.43Å; D158-D162 PolarHBondContact O-N 3Å
159	F	61.9	Low	55.9	Low	53 Å²	53	66.7 Å²	66.7	23%	0.232	34%	0.339	C	S	.	.	H	α-helix	trans	-60.8	-44.3	173.5	173.9	-98.9	0	0	0	112.6	C129 F132 M134 A155 Q156 I157 D162 C163	C129-F159 HydrophobicContact CB-CD1 3.96Å; C129-F159 HydrophobicContact CB-CE1 4.17Å; F132-F159 HydrophobicContact CB-CE1 3.74Å; F132-F159 HydrophobicContact CB-CZ 4.04Å; M134-F159 HydrophobicContact CB-CD1 4.02Å; M134-F159 HydrophobicContact CB-CE1 3.57Å; M134-F159 HydrophobicContact CB-CE2 4.13Å; M134-F159 HydrophobicContact CB-CG 4.46Å; M134-F159 HydrophobicContact CB-CZ 3.65Å; M134-F159 HydrophobicContact CE-CB 4.18Å; M134-F159 HydrophobicContact CE-CD1 4.25Å; M134-F159 HydrophobicContact CE-CG 4.21Å; M134-F159 HydrophobicContact CG-CE1 4.46Å; M134-F159 HydrophobicContact CG-CE2 4.48Å; M134-F159 HydrophobicContact CG-CZ 4.46Å; M134-F159 HydrophobicContact SD-CB 3.77Å; M134-F159 HydrophobicContact SD-CD1 3.75Å; M134-F159 HydrophobicContact SD-CD2 3.61Å; M134-F159 HydrophobicContact SD-CE1 4.24Å; M134-F159 HydrophobicContact SD-CE2 4.12Å; M134-F159 HydrophobicContact SD-CG 3.4Å; M134-F159 WeakPolarHBondContact SD-CG 3.49Å; M134-F159 HydrophobicContact SD-CZ 4.42Å; A155-F159 PolarHBondContact O-N 2.77Å; A155-F159 VanDerWaalsContact O-N 3.13Å; Q156-F159 PolarHBondContact O-N 2.68Å; I157-F159 VanDerWaalsContact C-N 3.29Å; I157-F159 PolarHBondContact O-N 3.07Å; F159-D162 PolarHBondContact O-N 3.43Å; F159-C163 VanDerWaalsContact CZ-SG 3.5Å; F159-C163 PolarHBondContact O-N 3.32Å; F159-C163 PolarHBondContact O-SG 3.41Å; F159-C163 VanDerWaalsContact O-SG 3.36Å
160	L	50.4	Low	55.1	Low	30 Å²	30	69.4 Å²	69.4	16%	0.157	36%	0.356	C	S	.	.	H	α-helix	trans	-67.5	-40.4	178.1	-72.9	172.3	0	0	0	112.3	I125 A128 F132 Q156 I157 D158 D162 C163 L164	I125-L160 HydrophobicContact CG2-CD1 3.66Å; A128-L160 HydrophobicContact CB-CD1 3.97Å; A128-L160 HydrophobicContact CB-CD2 4.04Å; F132-L160 HydrophobicContact CD2-CD2 3.49Å; F132-L160 VanDerWaalsContact CD2-CD2 3.49Å; F132-L160 HydrophobicContact CE2-CD2 3.81Å; Q156-L160 WeakPolarHBondContact O-CG 3.31Å; Q156-L160 PolarHBondContact O-N 3.44Å; I157-L160 CarbonylContact O-C 3.52Å; I157-L160 PolarHBondContact O-N 3.4Å; I157-L160 VanDerWaalsContact O-N 3.09Å; D158-L160 PolarHBondContact O-N 3.16Å; L160-D162 VanDerWaalsContact C-N 3.3Å; L160-C163 WeakPolarHBondContact O-CB 3.2Å; L160-C163 PolarHBondContact O-N 3.46Å; L160-L164 WeakPolarHBondContact O-CB 3.25Å; L160-L164 WeakPolarHBondContact O-CG 3.39Å; L160-L164 PolarHBondContact O-N 3.12Å
161	L	51.6	Low	54	Low	19 Å²	19	70 Å²	70	10%	0.099	36%	0.359	C	S	.	.	H	α-helix	trans	-62.5	-40.5	174.1	-73.4	175.4	0	0	0	110.4	I157 D158 L164 R165 M175	I157-L161 HydrophobicContact CG2-CD1 3.83Å; I157-L161 HydrophobicContact CG2-CG 4.15Å; I157-L161 WeakPolarHBondContact O-CB 3.45Å; I157-L161 WeakPolarHBondContact O-CG 3.32Å; I157-L161 PolarHBondContact O-N 2.97Å; D158-L161 PolarHBondContact O-N 3.05Å; L161-L164 PolarHBondContact O-N 3.11Å; L161-R165 WeakPolarHBondContact O-CB 3.48Å; L161-R165 VanDerWaalsContact O-CG 3.28Å; L161-R165 WeakPolarHBondContact O-CG 3.29Å; L161-R165 PolarHBondContact O-N 2.91Å; L161-M175 HydrophobicContact CD2-CB 4.38Å
162	D	57.6	Low	52.5	Low	78 Å²	78	64.8 Å²	64.8	42%	0.417	33%	0.331	S	S	.	.	H	α-helix	trans	-65.6	-39.5	173.1	-88.9	4.3	0	0	0	112.4	D158 F159 L160 L164 R165 K166	D158-D162 WeakPolarHBondContact O-CB 3.43Å; D158-D162 PolarHBondContact O-N 3Å; F159-D162 PolarHBondContact O-N 3.43Å; L160-D162 VanDerWaalsContact C-N 3.3Å; D162-L164 VanDerWaalsContact C-N 3.32Å; D162-L164 PolarHBondContact O-N 3.13Å; D162-R165 IonicContact OD1-CZ 2.68Å; D162-R165 IonicContact OD1-NH1 3.08Å; D162-R165 PolarHBondContact OD1-NH1 2.83Å; D162-K166 VanDerWaalsContact O-CG 3.28Å; D162-K166 WeakPolarHBondContact O-CG 3.38Å; D162-K166 PolarHBondContact O-N 3.37Å
163	C	49.9	Very low	51.7	Low	16 Å²	16	65.8 Å²	65.8	11%	0.108	34%	0.342	C	S	.	.	H	α-helix	trans	-61	-40.7	171.2	-74.8	0	0	0	0	112	F132 F159 L160 K166	F132-C163 HydrophobicContact CD1-CB 4.08Å; F132-C163 HydrophobicContact CE1-CB 4.36Å; F132-C163 HydrophobicContact CG-CB 4.16Å; F159-C163 VanDerWaalsContact CZ-SG 3.5Å; F159-C163 PolarHBondContact O-N 3.32Å; F159-C163 PolarHBondContact O-SG 3.41Å; F159-C163 VanDerWaalsContact O-SG 3.36Å; L160-C163 WeakPolarHBondContact O-CB 3.2Å; L160-C163 PolarHBondContact O-N 3.46Å; C163-K166 WeakPolarHBondContact O-CB 3.37Å; C163-K166 PolarHBondContact O-N 3.42Å
164	L	44.9	Very low	50.8	Low	44 Å²	44	71.3 Å²	71.3	23%	0.23	37%	0.365	C	S	.	.	H	α-helix	trans	-72.6	-40.2	179	-73.3	169.9	0	0	0	112.2	L160 L161 D162 K166 V167 D168 M175	L160-L164 WeakPolarHBondContact O-CB 3.25Å; L160-L164 WeakPolarHBondContact O-CG 3.39Å; L160-L164 PolarHBondContact O-N 3.12Å; L161-L164 PolarHBondContact O-N 3.11Å; D162-L164 VanDerWaalsContact C-N 3.32Å; D162-L164 PolarHBondContact O-N 3.13Å; L164-K166 PolarHBondContact O-N 2.85Å; L164-V167 PolarHBondContact O-N 3.3Å; L164-D168 PolarHBondContact O-N 3.11Å; L164-M175 HydrophobicContact CD1-CG 4.48Å
165	R	47.4	Very low	49.5	Very low	109 Å²	109	69.2 Å²	69.2	41%	0.411	35%	0.353	S	S	.	.	H	α-helix	trans	-56.7	-34	173.7	-78.5	177.4	-175.5	139.7	-0.2	112	L161 D162 V167 A172	L161-R165 WeakPolarHBondContact O-CB 3.48Å; L161-R165 VanDerWaalsContact O-CG 3.28Å; L161-R165 WeakPolarHBondContact O-CG 3.29Å; L161-R165 PolarHBondContact O-N 2.91Å; D162-R165 IonicContact OD1-CZ 2.68Å; D162-R165 IonicContact OD1-NH1 3.08Å; D162-R165 PolarHBondContact OD1-NH1 2.83Å; R165-V167 VanDerWaalsContact C-N 3.3Å; R165-V167 PolarHBondContact O-N 3.26Å; R165-A172 HydrophobicContact CB-CB 4.41Å; R165-A172 HydrophobicContact CG-CB 3.4Å; R165-A172 VanDerWaalsContact CG-CB 3.4Å
166	K	46.8	Very low	48.3	Very low	168 Å²	168	69.3 Å²	69.3	73%	0.73	35%	0.346	S	S	*	.	H	α-helix	trans	-68.7	-26.5	175.1	-70.5	170.8	-173.9	-178.4	0	113.5	D162 C163 L164	D162-K166 VanDerWaalsContact O-CG 3.28Å; D162-K166 WeakPolarHBondContact O-CG 3.38Å; D162-K166 PolarHBondContact O-N 3.37Å; C163-K166 WeakPolarHBondContact O-CB 3.37Å; C163-K166 PolarHBondContact O-N 3.42Å; L164-K166 PolarHBondContact O-N 2.85Å
167	V	41.6	Very low	47.4	Very low	119 Å²	119	74 Å²	74	72%	0.721	37%	0.371	S	S	*	.	H	α-helix	trans	-89.7	-47	179.8	-179.1	0	0	0	0	110.7	L164 R165	L164-V167 PolarHBondContact O-N 3.3Å; R165-V167 VanDerWaalsContact C-N 3.3Å; R165-V167 PolarHBondContact O-N 3.26Å
168	D	41.6	Very low	46.6	Very low	61 Å²	61	73 Å²	73	33%	0.326	37%	0.369	S	S	.	.			trans	-161.4	117	175.6	-175	-28.3	0	0	0	110.2	L164 T170 W171	L164-D168 PolarHBondContact O-N 3.11Å; D168-T170 VanDerWaalsContact C-N 3.32Å; D168-T170 PolarHBondContact O-N 3.37Å; D168-T170 WeakPolarHBondContact OD1-CB 3.42Å; D168-T170 PolarHBondContact OD1-N 3.42Å; D168-T170 PolarHBondContact OD1-OG1 2.97Å; D168-W171 HydrophobicContact CB-CB 4.32Å; D168-W171 PolarHBondContact O-N 3.27Å
169	P	46.3	Very low	45.5	Very low	77 Å²	77	70.8 Å²	70.8	50%	0.5	36%	0.364	S	S	.	.	H	α-helix	trans	-67.2	-28.6	-178.4	23.6	-30.8	0	0	0	113.5	W171 A172 D173	P169-W171 PolarHBondContact O-N 2.78Å; P169-A172 PolarHBondContact O-N 3.42Å; P169-D173 PolarHBondContact O-N 3.23Å
170	T	47.4	Very low	44.5	Very low	66 Å²	66	75.1 Å²	75.1	41%	0.405	38%	0.383	S	S	.	.	H	α-helix	trans	-68.7	-25.7	179.2	68.7	0	0	0	0	112.2	D168 K174	D168-T170 VanDerWaalsContact C-N 3.32Å; D168-T170 PolarHBondContact O-N 3.37Å; D168-T170 WeakPolarHBondContact OD1-CB 3.42Å; D168-T170 PolarHBondContact OD1-N 3.42Å; D168-T170 PolarHBondContact OD1-OG1 2.97Å; T170-K174 WeakPolarHBondContact O-CB 3.45Å; T170-K174 WeakPolarHBondContact O-CD 3.35Å; T170-K174 WeakPolarHBondContact O-CG 3.09Å; T170-K174 PolarHBondContact O-N 3.17Å
171	W	40.8	Very low	43.9	Very low	136 Å²	136	78.7 Å²	78.7	52%	0.515	40%	0.402	S	S	.	.	H	α-helix	trans	-74.7	-36.4	175.7	-103.6	62.3	0	0	0	112.2	D168 P169 K174 M175	D168-W171 HydrophobicContact CB-CB 4.32Å; D168-W171 PolarHBondContact O-N 3.27Å; P169-W171 PolarHBondContact O-N 2.78Å; W171-K174 PolarHBondContact O-N 3.3Å; W171-M175 WeakPolarHBondContact O-CB 3.35Å; W171-M175 WeakPolarHBondContact O-CG 3.31Å; W171-M175 PolarHBondContact O-N 3.07Å
172	A	39.5	Very low	43.1	Very low	1 Å²	1	84.2 Å²	84.2	1%	0.008	43%	0.43	C	S	.	.	H	α-helix	trans	-66.7	-41.3	177.4	0	0	0	0	0	111.5	R165 P169 M175 N176	R165-A172 HydrophobicContact CB-CB 4.41Å; R165-A172 HydrophobicContact CG-CB 3.4Å; R165-A172 VanDerWaalsContact CG-CB 3.4Å; P169-A172 PolarHBondContact O-N 3.42Å; A172-M175 PolarHBondContact O-N 3.45Å; A172-N176 VanDerWaalsContact O-CB 3.24Å; A172-N176 WeakPolarHBondContact O-CB 3.32Å; A172-N176 PolarHBondContact O-N 3.1Å
173	D	47	Very low	42.2	Very low	93 Å²	93	88.4 Å²	88.4	50%	0.497	45%	0.447	S	S	.	.	H	α-helix	trans	-65.8	-45.6	175.8	-68.1	-25.2	0	0	0	111.2	P169 M175 N176 D177	P169-D173 PolarHBondContact O-N 3.23Å; D173-M175 VanDerWaalsContact C-N 3.31Å; D173-M175 PolarHBondContact O-N 3.09Å; D173-N176 PolarHBondContact O-N 2.89Å; D173-D177 WeakPolarHBondContact O-CB 3.46Å; D173-D177 PolarHBondContact O-N 2.98Å
174	K	42.6	Very low	41.5	Very low	126 Å²	126	91.6 Å²	91.6	55%	0.548	46%	0.462	S	S	.	.	H	α-helix	trans	-61.7	-38	174.2	-73.8	172	-175.5	170	0	112.3	T170 W171 C178	T170-K174 WeakPolarHBondContact O-CB 3.45Å; T170-K174 WeakPolarHBondContact O-CD 3.35Å; T170-K174 WeakPolarHBondContact O-CG 3.09Å; T170-K174 PolarHBondContact O-N 3.17Å; W171-K174 PolarHBondContact O-N 3.3Å; K174-C178 VanDerWaalsContact O-CB 3.3Å; K174-C178 WeakPolarHBondContact O-CB 3.43Å; K174-C178 PolarHBondContact O-N 3.02Å; K174-C178 PolarHBondContact O-SG 3.37Å
175	M	36.7	Very low	41	Very low	41 Å²	41	91.9 Å²	91.9	20%	0.202	47%	0.468	C	S	.	.	H	α-helix	trans	-69.2	-41.2	175.4	-92.8	-83.6	-161.9	0	0	111.6	L161 L164 W171 A172 D173 D177 C178 A179 I188	L161-M175 HydrophobicContact CD2-CB 4.38Å; L164-M175 HydrophobicContact CD1-CG 4.48Å; W171-M175 WeakPolarHBondContact O-CB 3.35Å; W171-M175 WeakPolarHBondContact O-CG 3.31Å; W171-M175 PolarHBondContact O-N 3.07Å; A172-M175 PolarHBondContact O-N 3.45Å; D173-M175 VanDerWaalsContact C-N 3.31Å; D173-M175 PolarHBondContact O-N 3.09Å; M175-D177 VanDerWaalsContact C-N 3.33Å; M175-C178 CarbonylContact O-C 3.58Å; M175-C178 PolarHBondContact O-N 3.48Å; M175-A179 WeakPolarHBondContact O-CB 3.3Å; M175-A179 PolarHBondContact O-N 2.94Å; M175-I188 HydrophobicContact CE-CG2 3.76Å; M175-I188 HydrophobicContact SD-CD1 4.45Å; M175-I188 HydrophobicContact SD-CG2 4.23Å
176	N	42.8	Very low	40.6	Very low	58 Å²	58	92.8 Å²	92.8	31%	0.31	48%	0.475	S	S	.	.	H	α-helix	trans	-65.1	-41	177.3	-166.9	15	0	0	0	110.6	A172 D173 A179 K180	A172-N176 VanDerWaalsContact O-CB 3.24Å; A172-N176 WeakPolarHBondContact O-CB 3.32Å; A172-N176 PolarHBondContact O-N 3.1Å; D173-N176 PolarHBondContact O-N 2.89Å; N176-A179 PolarHBondContact O-N 2.84Å; N176-K180 WeakPolarHBondContact O-CG 3.3Å; N176-K180 PolarHBondContact O-N 3.38Å
177	D	43.5	Very low	40.3	Very low	103 Å²	103	87.4 Å²	87.4	55%	0.551	46%	0.456	S	S	*	.	H	α-helix	trans	-65.1	-39.4	172.3	-73.1	-17.8	0	0	0	111.8	D173 M175	D173-D177 WeakPolarHBondContact O-CB 3.46Å; D173-D177 PolarHBondContact O-N 2.98Å; M175-D177 VanDerWaalsContact C-N 3.33Å
178	C	36.1	Very low	40	Very low	40 Å²	40	82.8 Å²	82.8	27%	0.27	43%	0.427	S	S	.	.	H	α-helix	trans	-71.8	-32.2	175.3	-71.5	0	0	0	0	113.4	K174 M175 K180 D181 L184 I188	K174-C178 VanDerWaalsContact O-CB 3.3Å; K174-C178 WeakPolarHBondContact O-CB 3.43Å; K174-C178 PolarHBondContact O-N 3.02Å; K174-C178 PolarHBondContact O-SG 3.37Å; M175-C178 CarbonylContact O-C 3.58Å; M175-C178 PolarHBondContact O-N 3.48Å; C178-K180 VanDerWaalsContact C-N 3.31Å; C178-D181 PolarHBondContact O-N 2.82Å; C178-D181 VanDerWaalsContact O-N 3.15Å; C178-L184 HydrophobicContact CB-CD2 4.46Å; C178-I188 HydrophobicContact CB-CD1 4.12Å
179	A	38.8	Very low	39.8	Very low	49 Å²	49	81.9 Å²	81.9	41%	0.405	42%	0.421	S	S	.	.	H	α-helix	trans	-72.3	-27.7	-179.2	0	0	0	0	0	111.8	M175 N176 D181	M175-A179 WeakPolarHBondContact O-CB 3.3Å; M175-A179 PolarHBondContact O-N 2.94Å; N176-A179 PolarHBondContact O-N 2.84Å; A179-D181 PolarHBondContact O-N 3.45Å
180	K	42	Very low	39.6	Very low	143 Å²	143	81.7 Å²	81.7	62%	0.622	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.7	170	-72.1	171.6	-173.2	166.8	0	112.5	N176 C178 I182	N176-K180 WeakPolarHBondContact O-CG 3.3Å; N176-K180 PolarHBondContact O-N 3.38Å; C178-K180 VanDerWaalsContact C-N 3.31Å; K180-I182 PolarHBondContact O-N 3.27Å
181	D	37	Very low	39.3	Very low	106 Å²	106	79 Å²	79	57%	0.567	40%	0.402	S	S	*	.	S	Bend	trans	-90.7	91.6	167.8	-102.7	-24.8	0	0	0	110.2	C178 A179 H183 L184 S185	C178-D181 PolarHBondContact O-N 2.82Å; C178-D181 VanDerWaalsContact O-N 3.15Å; A179-D181 PolarHBondContact O-N 3.45Å; D181-H183 PolarHBondContact O-N 3.36Å; D181-L184 HydrophobicContact CB-CB 4.39Å; D181-L184 PolarHBondContact O-N 2.84Å; D181-S185 PolarHBondContact O-N 2.88Å
182	I	35.8	Very low	39.3	Very low	135 Å²	135	77.5 Å²	77.5	69%	0.692	40%	0.403	S	S	*	.	H	α-helix	trans	-49.3	-31	-177.4	-71.1	169.5	0	0	0	112.9	K180	K180-I182 PolarHBondContact O-N 3.27Å
183	H	37.8	Very low	39.5	Very low	166 Å²	166	80.2 Å²	80.2	77%	0.769	42%	0.417	S	S	*	.	H	α-helix	trans	-74.4	-30.9	177.6	-76.2	-60	0	0	0	114.4	D181 V187	D181-H183 PolarHBondContact O-N 3.36Å; H183-V187 WeakPolarHBondContact O-CG2 3.48Å
184	L	34.5	Very low	39.3	Very low	82 Å²	82	77.3 Å²	77.3	43%	0.429	40%	0.401	S	S	.	.	H	α-helix	trans	-77.8	-34.2	174.5	-112.3	98.4	0	0	0	111.6	C178 D181 K186 V187 I188	C178-L184 HydrophobicContact CB-CD2 4.46Å; D181-L184 HydrophobicContact CB-CB 4.39Å; D181-L184 PolarHBondContact O-N 2.84Å; L184-K186 PolarHBondContact O-N 2.88Å; L184-V187 PolarHBondContact O-N 2.9Å; L184-V187 VanDerWaalsContact O-N 3.09Å; L184-I188 HydrophobicContact CD2-CD1 4.26Å; L184-I188 WeakPolarHBondContact O-CG1 3.46Å; L184-I188 PolarHBondContact O-N 2.87Å
185	S	34	Very low	39.1	Very low	50 Å²	50	74.1 Å²	74.1	35%	0.35	39%	0.392	S	S	.	.	H	α-helix	trans	-55.7	-49.5	179.1	-172	0	0	0	0	111.8	D181 V187 I188 E189	D181-S185 PolarHBondContact O-N 2.88Å; S185-V187 VanDerWaalsContact C-N 3.28Å; S185-V187 PolarHBondContact O-N 3.42Å; S185-I188 PolarHBondContact O-N 2.84Å; S185-E189 VanDerWaalsContact O-CB 3.25Å; S185-E189 WeakPolarHBondContact O-CB 3.5Å; S185-E189 PolarHBondContact O-N 3.38Å
186	K	39.1	Very low	39.1	Very low	129 Å²	129	73.6 Å²	73.6	56%	0.561	40%	0.397	S	S	*	.	H	α-helix	trans	-58.9	-36.6	176.3	-119.8	171.5	-177.7	172.8	0	112.9	L184 T190	L184-K186 PolarHBondContact O-N 2.88Å; K186-T190 PolarHBondContact O-N 3.2Å; K186-T190 PolarHBondContact O-OG1 3.43Å
187	V	40.4	Very low	39.1	Very low	55 Å²	55	74.2 Å²	74.2	33%	0.333	40%	0.401	S	S	.	.	H	α-helix	trans	-74.4	-41.7	179.8	176.5	0	0	0	0	111.5	H183 L184 S185 E189 T190 L191 I223	H183-V187 WeakPolarHBondContact O-CG2 3.48Å; L184-V187 PolarHBondContact O-N 2.9Å; L184-V187 VanDerWaalsContact O-N 3.09Å; S185-V187 VanDerWaalsContact C-N 3.28Å; S185-V187 PolarHBondContact O-N 3.42Å; V187-E189 VanDerWaalsContact C-N 3.34Å; V187-T190 PolarHBondContact O-N 2.85Å; V187-L191 HydrophobicContact CG1-CD1 4.09Å; V187-L191 WeakPolarHBondContact O-CB 3.48Å; V187-L191 WeakPolarHBondContact O-CD1 3.31Å; V187-L191 VanDerWaalsContact O-CG 3.31Å; V187-L191 WeakPolarHBondContact O-CG 3.43Å; V187-L191 PolarHBondContact O-N 2.86Å; V187-I223 HydrophobicContact CG1-CD1 3.49Å; V187-I223 VanDerWaalsContact CG1-CD1 3.49Å; V187-I223 HydrophobicContact CG1-CG1 4.03Å
188	I	35.9	Very low	38.7	Very low	22 Å²	22	70.4 Å²	70.4	11%	0.113	38%	0.383	C	S	.	.	H	α-helix	trans	-64.1	-42.2	174.8	-67.8	171	0	0	0	110.2	M175 C178 L184 S185 L191 L192	M175-I188 HydrophobicContact CE-CG2 3.76Å; M175-I188 HydrophobicContact SD-CD1 4.45Å; M175-I188 HydrophobicContact SD-CG2 4.23Å; C178-I188 HydrophobicContact CB-CD1 4.12Å; L184-I188 HydrophobicContact CD2-CD1 4.26Å; L184-I188 WeakPolarHBondContact O-CG1 3.46Å; L184-I188 PolarHBondContact O-N 2.87Å; S185-I188 PolarHBondContact O-N 2.84Å; I188-L191 PolarHBondContact O-N 3.46Å; I188-L192 HydrophobicContact CG2-CD1 3.93Å; I188-L192 HydrophobicContact CG2-CG 4.37Å; I188-L192 WeakPolarHBondContact O-CG 3.37Å; I188-L192 PolarHBondContact O-N 2.89Å
189	E	38.6	Very low	38.6	Very low	42 Å²	42	73.8 Å²	73.8	20%	0.196	40%	0.395	C	S	.	.	H	α-helix	trans	-58.7	-50.5	175.4	-175.2	-178.8	-165.4	0	0	111.3	H124 S185 V187 L191 L192 I193	H124-E189 WeakPolarHBondContact CB-OE1 3.47Å; H124-E189 IonicContact CD2-OE1 3.45Å; H124-E189 IonicContact CG-OE1 2.66Å; S185-E189 VanDerWaalsContact O-CB 3.25Å; S185-E189 WeakPolarHBondContact O-CB 3.5Å; S185-E189 PolarHBondContact O-N 3.38Å; V187-E189 VanDerWaalsContact C-N 3.34Å; E189-L191 VanDerWaalsContact C-N 3.27Å; E189-L191 PolarHBondContact O-N 3.35Å; E189-L192 PolarHBondContact O-N 2.89Å; E189-I193 HydrophobicContact CG-CD1 4.03Å; E189-I193 VanDerWaalsContact O-CG1 3.3Å; E189-I193 WeakPolarHBondContact O-CG1 3.41Å; E189-I193 PolarHBondContact O-N 3.16Å
190	T	42	Very low	38.5	Very low	72 Å²	72	77.5 Å²	77.5	44%	0.442	40%	0.398	S	S	.	.	H	α-helix	trans	-59.5	-40	177.6	-39.6	0	0	0	0	111.3	K186 V187 D194	K186-T190 PolarHBondContact O-N 3.2Å; K186-T190 PolarHBondContact O-OG1 3.43Å; V187-T190 PolarHBondContact O-N 2.85Å; T190-D194 WeakPolarHBondContact O-CB 3.31Å; T190-D194 PolarHBondContact O-N 3.15Å
191	L	40.2	Very low	38.1	Very low	10 Å²	10	71.7 Å²	71.7	5%	0.052	38%	0.377	C	S	.	.	H	α-helix	trans	-70.3	-39.6	178.8	-75.6	165.5	0	0	0	113	V187 I188 E189 D194 V195 F216 I223	V187-L191 HydrophobicContact CG1-CD1 4.09Å; V187-L191 WeakPolarHBondContact O-CB 3.48Å; V187-L191 WeakPolarHBondContact O-CD1 3.31Å; V187-L191 VanDerWaalsContact O-CG 3.31Å; V187-L191 WeakPolarHBondContact O-CG 3.43Å; V187-L191 PolarHBondContact O-N 2.86Å; I188-L191 PolarHBondContact O-N 3.46Å; E189-L191 VanDerWaalsContact C-N 3.27Å; E189-L191 PolarHBondContact O-N 3.35Å; L191-D194 PolarHBondContact O-N 2.93Å; L191-V195 VanDerWaalsContact O-CG2 3.29Å; L191-V195 WeakPolarHBondContact O-CG2 2.98Å; L191-V195 PolarHBondContact O-N 3.02Å; L191-F216 HydrophobicContact CD2-CD2 4.12Å; L191-F216 HydrophobicContact CD2-CE2 3.46Å; L191-F216 VanDerWaalsContact CD2-CE2 3.46Å; L191-F216 HydrophobicContact CD2-CZ 3.82Å; L191-I223 HydrophobicContact CD1-CD1 4.04Å
192	L	40.8	Very low	38	Very low	105 Å²	105	69 Å²	69	55%	0.55	37%	0.369	S	S	.	.	H	α-helix	trans	-65.6	-40.8	175.9	-77.4	170.4	0	0	0	111	I188 E189 V195 G196	I188-L192 HydrophobicContact CG2-CD1 3.93Å; I188-L192 HydrophobicContact CG2-CG 4.37Å; I188-L192 WeakPolarHBondContact O-CG 3.37Å; I188-L192 PolarHBondContact O-N 2.89Å; E189-L192 PolarHBondContact O-N 2.89Å; L192-V195 PolarHBondContact O-N 3.29Å; L192-G196 PolarHBondContact O-N 3.18Å
193	I	43.8	Very low	38.2	Very low	57 Å²	57	66.5 Å²	66.5	29%	0.292	37%	0.369	S	S	.	.	H	α-helix	trans	-61.6	-44.9	173.1	-67.7	167.2	0	0	0	110.2	H124 E189 G196 N197	H124-I193 HydrophobicContact CB-CD1 4.37Å; E189-I193 HydrophobicContact CG-CD1 4.03Å; E189-I193 VanDerWaalsContact O-CG1 3.3Å; E189-I193 WeakPolarHBondContact O-CG1 3.41Å; E189-I193 PolarHBondContact O-N 3.16Å; I193-G196 PolarHBondContact O-N 3.35Å; I193-N197 WeakPolarHBondContact O-CB 3.34Å; I193-N197 PolarHBondContact O-N 3.3Å; I193-N197 PolarHBondContact O-ND2 3.41Å
194	D	43.2	Very low	38.5	Very low	33 Å²	33	65.3 Å²	65.3	18%	0.176	37%	0.368	C	S	.	.	H	α-helix	trans	-67	-38.4	179.2	-83.4	-14.6	0	0	0	112.8	T190 L191 N197 A198 F216	T190-D194 WeakPolarHBondContact O-CB 3.31Å; T190-D194 PolarHBondContact O-N 3.15Å; L191-D194 PolarHBondContact O-N 2.93Å; D194-N197 PolarHBondContact O-N 2.8Å; D194-A198 VanDerWaalsContact O-CB 3.26Å; D194-A198 WeakPolarHBondContact O-CB 3.35Å; D194-A198 PolarHBondContact O-N 3.44Å; D194-F216 HydrophobicContact CB-CD2 4.25Å
195	V	37.7	Very low	38.8	Very low	59 Å²	59	64 Å²	64	36%	0.358	37%	0.366	S	S	.	.	H	α-helix	trans	-64.4	-43.1	171.9	171.7	0	0	0	0	110.6	L191 L192 N197 A198 H199 F216	L191-V195 VanDerWaalsContact O-CG2 3.29Å; L191-V195 WeakPolarHBondContact O-CG2 2.98Å; L191-V195 PolarHBondContact O-N 3.02Å; L192-V195 PolarHBondContact O-N 3.29Å; V195-N197 PolarHBondContact O-N 3.46Å; V195-A198 WeakPolarHBondContact O-CB 3.31Å; V195-A198 PolarHBondContact O-N 3.38Å; V195-H199 PolarHBondContact O-N 2.88Å; V195-F216 HydrophobicContact CG2-CE2 3.64Å; V195-F216 HydrophobicContact CG2-CZ 3.96Å
196	G	36.9	Very low	39.2	Very low	29 Å²	29	70.2 Å²	70.2	30%	0.299	39%	0.387	S	S	.	.	H	α-helix	trans	-62.9	-40.4	176.4	0	0	0	0	0	112.7	L192 I193 H199 R200	L192-G196 PolarHBondContact O-N 3.18Å; I193-G196 PolarHBondContact O-N 3.35Å; G196-H199 PolarHBondContact O-N 2.86Å; G196-R200 PolarHBondContact O-N 3.35Å
197	N	42	Very low	39.6	Very low	72 Å²	72	67.2 Å²	67.2	39%	0.385	39%	0.386	S	S	.	.	H	α-helix	trans	-69.4	-39.8	174.7	-72.4	-19.6	0	0	0	111.5	I193 D194 V195 H199 R200 A201	I193-N197 WeakPolarHBondContact O-CB 3.34Å; I193-N197 PolarHBondContact O-N 3.3Å; I193-N197 PolarHBondContact O-ND2 3.41Å; D194-N197 PolarHBondContact O-N 2.8Å; V195-N197 PolarHBondContact O-N 3.46Å; N197-H199 VanDerWaalsContact C-N 3.29Å; N197-H199 PolarHBondContact O-N 3.23Å; N197-R200 PolarHBondContact O-N 2.91Å; N197-A201 WeakPolarHBondContact O-CB 3.23Å; N197-A201 PolarHBondContact O-N 3.41Å
198	A	36.5	Very low	39.6	Very low	22 Å²	22	66.4 Å²	66.4	18%	0.182	39%	0.385	C	S	.	.	H	α-helix	trans	-59.6	-41.2	173.5	0	0	0	0	0	111.3	D194 V195 A202 S212	D194-A198 VanDerWaalsContact O-CB 3.26Å; D194-A198 WeakPolarHBondContact O-CB 3.35Å; D194-A198 PolarHBondContact O-N 3.44Å; V195-A198 WeakPolarHBondContact O-CB 3.31Å; V195-A198 PolarHBondContact O-N 3.38Å; A198-A202 VanDerWaalsContact O-CB 3.32Å; A198-A202 WeakPolarHBondContact O-CB 3.26Å; A198-A202 PolarHBondContact O-N 3.3Å; A198-S212 WeakPolarHBondContact CA-OG 3.43Å; A198-S212 WeakPolarHBondContact CB-OG 3.46Å
199	H	33.8	Very low	39.8	Very low	112 Å²	112	66.7 Å²	66.7	52%	0.519	39%	0.387	S	S	.	.	H	α-helix	trans	-67.6	-40.9	177.3	-97.7	-78.6	0	0	0	113	V195 G196 N197 A202	V195-H199 PolarHBondContact O-N 2.88Å; G196-H199 PolarHBondContact O-N 2.86Å; N197-H199 VanDerWaalsContact C-N 3.29Å; N197-H199 PolarHBondContact O-N 3.23Å; H199-A202 WeakPolarHBondContact O-CB 3.45Å; H199-A202 PolarHBondContact O-N 3.45Å
200	R	36.2	Very low	40.3	Very low	127 Å²	127	71 Å²	71	48%	0.479	41%	0.407	S	S	.	.	H	α-helix	trans	-68.1	-45.4	173.2	-91.8	-172.3	-75.7	-159.8	-1.8	112.1	G196 N197 A202 A203 D204	G196-R200 PolarHBondContact O-N 3.35Å; N197-R200 PolarHBondContact O-N 2.91Å; R200-A202 PolarHBondContact O-N 3.2Å; R200-A203 VanDerWaalsContact O-CB 3.29Å; R200-A203 WeakPolarHBondContact O-CB 3.24Å; R200-A203 PolarHBondContact O-N 2.92Å; R200-D204 PolarHBondContact O-N 3.49Å
201	A	33.7	Very low	40.6	Very low	21 Å²	21	70.7 Å²	70.7	17%	0.174	41%	0.411	C	S	.	.	H	α-helix	trans	-61.3	-29.8	175.4	0	0	0	0	0	112.8	N197 A203 D204 S205 A208	N197-A201 WeakPolarHBondContact O-CB 3.23Å; N197-A201 PolarHBondContact O-N 3.41Å; A201-A203 PolarHBondContact O-N 3.4Å; A201-D204 PolarHBondContact O-N 2.95Å; A201-D204 VanDerWaalsContact O-N 3.12Å; A201-S205 PolarHBondContact O-N 2.9Å; A201-A208 HydrophobicContact CB-CB 3.77Å
202	A	34.9	Very low	40.7	Very low	48 Å²	48	71.2 Å²	71.2	40%	0.397	42%	0.416	S	S	.	.	H	α-helix	trans	-61.6	-31.7	172.9	0	0	0	0	0	113	A198 H199 R200 L209	A198-A202 VanDerWaalsContact O-CB 3.32Å; A198-A202 WeakPolarHBondContact O-CB 3.26Å; A198-A202 PolarHBondContact O-N 3.3Å; H199-A202 WeakPolarHBondContact O-CB 3.45Å; H199-A202 PolarHBondContact O-N 3.45Å; R200-A202 PolarHBondContact O-N 3.2Å; A202-L209 HydrophobicContact CB-CD1 3.41Å; A202-L209 VanDerWaalsContact CB-CD1 3.41Å
203	A	40.5	Very low	40.9	Very low	84 Å²	84	69.9 Å²	69.9	69%	0.694	40%	0.404	S	S	*	.	H	α-helix	trans	-72	-33.3	174.5	0	0	0	0	0	111.3	R200 A201	R200-A203 VanDerWaalsContact O-CB 3.29Å; R200-A203 WeakPolarHBondContact O-CB 3.24Å; R200-A203 PolarHBondContact O-N 2.92Å; A201-A203 PolarHBondContact O-N 3.4Å
204	D	42.9	Very low	41.2	Very low	140 Å²	140	70 Å²	70	75%	0.749	41%	0.413	S	S	*	.	H	α-helix	trans	-98.3	-30.5	-168.5	-64.2	-23.6	0	0	0	114.9	R200 A201	R200-D204 PolarHBondContact O-N 3.49Å; A201-D204 PolarHBondContact O-N 2.95Å; A201-D204 VanDerWaalsContact O-N 3.12Å
205	S	42.1	Very low	41.4	Very low	55 Å²	55	75.1 Å²	75.1	39%	0.385	43%	0.434	S	S	.	.			trans	-169.1	138.6	-178.9	166.2	0	0	0	0	115.4	A201 A207 A208 L209	A201-S205 PolarHBondContact O-N 2.9Å; S205-A207 VanDerWaalsContact C-N 3.28Å; S205-A207 PolarHBondContact O-N 3.3Å; S205-A207 PolarHBondContact OG-N 3.42Å; S205-A208 PolarHBondContact O-N 3.03Å; S205-L209 PolarHBondContact O-N 3.22Å
206	K	41.9	Very low	41.6	Very low	180 Å²	180	73.9 Å²	73.9	78%	0.783	42%	0.424	S	S	*	.	H	α-helix	trans	-57.8	-36.7	173.9	-170.9	-179.9	179.7	-176.6	0	112.9	Q210	K206-Q210 PolarHBondContact O-N 2.86Å
207	A	46.8	Very low	42.1	Very low	67 Å²	67	76.9 Å²	76.9	55%	0.554	43%	0.429	S	S	*	.	H	α-helix	trans	-70.9	-38.7	-179.9	0	0	0	0	0	111.6	S205 Q210 A211	S205-A207 VanDerWaalsContact C-N 3.28Å; S205-A207 PolarHBondContact O-N 3.3Å; S205-A207 PolarHBondContact OG-N 3.42Å; A207-Q210 PolarHBondContact O-N 2.8Å; A207-A211 PolarHBondContact O-N 3.23Å
208	A	41.6	Very low	42.5	Very low	38 Å²	38	77.4 Å²	77.4	31%	0.314	43%	0.434	S	S	.	.	H	α-helix	trans	-65.9	-38.8	178.2	0	0	0	0	0	111.6	A201 S205 A211 S212	A201-A208 HydrophobicContact CB-CB 3.77Å; S205-A208 PolarHBondContact O-N 3.03Å; A208-A211 PolarHBondContact O-N 2.92Å; A208-S212 VanDerWaalsContact O-CB 3.3Å; A208-S212 WeakPolarHBondContact O-CB 3.47Å; A208-S212 PolarHBondContact O-N 2.8Å
209	L	39.1	Very low	42.9	Very low	28 Å²	28	78.3 Å²	78.3	15%	0.147	44%	0.437	C	S	.	.	H	α-helix	trans	-62.1	-43.5	172.8	-167.9	90.6	0	0	0	112.3	A202 S205 S212 R213	A202-L209 HydrophobicContact CB-CD1 3.41Å; A202-L209 VanDerWaalsContact CB-CD1 3.41Å; S205-L209 PolarHBondContact O-N 3.22Å; L209-S212 PolarHBondContact O-N 3.09Å; L209-R213 WeakPolarHBondContact O-CB 3.17Å; L209-R213 WeakPolarHBondContact O-CG 3.3Å; L209-R213 PolarHBondContact O-N 2.83Å
210	Q	49.9	Very low	43.3	Very low	132 Å²	132	74.9 Å²	74.9	62%	0.617	43%	0.429	S	S	*	.	H	α-helix	trans	-67.7	-41.1	-179.2	-121.5	175.6	-15.2	0	0	111.8	K206 A207 R213 A214	K206-Q210 PolarHBondContact O-N 2.86Å; A207-Q210 PolarHBondContact O-N 2.8Å; Q210-R213 PolarHBondContact O-N 2.81Å; Q210-A214 PolarHBondContact O-N 3.49Å
211	A	48.2	Very low	43.9	Very low	65 Å²	65	71.6 Å²	71.6	54%	0.537	42%	0.421	S	S	.	.	H	α-helix	trans	-62.1	-45	173.2	0	0	0	0	0	111.3	A207 A208 R213 A214 K215	A207-A211 PolarHBondContact O-N 3.23Å; A208-A211 PolarHBondContact O-N 2.92Å; A211-R213 PolarHBondContact O-N 3.43Å; A211-A214 PolarHBondContact O-N 2.71Å; A211-K215 WeakPolarHBondContact O-CB 3.47Å; A211-K215 PolarHBondContact O-N 3.38Å
212	S	42.5	Very low	44.5	Very low	21 Å²	21	74.3 Å²	74.3	15%	0.147	44%	0.435	C	S	.	.	H	α-helix	trans	-61.9	-42.8	175.9	-170.2	0	0	0	0	112.1	A198 A208 L209 K215 F216	A198-S212 WeakPolarHBondContact CA-OG 3.43Å; A198-S212 WeakPolarHBondContact CB-OG 3.46Å; A208-S212 VanDerWaalsContact O-CB 3.3Å; A208-S212 WeakPolarHBondContact O-CB 3.47Å; A208-S212 PolarHBondContact O-N 2.8Å; L209-S212 PolarHBondContact O-N 3.09Å; S212-K215 PolarHBondContact O-N 2.85Å; S212-F216 VanDerWaalsContact O-CB 3.32Å; S212-F216 WeakPolarHBondContact O-CB 3.46Å; S212-F216 PolarHBondContact O-N 3.46Å
213	R	45	Very low	44.9	Very low	78 Å²	78	74.2 Å²	74.2	29%	0.294	43%	0.428	S	S	.	.	H	α-helix	trans	-59.2	-47	174.5	-80.9	178.1	168.6	-177.1	-4.1	111.5	L209 Q210 A211 K215 F216 F217 N288 D292	L209-R213 WeakPolarHBondContact O-CB 3.17Å; L209-R213 WeakPolarHBondContact O-CG 3.3Å; L209-R213 PolarHBondContact O-N 2.83Å; Q210-R213 PolarHBondContact O-N 2.81Å; A211-R213 PolarHBondContact O-N 3.43Å; R213-K215 PolarHBondContact O-N 2.78Å; R213-F216 PolarHBondContact O-N 3.5Å; R213-F217 WeakPolarHBondContact O-CD2 3.37Å; R213-F217 PolarHBondContact O-N 3.44Å; R213-N288 PolarHBondContact NH2-OD1 3.49Å; R213-D292 IonicContact NH2-OD1 2.64Å
214	A	50.2	Low	45.1	Very low	58 Å²	58	73.4 Å²	73.4	48%	0.479	41%	0.41	S	S	.	.	H	α-helix	trans	-63.2	-41.3	178.4	0	0	0	0	0	112.1	Q210 A211 F216 T218	Q210-A214 PolarHBondContact O-N 3.49Å; A211-A214 PolarHBondContact O-N 2.71Å; A214-F216 VanDerWaalsContact C-N 3.33Å; A214-T218 WeakPolarHBondContact O-CG2 3.34Å; A214-T218 PolarHBondContact O-N 3Å; A214-T218 PolarHBondContact O-OG1 3.24Å
215	K	47.5	Very low	45.3	Very low	142 Å²	142	72.7 Å²	72.7	62%	0.617	40%	0.4	S	S	*	.	H	α-helix	trans	-64.4	-37.9	175.1	-136.8	-178.5	-176.5	-169.3	0	112.1	A211 S212 R213 T218 T219	A211-K215 WeakPolarHBondContact O-CB 3.47Å; A211-K215 PolarHBondContact O-N 3.38Å; S212-K215 PolarHBondContact O-N 2.85Å; R213-K215 PolarHBondContact O-N 2.78Å; K215-T218 VanDerWaalsContact CA-OG1 3.26Å; K215-T218 WeakPolarHBondContact CA-OG1 3.33Å; K215-T218 PolarHBondContact O-OG1 2.99Å; K215-T219 WeakPolarHBondContact O-CB 3.38Å; K215-T219 PolarHBondContact O-N 2.94Å; K215-T219 PolarHBondContact O-OG1 3.46Å
216	F	42.2	Very low	45.4	Very low	33 Å²	33	73.1 Å²	73.1	15%	0.145	40%	0.4	C	S	.	.	H	α-helix	trans	-67.7	-46.2	178.5	-163.9	-96.7	0	0	0	112.2	L191 D194 V195 S212 R213 A214 T218 T219 A220 I284	L191-F216 HydrophobicContact CD2-CD2 4.12Å; L191-F216 HydrophobicContact CD2-CE2 3.46Å; L191-F216 VanDerWaalsContact CD2-CE2 3.46Å; L191-F216 HydrophobicContact CD2-CZ 3.82Å; D194-F216 HydrophobicContact CB-CD2 4.25Å; V195-F216 HydrophobicContact CG2-CE2 3.64Å; V195-F216 HydrophobicContact CG2-CZ 3.96Å; S212-F216 VanDerWaalsContact O-CB 3.32Å; S212-F216 WeakPolarHBondContact O-CB 3.46Å; S212-F216 PolarHBondContact O-N 3.46Å; R213-F216 PolarHBondContact O-N 3.5Å; A214-F216 VanDerWaalsContact C-N 3.33Å; F216-T218 PolarHBondContact O-N 3.1Å; F216-T219 PolarHBondContact O-N 2.91Å; F216-A220 PolarHBondContact O-N 3.41Å; F216-I284 HydrophobicContact CE1-CD1 3.94Å
217	F	47.3	Very low	45.4	Very low	92 Å²	92	66.9 Å²	66.9	40%	0.404	38%	0.375	S	S	.	.	H	α-helix	trans	-64.6	-39.3	176	-80	-66.5	0	0	0	112.6	R213 T219 A220 D221	R213-F217 WeakPolarHBondContact O-CD2 3.37Å; R213-F217 PolarHBondContact O-N 3.44Å; F217-T219 VanDerWaalsContact C-N 3.33Å; F217-A220 PolarHBondContact O-N 2.89Å; F217-D221 VanDerWaalsContact O-CB 3.25Å; F217-D221 WeakPolarHBondContact O-CB 3.49Å; F217-D221 PolarHBondContact O-N 2.89Å
218	T	49.4	Very low	45.3	Very low	82 Å²	82	67.1 Å²	67.1	50%	0.503	37%	0.367	S	S	.	.	H	α-helix	trans	-65.8	-37	175.4	42.9	0	0	0	0	112	A214 K215 F216 D221 T222	A214-T218 WeakPolarHBondContact O-CG2 3.34Å; A214-T218 PolarHBondContact O-N 3Å; A214-T218 PolarHBondContact O-OG1 3.24Å; K215-T218 VanDerWaalsContact CA-OG1 3.26Å; K215-T218 WeakPolarHBondContact CA-OG1 3.33Å; K215-T218 PolarHBondContact O-OG1 2.99Å; F216-T218 PolarHBondContact O-N 3.1Å; T218-D221 PolarHBondContact O-N 3.49Å; T218-T222 WeakPolarHBondContact O-CB 3.49Å; T218-T222 PolarHBondContact O-N 2.74Å; T218-T222 PolarHBondContact O-OG1 3.02Å
219	T	44.4	Very low	45.5	Very low	41 Å²	41	72.9 Å²	72.9	25%	0.252	38%	0.38	S	S	.	.	H	α-helix	trans	-67.3	-46.9	175.7	-53.6	0	0	0	0	111.4	K215 F216 F217 D221 T222 I223	K215-T219 WeakPolarHBondContact O-CB 3.38Å; K215-T219 PolarHBondContact O-N 2.94Å; K215-T219 PolarHBondContact O-OG1 3.46Å; F216-T219 PolarHBondContact O-N 2.91Å; F217-T219 VanDerWaalsContact C-N 3.33Å; T219-D221 VanDerWaalsContact C-N 3.33Å; T219-D221 PolarHBondContact O-N 3.42Å; T219-T222 WeakPolarHBondContact O-CB 3.49Å; T219-T222 PolarHBondContact O-N 2.85Å; T219-I223 HydrophobicContact CG2-CD1 4.06Å; T219-I223 VanDerWaalsContact O-CG1 3.27Å; T219-I223 WeakPolarHBondContact O-CG1 3.37Å; T219-I223 PolarHBondContact O-N 3.45Å
220	A	43.9	Very low	45.5	Very low	41 Å²	41	75 Å²	75	34%	0.339	39%	0.391	S	S	.	.	H	α-helix	trans	-59.1	-42.7	175.1	0	0	0	0	0	112.3	F216 F217 T222 I223 E224	F216-A220 PolarHBondContact O-N 3.41Å; F217-A220 PolarHBondContact O-N 2.89Å; A220-T222 VanDerWaalsContact C-N 3.34Å; A220-T222 PolarHBondContact O-N 3.35Å; A220-I223 PolarHBondContact O-N 3.03Å; A220-E224 PolarHBondContact O-N 3.35Å
221	D	49.1	Very low	45.1	Very low	57 Å²	57	71.2 Å²	71.2	31%	0.305	37%	0.371	S	S	.	.	H	α-helix	trans	-65.7	-36.6	176.9	-160.3	59.2	0	0	0	111.8	F217 T218 T219 K225	F217-D221 VanDerWaalsContact O-CB 3.25Å; F217-D221 WeakPolarHBondContact O-CB 3.49Å; F217-D221 PolarHBondContact O-N 2.89Å; T218-D221 PolarHBondContact O-N 3.49Å; T219-D221 VanDerWaalsContact C-N 3.33Å; T219-D221 PolarHBondContact O-N 3.42Å; D221-K225 WeakPolarHBondContact O-CB 3.39Å; D221-K225 WeakPolarHBondContact O-CD 3.31Å; D221-K225 VanDerWaalsContact O-CG 3.26Å; D221-K225 WeakPolarHBondContact O-CG 3.33Å; D221-K225 PolarHBondContact O-N 3.24Å; D221-K225 WeakPolarHBondContact OD2-CE 3.46Å; D221-K225 IonicContact OD2-NZ 3.72Å; D221-K225 PolarHBondContact OD2-NZ 2.83Å
222	T	44.9	Very low	45.4	Very low	79 Å²	79	74.1 Å²	74.1	49%	0.485	37%	0.374	S	S	.	.	H	α-helix	trans	-67	-39.1	174.3	-52.4	0	0	0	0	111.3	T218 T219 A220 K225 T226	T218-T222 WeakPolarHBondContact O-CB 3.49Å; T218-T222 PolarHBondContact O-N 2.74Å; T218-T222 PolarHBondContact O-OG1 3.02Å; T219-T222 WeakPolarHBondContact O-CB 3.49Å; T219-T222 PolarHBondContact O-N 2.85Å; A220-T222 VanDerWaalsContact C-N 3.34Å; A220-T222 PolarHBondContact O-N 3.35Å; T222-K225 PolarHBondContact O-N 3.27Å; T222-T226 WeakPolarHBondContact O-CB 3.45Å; T222-T226 PolarHBondContact O-N 3.39Å; T222-T226 PolarHBondContact O-OG1 3.4Å
223	I	43.2	Very low	45.5	Very low	46 Å²	46	76 Å²	76	24%	0.236	38%	0.384	C	S	.	.	H	α-helix	trans	-65.6	-47.8	176.3	-67.1	161.1	0	0	0	110.5	V187 L191 T219 A220 K225 T226 I227	V187-I223 HydrophobicContact CG1-CD1 3.49Å; V187-I223 VanDerWaalsContact CG1-CD1 3.49Å; V187-I223 HydrophobicContact CG1-CG1 4.03Å; L191-I223 HydrophobicContact CD1-CD1 4.04Å; T219-I223 HydrophobicContact CG2-CD1 4.06Å; T219-I223 VanDerWaalsContact O-CG1 3.27Å; T219-I223 WeakPolarHBondContact O-CG1 3.37Å; T219-I223 PolarHBondContact O-N 3.45Å; A220-I223 PolarHBondContact O-N 3.03Å; I223-K225 VanDerWaalsContact C-N 3.31Å; I223-K225 PolarHBondContact O-N 2.97Å; I223-T226 PolarHBondContact O-N 2.92Å; I223-T226 VanDerWaalsContact O-N 3.08Å; I223-I227 HydrophobicContact CG2-CD1 3.87Å; I223-I227 HydrophobicContact CG2-CG1 4.42Å; I223-I227 WeakPolarHBondContact O-CG1 3.22Å; I223-I227 PolarHBondContact O-N 3.42Å
224	E	44.6	Very low	45.5	Very low	67 Å²	67	73.7 Å²	73.7	31%	0.313	38%	0.378	S	S	.	.	H	α-helix	trans	-56.9	-46.3	175.8	-175	175.4	179.3	0	0	110.7	A220 T226 I227 L228 R281	A220-E224 PolarHBondContact O-N 3.35Å; E224-T226 VanDerWaalsContact C-N 3.33Å; E224-T226 PolarHBondContact O-N 3.43Å; E224-I227 PolarHBondContact O-N 3.25Å; E224-L228 HydrophobicContact CG-CD1 4.13Å; E224-L228 WeakPolarHBondContact O-CB 2.88Å; E224-L228 VanDerWaalsContact O-CG 3.29Å; E224-L228 WeakPolarHBondContact O-CG 3.25Å; E224-L228 PolarHBondContact O-N 2.84Å; E224-R281 IonicContact OE2-NH1 2.66Å
225	K	48.6	Very low	45.3	Very low	124 Å²	124	74.1 Å²	74.1	54%	0.539	37%	0.37	S	S	.	.	H	α-helix	trans	-61.7	-38.1	174.5	-76.1	167.8	177.2	159.1	0	113	D221 T222 I223 W229	D221-K225 WeakPolarHBondContact O-CB 3.39Å; D221-K225 WeakPolarHBondContact O-CD 3.31Å; D221-K225 VanDerWaalsContact O-CG 3.26Å; D221-K225 WeakPolarHBondContact O-CG 3.33Å; D221-K225 PolarHBondContact O-N 3.24Å; D221-K225 WeakPolarHBondContact OD2-CE 3.46Å; D221-K225 IonicContact OD2-NZ 3.72Å; D221-K225 PolarHBondContact OD2-NZ 2.83Å; T222-K225 PolarHBondContact O-N 3.27Å; I223-K225 VanDerWaalsContact C-N 3.31Å; I223-K225 PolarHBondContact O-N 2.97Å; K225-W229 VanDerWaalsContact O-CB 3.24Å; K225-W229 WeakPolarHBondContact O-CB 3.29Å; K225-W229 PolarHBondContact O-N 3.2Å
226	T	42.4	Very low	45.4	Very low	64 Å²	64	70.9 Å²	70.9	39%	0.393	36%	0.362	S	S	.	.	H	α-helix	trans	-69.8	-43	179.3	-55.6	0	0	0	0	111	T222 I223 E224 W229 I230	T222-T226 WeakPolarHBondContact O-CB 3.45Å; T222-T226 PolarHBondContact O-N 3.39Å; T222-T226 PolarHBondContact O-OG1 3.4Å; I223-T226 PolarHBondContact O-N 2.92Å; I223-T226 VanDerWaalsContact O-N 3.08Å; E224-T226 VanDerWaalsContact C-N 3.33Å; E224-T226 PolarHBondContact O-N 3.43Å; T226-W229 PolarHBondContact O-N 2.81Å; T226-I230 HydrophobicContact CG2-CD1 4.13Å; T226-I230 VanDerWaalsContact O-CG1 3.28Å; T226-I230 WeakPolarHBondContact O-CG1 3.45Å; T226-I230 PolarHBondContact O-N 2.95Å
227	I	42.1	Very low	45.6	Very low	50 Å²	50	70.9 Å²	70.9	26%	0.256	37%	0.368	S	S	.	.	H	α-helix	trans	-62.6	-44.8	175	-66.5	169.4	0	0	0	110.2	I223 E224 W229 I230 Y231	I223-I227 HydrophobicContact CG2-CD1 3.87Å; I223-I227 HydrophobicContact CG2-CG1 4.42Å; I223-I227 WeakPolarHBondContact O-CG1 3.22Å; I223-I227 PolarHBondContact O-N 3.42Å; E224-I227 PolarHBondContact O-N 3.25Å; I227-W229 VanDerWaalsContact C-N 3.32Å; I227-W229 PolarHBondContact O-N 2.84Å; I227-I230 PolarHBondContact O-N 2.71Å; I227-Y231 WeakPolarHBondContact O-CB 3.37Å; I227-Y231 PolarHBondContact O-N 3.16Å
228	L	44.6	Very low	45.5	Very low	72 Å²	72	67.1 Å²	67.1	38%	0.377	35%	0.353	S	S	.	.	H	α-helix	trans	-63.6	-36.8	175.5	-73.5	170.4	0	0	0	112.4	E224 Y231 Q232 I274	E224-L228 HydrophobicContact CG-CD1 4.13Å; E224-L228 WeakPolarHBondContact O-CB 2.88Å; E224-L228 VanDerWaalsContact O-CG 3.29Å; E224-L228 WeakPolarHBondContact O-CG 3.25Å; E224-L228 PolarHBondContact O-N 2.84Å; L228-Y231 PolarHBondContact O-N 3.02Å; L228-Q232 WeakPolarHBondContact O-CB 3.46Å; L228-Q232 WeakPolarHBondContact O-CG 3.37Å; L228-Q232 PolarHBondContact O-N 3.31Å; L228-I274 HydrophobicContact CD2-CD1 4.31Å
229	W	46.3	Very low	45.7	Very low	158 Å²	158	69.1 Å²	69.1	60%	0.598	36%	0.355	S	S	*	.	H	α-helix	trans	-67.5	-45.7	175	-179.7	80.1	0	0	0	111.5	K225 T226 I227 Y231 Q232 V233	K225-W229 VanDerWaalsContact O-CB 3.24Å; K225-W229 WeakPolarHBondContact O-CB 3.29Å; K225-W229 PolarHBondContact O-N 3.2Å; T226-W229 PolarHBondContact O-N 2.81Å; I227-W229 VanDerWaalsContact C-N 3.32Å; I227-W229 PolarHBondContact O-N 2.84Å; W229-Y231 VanDerWaalsContact C-N 3.29Å; W229-Y231 PolarHBondContact O-N 3.33Å; W229-Q232 CarbonylContact O-C 3.58Å; W229-Q232 PolarHBondContact O-N 2.63Å; W229-Q232 VanDerWaalsContact O-N 3.12Å; W229-V233 HydrophobicContact CD2-CG2 3.82Å; W229-V233 VanDerWaalsContact CE2-CG2 3.49Å; W229-V233 HydrophobicContact CE3-CG2 4.22Å; W229-V233 HydrophobicContact CG-CG2 4.37Å; W229-V233 HydrophobicContact CH2-CG2 4.06Å; W229-V233 HydrophobicContact CZ2-CG2 3.63Å; W229-V233 HydrophobicContact CZ3-CG2 4.33Å; W229-V233 WeakPolarHBondContact O-CB 3.39Å; W229-V233 VanDerWaalsContact O-CG2 3.3Å; W229-V233 WeakPolarHBondContact O-CG2 3.42Å; W229-V233 PolarHBondContact O-N 3.34Å
230	I	40.1	Very low	45.9	Very low	73 Å²	73	75.9 Å²	75.9	37%	0.374	38%	0.376	S	S	.	.	H	α-helix	trans	-57.5	-45.2	173.6	-68.6	166.3	0	0	0	109.8	T226 I227 Q232 V233 D234 Y270	T226-I230 HydrophobicContact CG2-CD1 4.13Å; T226-I230 VanDerWaalsContact O-CG1 3.28Å; T226-I230 WeakPolarHBondContact O-CG1 3.45Å; T226-I230 PolarHBondContact O-N 2.95Å; I227-I230 PolarHBondContact O-N 2.71Å; I230-Q232 VanDerWaalsContact C-N 3.35Å; I230-Q232 PolarHBondContact O-N 3.26Å; I230-V233 PolarHBondContact O-N 3.37Å; I230-D234 WeakPolarHBondContact O-CB 3.5Å; I230-D234 PolarHBondContact O-N 3.32Å; I230-Y270 HydrophobicContact CG2-CE1 4.23Å
231	Y	41.9	Very low	46	Very low	52 Å²	52	80 Å²	80	20%	0.204	38%	0.383	C	S	.	.	H	α-helix	trans	-59.4	-42.6	175.3	-179.7	-106.2	0	0	0	112.5	I227 L228 W229 D234 Q235 Y270	I227-Y231 WeakPolarHBondContact O-CB 3.37Å; I227-Y231 PolarHBondContact O-N 3.16Å; L228-Y231 PolarHBondContact O-N 3.02Å; W229-Y231 VanDerWaalsContact C-N 3.29Å; W229-Y231 PolarHBondContact O-N 3.33Å; Y231-D234 PolarHBondContact O-N 2.68Å; Y231-Q235 HydrophobicContact CE1-CG 4.25Å; Y231-Q235 WeakPolarHBondContact O-CB 3.22Å; Y231-Q235 PolarHBondContact O-N 3.28Å; Y231-Q235 PolarHBondContact OH-NE2 3.41Å; Y231-Y270 HydrophobicContact CD2-CD1 4.13Å; Y231-Y270 AromaticContact CD2-CD2 3.43Å; Y231-Y270 HydrophobicContact CD2-CD2 3.43Å; Y231-Y270 VanDerWaalsContact CD2-CD2 3.43Å; Y231-Y270 HydrophobicContact CD2-CE2 4.05Å; Y231-Y270 AromaticContact CD2-CG 3.47Å; Y231-Y270 HydrophobicContact CD2-CG 3.47Å; Y231-Y270 VanDerWaalsContact CD2-CG 3.47Å; Y231-Y270 AromaticContact CE2-CD2 3.88Å; Y231-Y270 HydrophobicContact CE2-CD2 3.88Å; Y231-Y270 HydrophobicContact CE2-CG 4.09Å; Y231-Y270 HydrophobicContact CG-CG 4.44Å
232	Q	53.1	Low	46.1	Very low	127 Å²	127	82 Å²	82	59%	0.593	39%	0.39	S	S	*	.	H	α-helix	trans	-69.1	-39.2	176.2	-81.8	-179.9	-17.1	0	0	113	L228 W229 I230 D234 Q235 T236	L228-Q232 WeakPolarHBondContact O-CB 3.46Å; L228-Q232 WeakPolarHBondContact O-CG 3.37Å; L228-Q232 PolarHBondContact O-N 3.31Å; W229-Q232 CarbonylContact O-C 3.58Å; W229-Q232 PolarHBondContact O-N 2.63Å; W229-Q232 VanDerWaalsContact O-N 3.12Å; I230-Q232 VanDerWaalsContact C-N 3.35Å; I230-Q232 PolarHBondContact O-N 3.26Å; Q232-D234 VanDerWaalsContact C-N 3.35Å; Q232-Q235 PolarHBondContact O-N 2.99Å; Q232-T236 PolarHBondContact O-N 2.7Å; Q232-T236 PolarHBondContact O-OG1 3.14Å
233	V	45.1	Very low	46.7	Very low	60 Å²	60	83.9 Å²	83.9	36%	0.364	39%	0.394	S	S	.	.	H	α-helix	trans	-64.8	-41.6	175	172.7	0	0	0	0	110	W229 I230 T236 A237	W229-V233 HydrophobicContact CD2-CG2 3.82Å; W229-V233 VanDerWaalsContact CE2-CG2 3.49Å; W229-V233 HydrophobicContact CE3-CG2 4.22Å; W229-V233 HydrophobicContact CG-CG2 4.37Å; W229-V233 HydrophobicContact CH2-CG2 4.06Å; W229-V233 HydrophobicContact CZ2-CG2 3.63Å; W229-V233 HydrophobicContact CZ3-CG2 4.33Å; W229-V233 WeakPolarHBondContact O-CB 3.39Å; W229-V233 VanDerWaalsContact O-CG2 3.3Å; W229-V233 WeakPolarHBondContact O-CG2 3.42Å; W229-V233 PolarHBondContact O-N 3.34Å; I230-V233 PolarHBondContact O-N 3.37Å; V233-T236 VanDerWaalsContact CA-OG1 3.31Å; V233-T236 WeakPolarHBondContact CA-OG1 3.29Å; V233-T236 PolarHBondContact O-N 2.92Å; V233-T236 PolarHBondContact O-OG1 3.49Å; V233-A237 VanDerWaalsContact O-CB 3.3Å; V233-A237 WeakPolarHBondContact O-CB 3.42Å; V233-A237 PolarHBondContact O-N 3.24Å
234	D	44.4	Very low	47.1	Very low	30 Å²	30	85 Å²	85	16%	0.16	40%	0.398	C	S	.	.	H	α-helix	trans	-72	-37.6	177.2	-166.4	47.4	0	0	0	112	I230 Y231 Q232 T236 A237 S238 R241	I230-D234 WeakPolarHBondContact O-CB 3.5Å; I230-D234 PolarHBondContact O-N 3.32Å; Y231-D234 PolarHBondContact O-N 2.68Å; Q232-D234 VanDerWaalsContact C-N 3.35Å; D234-T236 VanDerWaalsContact C-N 3.29Å; D234-T236 PolarHBondContact O-N 2.86Å; D234-A237 PolarHBondContact O-N 2.85Å; D234-S238 WeakPolarHBondContact O-CA 3.44Å; D234-S238 WeakPolarHBondContact O-CB 3.44Å; D234-S238 PolarHBondContact O-N 2.93Å; D234-R241 IonicContact OD1-NH2 3.73Å; D234-R241 PolarHBondContact OD1-NH2 3.48Å
235	Q	45.9	Very low	46.9	Very low	67 Å²	67	84.3 Å²	84.3	31%	0.313	40%	0.398	S	S	.	.	H	α-helix	trans	-58.6	-41	169.4	-90.4	-154.2	6.1	0	0	112.1	Y231 Q232 K239	Y231-Q235 HydrophobicContact CE1-CG 4.25Å; Y231-Q235 WeakPolarHBondContact O-CB 3.22Å; Y231-Q235 PolarHBondContact O-N 3.28Å; Y231-Q235 PolarHBondContact OH-NE2 3.41Å; Q232-Q235 PolarHBondContact O-N 2.99Å; Q235-K239 WeakPolarHBondContact O-CG 3.17Å; Q235-K239 PolarHBondContact O-N 2.98Å
236	T	51	Low	47	Very low	73 Å²	73	84.3 Å²	84.3	45%	0.448	40%	0.4	S	S	.	.	H	α-helix	trans	-73.2	-38.2	178.2	43.9	0	0	0	0	112.3	Q232 V233 D234 S238 K239 R240	Q232-T236 PolarHBondContact O-N 2.7Å; Q232-T236 PolarHBondContact O-OG1 3.14Å; V233-T236 VanDerWaalsContact CA-OG1 3.31Å; V233-T236 WeakPolarHBondContact CA-OG1 3.29Å; V233-T236 PolarHBondContact O-N 2.92Å; V233-T236 PolarHBondContact O-OG1 3.49Å; D234-T236 VanDerWaalsContact C-N 3.29Å; D234-T236 PolarHBondContact O-N 2.86Å; T236-S238 VanDerWaalsContact C-N 3.34Å; T236-K239 PolarHBondContact O-N 2.95Å; T236-R240 WeakPolarHBondContact O-CG 3.39Å; T236-R240 PolarHBondContact O-N 3.33Å
237	A	44.5	Very low	47.3	Very low	34 Å²	34	89.6 Å²	89.6	28%	0.281	41%	0.413	S	S	.	.	H	α-helix	trans	-65.3	-37	172.1	0	0	0	0	0	111.8	V233 D234 R240 R241	V233-A237 VanDerWaalsContact O-CB 3.3Å; V233-A237 WeakPolarHBondContact O-CB 3.42Å; V233-A237 PolarHBondContact O-N 3.24Å; D234-A237 PolarHBondContact O-N 2.85Å; A237-R240 PolarHBondContact O-N 3.34Å; A237-R241 WeakPolarHBondContact O-CB 3.49Å; A237-R241 WeakPolarHBondContact O-CG 3.49Å; A237-R241 PolarHBondContact O-N 2.88Å
238	S	45.3	Very low	47.4	Very low	12 Å²	12	93.9 Å²	93.9	8%	0.084	43%	0.426	C	S	.	.	H	α-helix	trans	-66.7	-46.2	175.2	-166.3	0	0	0	0	110.8	D234 T236 R240 R241 E242	D234-S238 WeakPolarHBondContact O-CA 3.44Å; D234-S238 WeakPolarHBondContact O-CB 3.44Å; D234-S238 PolarHBondContact O-N 2.93Å; T236-S238 VanDerWaalsContact C-N 3.34Å; S238-R240 VanDerWaalsContact C-N 3.28Å; S238-R240 PolarHBondContact O-N 3.03Å; S238-R241 CarbonylContact O-C 3.6Å; S238-R241 WeakPolarHBondContact O-CA 3.48Å; S238-R241 WeakPolarHBondContact O-CB 3.42Å; S238-R241 PolarHBondContact O-N 3.33Å; S238-E242 PolarHBondContact O-N 2.64Å
239	K	54.2	Low	47.2	Very low	125 Å²	125	96.8 Å²	96.8	54%	0.543	44%	0.435	S	S	.	.	H	α-helix	trans	-59	-37.6	171.3	-77.6	179.6	-179.3	175.7	0	112.7	Q235 T236 Q243	Q235-K239 WeakPolarHBondContact O-CG 3.17Å; Q235-K239 PolarHBondContact O-N 2.98Å; T236-K239 PolarHBondContact O-N 2.95Å; K239-Q243 WeakPolarHBondContact O-CB 3.28Å; K239-Q243 VanDerWaalsContact O-CG 3.26Å; K239-Q243 WeakPolarHBondContact O-CG 3.36Å; K239-Q243 PolarHBondContact O-N 2.63Å
240	R	49.3	Very low	47.2	Very low	183 Å²	183	96.4 Å²	96.4	69%	0.691	45%	0.445	S	S	*	.	H	α-helix	trans	-66.7	-40.6	172.4	-74.1	-175.4	-159.2	175.2	7	111.9	T236 A237 S238 Q243 E244	T236-R240 WeakPolarHBondContact O-CG 3.39Å; T236-R240 PolarHBondContact O-N 3.33Å; A237-R240 PolarHBondContact O-N 3.34Å; S238-R240 VanDerWaalsContact C-N 3.28Å; S238-R240 PolarHBondContact O-N 3.03Å; R240-Q243 PolarHBondContact O-N 2.88Å; R240-E244 VanDerWaalsContact O-CB 3.24Å; R240-E244 WeakPolarHBondContact O-CB 3.31Å; R240-E244 PolarHBondContact O-N 2.89Å
241	R	46.4	Very low	47.3	Very low	127 Å²	127	102 Å²	102	48%	0.479	47%	0.466	S	S	.	.	H	α-helix	trans	-64.5	-43.1	175.5	-80.8	-174.2	-92.8	-170	-3.1	111.4	D234 A237 S238 E244 V245	D234-R241 IonicContact OD1-NH2 3.73Å; D234-R241 PolarHBondContact OD1-NH2 3.48Å; A237-R241 WeakPolarHBondContact O-CB 3.49Å; A237-R241 WeakPolarHBondContact O-CG 3.49Å; A237-R241 PolarHBondContact O-N 2.88Å; S238-R241 CarbonylContact O-C 3.6Å; S238-R241 WeakPolarHBondContact O-CA 3.48Å; S238-R241 WeakPolarHBondContact O-CB 3.42Å; S238-R241 PolarHBondContact O-N 3.33Å; R241-E244 PolarHBondContact O-N 3.34Å; R241-V245 VanDerWaalsContact O-CB 3.3Å; R241-V245 WeakPolarHBondContact O-CB 3.25Å; R241-V245 WeakPolarHBondContact O-CG2 3.44Å; R241-V245 PolarHBondContact O-N 2.81Å
242	E	49.5	Very low	47.2	Very low	100 Å²	100	105.3 Å²	105.3	47%	0.467	49%	0.487	S	S	.	.	H	α-helix	trans	-60.3	-47.7	172.6	-80	-175.1	152.7	0	0	111.1	S238 E244 V245 E246	S238-E242 PolarHBondContact O-N 2.64Å; E242-E244 VanDerWaalsContact C-N 3.32Å; E242-E244 PolarHBondContact O-N 3.14Å; E242-V245 PolarHBondContact O-N 3.44Å; E242-E246 WeakPolarHBondContact O-CB 3.32Å; E242-E246 PolarHBondContact O-N 2.76Å
243	Q	59.3	Low	46.5	Very low	118 Å²	118	103.7 Å²	103.7	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-60.9	-39.8	175.9	-74.9	176.8	1	0	0	112.6	K239 R240 E246 R247	K239-Q243 WeakPolarHBondContact O-CB 3.28Å; K239-Q243 VanDerWaalsContact O-CG 3.26Å; K239-Q243 WeakPolarHBondContact O-CG 3.36Å; K239-Q243 PolarHBondContact O-N 2.63Å; R240-Q243 PolarHBondContact O-N 2.88Å; Q243-E246 PolarHBondContact O-N 3.27Å; Q243-R247 WeakPolarHBondContact O-CG 3.48Å; Q243-R247 PolarHBondContact O-N 3.33Å
244	E	49.8	Very low	46.3	Very low	70 Å²	70	106.9 Å²	106.9	33%	0.327	52%	0.519	S	S	.	.	H	α-helix	trans	-72.2	-35.7	178.5	-167.2	67.5	-165.4	0	0	111.6	R240 R241 E242 R247 R248	R240-E244 VanDerWaalsContact O-CB 3.24Å; R240-E244 WeakPolarHBondContact O-CB 3.31Å; R240-E244 PolarHBondContact O-N 2.89Å; R241-E244 PolarHBondContact O-N 3.34Å; E242-E244 VanDerWaalsContact C-N 3.32Å; E242-E244 PolarHBondContact O-N 3.14Å; E244-R247 CarbonylContact O-C 3.6Å; E244-R247 WeakPolarHBondContact O-CB 3.41Å; E244-R247 PolarHBondContact O-N 3.37Å; E244-R247 IonicContact OE2-NH1 2.87Å; E244-R247 PolarHBondContact OE2-NH1 3.49Å; E244-R247 VanDerWaalsContact OE2-NH1 3.08Å; E244-R248 VanDerWaalsContact O-CB 3.3Å; E244-R248 WeakPolarHBondContact O-CB 3.24Å; E244-R248 VanDerWaalsContact O-CG 3.23Å; E244-R248 WeakPolarHBondContact O-CG 3.46Å; E244-R248 PolarHBondContact O-N 3.43Å; E244-R248 IonicContact OE1-NE 3.5Å; E244-R248 IonicContact OE1-NH2 3.7Å
245	V	41.3	Very low	46.4	Very low	51 Å²	51	107.9 Å²	107.9	31%	0.309	53%	0.528	S	S	.	.	H	α-helix	trans	-69	-38.1	172.4	169.9	0	0	0	0	110.5	R241 E242 R247 R248 K249 L259	R241-V245 VanDerWaalsContact O-CB 3.3Å; R241-V245 WeakPolarHBondContact O-CB 3.25Å; R241-V245 WeakPolarHBondContact O-CG2 3.44Å; R241-V245 PolarHBondContact O-N 2.81Å; E242-V245 PolarHBondContact O-N 3.44Å; V245-R247 VanDerWaalsContact C-N 3.29Å; V245-R247 PolarHBondContact O-N 3.08Å; V245-R248 CarbonylContact O-C 3.59Å; V245-R248 PolarHBondContact O-N 3.05Å; V245-R248 VanDerWaalsContact O-N 3.09Å; V245-K249 PolarHBondContact O-N 3.38Å; V245-L259 HydrophobicContact CG1-CD1 4.4Å; V245-L259 HydrophobicContact CG2-CD1 3.96Å
246	E	49.6	Very low	46.2	Very low	124 Å²	124	109.2 Å²	109.2	58%	0.579	54%	0.542	S	S	*	.	H	α-helix	trans	-63.7	-36.3	173	-147.7	103.9	-122.9	0	0	111.1	E242 Q243 K249	E242-E246 WeakPolarHBondContact O-CB 3.32Å; E242-E246 PolarHBondContact O-N 2.76Å; Q243-E246 PolarHBondContact O-N 3.27Å; E246-K249 WeakPolarHBondContact O-CB 3.43Å; E246-K249 IonicContact OE1-NZ 2.7Å; E246-K249 PolarHBondContact OE1-NZ 3.28Å
247	R	48.7	Very low	46.1	Very low	176 Å²	176	109.9 Å²	109.9	66%	0.664	55%	0.547	S	S	*	.	H	α-helix	trans	-68.4	-37.8	169.4	-70.7	174.1	-172.4	166.4	-2	112.4	Q243 E244 V245	Q243-R247 WeakPolarHBondContact O-CG 3.48Å; Q243-R247 PolarHBondContact O-N 3.33Å; E244-R247 CarbonylContact O-C 3.6Å; E244-R247 WeakPolarHBondContact O-CB 3.41Å; E244-R247 PolarHBondContact O-N 3.37Å; E244-R247 IonicContact OE2-NH1 2.87Å; E244-R247 PolarHBondContact OE2-NH1 3.49Å; E244-R247 VanDerWaalsContact OE2-NH1 3.08Å; V245-R247 VanDerWaalsContact C-N 3.29Å; V245-R247 PolarHBondContact O-N 3.08Å
248	R	44.6	Very low	46.1	Very low	140 Å²	140	113.1 Å²	113.1	53%	0.528	56%	0.559	S	S	.	*	H	α-helix	trans	-85.8	-3.2	-179	-71.3	-179	-172	-164	3	114.3	E244 V245 N250 K251 L252	E244-R248 VanDerWaalsContact O-CB 3.3Å; E244-R248 WeakPolarHBondContact O-CB 3.24Å; E244-R248 VanDerWaalsContact O-CG 3.23Å; E244-R248 WeakPolarHBondContact O-CG 3.46Å; E244-R248 PolarHBondContact O-N 3.43Å; E244-R248 IonicContact OE1-NE 3.5Å; E244-R248 IonicContact OE1-NH2 3.7Å; V245-R248 CarbonylContact O-C 3.59Å; V245-R248 PolarHBondContact O-N 3.05Å; V245-R248 VanDerWaalsContact O-N 3.09Å; R248-N250 PolarHBondContact O-N 3.3Å; R248-K251 PolarHBondContact O-N 2.84Å; R248-L252 PolarHBondContact O-N 3.49Å
249	K	40	Very low	45.8	Very low	132 Å²	132	115.5 Å²	115.5	57%	0.574	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-19.7	171.7	-127	175.7	-170.3	167.3	0	111.9	V245 E246	V245-K249 PolarHBondContact O-N 3.38Å; E246-K249 WeakPolarHBondContact O-CB 3.43Å; E246-K249 IonicContact OE1-NZ 2.7Å; E246-K249 PolarHBondContact OE1-NZ 3.28Å
250	N	46.3	Very low	45.4	Very low	151 Å²	151	116.6 Å²	116.6	81%	0.807	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-1.7	174.3	-68.8	-12.8	0	0	0	115.7	R248	R248-N250 PolarHBondContact O-N 3.3Å
251	K	43.1	Very low	45.3	Very low	189 Å²	189	112.5 Å²	112.5	82%	0.822	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.9	-27.6	-177.5	-73.1	-169.6	177	-178	0	117	R248	R248-K251 PolarHBondContact O-N 2.84Å
252	L	40	Very low	45.1	Very low	122 Å²	122	110.8 Å²	110.8	64%	0.639	56%	0.564	S	S	*	*			trans	-140.1	109.9	-177	-73.5	163.2	0	0	0	109.9	R248 L254	R248-L252 PolarHBondContact O-N 3.49Å; L252-L254 PolarHBondContact O-N 3.4Å
253	G	38.4	Very low	44.9	Very low	93 Å²	93	109.1 Å²	109.1	96%	0.959	56%	0.556	S	S	*	*			trans	-71.5	60.7	-175.6	0	0	0	0	0	114.2
254	L	41.2	Very low	44.4	Very low	127 Å²	127	107.1 Å²	107.1	67%	0.665	55%	0.552	S	S	*	*			trans	-76.6	130.1	164.8	-82.1	160.3	0	0	0	109.5	L252	L252-L254 PolarHBondContact O-N 3.4Å
255	S	45.9	Very low	44.1	Very low	51 Å²	51	109 Å²	109	36%	0.357	56%	0.561	S	S	.	*			trans	-63.2	127.2	-179.7	168.5	0	0	0	0	110.5	V257 D258	S255-V257 PolarHBondContact O-N 2.81Å; S255-V257 WeakPolarHBondContact OG-CB 3.45Å; S255-V257 PolarHBondContact OG-N 2.92Å; S255-D258 PolarHBondContact O-N 3.38Å
256	P	42.7	Very low	44.1	Very low	95 Å²	95	109.4 Å²	109.4	62%	0.617	56%	0.561	S	S	*	*	H	α-helix	trans	-64.1	-8.7	175.8	23.8	-31.3	0	0	0	113.7
257	V	47.3	Very low	43.8	Very low	88 Å²	88	105.4 Å²	105.4	53%	0.533	55%	0.547	S	S	.	.	H	α-helix	trans	-74.3	-46	178.5	-175.5	0	0	0	0	110.9	S255 L259 K260 E261	S255-V257 PolarHBondContact O-N 2.81Å; S255-V257 WeakPolarHBondContact OG-CB 3.45Å; S255-V257 PolarHBondContact OG-N 2.92Å; V257-L259 PolarHBondContact O-N 3Å; V257-K260 PolarHBondContact O-N 3.35Å; V257-E261 WeakPolarHBondContact O-CB 3.43Å; V257-E261 PolarHBondContact O-N 2.99Å
258	D	44.6	Very low	43.5	Very low	101 Å²	101	106.2 Å²	106.2	54%	0.54	55%	0.55	S	S	.	.	H	α-helix	trans	-66.8	-38.6	-172.2	-59.4	-29.4	0	0	0	112	S255 E261 L262	S255-D258 PolarHBondContact O-N 3.38Å; D258-E261 PolarHBondContact O-N 3.46Å; D258-L262 WeakPolarHBondContact O-CB 3.47Å; D258-L262 PolarHBondContact O-N 2.87Å
259	L	40.3	Very low	43.3	Very low	63 Å²	63	107.3 Å²	107.3	33%	0.33	56%	0.559	S	S	.	*	H	α-helix	trans	-67.5	-38.4	177.1	-103	150.3	0	0	0	112.5	V245 V257 E261 H263	V245-L259 HydrophobicContact CG1-CD1 4.4Å; V245-L259 HydrophobicContact CG2-CD1 3.96Å; V257-L259 PolarHBondContact O-N 3Å; L259-E261 VanDerWaalsContact C-N 3.34Å; L259-H263 WeakPolarHBondContact O-CB 3.49Å; L259-H263 PolarHBondContact O-N 3.43Å
260	K	45.7	Very low	43.4	Very low	147 Å²	147	103.1 Å²	103.1	64%	0.639	54%	0.54	S	S	*	.	H	α-helix	trans	-70.6	-35.3	178.7	-158.9	178	-174.9	-179.1	0	111.3	V257 H263 T264	V257-K260 PolarHBondContact O-N 3.35Å; K260-H263 PolarHBondContact O-N 3.13Å; K260-T264 PolarHBondContact O-N 3.35Å; K260-T264 PolarHBondContact O-OG1 3.39Å
261	E	47.4	Very low	43.3	Very low	97 Å²	97	100.6 Å²	100.6	45%	0.453	52%	0.523	S	S	.	.	H	α-helix	trans	-70.5	-44.3	177.2	-157.5	156.5	-157.9	0	0	111.4	V257 D258 L259 H263 T264 Q265	V257-E261 WeakPolarHBondContact O-CB 3.43Å; V257-E261 PolarHBondContact O-N 2.99Å; D258-E261 PolarHBondContact O-N 3.46Å; L259-E261 VanDerWaalsContact C-N 3.34Å; E261-H263 VanDerWaalsContact C-N 3.3Å; E261-H263 PolarHBondContact O-N 2.9Å; E261-T264 PolarHBondContact O-N 2.78Å; E261-Q265 WeakPolarHBondContact O-CG 3.48Å; E261-Q265 PolarHBondContact O-N 3.11Å
262	L	42.1	Very low	43.1	Very low	92 Å²	92	94.5 Å²	94.5	48%	0.482	51%	0.507	S	S	.	.	H	α-helix	trans	-58.4	-41.8	172.1	-160.2	91.5	0	0	0	111.8	D258 T264 Q265 L266	D258-L262 WeakPolarHBondContact O-CB 3.47Å; D258-L262 PolarHBondContact O-N 2.87Å; L262-T264 VanDerWaalsContact C-N 3.35Å; L262-T264 PolarHBondContact O-N 2.96Å; L262-Q265 PolarHBondContact O-N 3.47Å; L262-L266 HydrophobicContact CD2-CD1 4.33Å; L262-L266 HydrophobicContact CG-CD1 4.39Å; L262-L266 PolarHBondContact O-N 3.22Å
263	H	45.8	Very low	43.1	Very low	64 Å²	64	90.6 Å²	90.6	30%	0.296	49%	0.493	S	S	.	.	H	α-helix	trans	-66.7	-37.5	178.7	-166.9	45.7	0	0	0	112.5	L259 K260 E261 S267	L259-H263 WeakPolarHBondContact O-CB 3.49Å; L259-H263 PolarHBondContact O-N 3.43Å; K260-H263 PolarHBondContact O-N 3.13Å; E261-H263 VanDerWaalsContact C-N 3.3Å; E261-H263 PolarHBondContact O-N 2.9Å; H263-S267 WeakPolarHBondContact O-CB 3.43Å; H263-S267 PolarHBondContact O-N 3.33Å
264	T	47.6	Very low	43.3	Very low	76 Å²	76	87.5 Å²	87.5	47%	0.466	45%	0.454	S	S	.	.	H	α-helix	trans	-63.9	-44.7	174.6	-51.8	0	0	0	0	109.9	K260 E261 L262 S267 W268	K260-T264 PolarHBondContact O-N 3.35Å; K260-T264 PolarHBondContact O-OG1 3.39Å; E261-T264 PolarHBondContact O-N 2.78Å; L262-T264 VanDerWaalsContact C-N 3.35Å; L262-T264 PolarHBondContact O-N 2.96Å; T264-S267 PolarHBondContact O-N 3.48Å; T264-W268 PolarHBondContact O-N 3.01Å
265	Q	43.6	Very low	43.5	Very low	110 Å²	110	85.3 Å²	85.3	51%	0.514	44%	0.44	S	S	.	.	H	α-helix	trans	-61.9	-45.9	177.7	-69.5	173.6	3.5	0	0	112.7	E261 L262 S267 W268 F269	E261-Q265 WeakPolarHBondContact O-CG 3.48Å; E261-Q265 PolarHBondContact O-N 3.11Å; L262-Q265 PolarHBondContact O-N 3.47Å; Q265-S267 PolarHBondContact O-N 3.08Å; Q265-W268 PolarHBondContact O-N 3.35Å; Q265-F269 PolarHBondContact O-N 2.95Å
266	L	41.7	Very low	43.2	Very low	60 Å²	60	88.6 Å²	88.6	31%	0.314	45%	0.453	S	S	.	.	H	α-helix	trans	-62.1	-42.3	175.9	-102.8	139.7	0	0	0	112.1	L262 W268 F269 Y270	L262-L266 HydrophobicContact CD2-CD1 4.33Å; L262-L266 HydrophobicContact CG-CD1 4.39Å; L262-L266 PolarHBondContact O-N 3.22Å; L266-W268 VanDerWaalsContact C-N 3.3Å; L266-W268 PolarHBondContact O-N 3.06Å; L266-F269 WeakPolarHBondContact O-CB 3.46Å; L266-F269 PolarHBondContact O-N 2.85Å; L266-Y270 HydrophobicContact CD2-CD2 4.28Å; L266-Y270 HydrophobicContact CD2-CE2 3.53Å; L266-Y270 WeakPolarHBondContact O-CD2 3.26Å; L266-Y270 PolarHBondContact O-N 3.39Å
267	S	43.6	Very low	43.2	Very low	40 Å²	40	86.2 Å²	86.2	28%	0.28	44%	0.442	S	S	.	.	H	α-helix	trans	-62.1	-37.5	176.1	-173.2	0	0	0	0	112.5	H263 T264 Q265 Q271	H263-S267 WeakPolarHBondContact O-CB 3.43Å; H263-S267 PolarHBondContact O-N 3.33Å; T264-S267 PolarHBondContact O-N 3.48Å; Q265-S267 PolarHBondContact O-N 3.08Å; S267-Q271 WeakPolarHBondContact O-CB 3.49Å; S267-Q271 PolarHBondContact O-N 3.42Å; S267-Q271 VanDerWaalsContact O-N 3.08Å
268	W	41.7	Very low	43.1	Very low	192 Å²	192	87.8 Å²	87.8	73%	0.727	44%	0.438	S	S	*	.	H	α-helix	trans	-65.7	-41.7	174.9	-89.8	77.8	0	0	0	111.7	T264 Q265 L266 Q271 A272	T264-W268 PolarHBondContact O-N 3.01Å; Q265-W268 PolarHBondContact O-N 3.35Å; L266-W268 VanDerWaalsContact C-N 3.3Å; L266-W268 PolarHBondContact O-N 3.06Å; W268-Q271 PolarHBondContact O-N 3.22Å; W268-A272 WeakPolarHBondContact O-CB 3.32Å; W268-A272 PolarHBondContact O-N 3.03Å
269	F	40.6	Very low	43	Very low	164 Å²	164	87.4 Å²	87.4	72%	0.719	43%	0.433	S	S	*	.	H	α-helix	trans	-60.3	-46.9	175.4	-106.2	-81.3	0	0	0	112.5	Q265 L266 Q271 A272 A273	Q265-F269 PolarHBondContact O-N 2.95Å; L266-F269 WeakPolarHBondContact O-CB 3.46Å; L266-F269 PolarHBondContact O-N 2.85Å; F269-Q271 VanDerWaalsContact C-N 3.35Å; F269-Q271 PolarHBondContact O-N 3.32Å; F269-A272 PolarHBondContact O-N 3.1Å; F269-A273 PolarHBondContact O-N 3.26Å
270	Y	41.3	Very low	42.8	Very low	44 Å²	44	90.3 Å²	90.3	17%	0.173	44%	0.44	C	S	.	.	H	α-helix	trans	-64.8	-38.2	177.4	-74.5	-64.6	0	0	0	112.7	I230 Y231 L266 A273 I274	I230-Y270 HydrophobicContact CG2-CE1 4.23Å; Y231-Y270 HydrophobicContact CD2-CD1 4.13Å; Y231-Y270 AromaticContact CD2-CD2 3.43Å; Y231-Y270 HydrophobicContact CD2-CD2 3.43Å; Y231-Y270 VanDerWaalsContact CD2-CD2 3.43Å; Y231-Y270 HydrophobicContact CD2-CE2 4.05Å; Y231-Y270 AromaticContact CD2-CG 3.47Å; Y231-Y270 HydrophobicContact CD2-CG 3.47Å; Y231-Y270 VanDerWaalsContact CD2-CG 3.47Å; Y231-Y270 AromaticContact CE2-CD2 3.88Å; Y231-Y270 HydrophobicContact CE2-CD2 3.88Å; Y231-Y270 HydrophobicContact CE2-CG 4.09Å; Y231-Y270 HydrophobicContact CG-CG 4.44Å; L266-Y270 HydrophobicContact CD2-CD2 4.28Å; L266-Y270 HydrophobicContact CD2-CE2 3.53Å; L266-Y270 WeakPolarHBondContact O-CD2 3.26Å; L266-Y270 PolarHBondContact O-N 3.39Å; Y270-A273 PolarHBondContact O-N 2.97Å; Y270-I274 VanDerWaalsContact O-CG1 3.31Å; Y270-I274 WeakPolarHBondContact O-CG1 3.37Å; Y270-I274 PolarHBondContact O-N 3.38Å
271	Q	44.4	Very low	42.7	Very low	98 Å²	98	88.6 Å²	88.6	46%	0.458	43%	0.429	S	S	.	.	H	α-helix	trans	-64.2	-41.8	176.1	-164	72.2	12.1	0	0	111.4	S267 W268 F269 I274 E275	S267-Q271 WeakPolarHBondContact O-CB 3.49Å; S267-Q271 PolarHBondContact O-N 3.42Å; S267-Q271 VanDerWaalsContact O-N 3.08Å; W268-Q271 PolarHBondContact O-N 3.22Å; F269-Q271 VanDerWaalsContact C-N 3.35Å; F269-Q271 PolarHBondContact O-N 3.32Å; Q271-I274 PolarHBondContact O-N 2.86Å; Q271-E275 PolarHBondContact O-N 3.33Å
272	A	39.8	Very low	42.5	Very low	60 Å²	60	90.6 Å²	90.6	50%	0.496	43%	0.433	S	S	.	.	H	α-helix	trans	-62.8	-41.4	175.3	0	0	0	0	0	111.9	W268 F269 I274 E275 L276	W268-A272 WeakPolarHBondContact O-CB 3.32Å; W268-A272 PolarHBondContact O-N 3.03Å; F269-A272 PolarHBondContact O-N 3.1Å; A272-I274 VanDerWaalsContact C-N 3.34Å; A272-I274 PolarHBondContact O-N 3.2Å; A272-E275 PolarHBondContact O-N 2.8Å; A272-L276 WeakPolarHBondContact O-CB 3.44Å; A272-L276 PolarHBondContact O-N 3.22Å
273	A	39.2	Very low	42.4	Very low	40 Å²	40	92 Å²	92	33%	0.331	44%	0.435	S	S	.	.	H	α-helix	trans	-62.9	-38.5	175.7	0	0	0	0	0	112.6	F269 Y270 A277	F269-A273 PolarHBondContact O-N 3.26Å; Y270-A273 PolarHBondContact O-N 2.97Å; A273-A277 WeakPolarHBondContact O-CB 3.39Å; A273-A277 PolarHBondContact O-N 3.2Å
274	I	43.5	Very low	42.3	Very low	29 Å²	29	91 Å²	91	15%	0.149	43%	0.431	C	S	.	.	H	α-helix	trans	-66.3	-46.2	175.8	-68.8	165.5	0	0	0	111.3	L228 Y270 Q271 A272 L276 A277 R278	L228-I274 HydrophobicContact CD2-CD1 4.31Å; Y270-I274 VanDerWaalsContact O-CG1 3.31Å; Y270-I274 WeakPolarHBondContact O-CG1 3.37Å; Y270-I274 PolarHBondContact O-N 3.38Å; Q271-I274 PolarHBondContact O-N 2.86Å; A272-I274 VanDerWaalsContact C-N 3.34Å; A272-I274 PolarHBondContact O-N 3.2Å; I274-L276 VanDerWaalsContact C-N 3.33Å; I274-L276 PolarHBondContact O-N 2.93Å; I274-A277 PolarHBondContact O-N 2.84Å; I274-R278 WeakPolarHBondContact O-CG 3.43Å; I274-R278 PolarHBondContact O-N 3.41Å
275	E	44.1	Very low	42.1	Very low	80 Å²	80	92.5 Å²	92.5	37%	0.374	43%	0.433	S	S	.	.	H	α-helix	trans	-63.4	-39.9	177.2	-70.6	-60.3	145.5	0	0	111.3	Q271 A272 A277 R278 E279	Q271-E275 PolarHBondContact O-N 3.33Å; A272-E275 PolarHBondContact O-N 2.8Å; E275-A277 VanDerWaalsContact C-N 3.34Å; E275-A277 PolarHBondContact O-N 3.44Å; E275-R278 WeakPolarHBondContact O-CB 3.43Å; E275-R278 PolarHBondContact O-N 2.97Å; E275-R278 IonicContact OE1-CZ 2.81Å; E275-R278 IonicContact OE1-NH1 3.98Å; E275-R278 PolarHBondContact OE1-NH1 2.79Å; E275-E279 PolarHBondContact O-N 2.73Å
276	L	41.1	Very low	42.1	Very low	120 Å²	120	89.9 Å²	89.9	63%	0.628	42%	0.422	S	S	*	.	H	α-helix	trans	-61.4	-41.5	174.2	-170.6	69.7	0	0	0	112.1	A272 I274 R278 E279 R280	A272-L276 WeakPolarHBondContact O-CB 3.44Å; A272-L276 PolarHBondContact O-N 3.22Å; I274-L276 VanDerWaalsContact C-N 3.33Å; I274-L276 PolarHBondContact O-N 2.93Å; L276-R278 VanDerWaalsContact C-N 3.33Å; L276-R278 PolarHBondContact O-N 3.45Å; L276-E279 PolarHBondContact O-N 3.02Å; L276-R280 VanDerWaalsContact O-CB 3.32Å; L276-R280 WeakPolarHBondContact O-CB 3.45Å; L276-R280 PolarHBondContact O-N 2.99Å
277	A	41.5	Very low	41.9	Very low	45 Å²	45	89.4 Å²	89.4	37%	0.372	42%	0.423	S	S	.	.	H	α-helix	trans	-63.9	-37.3	175.2	0	0	0	0	0	112.4	A273 I274 E275 R281	A273-A277 WeakPolarHBondContact O-CB 3.39Å; A273-A277 PolarHBondContact O-N 3.2Å; I274-A277 PolarHBondContact O-N 2.84Å; E275-A277 VanDerWaalsContact C-N 3.34Å; E275-A277 PolarHBondContact O-N 3.44Å; A277-R281 PolarHBondContact O-N 3.08Å
278	R	44.9	Very low	41.9	Very low	122 Å²	122	89.4 Å²	89.4	46%	0.46	42%	0.42	S	S	.	.	H	α-helix	trans	-67.2	-45.9	175.5	-72.4	172.3	177.6	170.6	-0.4	112.2	I274 E275 L276 R280 R281 R282	I274-R278 WeakPolarHBondContact O-CG 3.43Å; I274-R278 PolarHBondContact O-N 3.41Å; E275-R278 WeakPolarHBondContact O-CB 3.43Å; E275-R278 PolarHBondContact O-N 2.97Å; E275-R278 IonicContact OE1-CZ 2.81Å; E275-R278 IonicContact OE1-NH1 3.98Å; E275-R278 PolarHBondContact OE1-NH1 2.79Å; L276-R278 VanDerWaalsContact C-N 3.33Å; L276-R278 PolarHBondContact O-N 3.45Å; R278-R280 VanDerWaalsContact C-N 3.26Å; R278-R280 PolarHBondContact O-N 2.69Å; R278-R281 WeakPolarHBondContact O-CB 3.16Å; R278-R281 PolarHBondContact O-N 3.46Å; R278-R281 VanDerWaalsContact O-N 3.12Å; R278-R282 PolarHBondContact O-N 3.46Å; R278-R282 VanDerWaalsContact O-N 3.08Å
279	E	43	Very low	42	Very low	93 Å²	93	81.2 Å²	81.2	44%	0.435	39%	0.39	S	S	.	.	H	α-helix	trans	-65	-34.9	178.2	-130.8	58.1	-158.3	0	0	110.9	E275 L276 R282 F283	E275-E279 PolarHBondContact O-N 2.73Å; L276-E279 PolarHBondContact O-N 3.02Å; E279-R282 WeakPolarHBondContact O-CB 3.44Å; E279-R282 PolarHBondContact O-N 3.36Å; E279-R282 IonicContact OE1-CZ 3.86Å; E279-R282 IonicContact OE1-NH1 2.71Å; E279-R282 PolarHBondContact OE1-NH1 2.82Å; E279-R282 IonicContact OE2-CZ 3.56Å; E279-R282 IonicContact OE2-NE 3.67Å; E279-R282 IonicContact OE2-NH1 3.42Å; E279-R282 PolarHBondContact OE2-NH1 3.48Å; E279-R282 VanDerWaalsContact OE2-NH1 3.09Å; E279-F283 PolarHBondContact O-N 3.47Å
280	R	37.3	Very low	42	Very low	123 Å²	123	78.6 Å²	78.6	46%	0.464	38%	0.38	S	S	.	.	H	α-helix	trans	-63.1	-40.7	171.8	-165.8	174.2	-177.1	179	1.2	112.3	L276 R278 F283 I284	L276-R280 VanDerWaalsContact O-CB 3.32Å; L276-R280 WeakPolarHBondContact O-CB 3.45Å; L276-R280 PolarHBondContact O-N 2.99Å; R278-R280 VanDerWaalsContact C-N 3.26Å; R278-R280 PolarHBondContact O-N 2.69Å; R280-F283 PolarHBondContact O-N 3.33Å; R280-I284 HydrophobicContact CG-CD1 4.23Å; R280-I284 WeakPolarHBondContact O-CD1 3.31Å; R280-I284 VanDerWaalsContact O-CG1 3.27Å; R280-I284 WeakPolarHBondContact O-CG1 3.31Å; R280-I284 PolarHBondContact O-N 2.62Å
281	R	42.7	Very low	42	Very low	112 Å²	112	79.9 Å²	79.9	42%	0.423	39%	0.39	S	S	.	.	H	α-helix	trans	-60.1	-44.5	173.6	-162	-176	-149.9	146.5	9.3	111.4	E224 A277 R278 I284 E285	E224-R281 IonicContact OE2-NH1 2.66Å; A277-R281 PolarHBondContact O-N 3.08Å; R278-R281 WeakPolarHBondContact O-CB 3.16Å; R278-R281 PolarHBondContact O-N 3.46Å; R278-R281 VanDerWaalsContact O-N 3.12Å; R281-I284 PolarHBondContact O-N 3.39Å; R281-E285 PolarHBondContact O-N 2.94Å
282	R	43.9	Very low	41.9	Very low	139 Å²	139	78.8 Å²	78.8	53%	0.525	39%	0.387	S	S	.	.	H	α-helix	trans	-60.9	-45.6	175.9	-70.1	177.5	177.6	169	1.9	112	R278 E279 I284 E285 I286	R278-R282 PolarHBondContact O-N 3.46Å; R278-R282 VanDerWaalsContact O-N 3.08Å; E279-R282 WeakPolarHBondContact O-CB 3.44Å; E279-R282 PolarHBondContact O-N 3.36Å; E279-R282 IonicContact OE1-CZ 3.86Å; E279-R282 IonicContact OE1-NH1 2.71Å; E279-R282 PolarHBondContact OE1-NH1 2.82Å; E279-R282 IonicContact OE2-CZ 3.56Å; E279-R282 IonicContact OE2-NE 3.67Å; E279-R282 IonicContact OE2-NH1 3.42Å; E279-R282 PolarHBondContact OE2-NH1 3.48Å; E279-R282 VanDerWaalsContact OE2-NH1 3.09Å; R282-I284 VanDerWaalsContact C-N 3.31Å; R282-I284 PolarHBondContact O-N 3.25Å; R282-E285 PolarHBondContact O-N 3.43Å; R282-I286 WeakPolarHBondContact O-CG1 3.47Å; R282-I286 PolarHBondContact O-N 2.89Å
283	F	40.2	Very low	41.9	Very low	122 Å²	122	78.7 Å²	78.7	54%	0.535	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-41.4	177.3	-173.5	-101.4	0	0	0	112.1	E279 R280 E285 I286 C287	E279-F283 PolarHBondContact O-N 3.47Å; R280-F283 PolarHBondContact O-N 3.33Å; F283-E285 PolarHBondContact O-N 3.29Å; F283-I286 WeakPolarHBondContact O-CB 3.4Å; F283-I286 PolarHBondContact O-N 2.78Å; F283-C287 WeakPolarHBondContact CE1-SG 3.25Å; F283-C287 PolarHBondContact O-N 3.22Å; F283-C287 PolarHBondContact O-SG 2.9Å; F283-C287 VanDerWaalsContact O-SG 3.4Å
284	I	42	Very low	41.8	Very low	42 Å²	42	80.1 Å²	80.1	22%	0.215	38%	0.382	C	S	.	.	H	α-helix	trans	-64.5	-39.3	176.7	-68.1	157.7	0	0	0	111.9	F216 R280 R281 R282 I286 C287 N288	F216-I284 HydrophobicContact CE1-CD1 3.94Å; R280-I284 HydrophobicContact CG-CD1 4.23Å; R280-I284 WeakPolarHBondContact O-CD1 3.31Å; R280-I284 VanDerWaalsContact O-CG1 3.27Å; R280-I284 WeakPolarHBondContact O-CG1 3.31Å; R280-I284 PolarHBondContact O-N 2.62Å; R281-I284 PolarHBondContact O-N 3.39Å; R282-I284 VanDerWaalsContact C-N 3.31Å; R282-I284 PolarHBondContact O-N 3.25Å; I284-I286 VanDerWaalsContact C-N 3.29Å; I284-I286 PolarHBondContact O-N 3.32Å; I284-C287 PolarHBondContact O-N 2.94Å; I284-N288 WeakPolarHBondContact O-CB 3.17Å; I284-N288 PolarHBondContact O-N 2.91Å; I284-N288 PolarHBondContact O-ND2 2.79Å
285	E	44.4	Very low	41.6	Very low	107 Å²	107	83 Å²	83	50%	0.5	39%	0.393	S	S	.	.	H	α-helix	trans	-61.7	-40.1	173.7	-73.6	174.6	179.7	0	0	111.2	R281 R282 F283 N288 L289	R281-E285 PolarHBondContact O-N 2.94Å; R282-E285 PolarHBondContact O-N 3.43Å; F283-E285 PolarHBondContact O-N 3.29Å; E285-N288 PolarHBondContact O-N 3.21Å; E285-L289 PolarHBondContact O-N 3.49Å
286	I	42.6	Very low	41.3	Very low	55 Å²	55	80.9 Å²	80.9	28%	0.282	38%	0.383	S	S	.	.	H	α-helix	trans	-65.6	-46.3	175.5	-65.2	163.5	0	0	0	111.5	R282 F283 I284 N288 L289 H290 L328	R282-I286 WeakPolarHBondContact O-CG1 3.47Å; R282-I286 PolarHBondContact O-N 2.89Å; F283-I286 WeakPolarHBondContact O-CB 3.4Å; F283-I286 PolarHBondContact O-N 2.78Å; I284-I286 VanDerWaalsContact C-N 3.29Å; I284-I286 PolarHBondContact O-N 3.32Å; I286-N288 VanDerWaalsContact C-N 3.32Å; I286-N288 PolarHBondContact O-N 3Å; I286-L289 WeakPolarHBondContact O-CB 3.17Å; I286-L289 PolarHBondContact O-N 3.49Å; I286-H290 PolarHBondContact O-N 3.15Å; I286-L328 HydrophobicContact CD1-CD1 3.86Å
287	C	37.3	Very low	40.9	Very low	50 Å²	50	80 Å²	80	34%	0.338	38%	0.383	S	S	.	.	H	α-helix	trans	-62	-39.1	177	-68.7	0	0	0	0	112.1	F283 I284 H290 L291	F283-C287 WeakPolarHBondContact CE1-SG 3.25Å; F283-C287 PolarHBondContact O-N 3.22Å; F283-C287 PolarHBondContact O-SG 2.9Å; F283-C287 VanDerWaalsContact O-SG 3.4Å; I284-C287 PolarHBondContact O-N 2.94Å; C287-H290 PolarHBondContact O-N 3.39Å; C287-L291 PolarHBondContact O-N 3.31Å
288	N	44.5	Very low	40.6	Very low	40 Å²	40	88.4 Å²	88.4	21%	0.214	41%	0.405	C	S	.	.	H	α-helix	trans	-63.7	-41	174.5	-82.5	-59.7	0	0	0	111.7	R213 I284 E285 I286 L291 D292	R213-N288 PolarHBondContact NH2-OD1 3.49Å; I284-N288 WeakPolarHBondContact O-CB 3.17Å; I284-N288 PolarHBondContact O-N 2.91Å; I284-N288 PolarHBondContact O-ND2 2.79Å; E285-N288 PolarHBondContact O-N 3.21Å; I286-N288 VanDerWaalsContact C-N 3.32Å; I286-N288 PolarHBondContact O-N 3Å; N288-L291 PolarHBondContact O-N 2.84Å; N288-D292 PolarHBondContact O-N 2.78Å
289	L	44.6	Very low	40.1	Very low	21 Å²	21	88.5 Å²	88.5	11%	0.11	41%	0.414	C	S	.	.	H	α-helix	trans	-61.6	-46.8	173.5	-177.2	80.5	0	0	0	111.1	E285 I286 L291 D292 I293 L321	E285-L289 PolarHBondContact O-N 3.49Å; I286-L289 WeakPolarHBondContact O-CB 3.17Å; I286-L289 PolarHBondContact O-N 3.49Å; L289-L291 VanDerWaalsContact C-N 3.29Å; L289-L291 PolarHBondContact O-N 2.8Å; L289-D292 CarbonylContact O-C 3.45Å; L289-D292 PolarHBondContact O-N 2.79Å; L289-D292 VanDerWaalsContact O-N 3.07Å; L289-I293 HydrophobicContact CD1-CD1 4.49Å; L289-I293 HydrophobicContact CD2-CD1 3.96Å; L289-I293 HydrophobicContact CG-CD1 3.83Å; L289-I293 HydrophobicContact CG-CG1 4.3Å; L289-I293 WeakPolarHBondContact O-CG1 3.23Å; L289-I293 PolarHBondContact O-N 2.83Å; L289-L321 HydrophobicContact CD1-CB 3.78Å; L289-L321 HydrophobicContact CD1-CD1 3.71Å; L289-L321 HydrophobicContact CD1-CD2 4.42Å; L289-L321 HydrophobicContact CD1-CG 4.14Å; L289-L321 HydrophobicContact CD2-CB 3.68Å; L289-L321 HydrophobicContact CD2-CD2 3.92Å; L289-L321 HydrophobicContact CD2-CG 4.26Å; L289-L321 HydrophobicContact CG-CB 4.34Å
290	H	39.6	Very low	39.6	Very low	109 Å²	109	90.3 Å²	90.3	51%	0.505	42%	0.423	S	S	.	.	H	α-helix	trans	-58.7	-43.1	178.1	-118.4	75.8	0	0	0	111.3	I286 C287 D292 I293 V294	I286-H290 PolarHBondContact O-N 3.15Å; C287-H290 PolarHBondContact O-N 3.39Å; H290-D292 VanDerWaalsContact C-N 3.33Å; H290-D292 PolarHBondContact O-N 3.3Å; H290-I293 PolarHBondContact O-N 2.8Å; H290-V294 VanDerWaalsContact O-CB 3.32Å; H290-V294 WeakPolarHBondContact O-CB 3.23Å; H290-V294 WeakPolarHBondContact O-CG2 3.31Å; H290-V294 PolarHBondContact O-N 3.48Å
291	L	40.5	Very low	39.4	Very low	71 Å²	71	96 Å²	96	37%	0.372	44%	0.444	S	S	.	.	H	α-helix	trans	-63.8	-36.3	174.5	-80.9	164.8	0	0	0	112.7	C287 N288 L289 K295	C287-L291 PolarHBondContact O-N 3.31Å; N288-L291 PolarHBondContact O-N 2.84Å; L289-L291 VanDerWaalsContact C-N 3.29Å; L289-L291 PolarHBondContact O-N 2.8Å; L291-K295 VanDerWaalsContact O-CB 3.32Å; L291-K295 WeakPolarHBondContact O-CB 3.47Å; L291-K295 VanDerWaalsContact O-CG 3.23Å; L291-K295 WeakPolarHBondContact O-CG 3.19Å; L291-K295 PolarHBondContact O-N 3.3Å
292	D	44	Very low	38.9	Very low	75 Å²	75	99.1 Å²	99.1	40%	0.401	46%	0.457	S	S	.	.	H	α-helix	trans	-72	-39.3	176.7	-74.1	-14.1	0	0	0	111.8	R213 N288 L289 H290 K295 E296	R213-D292 IonicContact NH2-OD1 2.64Å; N288-D292 PolarHBondContact O-N 2.78Å; L289-D292 CarbonylContact O-C 3.45Å; L289-D292 PolarHBondContact O-N 2.79Å; L289-D292 VanDerWaalsContact O-N 3.07Å; H290-D292 VanDerWaalsContact C-N 3.33Å; H290-D292 PolarHBondContact O-N 3.3Å; D292-K295 PolarHBondContact O-N 2.83Å; D292-E296 PolarHBondContact O-N 3.21Å
293	I	39.1	Very low	38.8	Very low	58 Å²	58	97.2 Å²	97.2	30%	0.297	46%	0.457	S	S	.	.	H	α-helix	trans	-63.9	-50.4	172.6	-67.4	168.6	0	0	0	109.8	L289 H290 K295 E296 V297	L289-I293 HydrophobicContact CD1-CD1 4.49Å; L289-I293 HydrophobicContact CD2-CD1 3.96Å; L289-I293 HydrophobicContact CG-CD1 3.83Å; L289-I293 HydrophobicContact CG-CG1 4.3Å; L289-I293 WeakPolarHBondContact O-CG1 3.23Å; L289-I293 PolarHBondContact O-N 2.83Å; H290-I293 PolarHBondContact O-N 2.8Å; I293-K295 PolarHBondContact O-N 3.39Å; I293-E296 PolarHBondContact O-N 2.9Å; I293-E296 VanDerWaalsContact O-N 3.08Å; I293-V297 HydrophobicContact CG2-CG2 4.19Å; I293-V297 WeakPolarHBondContact O-CB 3.24Å; I293-V297 VanDerWaalsContact O-CG2 3.29Å; I293-V297 WeakPolarHBondContact O-CG2 3.31Å; I293-V297 PolarHBondContact O-N 2.88Å
294	V	36.2	Very low	38.6	Very low	70 Å²	70	96 Å²	96	42%	0.424	46%	0.462	S	S	.	.	H	α-helix	trans	-58.9	-38.7	177.6	170.5	0	0	0	0	109.9	H290 V297 R298	H290-V294 VanDerWaalsContact O-CB 3.32Å; H290-V294 WeakPolarHBondContact O-CB 3.23Å; H290-V294 WeakPolarHBondContact O-CG2 3.31Å; H290-V294 PolarHBondContact O-N 3.48Å; V294-V297 PolarHBondContact O-N 2.9Å; V294-R298 VanDerWaalsContact O-CB 3.24Å; V294-R298 WeakPolarHBondContact O-CB 3.48Å; V294-R298 PolarHBondContact O-N 2.88Å
295	K	39.7	Very low	38.5	Very low	88 Å²	88	101.1 Å²	101.1	38%	0.383	49%	0.485	S	S	.	.	H	α-helix	trans	-64.2	-45.1	173	-81.7	174.4	-177.7	175.1	0	112.8	L291 D292 I293 V297 R298 L299	L291-K295 VanDerWaalsContact O-CB 3.32Å; L291-K295 WeakPolarHBondContact O-CB 3.47Å; L291-K295 VanDerWaalsContact O-CG 3.23Å; L291-K295 WeakPolarHBondContact O-CG 3.19Å; L291-K295 PolarHBondContact O-N 3.3Å; D292-K295 PolarHBondContact O-N 2.83Å; I293-K295 PolarHBondContact O-N 3.39Å; K295-V297 VanDerWaalsContact C-N 3.29Å; K295-V297 PolarHBondContact O-N 2.82Å; K295-R298 PolarHBondContact O-N 3.03Å; K295-L299 VanDerWaalsContact O-CB 3.23Å; K295-L299 WeakPolarHBondContact O-CB 3.43Å; K295-L299 PolarHBondContact O-N 3.04Å
296	E	38.4	Very low	38.5	Very low	36 Å²	36	99.6 Å²	99.6	17%	0.168	48%	0.48	C	S	.	.	H	α-helix	trans	-64.3	-35.3	176.3	-81.2	-159.6	167.6	0	0	112.3	D292 I293 L299 R314	D292-E296 PolarHBondContact O-N 3.21Å; I293-E296 PolarHBondContact O-N 2.9Å; I293-E296 VanDerWaalsContact O-N 3.08Å; E296-L299 VanDerWaalsContact O-O 3.13Å; E296-R314 IonicContact OE1-CZ 3.65Å; E296-R314 VanDerWaalsContact OE1-CZ 3.31Å; E296-R314 IonicContact OE1-NH1 3.88Å; E296-R314 PolarHBondContact OE1-NH1 2.71Å; E296-R314 IonicContact OE1-NH2 3.01Å; E296-R314 PolarHBondContact OE1-NH2 3.13Å
297	V	33.2	Very low	38.3	Very low	103 Å²	103	99 Å²	99	62%	0.624	48%	0.479	S	S	*	.	H	α-helix	trans	-74.1	-37.7	176.7	175.7	0	0	0	0	111.5	I293 V294 K295	I293-V297 HydrophobicContact CG2-CG2 4.19Å; I293-V297 WeakPolarHBondContact O-CB 3.24Å; I293-V297 VanDerWaalsContact O-CG2 3.29Å; I293-V297 WeakPolarHBondContact O-CG2 3.31Å; I293-V297 PolarHBondContact O-N 2.88Å; V294-V297 PolarHBondContact O-N 2.9Å; K295-V297 VanDerWaalsContact C-N 3.29Å; K295-V297 PolarHBondContact O-N 2.82Å
298	R	34.2	Very low	38.3	Very low	221 Å²	221	100.5 Å²	100.5	83%	0.834	49%	0.486	S	S	*	.	H	α-helix	trans	-76.3	-33.1	178.7	-132.1	174.6	-174.9	169.7	1	112.1	V294 K295 Q300	V294-R298 VanDerWaalsContact O-CB 3.24Å; V294-R298 WeakPolarHBondContact O-CB 3.48Å; V294-R298 PolarHBondContact O-N 2.88Å; K295-R298 PolarHBondContact O-N 3.03Å; R298-Q300 PolarHBondContact O-N 3.39Å
299	L	35	Very low	38.1	Very low	124 Å²	124	101.5 Å²	101.5	65%	0.649	49%	0.494	S	S	*	.	S	Bend	trans	-91.8	89.3	174.7	-71.5	161.6	0	0	0	109.7	K295 E296	K295-L299 VanDerWaalsContact O-CB 3.23Å; K295-L299 WeakPolarHBondContact O-CB 3.43Å; K295-L299 PolarHBondContact O-N 3.04Å; E296-L299 VanDerWaalsContact O-O 3.13Å
300	Q	32.2	Very low	37.9	Very low	131 Å²	131	106.3 Å²	106.3	61%	0.612	51%	0.511	S	S	*	.			trans	108.1	120.1	155.5	-56.9	178.5	-8.8	0	0	116.2	R298 Y302	R298-Q300 PolarHBondContact O-N 3.39Å; Q300-Y302 VanDerWaalsContact C-N 3.29Å; Q300-Y302 PolarHBondContact O-N 3.38Å
301	R	32.2	Very low	37.8	Very low	241 Å²	241	102.2 Å²	102.2	91%	0.909	49%	0.492	S	S	*	.			trans	-54.3	76.3	161.6	-61.6	174.3	174.7	-171.8	-2.9	111.7
302	Y	33.5	Very low	37.8	Very low	178 Å²	178	103.9 Å²	103.9	70%	0.698	50%	0.501	S	S	*	.			trans	-152.3	126.2	166.6	-89.9	-75.4	0	0	0	111.9	Q300	Q300-Y302 VanDerWaalsContact C-N 3.29Å; Q300-Y302 PolarHBondContact O-N 3.38Å
303	D	40.4	Very low	37.7	Very low	100 Å²	100	110.4 Å²	110.4	54%	0.535	52%	0.52	S	S	.	.			trans	6.7	119.6	164.3	-134.9	-38.1	0	0	0	118.5	E305 N306	D303-E305 PolarHBondContact O-N 3.45Å; D303-E305 VanDerWaalsContact O-N 3.08Å; D303-N306 WeakPolarHBondContact O-CB 3.35Å; D303-N306 PolarHBondContact O-N 3.01Å
304	P	37.9	Very low	37.7	Very low	97 Å²	97	114.4 Å²	114.4	63%	0.63	53%	0.532	S	S	*	.	H	α-helix	trans	-54.3	-28.8	-178.9	19.5	-33.6	0	0	0	114.7	N306 V307 V308	P304-N306 PolarHBondContact O-N 2.98Å; P304-V307 PolarHBondContact O-N 3.22Å; P304-V307 VanDerWaalsContact O-N 3.14Å; P304-V308 PolarHBondContact O-N 2.96Å
305	E	40	Very low	37.9	Very low	149 Å²	149	116.1 Å²	116.1	70%	0.696	54%	0.543	S	S	*	.	H	α-helix	trans	-59.7	-35.7	176.1	-67.8	-173.8	166.3	0	0	112	D303 V309	D303-E305 PolarHBondContact O-N 3.45Å; D303-E305 VanDerWaalsContact O-N 3.08Å; E305-V309 WeakPolarHBondContact O-CB 3.35Å; E305-V309 WeakPolarHBondContact O-CG2 3.36Å; E305-V309 PolarHBondContact O-N 2.96Å
306	N	42.5	Very low	37.9	Very low	75 Å²	75	117.4 Å²	117.4	40%	0.401	56%	0.56	S	S	.	*	H	α-helix	trans	-73.6	-29.1	178.5	-108.8	-24.2	0	0	0	112.8	D303 P304 R310	D303-N306 WeakPolarHBondContact O-CB 3.35Å; D303-N306 PolarHBondContact O-N 3.01Å; P304-N306 PolarHBondContact O-N 2.98Å; N306-R310 VanDerWaalsContact O-CB 3.31Å; N306-R310 WeakPolarHBondContact O-CB 3.46Å; N306-R310 VanDerWaalsContact O-CG 3.3Å; N306-R310 WeakPolarHBondContact O-CG 3.49Å; N306-R310 PolarHBondContact O-N 3.39Å
307	V	38.6	Very low	37.8	Very low	41 Å²	41	119 Å²	119	25%	0.248	58%	0.575	C	S	.	*	H	α-helix	trans	-67.1	-46.8	175.5	178.9	0	0	0	0	109.6	P304 V309 R310 L311	P304-V307 PolarHBondContact O-N 3.22Å; P304-V307 VanDerWaalsContact O-N 3.14Å; V307-V309 PolarHBondContact O-N 3.47Å; V307-R310 PolarHBondContact O-N 2.99Å; V307-L311 HydrophobicContact CG1-CD1 3.78Å; V307-L311 HydrophobicContact CG1-CG 4.49Å; V307-L311 WeakPolarHBondContact O-CB 3.22Å; V307-L311 WeakPolarHBondContact O-CG 3.43Å; V307-L311 PolarHBondContact O-N 2.91Å
308	V	37.3	Very low	37.7	Very low	83 Å²	83	115.1 Å²	115.1	50%	0.503	55%	0.552	S	S	.	*	H	α-helix	trans	-62.8	-43.8	176.1	-179.9	0	0	0	0	110.9	P304 R310 L311 N312	P304-V308 PolarHBondContact O-N 2.96Å; V308-R310 PolarHBondContact O-N 3.49Å; V308-L311 PolarHBondContact O-N 3.4Å; V308-N312 VanDerWaalsContact O-CB 3.28Å; V308-N312 WeakPolarHBondContact O-CB 3.42Å; V308-N312 PolarHBondContact O-N 2.77Å
309	V	40	Very low	37.6	Very low	61 Å²	61	105.5 Å²	105.5	37%	0.37	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-38.8	177.2	173.1	0	0	0	0	111.7	E305 V307 R313	E305-V309 WeakPolarHBondContact O-CB 3.35Å; E305-V309 WeakPolarHBondContact O-CG2 3.36Å; E305-V309 PolarHBondContact O-N 2.96Å; V307-V309 PolarHBondContact O-N 3.47Å; V309-R313 HydrophobicContact CG1-CG 4.33Å; V309-R313 VanDerWaalsContact O-CB 3.27Å; V309-R313 WeakPolarHBondContact O-CB 3.14Å; V309-R313 VanDerWaalsContact O-CG 3.24Å; V309-R313 WeakPolarHBondContact O-CG 3.49Å; V309-R313 PolarHBondContact O-N 3.02Å
310	R	41.1	Very low	37.6	Very low	122 Å²	122	106.2 Å²	106.2	46%	0.46	52%	0.523	S	S	.	.	H	α-helix	trans	-70.2	-41.7	176	-78.1	-179.1	-167.6	170.9	5	112.3	N306 V307 V308 N312 R313 R314	N306-R310 VanDerWaalsContact O-CB 3.31Å; N306-R310 WeakPolarHBondContact O-CB 3.46Å; N306-R310 VanDerWaalsContact O-CG 3.3Å; N306-R310 WeakPolarHBondContact O-CG 3.49Å; N306-R310 PolarHBondContact O-N 3.39Å; V307-R310 PolarHBondContact O-N 2.99Å; V308-R310 PolarHBondContact O-N 3.49Å; R310-N312 VanDerWaalsContact C-N 3.3Å; R310-N312 PolarHBondContact O-N 3.26Å; R310-R313 PolarHBondContact O-N 3.28Å; R310-R314 PolarHBondContact O-N 3.43Å
311	L	38.4	Very low	37.7	Very low	23 Å²	23	102.5 Å²	102.5	12%	0.12	51%	0.507	C	S	.	.	H	α-helix	trans	-63.2	-37.6	175.5	-79.2	165	0	0	0	111.7	V307 V308 T318	V307-L311 HydrophobicContact CG1-CD1 3.78Å; V307-L311 HydrophobicContact CG1-CG 4.49Å; V307-L311 WeakPolarHBondContact O-CB 3.22Å; V307-L311 WeakPolarHBondContact O-CG 3.43Å; V307-L311 PolarHBondContact O-N 2.91Å; V308-L311 PolarHBondContact O-N 3.4Å; L311-T318 HydrophobicContact CD2-CG2 3.7Å; L311-T318 PolarHBondContact O-OG1 3.07Å
312	N	39.2	Very low	37.8	Very low	106 Å²	106	94.5 Å²	94.5	57%	0.567	49%	0.485	S	S	*	.	H	α-helix	trans	-78.4	-25.8	175.4	-81.3	-23.7	0	0	0	114.1	V308 R310 R314	V308-N312 VanDerWaalsContact O-CB 3.28Å; V308-N312 WeakPolarHBondContact O-CB 3.42Å; V308-N312 PolarHBondContact O-N 2.77Å; R310-N312 VanDerWaalsContact C-N 3.3Å; R310-N312 PolarHBondContact O-N 3.26Å; N312-R314 VanDerWaalsContact C-N 3.33Å
313	R	43.3	Very low	38	Very low	212 Å²	212	91.3 Å²	91.3	80%	0.8	48%	0.48	S	S	*	.	H	α-helix	trans	-79.1	-18.2	172	-78.8	-177.4	-178.1	-171.4	3.3	112.7	V309 R310	V309-R313 HydrophobicContact CG1-CG 4.33Å; V309-R313 VanDerWaalsContact O-CB 3.27Å; V309-R313 WeakPolarHBondContact O-CB 3.14Å; V309-R313 VanDerWaalsContact O-CG 3.24Å; V309-R313 WeakPolarHBondContact O-CG 3.49Å; V309-R313 PolarHBondContact O-N 3.02Å; R310-R313 PolarHBondContact O-N 3.28Å
314	R	39	Very low	37.7	Very low	141 Å²	141	92.1 Å²	92.1	53%	0.532	48%	0.48	S	S	.	.	S	Bend	trans	-74.6	151.4	167.1	-77.2	-174.2	178.4	152.4	10.3	109.9	E296 R310 N312	E296-R314 IonicContact OE1-CZ 3.65Å; E296-R314 VanDerWaalsContact OE1-CZ 3.31Å; E296-R314 IonicContact OE1-NH1 3.88Å; E296-R314 PolarHBondContact OE1-NH1 2.71Å; E296-R314 IonicContact OE1-NH2 3.01Å; E296-R314 PolarHBondContact OE1-NH2 3.13Å; R310-R314 PolarHBondContact O-N 3.43Å; N312-R314 VanDerWaalsContact C-N 3.33Å
315	T	38.9	Very low	37.4	Very low	107 Å²	107	89.2 Å²	89.2	66%	0.656	46%	0.464	S	S	*	.			trans	-43.2	143.5	-177.8	34.5	0	0	0	0	111.9	S317 T318	T315-S317 PolarHBondContact O-N 3.48Å; T315-S317 PolarHBondContact O-OG 3.17Å; T315-T318 PolarHBondContact O-N 3.42Å; T315-T318 PolarHBondContact O-OG1 3.41Å
316	P	40.3	Very low	37.2	Very low	114 Å²	114	86.4 Å²	86.4	74%	0.74	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	1.3	-160.5	18.6	-31.2	0	0	0	117.5
317	S	37.4	Very low	36.9	Very low	71 Å²	71	86.8 Å²	86.8	50%	0.497	46%	0.462	S	S	.	.	H	α-helix	trans	-67	-33.6	170.4	57.9	0	0	0	0	113.2	T315 L321	T315-S317 PolarHBondContact O-N 3.48Å; T315-S317 PolarHBondContact O-OG 3.17Å; S317-L321 WeakPolarHBondContact O-CD1 3.18Å; S317-L321 WeakPolarHBondContact O-CG 3.37Å; S317-L321 PolarHBondContact O-N 3.36Å
318	T	29.3	Very low	36.7	Very low	21 Å²	21	88.5 Å²	88.5	13%	0.129	47%	0.47	C	S	.	.	H	α-helix	trans	-75.8	-34	-177.2	18.4	0	0	0	0	113.9	L311 T315 L321 V322	L311-T318 HydrophobicContact CD2-CG2 3.7Å; L311-T318 PolarHBondContact O-OG1 3.07Å; T315-T318 PolarHBondContact O-N 3.42Å; T315-T318 PolarHBondContact O-OG1 3.41Å; T318-L321 PolarHBondContact O-N 2.96Å; T318-V322 PolarHBondContact O-N 3.31Å
319	G	32.5	Very low	36.7	Very low	19 Å²	19	92 Å²	92	20%	0.196	48%	0.478	C	S	.	.	H	α-helix	trans	-63	-42	175.5	0	0	0	0	0	112.4	L321 V322	G319-L321 PolarHBondContact O-N 3.46Å; G319-V322 PolarHBondContact O-N 2.93Å
320	M	36.3	Very low	36.6	Very low	139 Å²	139	91.9 Å²	91.9	69%	0.685	48%	0.48	S	S	*	.	H	α-helix	trans	-65.5	-24	175.3	-67.6	-143.7	-57.4	0	0	113.5	H324	M320-H324 WeakPolarHBondContact O-CB 3.12Å; M320-H324 PolarHBondContact O-N 2.93Å
321	L	32.6	Very low	36.5	Very low	53 Å²	53	89.1 Å²	89.1	28%	0.277	48%	0.477	S	S	.	.	H	α-helix	trans	-79.1	-30.8	-177.8	-80.5	156.1	0	0	0	112.7	L289 S317 T318 G319 H324 A325	L289-L321 HydrophobicContact CD1-CB 3.78Å; L289-L321 HydrophobicContact CD1-CD1 3.71Å; L289-L321 HydrophobicContact CD1-CD2 4.42Å; L289-L321 HydrophobicContact CD1-CG 4.14Å; L289-L321 HydrophobicContact CD2-CB 3.68Å; L289-L321 HydrophobicContact CD2-CD2 3.92Å; L289-L321 HydrophobicContact CD2-CG 4.26Å; L289-L321 HydrophobicContact CG-CB 4.34Å; S317-L321 WeakPolarHBondContact O-CD1 3.18Å; S317-L321 WeakPolarHBondContact O-CG 3.37Å; S317-L321 PolarHBondContact O-N 3.36Å; T318-L321 PolarHBondContact O-N 2.96Å; G319-L321 PolarHBondContact O-N 3.46Å; L321-H324 PolarHBondContact O-N 3.22Å; L321-A325 PolarHBondContact O-N 3.37Å
322	V	34.6	Very low	36.5	Very low	72 Å²	72	93.9 Å²	93.9	44%	0.436	50%	0.497	S	S	.	.	H	α-helix	trans	-67.3	-45	171.1	179.4	0	0	0	0	110.3	T318 G319 H324 A325 T326	T318-V322 PolarHBondContact O-N 3.31Å; G319-V322 PolarHBondContact O-N 2.93Å; V322-H324 VanDerWaalsContact C-N 3.26Å; V322-H324 PolarHBondContact O-N 2.95Å; V322-A325 PolarHBondContact O-N 3.05Å; V322-T326 PolarHBondContact O-N 2.9Å; V322-T326 VanDerWaalsContact O-N 3.14Å; V322-T326 PolarHBondContact O-OG1 3.36Å
323	D	38.1	Very low	36.4	Very low	111 Å²	111	95.8 Å²	95.8	59%	0.594	50%	0.496	S	S	*	.	H	α-helix	trans	-58.3	-41	173.7	-71.1	-17.8	0	0	0	110.9	T326 V327	D323-T326 PolarHBondContact O-N 3.13Å; D323-V327 WeakPolarHBondContact O-CG2 3.42Å; D323-V327 PolarHBondContact O-N 2.87Å; D323-V327 VanDerWaalsContact O-N 3.08Å
324	H	34.1	Very low	36.3	Very low	118 Å²	118	90.2 Å²	90.2	55%	0.546	48%	0.482	S	S	.	.	H	α-helix	trans	-66.3	-41.9	177.7	-122	57	0	0	0	114.1	M320 L321 V322 T326 V327 L328	M320-H324 WeakPolarHBondContact O-CB 3.12Å; M320-H324 PolarHBondContact O-N 2.93Å; L321-H324 PolarHBondContact O-N 3.22Å; V322-H324 VanDerWaalsContact C-N 3.26Å; V322-H324 PolarHBondContact O-N 2.95Å; H324-T326 PolarHBondContact O-N 2.98Å; H324-V327 PolarHBondContact O-N 2.77Å; H324-L328 WeakPolarHBondContact O-CG 3.45Å; H324-L328 PolarHBondContact O-N 3.05Å
325	A	32.9	Very low	36.3	Very low	35 Å²	35	89.4 Å²	89.4	29%	0.289	49%	0.485	S	S	.	.	H	α-helix	trans	-62.5	-34.8	176.5	0	0	0	0	0	111.6	L321 V322 L328 F329	L321-A325 PolarHBondContact O-N 3.37Å; V322-A325 PolarHBondContact O-N 3.05Å; A325-L328 PolarHBondContact O-N 3.46Å; A325-F329 PolarHBondContact O-N 2.91Å
326	T	35.7	Very low	36.4	Very low	90 Å²	90	87.3 Å²	87.3	55%	0.552	47%	0.469	S	S	*	.	H	α-helix	trans	-67.5	-41.2	175.8	-37.5	0	0	0	0	111.3	V322 D323 H324 F329 S330	V322-T326 PolarHBondContact O-N 2.9Å; V322-T326 VanDerWaalsContact O-N 3.14Å; V322-T326 PolarHBondContact O-OG1 3.36Å; D323-T326 PolarHBondContact O-N 3.13Å; H324-T326 PolarHBondContact O-N 2.98Å; T326-F329 PolarHBondContact O-N 3.47Å; T326-S330 PolarHBondContact O-N 3.34Å
327	V	35.2	Very low	36.4	Very low	84 Å²	84	86.1 Å²	86.1	51%	0.509	46%	0.455	S	S	.	.	H	α-helix	trans	-64.6	-37.8	173.2	174.1	0	0	0	0	111.8	D323 H324 S330 T331	D323-V327 WeakPolarHBondContact O-CG2 3.42Å; D323-V327 PolarHBondContact O-N 2.87Å; D323-V327 VanDerWaalsContact O-N 3.08Å; H324-V327 PolarHBondContact O-N 2.77Å; V327-S330 WeakPolarHBondContact O-CB 3.27Å; V327-S330 PolarHBondContact O-N 2.83Å; V327-T331 PolarHBondContact O-N 3.31Å; V327-T331 PolarHBondContact O-OG1 2.74Å
328	L	35.2	Very low	36.7	Very low	77 Å²	77	88.3 Å²	88.3	40%	0.403	46%	0.457	S	S	.	.	H	α-helix	trans	-68.7	-39.8	176.6	-74.2	169.2	0	0	0	112.5	I286 H324 A325 S330 T331 F332	I286-L328 HydrophobicContact CD1-CD1 3.86Å; H324-L328 WeakPolarHBondContact O-CG 3.45Å; H324-L328 PolarHBondContact O-N 3.05Å; A325-L328 PolarHBondContact O-N 3.46Å; L328-S330 VanDerWaalsContact C-N 3.33Å; L328-T331 VanDerWaalsContact CA-OG1 3.28Å; L328-T331 WeakPolarHBondContact CA-OG1 3.44Å; L328-T331 PolarHBondContact O-N 3.5Å; L328-T331 PolarHBondContact O-OG1 3.13Å; L328-F332 PolarHBondContact O-N 3.25Å
329	F	36	Very low	37.2	Very low	155 Å²	155	95.4 Å²	95.4	68%	0.68	48%	0.482	S	S	*	.	H	α-helix	trans	-64.9	-37.9	172.7	-107.9	-81.2	0	0	0	112.1	A325 T326 W333	A325-F329 PolarHBondContact O-N 2.91Å; T326-F329 PolarHBondContact O-N 3.47Å; F329-W333 WeakPolarHBondContact O-CB 3.38Å; F329-W333 PolarHBondContact O-N 3.31Å; F329-W333 VanDerWaalsContact O-N 3.09Å
330	S	38.5	Very low	37.6	Very low	60 Å²	60	98.3 Å²	98.3	42%	0.42	49%	0.492	S	S	.	.	H	α-helix	trans	-60.5	-50.5	172.9	-176.2	0	0	0	0	111.2	T326 V327 L328 F332 W333 D334	T326-S330 PolarHBondContact O-N 3.34Å; V327-S330 WeakPolarHBondContact O-CB 3.27Å; V327-S330 PolarHBondContact O-N 2.83Å; L328-S330 VanDerWaalsContact C-N 3.33Å; S330-F332 PolarHBondContact O-N 2.81Å; S330-W333 WeakPolarHBondContact O-CB 3.48Å; S330-W333 PolarHBondContact O-N 2.85Å; S330-W333 VanDerWaalsContact O-N 3.11Å; S330-D334 PolarHBondContact O-N 2.84Å; S330-D334 VanDerWaalsContact O-OD2 3.14Å; S330-D334 PolarHBondContact OG-OD2 2.74Å
331	T	39.4	Very low	38	Very low	64 Å²	64	95.3 Å²	95.3	39%	0.393	48%	0.482	S	S	.	.	H	α-helix	trans	-65.1	-38.8	-177.9	41.7	0	0	0	0	112.9	V327 L328 W333 D334 E335	V327-T331 PolarHBondContact O-N 3.31Å; V327-T331 PolarHBondContact O-OG1 2.74Å; L328-T331 VanDerWaalsContact CA-OG1 3.28Å; L328-T331 WeakPolarHBondContact CA-OG1 3.44Å; L328-T331 PolarHBondContact O-N 3.5Å; L328-T331 PolarHBondContact O-OG1 3.13Å; T331-W333 VanDerWaalsContact C-N 3.31Å; T331-W333 PolarHBondContact O-N 3.32Å; T331-D334 PolarHBondContact O-N 2.77Å; T331-E335 PolarHBondContact O-N 2.8Å
332	F	37.2	Very low	38.6	Very low	122 Å²	122	97.6 Å²	97.6	54%	0.535	49%	0.491	S	S	.	.	H	α-helix	trans	-61.8	-40.3	171.9	178.8	-98.7	0	0	0	112	L328 S330 E335 L336	L328-F332 PolarHBondContact O-N 3.25Å; S330-F332 PolarHBondContact O-N 2.81Å; F332-E335 PolarHBondContact O-N 2.98Å; F332-L336 WeakPolarHBondContact O-CB 3.35Å; F332-L336 PolarHBondContact O-N 3.31Å
333	W	38.8	Very low	38.8	Very low	147 Å²	147	99.5 Å²	99.5	56%	0.557	50%	0.496	S	S	*	.	H	α-helix	trans	-68	-38.8	177.4	-158.1	-114.8	0	0	0	112.1	F329 S330 T331 L336 M337	F329-W333 WeakPolarHBondContact O-CB 3.38Å; F329-W333 PolarHBondContact O-N 3.31Å; F329-W333 VanDerWaalsContact O-N 3.09Å; S330-W333 WeakPolarHBondContact O-CB 3.48Å; S330-W333 PolarHBondContact O-N 2.85Å; S330-W333 VanDerWaalsContact O-N 3.11Å; T331-W333 VanDerWaalsContact C-N 3.31Å; T331-W333 PolarHBondContact O-N 3.32Å; W333-L336 HydrophobicContact CE3-CD2 3.92Å; W333-L336 HydrophobicContact CH2-CD2 4.3Å; W333-L336 HydrophobicContact CZ3-CD2 3.64Å; W333-L336 PolarHBondContact O-N 3.03Å; W333-M337 HydrophobicContact CZ2-CE 4.35Å; W333-M337 WeakPolarHBondContact O-CB 3.32Å; W333-M337 VanDerWaalsContact O-CG 3.31Å; W333-M337 WeakPolarHBondContact O-CG 3.45Å; W333-M337 PolarHBondContact O-N 3.47Å
334	D	40.9	Very low	39.1	Very low	94 Å²	94	103 Å²	103	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-63.9	-44.8	174.5	-65.4	-33.7	0	0	0	111.1	S330 T331 M337 E338	S330-D334 PolarHBondContact O-N 2.84Å; S330-D334 VanDerWaalsContact O-OD2 3.14Å; S330-D334 PolarHBondContact OG-OD2 2.74Å; T331-D334 PolarHBondContact O-N 2.77Å; D334-M337 PolarHBondContact O-N 3.3Å; D334-E338 WeakPolarHBondContact O-CB 3.43Å; D334-E338 PolarHBondContact O-N 3.39Å
335	E	39.1	Very low	39.6	Very low	124 Å²	124	102.5 Å²	102.5	58%	0.579	50%	0.502	S	S	*	.	H	α-helix	trans	-63.5	-40.4	175.4	-81.1	-173.9	166.4	0	0	112.5	T331 F332 E338 R339	T331-E335 PolarHBondContact O-N 2.8Å; F332-E335 PolarHBondContact O-N 2.98Å; E335-E338 PolarHBondContact O-N 2.84Å; E335-R339 PolarHBondContact O-N 3.25Å
336	L	39.4	Very low	40.1	Very low	64 Å²	64	104.8 Å²	104.8	34%	0.335	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-43.4	175.9	-176.2	68	0	0	0	111.1	F332 W333 R339 I340	F332-L336 WeakPolarHBondContact O-CB 3.35Å; F332-L336 PolarHBondContact O-N 3.31Å; W333-L336 HydrophobicContact CE3-CD2 3.92Å; W333-L336 HydrophobicContact CH2-CD2 4.3Å; W333-L336 HydrophobicContact CZ3-CD2 3.64Å; W333-L336 PolarHBondContact O-N 3.03Å; L336-R339 PolarHBondContact O-N 3Å; L336-I340 HydrophobicContact CG-CD1 4.34Å; L336-I340 WeakPolarHBondContact O-CG1 3.34Å; L336-I340 PolarHBondContact O-N 3.49Å
337	M	41.8	Very low	40.5	Very low	89 Å²	89	102.1 Å²	102.1	44%	0.438	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-36.9	176.3	-74.8	-63.5	-161.6	0	0	112.2	W333 D334 I340 T341	W333-M337 HydrophobicContact CZ2-CE 4.35Å; W333-M337 WeakPolarHBondContact O-CB 3.32Å; W333-M337 VanDerWaalsContact O-CG 3.31Å; W333-M337 WeakPolarHBondContact O-CG 3.45Å; W333-M337 PolarHBondContact O-N 3.47Å; D334-M337 PolarHBondContact O-N 3.3Å; M337-I340 PolarHBondContact O-N 3.08Å; M337-I340 HydrophobicContact SD-CD1 4.44Å; M337-T341 WeakPolarHBondContact O-CB 3.33Å; M337-T341 PolarHBondContact O-N 2.9Å; M337-T341 PolarHBondContact O-OG1 2.85Å
338	E	43.7	Very low	41.1	Very low	116 Å²	116	102 Å²	102	54%	0.542	50%	0.496	S	S	.	.	H	α-helix	trans	-62.7	-44.8	173.1	-168.3	176.3	177.1	0	0	110.8	D334 E335 T341 Q342	D334-E338 WeakPolarHBondContact O-CB 3.43Å; D334-E338 PolarHBondContact O-N 3.39Å; E335-E338 PolarHBondContact O-N 2.84Å; E338-T341 CarbonylContact O-C 3.59Å; E338-T341 WeakPolarHBondContact O-CB 3.42Å; E338-T341 PolarHBondContact O-N 2.74Å; E338-T341 VanDerWaalsContact O-N 3.15Å; E338-Q342 WeakPolarHBondContact O-CG 3.17Å; E338-Q342 PolarHBondContact O-N 3.43Å
339	R	40.2	Very low	41.7	Very low	171 Å²	171	102 Å²	102	65%	0.645	49%	0.493	S	S	*	.	H	α-helix	trans	-61.6	-43.7	174.7	-95	176.7	165.2	168.2	-4.9	113.2	E335 L336 T341 Q342 M343	E335-R339 PolarHBondContact O-N 3.25Å; L336-R339 PolarHBondContact O-N 3Å; R339-T341 VanDerWaalsContact C-N 3.25Å; R339-T341 PolarHBondContact O-N 2.66Å; R339-Q342 PolarHBondContact O-N 2.94Å; R339-M343 WeakPolarHBondContact O-CG 3.29Å; R339-M343 PolarHBondContact O-N 3.14Å
340	I	41	Very low	42	Very low	79 Å²	79	95.6 Å²	95.6	41%	0.405	47%	0.467	S	S	.	.	H	α-helix	trans	-60.8	-39.7	174.6	-69.6	168.7	0	0	0	110.4	L336 M337 M343 R344	L336-I340 HydrophobicContact CG-CD1 4.34Å; L336-I340 WeakPolarHBondContact O-CG1 3.34Å; L336-I340 PolarHBondContact O-N 3.49Å; M337-I340 PolarHBondContact O-N 3.08Å; M337-I340 HydrophobicContact SD-CD1 4.44Å; I340-M343 HydrophobicContact CG1-CE 4.24Å; I340-M343 PolarHBondContact O-N 2.9Å; I340-R344 PolarHBondContact O-N 2.75Å
341	T	44.4	Very low	42.6	Very low	77 Å²	77	99.2 Å²	99.2	47%	0.472	47%	0.471	S	S	.	.	H	α-helix	trans	-66.9	-43	177.4	-55.3	0	0	0	0	111.6	M337 E338 R339 R344 I345	M337-T341 WeakPolarHBondContact O-CB 3.33Å; M337-T341 PolarHBondContact O-N 2.9Å; M337-T341 PolarHBondContact O-OG1 2.85Å; E338-T341 CarbonylContact O-C 3.59Å; E338-T341 WeakPolarHBondContact O-CB 3.42Å; E338-T341 PolarHBondContact O-N 2.74Å; E338-T341 VanDerWaalsContact O-N 3.15Å; R339-T341 VanDerWaalsContact C-N 3.25Å; R339-T341 PolarHBondContact O-N 2.66Å; T341-R344 WeakPolarHBondContact O-CB 3.44Å; T341-R344 PolarHBondContact O-N 3.44Å; T341-R344 VanDerWaalsContact O-N 3.16Å; T341-I345 HydrophobicContact CG2-CD1 4.33Å; T341-I345 WeakPolarHBondContact O-CG1 3.38Å; T341-I345 PolarHBondContact O-N 3.41Å
342	Q	43.6	Very low	43.2	Very low	100 Å²	100	102 Å²	102	47%	0.467	48%	0.475	S	S	.	.	H	α-helix	trans	-60.1	-46.1	174.3	-71.9	175.3	4.5	0	0	111.5	E338 R339 R344 I345 V346	E338-Q342 WeakPolarHBondContact O-CG 3.17Å; E338-Q342 PolarHBondContact O-N 3.43Å; R339-Q342 PolarHBondContact O-N 2.94Å; Q342-R344 VanDerWaalsContact C-N 3.26Å; Q342-R344 PolarHBondContact O-N 2.88Å; Q342-I345 PolarHBondContact O-N 3.34Å; Q342-V346 WeakPolarHBondContact O-CG2 3.47Å; Q342-V346 PolarHBondContact O-N 3.12Å
343	M	39.9	Very low	43.6	Very low	113 Å²	113	98.2 Å²	98.2	56%	0.557	46%	0.46	S	S	*	.	H	α-helix	trans	-59.8	-36.5	174.6	-74.1	-166.6	-65.1	0	0	112.4	R339 I340 V346 A347	R339-M343 WeakPolarHBondContact O-CG 3.29Å; R339-M343 PolarHBondContact O-N 3.14Å; I340-M343 HydrophobicContact CG1-CE 4.24Å; I340-M343 PolarHBondContact O-N 2.9Å; M343-V346 PolarHBondContact O-N 2.97Å; M343-A347 WeakPolarHBondContact O-CB 3.5Å; M343-A347 PolarHBondContact O-N 3.31Å
344	R	43.5	Very low	44.1	Very low	183 Å²	183	92.9 Å²	92.9	69%	0.691	45%	0.446	S	S	*	.	H	α-helix	trans	-67.3	-41.9	176.6	-151.6	177.2	-167.4	-179.8	3.9	112.1	I340 T341 Q342 V346 A347 D348	I340-R344 PolarHBondContact O-N 2.75Å; T341-R344 WeakPolarHBondContact O-CB 3.44Å; T341-R344 PolarHBondContact O-N 3.44Å; T341-R344 VanDerWaalsContact O-N 3.16Å; Q342-R344 VanDerWaalsContact C-N 3.26Å; Q342-R344 PolarHBondContact O-N 2.88Å; R344-V346 VanDerWaalsContact C-N 3.33Å; R344-V346 PolarHBondContact O-N 3Å; R344-A347 PolarHBondContact O-N 2.93Å; R344-D348 PolarHBondContact O-N 3.28Å
345	I	44.9	Very low	45	Very low	109 Å²	109	92 Å²	92	56%	0.559	44%	0.442	S	S	*	.	H	α-helix	trans	-60.5	-44	173.4	-66.5	165.5	0	0	0	110.4	T341 Q342 D348 E349	T341-I345 HydrophobicContact CG2-CD1 4.33Å; T341-I345 WeakPolarHBondContact O-CG1 3.38Å; T341-I345 PolarHBondContact O-N 3.41Å; Q342-I345 PolarHBondContact O-N 3.34Å; I345-D348 PolarHBondContact O-N 3.1Å; I345-E349 WeakPolarHBondContact O-CB 3.21Å; I345-E349 PolarHBondContact O-N 3.18Å
346	V	43.2	Very low	45.6	Very low	82 Å²	82	87.7 Å²	87.7	50%	0.497	42%	0.423	S	S	.	.	H	α-helix	trans	-61.6	-44.6	175.8	174.2	0	0	0	0	110.8	Q342 M343 R344 D348 E349 V350	Q342-V346 WeakPolarHBondContact O-CG2 3.47Å; Q342-V346 PolarHBondContact O-N 3.12Å; M343-V346 PolarHBondContact O-N 2.97Å; R344-V346 VanDerWaalsContact C-N 3.33Å; R344-V346 PolarHBondContact O-N 3Å; V346-D348 PolarHBondContact O-N 2.76Å; V346-E349 PolarHBondContact O-N 3.34Å; V346-V350 HydrophobicContact CG1-CG2 4.5Å; V346-V350 WeakPolarHBondContact O-CG2 3.42Å; V346-V350 PolarHBondContact O-N 2.97Å
347	A	44.7	Very low	46.1	Very low	35 Å²	35	87 Å²	87	29%	0.289	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-41.3	178	0	0	0	0	0	112.9	M343 R344 V350 R351	M343-A347 WeakPolarHBondContact O-CB 3.5Å; M343-A347 PolarHBondContact O-N 3.31Å; R344-A347 PolarHBondContact O-N 2.93Å; A347-V350 PolarHBondContact O-N 3.37Å; A347-R351 PolarHBondContact O-N 2.95Å
348	D	48.8	Very low	47	Very low	82 Å²	82	88.9 Å²	88.9	44%	0.439	42%	0.422	S	S	.	.	H	α-helix	trans	-68.1	-37.7	176.4	-74.5	-25.4	0	0	0	111.7	R344 I345 V346 R351 R352	R344-D348 PolarHBondContact O-N 3.28Å; I345-D348 PolarHBondContact O-N 3.1Å; V346-D348 PolarHBondContact O-N 2.76Å; D348-R351 PolarHBondContact O-N 3.49Å; D348-R351 IonicContact OD1-NH1 3.09Å; D348-R351 PolarHBondContact OD1-NH1 2.8Å; D348-R352 WeakPolarHBondContact O-CB 3.44Å; D348-R352 PolarHBondContact O-N 3.1Å
349	E	46.9	Very low	47.5	Very low	77 Å²	77	89.9 Å²	89.9	36%	0.36	42%	0.42	S	S	.	.	H	α-helix	trans	-66.5	-38.3	174.5	-174.2	58.4	-161.8	0	0	111.7	I345 V346 R352 L353	I345-E349 WeakPolarHBondContact O-CB 3.21Å; I345-E349 PolarHBondContact O-N 3.18Å; V346-E349 PolarHBondContact O-N 3.34Å; E349-R352 WeakPolarHBondContact O-CB 3.45Å; E349-R352 PolarHBondContact O-N 3.32Å; E349-R352 IonicContact OE1-CZ 3.54Å; E349-R352 IonicContact OE1-NE 2.69Å; E349-R352 PolarHBondContact OE1-NE 2.72Å; E349-R352 IonicContact OE1-NH2 3.18Å; E349-R352 PolarHBondContact OE1-NH2 3.4Å; E349-R352 IonicContact OE2-CZ 3.64Å; E349-R352 IonicContact OE2-NE 3.95Å; E349-R352 PolarHBondContact OE2-NE 3.29Å; E349-R352 IonicContact OE2-NH2 3.08Å; E349-L353 HydrophobicContact CG-CD1 4.43Å; E349-L353 WeakPolarHBondContact O-CB 3.42Å; E349-L353 VanDerWaalsContact O-CG 3.25Å; E349-L353 WeakPolarHBondContact O-CG 3.45Å; E349-L353 PolarHBondContact O-N 2.87Å
350	V	43.3	Very low	48.1	Very low	19 Å²	19	85.5 Å²	85.5	12%	0.115	41%	0.41	C	S	.	.	H	α-helix	trans	-64.6	-42.2	172.5	176.6	0	0	0	0	111.2	V346 A347 R352 L353 A354 F406 I410	V346-V350 HydrophobicContact CG1-CG2 4.5Å; V346-V350 WeakPolarHBondContact O-CG2 3.42Å; V346-V350 PolarHBondContact O-N 2.97Å; A347-V350 PolarHBondContact O-N 3.37Å; V350-R352 VanDerWaalsContact C-N 3.32Å; V350-R352 PolarHBondContact O-N 3.49Å; V350-L353 WeakPolarHBondContact O-CB 3.3Å; V350-L353 PolarHBondContact O-N 2.8Å; V350-L353 VanDerWaalsContact O-N 3.17Å; V350-A354 PolarHBondContact O-N 3.46Å; V350-F406 HydrophobicContact CG1-CB 4.34Å; V350-F406 HydrophobicContact CG1-CD1 3.66Å; V350-F406 HydrophobicContact CG1-CE1 4.04Å; V350-F406 HydrophobicContact CG1-CG 3.98Å; V350-F406 HydrophobicContact CG2-CD1 4.05Å; V350-F406 HydrophobicContact CG2-CE1 3.66Å; V350-F406 HydrophobicContact CG2-CZ 4.37Å; V350-I410 HydrophobicContact CB-CD1 3.95Å; V350-I410 HydrophobicContact CG1-CD1 3.37Å; V350-I410 HydrophobicContact CG2-CD1 4.41Å
351	R	50.1	Low	48.8	Very low	137 Å²	137	85.9 Å²	85.9	52%	0.517	41%	0.408	S	S	.	.	H	α-helix	trans	-60.8	-43.5	175.8	-165.4	-175.6	-74.8	130.3	-5.9	111	A347 D348 L353 A354 D355	A347-R351 PolarHBondContact O-N 2.95Å; D348-R351 PolarHBondContact O-N 3.49Å; D348-R351 IonicContact OD1-NH1 3.09Å; D348-R351 PolarHBondContact OD1-NH1 2.8Å; R351-L353 VanDerWaalsContact C-N 3.34Å; R351-L353 PolarHBondContact O-N 3.47Å; R351-A354 WeakPolarHBondContact O-CB 3.5Å; R351-A354 PolarHBondContact O-N 2.93Å; R351-D355 PolarHBondContact O-N 3.19Å
352	R	51.5	Low	49.6	Very low	123 Å²	123	89 Å²	89	46%	0.464	42%	0.417	S	S	.	.	H	α-helix	trans	-61.4	-40.3	174.3	-166.5	-171.2	77.1	86.2	2.7	112.2	D348 E349 V350 D355 N356	D348-R352 WeakPolarHBondContact O-CB 3.44Å; D348-R352 PolarHBondContact O-N 3.1Å; E349-R352 WeakPolarHBondContact O-CB 3.45Å; E349-R352 PolarHBondContact O-N 3.32Å; E349-R352 IonicContact OE1-CZ 3.54Å; E349-R352 IonicContact OE1-NE 2.69Å; E349-R352 PolarHBondContact OE1-NE 2.72Å; E349-R352 IonicContact OE1-NH2 3.18Å; E349-R352 PolarHBondContact OE1-NH2 3.4Å; E349-R352 IonicContact OE2-CZ 3.64Å; E349-R352 IonicContact OE2-NE 3.95Å; E349-R352 PolarHBondContact OE2-NE 3.29Å; E349-R352 IonicContact OE2-NH2 3.08Å; V350-R352 VanDerWaalsContact C-N 3.32Å; V350-R352 PolarHBondContact O-N 3.49Å; R352-D355 PolarHBondContact O-N 3.37Å; R352-N356 PolarHBondContact NH1-ND2 3.03Å; R352-N356 WeakPolarHBondContact O-CB 3.13Å; R352-N356 VanDerWaalsContact O-CG 3.28Å; R352-N356 PolarHBondContact O-N 2.77Å; R352-N356 PolarHBondContact O-ND2 3.29Å
353	L	46.3	Very low	50.1	Low	42 Å²	42	89.9 Å²	89.9	22%	0.22	42%	0.422	C	S	.	.	H	α-helix	trans	-66.1	-37.7	175.4	-74.1	169.9	0	0	0	112	E349 V350 R351 N356 W357	E349-L353 HydrophobicContact CG-CD1 4.43Å; E349-L353 WeakPolarHBondContact O-CB 3.42Å; E349-L353 VanDerWaalsContact O-CG 3.25Å; E349-L353 WeakPolarHBondContact O-CG 3.45Å; E349-L353 PolarHBondContact O-N 2.87Å; V350-L353 WeakPolarHBondContact O-CB 3.3Å; V350-L353 PolarHBondContact O-N 2.8Å; V350-L353 VanDerWaalsContact O-N 3.17Å; R351-L353 VanDerWaalsContact C-N 3.34Å; R351-L353 PolarHBondContact O-N 3.47Å; L353-N356 PolarHBondContact O-N 2.96Å; L353-W357 WeakPolarHBondContact O-CB 3.31Å; L353-W357 PolarHBondContact O-N 3.32Å
354	A	48	Very low	50.6	Low	34 Å²	34	86.1 Å²	86.1	28%	0.281	41%	0.406	S	S	.	.	H	α-helix	trans	-65.4	-40.5	174.4	0	0	0	0	0	112	V350 R351 W357 K358	V350-A354 PolarHBondContact O-N 3.46Å; R351-A354 WeakPolarHBondContact O-CB 3.5Å; R351-A354 PolarHBondContact O-N 2.93Å; A354-W357 PolarHBondContact O-N 3.04Å; A354-K358 PolarHBondContact O-N 2.85Å
355	D	60.1	Low	51.3	Low	77 Å²	77	79.5 Å²	79.5	41%	0.412	39%	0.39	S	S	.	.	H	α-helix	trans	-70.1	-38.5	175.9	-73.2	-25.3	0	0	0	112.8	R351 R352 W357 K358 R359	R351-D355 PolarHBondContact O-N 3.19Å; R352-D355 PolarHBondContact O-N 3.37Å; D355-W357 VanDerWaalsContact C-N 3.31Å; D355-K358 PolarHBondContact O-N 3.2Å; D355-R359 PolarHBondContact O-N 2.83Å
356	N	51.7	Low	51.9	Low	33 Å²	33	76.8 Å²	76.8	18%	0.176	38%	0.384	C	S	.	.	H	α-helix	trans	-61.3	-42.4	170.5	-74.4	-25.6	0	0	0	110.3	R352 L353 K358 R359 D360	R352-N356 PolarHBondContact NH1-ND2 3.03Å; R352-N356 WeakPolarHBondContact O-CB 3.13Å; R352-N356 VanDerWaalsContact O-CG 3.28Å; R352-N356 PolarHBondContact O-N 2.77Å; R352-N356 PolarHBondContact O-ND2 3.29Å; L353-N356 PolarHBondContact O-N 2.96Å; N356-K358 PolarHBondContact O-N 3.44Å; N356-R359 CarbonylContact O-C 3.59Å; N356-R359 WeakPolarHBondContact O-CB 3.39Å; N356-R359 PolarHBondContact O-N 3.11Å; N356-R359 VanDerWaalsContact O-N 3.12Å; N356-R359 PolarHBondContact OD1-NH2 3.02Å; N356-D360 VanDerWaalsContact O-CG 3.31Å; N356-D360 PolarHBondContact O-N 3.26Å
357	W	51.2	Low	52.3	Low	49 Å²	49	76 Å²	76	19%	0.186	38%	0.377	C	S	.	.	H	α-helix	trans	-62.9	-40.3	176.2	176.6	84.5	0	0	0	113.1	L353 A354 D355 R359 D360 K361 I403	L353-W357 WeakPolarHBondContact O-CB 3.31Å; L353-W357 PolarHBondContact O-N 3.32Å; A354-W357 PolarHBondContact O-N 3.04Å; D355-W357 VanDerWaalsContact C-N 3.31Å; W357-R359 PolarHBondContact O-N 3.31Å; W357-D360 PolarHBondContact O-N 2.74Å; W357-K361 HydrophobicContact CD2-CB 4.48Å; W357-K361 HydrophobicContact CE3-CD 4.48Å; W357-K361 HydrophobicContact CH2-CD 3.74Å; W357-K361 HydrophobicContact CZ2-CD 3.91Å; W357-K361 HydrophobicContact CZ3-CD 4.01Å; W357-K361 WeakPolarHBondContact O-CB 3.46Å; W357-K361 PolarHBondContact O-N 2.86Å; W357-I403 HydrophobicContact CB-CD1 3.95Å; W357-I403 HydrophobicContact CD2-CD1 3Å; W357-I403 HydrophobicContact CD2-CG1 4.44Å; W357-I403 VanDerWaalsContact CE2-CD1 3.41Å; W357-I403 HydrophobicContact CE3-CD1 3.06Å; W357-I403 HydrophobicContact CG-CD1 3.41Å; W357-I403 VanDerWaalsContact CG-CD1 3.41Å; W357-I403 HydrophobicContact CH2-CD1 3.75Å; W357-I403 HydrophobicContact CZ2-CD1 3.78Å; W357-I403 HydrophobicContact CZ3-CD1 3.44Å; W357-I403 VanDerWaalsContact CZ3-CD1 3.44Å
358	K	60.2	Low	52.7	Low	129 Å²	129	75 Å²	75	56%	0.561	37%	0.366	S	S	*	.	H	α-helix	trans	-56.4	-39.1	174.1	-79.7	179.6	-178.8	169.1	0	111.4	A354 D355 N356 Q362	A354-K358 PolarHBondContact O-N 2.85Å; D355-K358 PolarHBondContact O-N 3.2Å; N356-K358 PolarHBondContact O-N 3.44Å; K358-Q362 WeakPolarHBondContact O-CG 3.49Å; K358-Q362 PolarHBondContact O-N 3.25Å
359	R	55	Low	53.3	Low	137 Å²	137	73.7 Å²	73.7	52%	0.517	37%	0.366	S	S	.	.	H	α-helix	trans	-70.6	-46.9	174.4	-79.5	-176	-84.1	141.2	-4.5	112.4	D355 N356 W357 K361 Q362 Q363	D355-R359 PolarHBondContact O-N 2.83Å; N356-R359 CarbonylContact O-C 3.59Å; N356-R359 WeakPolarHBondContact O-CB 3.39Å; N356-R359 PolarHBondContact O-N 3.11Å; N356-R359 VanDerWaalsContact O-N 3.12Å; N356-R359 PolarHBondContact OD1-NH2 3.02Å; W357-R359 PolarHBondContact O-N 3.31Å; R359-K361 VanDerWaalsContact C-N 3.26Å; R359-K361 PolarHBondContact O-N 3.31Å; R359-Q362 WeakPolarHBondContact O-CB 3.42Å; R359-Q362 PolarHBondContact O-N 2.95Å; R359-Q362 VanDerWaalsContact O-N 3.1Å; R359-Q363 WeakPolarHBondContact O-CG 3.39Å; R359-Q363 PolarHBondContact O-N 3.44Å
360	D	52.2	Low	53.8	Low	79 Å²	79	76.1 Å²	76.1	42%	0.422	38%	0.378	S	S	.	.	H	α-helix	trans	-62.2	-36	178.7	-67.4	-11.6	0	0	0	111.1	N356 W357 Q363 C364	N356-D360 VanDerWaalsContact O-CG 3.31Å; N356-D360 PolarHBondContact O-N 3.26Å; W357-D360 PolarHBondContact O-N 2.74Å; D360-Q363 PolarHBondContact O-N 3.2Å; D360-C364 WeakPolarHBondContact O-CB 3.43Å; D360-C364 PolarHBondContact O-N 3.46Å; D360-C364 PolarHBondContact O-SG 3.45Å
361	K	54.9	Low	54.2	Low	86 Å²	86	75.5 Å²	75.5	37%	0.374	38%	0.375	S	S	.	.	H	α-helix	trans	-62.5	-42.6	173.4	-177.7	-177.5	-179.2	-179.8	0	111.8	W357 R359 A365	W357-K361 HydrophobicContact CD2-CB 4.48Å; W357-K361 HydrophobicContact CE3-CD 4.48Å; W357-K361 HydrophobicContact CH2-CD 3.74Å; W357-K361 HydrophobicContact CZ2-CD 3.91Å; W357-K361 HydrophobicContact CZ3-CD 4.01Å; W357-K361 WeakPolarHBondContact O-CB 3.46Å; W357-K361 PolarHBondContact O-N 2.86Å; R359-K361 VanDerWaalsContact C-N 3.26Å; R359-K361 PolarHBondContact O-N 3.31Å; K361-A365 VanDerWaalsContact O-CB 3.31Å; K361-A365 WeakPolarHBondContact O-CB 3.3Å; K361-A365 PolarHBondContact O-N 2.93Å
362	Q	62	Low	54.8	Low	142 Å²	142	72.1 Å²	72.1	66%	0.664	37%	0.366	S	S	*	.	H	α-helix	trans	-66	-41.2	175.1	-73.3	174.5	-12.5	0	0	111.2	K358 R359 A365 A366	K358-Q362 WeakPolarHBondContact O-CG 3.49Å; K358-Q362 PolarHBondContact O-N 3.25Å; R359-Q362 WeakPolarHBondContact O-CB 3.42Å; R359-Q362 PolarHBondContact O-N 2.95Å; R359-Q362 VanDerWaalsContact O-N 3.1Å; Q362-A365 PolarHBondContact O-N 3.44Å; Q362-A366 PolarHBondContact O-N 3.22Å
363	Q	54.8	Low	55.4	Low	120 Å²	120	71.5 Å²	71.5	56%	0.561	37%	0.369	S	S	*	.	H	α-helix	trans	-65.9	-44.6	176.3	-70.7	-179.3	-7.6	0	0	112.3	R359 D360 A365 A366 I367	R359-Q363 WeakPolarHBondContact O-CG 3.39Å; R359-Q363 PolarHBondContact O-N 3.44Å; D360-Q363 PolarHBondContact O-N 3.2Å; Q363-A365 VanDerWaalsContact C-N 3.33Å; Q363-A365 PolarHBondContact O-N 2.99Å; Q363-A366 WeakPolarHBondContact O-CB 3.41Å; Q363-A366 PolarHBondContact O-N 3.45Å; Q363-I367 VanDerWaalsContact O-CG1 3.31Å; Q363-I367 WeakPolarHBondContact O-CG1 3.47Å; Q363-I367 PolarHBondContact O-N 3.12Å
364	C	49	Very low	55.6	Low	34 Å²	34	72.7 Å²	72.7	23%	0.23	38%	0.375	C	S	.	.	H	α-helix	trans	-63.3	-39.8	175.7	-67.4	0	0	0	0	111.2	D360 A366 I367 M368	D360-C364 WeakPolarHBondContact O-CB 3.43Å; D360-C364 PolarHBondContact O-N 3.46Å; D360-C364 PolarHBondContact O-SG 3.45Å; C364-A366 VanDerWaalsContact C-N 3.32Å; C364-A366 PolarHBondContact O-N 3.26Å; C364-I367 PolarHBondContact O-N 2.94Å; C364-M368 WeakPolarHBondContact O-CB 3.38Å; C364-M368 VanDerWaalsContact O-CG 3.29Å; C364-M368 WeakPolarHBondContact O-CG 3.34Å; C364-M368 PolarHBondContact O-N 2.92Å
365	A	59.2	Low	56.1	Low	43 Å²	43	72.7 Å²	72.7	36%	0.355	38%	0.375	S	S	.	.	H	α-helix	trans	-62.1	-39.9	174.6	0	0	0	0	0	112	K361 Q362 Q363 A369	K361-A365 VanDerWaalsContact O-CB 3.31Å; K361-A365 WeakPolarHBondContact O-CB 3.3Å; K361-A365 PolarHBondContact O-N 2.93Å; Q362-A365 PolarHBondContact O-N 3.44Å; Q363-A365 VanDerWaalsContact C-N 3.33Å; Q363-A365 PolarHBondContact O-N 2.99Å; A365-A369 WeakPolarHBondContact O-CB 3.38Å; A365-A369 PolarHBondContact O-N 3.06Å
366	A	57.4	Low	56.2	Low	52 Å²	52	76.3 Å²	76.3	43%	0.43	39%	0.387	S	S	.	.	H	α-helix	trans	-65.1	-46.3	174.5	0	0	0	0	0	112	Q362 Q363 C364 M368 A369 E370	Q362-A366 PolarHBondContact O-N 3.22Å; Q363-A366 WeakPolarHBondContact O-CB 3.41Å; Q363-A366 PolarHBondContact O-N 3.45Å; C364-A366 VanDerWaalsContact C-N 3.32Å; C364-A366 PolarHBondContact O-N 3.26Å; A366-M368 VanDerWaalsContact C-N 3.34Å; A366-M368 PolarHBondContact O-N 3.27Å; A366-A369 WeakPolarHBondContact O-CB 3.37Å; A366-A369 PolarHBondContact O-N 3.35Å; A366-E370 PolarHBondContact O-N 3.42Å
367	I	50.1	Low	56.4	Low	66 Å²	66	78.1 Å²	78.1	34%	0.338	40%	0.4	S	S	.	.	H	α-helix	trans	-63	-40.8	177.7	-65.6	165.3	0	0	0	111	Q363 C364 E370 C371 L388 L392	Q363-I367 VanDerWaalsContact O-CG1 3.31Å; Q363-I367 WeakPolarHBondContact O-CG1 3.47Å; Q363-I367 PolarHBondContact O-N 3.12Å; C364-I367 PolarHBondContact O-N 2.94Å; I367-E370 PolarHBondContact O-N 3.03Å; I367-C371 WeakPolarHBondContact O-CB 3.48Å; I367-C371 PolarHBondContact O-N 3.3Å; I367-C371 PolarHBondContact O-SG 3.42Å; I367-L388 HydrophobicContact CG2-CD2 4.41Å; I367-L392 HydrophobicContact CB-CD1 4.37Å; I367-L392 HydrophobicContact CG2-CD1 3.68Å
368	M	53.3	Low	56.6	Low	15 Å²	15	86.3 Å²	86.3	7%	0.074	44%	0.436	C	S	.	.	H	α-helix	trans	-65.3	-39.3	175.8	-73.4	-164.7	-52.4	0	0	111.9	C364 A366 C371 D372 L392 R396	C364-M368 WeakPolarHBondContact O-CB 3.38Å; C364-M368 VanDerWaalsContact O-CG 3.29Å; C364-M368 WeakPolarHBondContact O-CG 3.34Å; C364-M368 PolarHBondContact O-N 2.92Å; A366-M368 VanDerWaalsContact C-N 3.34Å; A366-M368 PolarHBondContact O-N 3.27Å; M368-C371 WeakPolarHBondContact O-CB 3.38Å; M368-C371 PolarHBondContact O-N 3.07Å; M368-D372 PolarHBondContact O-N 3.09Å; M368-L392 HydrophobicContact CG-CB 4.46Å; M368-L392 HydrophobicContact CG-CD1 4.29Å; M368-R396 VanDerWaalsContact CE-NH1 3.35Å
369	A	62.7	Low	55.9	Low	53 Å²	53	83.4 Å²	83.4	44%	0.438	43%	0.425	S	S	.	.	H	α-helix	trans	-63.6	-41.2	174.4	0	0	0	0	0	111.8	A365 A366 D372 E373	A365-A369 WeakPolarHBondContact O-CB 3.38Å; A365-A369 PolarHBondContact O-N 3.06Å; A366-A369 WeakPolarHBondContact O-CB 3.37Å; A366-A369 PolarHBondContact O-N 3.35Å; A369-D372 PolarHBondContact O-N 2.92Å; A369-E373 PolarHBondContact O-N 3Å
370	E	57.3	Low	55.8	Low	128 Å²	128	82.9 Å²	82.9	60%	0.598	44%	0.439	S	S	*	.	H	α-helix	trans	-63.7	-39.6	172.6	-74	179.6	-179.8	0	0	112.1	A366 I367 D372 E373 L374	A366-E370 PolarHBondContact O-N 3.42Å; I367-E370 PolarHBondContact O-N 3.03Å; E370-D372 VanDerWaalsContact C-N 3.34Å; E370-E373 PolarHBondContact O-N 3.47Å; E370-L374 WeakPolarHBondContact O-CB 3.39Å; E370-L374 VanDerWaalsContact O-CG 3.3Å; E370-L374 WeakPolarHBondContact O-CG 3.31Å; E370-L374 PolarHBondContact O-N 2.89Å
371	C	51	Low	55.9	Low	7 Å²	7	87.5 Å²	87.5	5%	0.047	45%	0.451	C	S	.	.	H	α-helix	trans	-63.9	-38.9	174.3	-68.8	0	0	0	0	111.8	I367 M368 L374 A375	I367-C371 WeakPolarHBondContact O-CB 3.48Å; I367-C371 PolarHBondContact O-N 3.3Å; I367-C371 PolarHBondContact O-SG 3.42Å; M368-C371 WeakPolarHBondContact O-CB 3.38Å; M368-C371 PolarHBondContact O-N 3.07Å; C371-L374 PolarHBondContact O-N 3.49Å; C371-A375 WeakPolarHBondContact O-CB 2.83Å; C371-A375 PolarHBondContact O-N 3.1Å
372	D	63.9	Low	56	Low	65 Å²	65	88 Å²	88	35%	0.348	45%	0.453	S	S	.	.	H	α-helix	trans	-67.1	-40.7	177.1	-75.3	-19.8	0	0	0	111.6	M368 A369 E370 A375 K376 K389	M368-D372 PolarHBondContact O-N 3.09Å; A369-D372 PolarHBondContact O-N 2.92Å; E370-D372 VanDerWaalsContact C-N 3.34Å; D372-A375 PolarHBondContact O-N 3.17Å; D372-K376 WeakPolarHBondContact O-CG 3.2Å; D372-K376 PolarHBondContact O-N 2.76Å; D372-K389 IonicContact OD1-NZ 3.37Å; D372-K389 PolarHBondContact OD1-NZ 2.79Å; D372-K389 IonicContact OD2-NZ 3.78Å
373	E	62.6	Low	55.8	Low	111 Å²	111	89.5 Å²	89.5	52%	0.519	46%	0.457	S	S	.	.	H	α-helix	trans	-64.3	-43.4	172.5	-73.3	-56.4	138.1	0	0	111.8	A369 E370 A375 K376	A369-E373 PolarHBondContact O-N 3Å; E370-E373 PolarHBondContact O-N 3.47Å; E373-A375 VanDerWaalsContact C-N 3.34Å; E373-A375 PolarHBondContact O-N 3.34Å; E373-K376 WeakPolarHBondContact O-CB 3.46Å; E373-K376 PolarHBondContact O-N 3.27Å; E373-K376 IonicContact OE1-NZ 3.27Å; E373-K376 PolarHBondContact OE1-NZ 3.06Å; E373-K376 IonicContact OE2-NZ 3.97Å
374	L	50.9	Low	55.8	Low	67 Å²	67	86.8 Å²	86.8	35%	0.351	46%	0.455	S	S	.	.	H	α-helix	trans	-66.4	-35.3	176.1	-74	167.4	0	0	0	112.4	E370 C371 K376 T377 L385	E370-L374 WeakPolarHBondContact O-CB 3.39Å; E370-L374 VanDerWaalsContact O-CG 3.3Å; E370-L374 WeakPolarHBondContact O-CG 3.31Å; E370-L374 PolarHBondContact O-N 2.89Å; C371-L374 PolarHBondContact O-N 3.49Å; L374-K376 VanDerWaalsContact C-N 3.27Å; L374-K376 PolarHBondContact O-N 2.81Å; L374-T377 PolarHBondContact O-N 3.32Å; L374-T377 PolarHBondContact O-OG1 3.48Å; L374-L385 HydrophobicContact CB-CD1 3.76Å; L374-L385 HydrophobicContact CD1-CD1 4.09Å; L374-L385 HydrophobicContact CD1-CD2 4.24Å
375	A	57.8	Low	55.9	Low	33 Å²	33	86.6 Å²	86.6	27%	0.273	45%	0.452	S	S	.	.	H	α-helix	trans	-68.5	-24.8	178.1	0	0	0	0	0	113.1	C371 D372 E373 T377	C371-A375 WeakPolarHBondContact O-CB 2.83Å; C371-A375 PolarHBondContact O-N 3.1Å; D372-A375 PolarHBondContact O-N 3.17Å; E373-A375 VanDerWaalsContact C-N 3.34Å; E373-A375 PolarHBondContact O-N 3.34Å; A375-T377 VanDerWaalsContact C-N 3.26Å
376	K	62.3	Low	56.1	Low	153 Å²	153	88.9 Å²	88.9	67%	0.665	46%	0.455	S	S	*	.	H	α-helix	trans	-69.5	-24.9	170.3	-67.9	169.7	-170.4	172.5	0	112.2	D372 E373 L374	D372-K376 WeakPolarHBondContact O-CG 3.2Å; D372-K376 PolarHBondContact O-N 2.76Å; E373-K376 WeakPolarHBondContact O-CB 3.46Å; E373-K376 PolarHBondContact O-N 3.27Å; E373-K376 IonicContact OE1-NZ 3.27Å; E373-K376 PolarHBondContact OE1-NZ 3.06Å; E373-K376 IonicContact OE2-NZ 3.97Å; L374-K376 VanDerWaalsContact C-N 3.27Å; L374-K376 PolarHBondContact O-N 2.81Å
377	T	56.7	Low	56.2	Low	72 Å²	72	89.8 Å²	89.8	44%	0.442	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	152.9	174.7	73.5	0	0	0	0	111.2	L374 A375 H379	L374-T377 PolarHBondContact O-N 3.32Å; L374-T377 PolarHBondContact O-OG1 3.48Å; A375-T377 VanDerWaalsContact C-N 3.26Å; T377-H379 PolarHBondContact O-N 3.12Å
378	K	55.1	Low	56.4	Low	220 Å²	220	90.5 Å²	90.5	96%	0.957	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	54.9	172	-72.7	-175.5	179.1	177.2	0	111.1
379	H	46	Very low	56.9	Low	68 Å²	68	92.7 Å²	92.7	32%	0.315	47%	0.472	S	S	.	.			trans	-75.5	132.2	-174.6	-153.8	-85.8	0	0	0	110.8	T377 R381 K382	T377-H379 PolarHBondContact O-N 3.12Å; H379-R381 PolarHBondContact ND1-N 3.2Å; H379-R381 PolarHBondContact O-N 3.09Å; H379-K382 PolarHBondContact O-N 2.93Å; H379-K382 VanDerWaalsContact O-N 3.16Å
380	P	53.5	Low	57.1	Low	126 Å²	126	97 Å²	97	82%	0.818	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.8	-179.1	23.5	-33.7	0	0	0	113.6
381	R	54.2	Low	57.2	Low	177 Å²	177	95.8 Å²	95.8	67%	0.668	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	16.8	-179.2	-60.8	-175.2	178.4	172.9	-0.3	114.4	H379 K383 A384 L385	H379-R381 PolarHBondContact ND1-N 3.2Å; H379-R381 PolarHBondContact O-N 3.09Å; R381-K383 VanDerWaalsContact C-N 3.29Å; R381-K383 PolarHBondContact O-N 3.27Å; R381-A384 PolarHBondContact O-N 3.46Å; R381-L385 PolarHBondContact O-N 3.17Å
382	K	56.5	Low	57.6	Low	96 Å²	96	96.6 Å²	96.6	42%	0.417	48%	0.483	S	S	.	.	H	α-helix	trans	-49.6	-45.1	-177	-173.6	174.6	177.3	174	0	113.6	H379 A384 L385 E386	H379-K382 PolarHBondContact O-N 2.93Å; H379-K382 VanDerWaalsContact O-N 3.16Å; K382-A384 PolarHBondContact O-N 3.39Å; K382-L385 PolarHBondContact O-N 3.31Å; K382-E386 VanDerWaalsContact CE-OE1 3.25Å; K382-E386 WeakPolarHBondContact CE-OE1 3.46Å; K382-E386 PolarHBondContact O-N 2.89Å
383	K	57.9	Low	57.7	Low	173 Å²	173	97.8 Å²	97.8	75%	0.752	49%	0.487	S	S	*	.	H	α-helix	trans	-60.7	-42.1	176.6	-82.9	-173	175.1	-178.1	0	113.5	R381 E386 S387	R381-K383 VanDerWaalsContact C-N 3.29Å; R381-K383 PolarHBondContact O-N 3.27Å; K383-E386 PolarHBondContact O-N 2.98Å; K383-S387 PolarHBondContact O-N 3.49Å; K383-S387 PolarHBondContact O-OG 3.31Å
384	A	54.8	Low	57.7	Low	63 Å²	63	95.5 Å²	95.5	52%	0.521	48%	0.483	S	S	.	.	H	α-helix	trans	-69	-36.8	179.6	0	0	0	0	0	111.6	R381 K382 S387 L388	R381-A384 PolarHBondContact O-N 3.46Å; K382-A384 PolarHBondContact O-N 3.39Å; A384-S387 PolarHBondContact O-N 3.12Å; A384-L388 WeakPolarHBondContact O-CB 3.33Å; A384-L388 PolarHBondContact O-N 2.91Å
385	L	50.8	Low	58	Low	31 Å²	31	95.4 Å²	95.4	16%	0.162	48%	0.483	C	S	.	.	H	α-helix	trans	-67.3	-39.9	173.2	-72.7	166.5	0	0	0	111.7	L374 R381 K382 L388 K389	L374-L385 HydrophobicContact CB-CD1 3.76Å; L374-L385 HydrophobicContact CD1-CD1 4.09Å; L374-L385 HydrophobicContact CD1-CD2 4.24Å; R381-L385 PolarHBondContact O-N 3.17Å; K382-L385 PolarHBondContact O-N 3.31Å; L385-L388 PolarHBondContact O-N 3.27Å; L385-K389 WeakPolarHBondContact O-CB 3.49Å; L385-K389 PolarHBondContact O-N 3.21Å
386	E	62.3	Low	58	Low	90 Å²	90	99 Å²	99	42%	0.421	49%	0.49	S	S	.	.	H	α-helix	trans	-62.7	-41.7	172.4	-84.9	166.4	176.7	0	0	112.1	K382 K383 K389 Q390	K382-E386 VanDerWaalsContact CE-OE1 3.25Å; K382-E386 WeakPolarHBondContact CE-OE1 3.46Å; K382-E386 PolarHBondContact O-N 2.89Å; K383-E386 PolarHBondContact O-N 2.98Å; E386-K389 WeakPolarHBondContact O-CB 3.27Å; E386-K389 PolarHBondContact O-N 2.66Å; E386-Q390 WeakPolarHBondContact O-CG 3.48Å; E386-Q390 PolarHBondContact O-N 3.33Å
387	S	61.6	Low	57.9	Low	72 Å²	72	94.8 Å²	94.8	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-65.1	-41.1	173.9	-62.2	0	0	0	0	112.4	K383 A384 K389 Q390 L391	K383-S387 PolarHBondContact O-N 3.49Å; K383-S387 PolarHBondContact O-OG 3.31Å; A384-S387 PolarHBondContact O-N 3.12Å; S387-K389 VanDerWaalsContact C-N 3.31Å; S387-K389 PolarHBondContact O-N 3.28Å; S387-Q390 PolarHBondContact O-N 2.9Å; S387-L391 WeakPolarHBondContact O-CB 3.16Å; S387-L391 PolarHBondContact O-N 3.3Å
388	L	53.7	Low	57.9	Low	80 Å²	80	93.9 Å²	93.9	42%	0.419	48%	0.483	S	S	.	.	H	α-helix	trans	-61.7	-42.1	174.2	-169.1	80.5	0	0	0	110.8	I367 A384 L385 L391 L392	I367-L388 HydrophobicContact CG2-CD2 4.41Å; A384-L388 WeakPolarHBondContact O-CB 3.33Å; A384-L388 PolarHBondContact O-N 2.91Å; L385-L388 PolarHBondContact O-N 3.27Å; L388-L391 PolarHBondContact O-N 2.87Å; L388-L392 HydrophobicContact CD2-CD1 4.46Å; L388-L392 HydrophobicContact CG-CD1 4.23Å; L388-L392 VanDerWaalsContact O-CG 3.31Å; L388-L392 WeakPolarHBondContact O-CG 3.43Å; L388-L392 PolarHBondContact O-N 3.26Å
389	K	64.1	Low	57.6	Low	62 Å²	62	84.8 Å²	84.8	27%	0.27	45%	0.447	S	S	.	.	H	α-helix	trans	-60.9	-48.6	176	-175.3	175.6	-179.5	170.7	0	111.3	D372 L385 E386 S387 L391 L392 E393	D372-K389 IonicContact OD1-NZ 3.37Å; D372-K389 PolarHBondContact OD1-NZ 2.79Å; D372-K389 IonicContact OD2-NZ 3.78Å; L385-K389 WeakPolarHBondContact O-CB 3.49Å; L385-K389 PolarHBondContact O-N 3.21Å; E386-K389 WeakPolarHBondContact O-CB 3.27Å; E386-K389 PolarHBondContact O-N 2.66Å; S387-K389 VanDerWaalsContact C-N 3.31Å; S387-K389 PolarHBondContact O-N 3.28Å; K389-L391 VanDerWaalsContact C-N 3.28Å; K389-L391 PolarHBondContact O-N 3.47Å; K389-L392 PolarHBondContact O-N 2.7Å; K389-E393 WeakPolarHBondContact O-CB 3.5Å; K389-E393 PolarHBondContact O-N 3.49Å
390	Q	65.6	Low	58.3	Low	142 Å²	142	87 Å²	87	66%	0.664	46%	0.456	S	S	*	.	H	α-helix	trans	-57.5	-41.8	176.3	-76.2	179.7	-9.3	0	0	112.2	E386 S387 E393 S394	E386-Q390 WeakPolarHBondContact O-CG 3.48Å; E386-Q390 PolarHBondContact O-N 3.33Å; S387-Q390 PolarHBondContact O-N 2.9Å; Q390-E393 PolarHBondContact O-N 3.33Å; Q390-S394 PolarHBondContact O-N 3.01Å; Q390-S394 PolarHBondContact O-OG 3.39Å
391	L	59.1	Low	58.4	Low	104 Å²	104	86.4 Å²	86.4	55%	0.545	44%	0.442	S	S	.	.	H	α-helix	trans	-65	-42.2	177.9	-155.5	105.7	0	0	0	112	S387 L388 K389 S394 D395	S387-L391 WeakPolarHBondContact O-CB 3.16Å; S387-L391 PolarHBondContact O-N 3.3Å; L388-L391 PolarHBondContact O-N 2.87Å; K389-L391 VanDerWaalsContact C-N 3.28Å; K389-L391 PolarHBondContact O-N 3.47Å; L391-S394 WeakPolarHBondContact CA-OG 3.44Å; L391-S394 PolarHBondContact O-OG 3.03Å; L391-D395 WeakPolarHBondContact O-CB 3.25Å; L391-D395 PolarHBondContact O-N 3.36Å
392	L	59.7	Low	58.3	Low	23 Å²	23	79.1 Å²	79.1	12%	0.12	42%	0.416	C	S	.	.	H	α-helix	trans	-67.5	-37.1	176.4	-71.3	170.2	0	0	0	112.1	I367 M368 L388 K389 D395 R396	I367-L392 HydrophobicContact CB-CD1 4.37Å; I367-L392 HydrophobicContact CG2-CD1 3.68Å; M368-L392 HydrophobicContact CG-CB 4.46Å; M368-L392 HydrophobicContact CG-CD1 4.29Å; L388-L392 HydrophobicContact CD2-CD1 4.46Å; L388-L392 HydrophobicContact CG-CD1 4.23Å; L388-L392 VanDerWaalsContact O-CG 3.31Å; L388-L392 WeakPolarHBondContact O-CG 3.43Å; L388-L392 PolarHBondContact O-N 3.26Å; K389-L392 PolarHBondContact O-N 2.7Å; L392-D395 PolarHBondContact O-N 2.82Å; L392-R396 WeakPolarHBondContact O-CB 3.48Å; L392-R396 PolarHBondContact O-N 3.5Å
393	E	66.5	Low	58.1	Low	90 Å²	90	75.6 Å²	75.6	42%	0.421	40%	0.401	S	S	.	.	H	α-helix	trans	-67.1	-42.7	176.8	-139.8	98.8	-132.7	0	0	111.1	K389 Q390 R396 A397	K389-E393 WeakPolarHBondContact O-CB 3.5Å; K389-E393 PolarHBondContact O-N 3.49Å; Q390-E393 PolarHBondContact O-N 3.33Å; E393-R396 PolarHBondContact O-N 2.97Å; E393-A397 PolarHBondContact O-N 3.39Å
394	S	62.1	Low	58.2	Low	63 Å²	63	72.3 Å²	72.3	44%	0.441	39%	0.389	S	S	.	.	H	α-helix	trans	-63.6	-40.8	174.4	57	0	0	0	0	112.1	Q390 L391 R396 A397 A398	Q390-S394 PolarHBondContact O-N 3.01Å; Q390-S394 PolarHBondContact O-OG 3.39Å; L391-S394 WeakPolarHBondContact CA-OG 3.44Å; L391-S394 PolarHBondContact O-OG 3.03Å; S394-R396 VanDerWaalsContact C-N 3.33Å; S394-R396 PolarHBondContact O-N 3.21Å; S394-A397 PolarHBondContact O-N 3.33Å; S394-A398 PolarHBondContact O-N 3.03Å
395	D	58.3	Low	58.1	Low	66 Å²	66	70.4 Å²	70.4	35%	0.353	37%	0.371	S	S	.	.	H	α-helix	trans	-65.2	-38	176.2	-88.7	0.6	0	0	0	111.9	L391 L392 S399	L391-D395 WeakPolarHBondContact O-CB 3.25Å; L391-D395 PolarHBondContact O-N 3.36Å; L392-D395 PolarHBondContact O-N 2.82Å; D395-S399 VanDerWaalsContact O-CB 3.23Å; D395-S399 WeakPolarHBondContact O-CB 3.49Å; D395-S399 PolarHBondContact O-N 3.24Å; D395-S399 PolarHBondContact O-OG 3.02Å
396	R	57	Low	57.9	Low	109 Å²	109	69.8 Å²	69.8	41%	0.411	37%	0.367	S	S	.	.	H	α-helix	trans	-64.3	-41	176.3	-174.4	178.5	177.5	165.4	-0.6	111.4	M368 L392 E393 S394 K400	M368-R396 VanDerWaalsContact CE-NH1 3.35Å; L392-R396 WeakPolarHBondContact O-CB 3.48Å; L392-R396 PolarHBondContact O-N 3.5Å; E393-R396 PolarHBondContact O-N 2.97Å; S394-R396 VanDerWaalsContact C-N 3.33Å; S394-R396 PolarHBondContact O-N 3.21Å; R396-K400 WeakPolarHBondContact O-CB 3.35Å; R396-K400 PolarHBondContact O-N 3.33Å; R396-K400 VanDerWaalsContact O-N 3.09Å
397	A	60.9	Low	57.5	Low	63 Å²	63	71.9 Å²	71.9	52%	0.521	38%	0.377	S	S	.	.	H	α-helix	trans	-65.2	-51.4	176.2	0	0	0	0	0	111.4	E393 S394 S399 K400 E401	E393-A397 PolarHBondContact O-N 3.39Å; S394-A397 PolarHBondContact O-N 3.33Å; A397-S399 VanDerWaalsContact C-N 3.31Å; A397-S399 PolarHBondContact O-N 2.83Å; A397-K400 PolarHBondContact O-N 2.93Å; A397-E401 PolarHBondContact O-N 3.23Å; A397-E401 VanDerWaalsContact O-N 3.1Å
398	A	55.5	Low	57	Low	53 Å²	53	71.3 Å²	71.3	44%	0.438	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-38.7	179.1	0	0	0	0	0	112.5	S394 L402	S394-A398 PolarHBondContact O-N 3.03Å; A398-L402 WeakPolarHBondContact O-CB 3.44Å; A398-L402 PolarHBondContact O-N 3.03Å; A398-L402 VanDerWaalsContact O-N 3.12Å
399	S	50.4	Low	56.7	Low	29 Å²	29	67.8 Å²	67.8	20%	0.203	36%	0.358	C	S	.	.	H	α-helix	trans	-73.1	-29.8	178.6	-56.7	0	0	0	0	113.3	D395 A397 L402 I403	D395-S399 VanDerWaalsContact O-CB 3.23Å; D395-S399 WeakPolarHBondContact O-CB 3.49Å; D395-S399 PolarHBondContact O-N 3.24Å; D395-S399 PolarHBondContact O-OG 3.02Å; A397-S399 VanDerWaalsContact C-N 3.31Å; A397-S399 PolarHBondContact O-N 2.83Å; S399-L402 WeakPolarHBondContact O-CB 3.43Å; S399-I403 PolarHBondContact O-N 3.06Å
400	K	60.4	Low	55.9	Low	115 Å²	115	66.8 Å²	66.8	50%	0.5	36%	0.355	S	S	.	.	H	α-helix	trans	-68.4	-47.2	174.7	-178	-176.5	166.5	-171	0	110.7	R396 A397 L402 I403 E404	R396-K400 WeakPolarHBondContact O-CB 3.35Å; R396-K400 PolarHBondContact O-N 3.33Å; R396-K400 VanDerWaalsContact O-N 3.09Å; A397-K400 PolarHBondContact O-N 2.93Å; K400-L402 VanDerWaalsContact C-N 3.26Å; K400-L402 PolarHBondContact O-N 3.03Å; K400-I403 PolarHBondContact O-N 3.4Å; K400-E404 WeakPolarHBondContact CE-OE1 3.4Å; K400-E404 IonicContact NZ-OE1 3.9Å; K400-E404 WeakPolarHBondContact O-CG 3.31Å; K400-E404 PolarHBondContact O-N 3.14Å
401	E	55.3	Low	55.3	Low	113 Å²	113	61.4 Å²	61.4	53%	0.528	34%	0.338	S	S	.	.	H	α-helix	trans	-55.2	-43.8	174.4	-175.3	-174.5	170.2	0	0	111	A397 I403 E404 T405	A397-E401 PolarHBondContact O-N 3.23Å; A397-E401 VanDerWaalsContact O-N 3.1Å; E401-I403 PolarHBondContact O-N 3.21Å; E401-E404 PolarHBondContact O-N 3.29Å; E401-T405 WeakPolarHBondContact O-CB 3.49Å; E401-T405 PolarHBondContact O-N 3.16Å; E401-T405 PolarHBondContact O-OG1 3.42Å
402	L	51.3	Low	54.9	Low	24 Å²	24	58.5 Å²	58.5	13%	0.126	33%	0.325	C	S	.	.	H	α-helix	trans	-58.8	-45.7	177.3	-167.7	111.4	0	0	0	112.5	A398 S399 K400 T405 F406 V465	A398-L402 WeakPolarHBondContact O-CB 3.44Å; A398-L402 PolarHBondContact O-N 3.03Å; A398-L402 VanDerWaalsContact O-N 3.12Å; S399-L402 WeakPolarHBondContact O-CB 3.43Å; K400-L402 VanDerWaalsContact C-N 3.26Å; K400-L402 PolarHBondContact O-N 3.03Å; L402-T405 WeakPolarHBondContact O-CB 3.46Å; L402-T405 PolarHBondContact O-N 3.24Å; L402-F406 HydrophobicContact CD1-CE2 4.12Å; L402-F406 HydrophobicContact CD2-CD2 3.77Å; L402-F406 HydrophobicContact CD2-CE2 3.57Å; L402-F406 HydrophobicContact CG-CD2 3.71Å; L402-F406 HydrophobicContact CG-CE2 3.57Å; L402-F406 WeakPolarHBondContact O-CB 3.3Å; L402-F406 WeakPolarHBondContact O-CD2 3.48Å; L402-F406 PolarHBondContact O-N 2.92Å; L402-V465 HydrophobicContact CD1-CG1 3.3Å; L402-V465 HydrophobicContact CG-CG1 4.08Å
403	I	53.2	Low	54.4	Low	22 Å²	22	59.3 Å²	59.3	11%	0.113	33%	0.329	C	S	.	.	H	α-helix	trans	-70.5	-42.8	-179.5	-72	172.4	0	0	0	111.3	W357 S399 K400 E401 T405 F406 E407	W357-I403 HydrophobicContact CB-CD1 3.95Å; W357-I403 HydrophobicContact CD2-CD1 3Å; W357-I403 HydrophobicContact CD2-CG1 4.44Å; W357-I403 VanDerWaalsContact CE2-CD1 3.41Å; W357-I403 HydrophobicContact CE3-CD1 3.06Å; W357-I403 HydrophobicContact CG-CD1 3.41Å; W357-I403 VanDerWaalsContact CG-CD1 3.41Å; W357-I403 HydrophobicContact CH2-CD1 3.75Å; W357-I403 HydrophobicContact CZ2-CD1 3.78Å; W357-I403 HydrophobicContact CZ3-CD1 3.44Å; W357-I403 VanDerWaalsContact CZ3-CD1 3.44Å; S399-I403 PolarHBondContact O-N 3.06Å; K400-I403 PolarHBondContact O-N 3.4Å; E401-I403 PolarHBondContact O-N 3.21Å; I403-T405 PolarHBondContact O-N 3.49Å; I403-F406 PolarHBondContact O-N 2.89Å; I403-E407 HydrophobicContact CG2-CG 4.14Å; I403-E407 WeakPolarHBondContact O-CB 3.48Å; I403-E407 WeakPolarHBondContact O-CG 3.47Å; I403-E407 PolarHBondContact O-N 3.43Å
404	E	60.2	Low	53.8	Low	105 Å²	105	59.8 Å²	59.8	49%	0.491	33%	0.332	S	S	.	.	H	α-helix	trans	-58.8	-38	174.3	-71.7	175.2	171.4	0	0	110.4	K400 E401 A408	K400-E404 WeakPolarHBondContact CE-OE1 3.4Å; K400-E404 IonicContact NZ-OE1 3.9Å; K400-E404 WeakPolarHBondContact O-CG 3.31Å; K400-E404 PolarHBondContact O-N 3.14Å; E401-E404 PolarHBondContact O-N 3.29Å; E404-A408 WeakPolarHBondContact O-CB 3.4Å; E404-A408 PolarHBondContact O-N 3.34Å
405	T	51.6	Low	53.7	Low	23 Å²	23	64 Å²	64	14%	0.141	34%	0.342	C	S	.	.	H	α-helix	trans	-67.7	-47.6	174.7	-52.2	0	0	0	0	112.1	E401 L402 I403 E407 A408 I409 H461 V465	E401-T405 WeakPolarHBondContact O-CB 3.49Å; E401-T405 PolarHBondContact O-N 3.16Å; E401-T405 PolarHBondContact O-OG1 3.42Å; L402-T405 WeakPolarHBondContact O-CB 3.46Å; L402-T405 PolarHBondContact O-N 3.24Å; I403-T405 PolarHBondContact O-N 3.49Å; T405-E407 PolarHBondContact O-N 2.98Å; T405-A408 PolarHBondContact O-N 3.44Å; T405-I409 HydrophobicContact CG2-CD1 3.78Å; T405-I409 WeakPolarHBondContact O-CB 3.48Å; T405-I409 WeakPolarHBondContact O-CD1 3.43Å; T405-I409 WeakPolarHBondContact O-CG1 3.32Å; T405-I409 PolarHBondContact O-N 2.79Å; T405-H461 VanDerWaalsContact CG2-CD2 3.44Å; T405-H461 WeakPolarHBondContact CG2-CD2 3.31Å; T405-H461 WeakPolarHBondContact CG2-NE2 3.39Å; T405-V465 HydrophobicContact CG2-CG2 4.22Å
406	F	47.7	Very low	53.4	Low	17 Å²	17	61.6 Å²	61.6	8%	0.075	33%	0.33	C	S	.	.	H	α-helix	trans	-62.9	-41.2	177	-87.1	-67.4	0	0	0	112	V350 L402 I403 I409 I410 L462 L466	V350-F406 HydrophobicContact CG1-CB 4.34Å; V350-F406 HydrophobicContact CG1-CD1 3.66Å; V350-F406 HydrophobicContact CG1-CE1 4.04Å; V350-F406 HydrophobicContact CG1-CG 3.98Å; V350-F406 HydrophobicContact CG2-CD1 4.05Å; V350-F406 HydrophobicContact CG2-CE1 3.66Å; V350-F406 HydrophobicContact CG2-CZ 4.37Å; L402-F406 HydrophobicContact CD1-CE2 4.12Å; L402-F406 HydrophobicContact CD2-CD2 3.77Å; L402-F406 HydrophobicContact CD2-CE2 3.57Å; L402-F406 HydrophobicContact CG-CD2 3.71Å; L402-F406 HydrophobicContact CG-CE2 3.57Å; L402-F406 WeakPolarHBondContact O-CB 3.3Å; L402-F406 WeakPolarHBondContact O-CD2 3.48Å; L402-F406 PolarHBondContact O-N 2.92Å; I403-F406 PolarHBondContact O-N 2.89Å; F406-I409 PolarHBondContact O-N 3.32Å; F406-I410 HydrophobicContact CB-CD1 4.43Å; F406-I410 HydrophobicContact CD1-CD1 4.17Å; F406-I410 VanDerWaalsContact O-CB 3.23Å; F406-I410 WeakPolarHBondContact O-CB 3.44Å; F406-I410 VanDerWaalsContact O-CG1 3.27Å; F406-I410 WeakPolarHBondContact O-CG1 3.4Å; F406-I410 PolarHBondContact O-N 3.18Å; F406-L462 HydrophobicContact CD1-CD1 3.67Å; F406-L462 HydrophobicContact CD1-CG 4.29Å; F406-L462 HydrophobicContact CE1-CD1 3.46Å; F406-L462 VanDerWaalsContact CE1-CD1 3.46Å; F406-L462 HydrophobicContact CE1-CD2 3.89Å; F406-L462 HydrophobicContact CE1-CG 3.63Å; F406-L462 HydrophobicContact CZ-CD1 4.47Å; F406-L462 HydrophobicContact CZ-CD2 4.4Å; F406-L462 HydrophobicContact CZ-CG 4.21Å; F406-L466 HydrophobicContact CZ-CD2 4.3Å
407	E	53.2	Low	53	Low	135 Å²	135	59.2 Å²	59.2	63%	0.631	33%	0.327	S	S	*	.	H	α-helix	trans	-67.3	-40.5	176.6	-74.1	-178.3	170.5	0	0	111.4	I403 T405 I409 G411	I403-E407 HydrophobicContact CG2-CG 4.14Å; I403-E407 WeakPolarHBondContact O-CB 3.48Å; I403-E407 WeakPolarHBondContact O-CG 3.47Å; I403-E407 PolarHBondContact O-N 3.43Å; T405-E407 PolarHBondContact O-N 2.98Å; E407-I409 PolarHBondContact O-N 3Å; E407-G411 PolarHBondContact O-N 3.16Å; E407-G411 VanDerWaalsContact O-N 3.14Å
408	A	52.2	Low	52.8	Low	60 Å²	60	58.6 Å²	58.6	50%	0.496	32%	0.322	S	S	.	.	H	α-helix	trans	-65.4	-24.4	174.5	0	0	0	0	0	113.3	E404 T405 P412	E404-A408 WeakPolarHBondContact O-CB 3.4Å; E404-A408 PolarHBondContact O-N 3.34Å; T405-A408 PolarHBondContact O-N 3.44Å; A408-P412 WeakPolarHBondContact O-CD 3.44Å; A408-P412 VanDerWaalsContact O-CG 3.24Å; A408-P412 WeakPolarHBondContact O-CG 3.36Å
409	I	46.8	Very low	52.9	Low	5 Å²	5	61.3 Å²	61.3	3%	0.026	33%	0.326	C	S	.	.	H	α-helix	trans	-90.3	-53.6	178	-69.8	168.6	0	0	0	111.5	T405 F406 E407 P412 L413 K458 L462	T405-I409 HydrophobicContact CG2-CD1 3.78Å; T405-I409 WeakPolarHBondContact O-CB 3.48Å; T405-I409 WeakPolarHBondContact O-CD1 3.43Å; T405-I409 WeakPolarHBondContact O-CG1 3.32Å; T405-I409 PolarHBondContact O-N 2.79Å; F406-I409 PolarHBondContact O-N 3.32Å; E407-I409 PolarHBondContact O-N 3Å; I409-P412 WeakPolarHBondContact O-CD 3.33Å; I409-L413 HydrophobicContact CG2-CD1 3.57Å; I409-L413 WeakPolarHBondContact O-CB 3.34Å; I409-L413 PolarHBondContact O-N 2.92Å; I409-K458 HydrophobicContact CB-CB 4.47Å; I409-K458 HydrophobicContact CB-CD 4.47Å; I409-K458 HydrophobicContact CG1-CB 4.05Å; I409-K458 HydrophobicContact CG1-CD 4.3Å; I409-K458 HydrophobicContact CG1-CG 4.07Å; I409-K458 HydrophobicContact CG2-CB 3.84Å; I409-K458 HydrophobicContact CG2-CD 4.36Å; I409-K458 HydrophobicContact CG2-CG 4.46Å; I409-L462 HydrophobicContact CB-CD1 4.43Å; I409-L462 HydrophobicContact CD1-CB 4.18Å; I409-L462 HydrophobicContact CD1-CD1 3.95Å; I409-L462 HydrophobicContact CG2-CD1 3.82Å
410	I	46.6	Very low	52.9	Low	41 Å²	41	61.9 Å²	61.9	21%	0.21	33%	0.326	C	S	.	.	H	α-helix	trans	-67.2	-42.3	-172.6	-70.9	174.6	0	0	0	111.6	V350 F406 L413 Q414	V350-I410 HydrophobicContact CB-CD1 3.95Å; V350-I410 HydrophobicContact CG1-CD1 3.37Å; V350-I410 HydrophobicContact CG2-CD1 4.41Å; F406-I410 HydrophobicContact CB-CD1 4.43Å; F406-I410 HydrophobicContact CD1-CD1 4.17Å; F406-I410 VanDerWaalsContact O-CB 3.23Å; F406-I410 WeakPolarHBondContact O-CB 3.44Å; F406-I410 VanDerWaalsContact O-CG1 3.27Å; F406-I410 WeakPolarHBondContact O-CG1 3.4Å; F406-I410 PolarHBondContact O-N 3.18Å; I410-L413 PolarHBondContact O-N 2.9Å; I410-Q414 HydrophobicContact CG2-CG 3.98Å; I410-Q414 VanDerWaalsContact CG2-NE2 3.35Å; I410-Q414 WeakPolarHBondContact O-CB 3.46Å; I410-Q414 WeakPolarHBondContact O-CG 3.49Å; I410-Q414 PolarHBondContact O-N 3.36Å
411	G	52.7	Low	52.7	Low	30 Å²	30	62.7 Å²	62.7	31%	0.309	33%	0.332	S	S	.	.	H	α-helix	trans	-56.9	-52.3	-179	0	0	0	0	0	112	E407 K415	E407-G411 PolarHBondContact O-N 3.16Å; E407-G411 VanDerWaalsContact O-N 3.14Å; G411-K415 PolarHBondContact O-N 3.48Å; G411-K415 VanDerWaalsContact O-N 3.12Å
412	P	51.6	Low	53.2	Low	42 Å²	42	63 Å²	63	27%	0.273	33%	0.334	S	S	.	.	H	α-helix	trans	-63.3	-42.2	173.1	-29.2	39.9	0	0	0	114.1	A408 I409 Q414 K415 T416 K458	A408-P412 WeakPolarHBondContact O-CD 3.44Å; A408-P412 VanDerWaalsContact O-CG 3.24Å; A408-P412 WeakPolarHBondContact O-CG 3.36Å; I409-P412 WeakPolarHBondContact O-CD 3.33Å; P412-Q414 VanDerWaalsContact C-N 3.34Å; P412-Q414 PolarHBondContact O-N 3.47Å; P412-K415 CarbonylContact O-C 3.6Å; P412-K415 WeakPolarHBondContact O-CB 3.42Å; P412-K415 PolarHBondContact O-N 3.34Å; P412-K415 VanDerWaalsContact O-N 3.14Å; P412-T416 PolarHBondContact O-N 3.06Å; P412-T416 PolarHBondContact O-OG1 3.34Å; P412-K458 VanDerWaalsContact CG-NZ 3.35Å
413	L	48.2	Very low	53.6	Low	40 Å²	40	66.6 Å²	66.6	21%	0.209	35%	0.349	C	S	.	.	H	α-helix	trans	-60	-40.9	177.3	-105.5	156.1	0	0	0	112.7	I409 I410 T416 T417 I455	I409-L413 HydrophobicContact CG2-CD1 3.57Å; I409-L413 WeakPolarHBondContact O-CB 3.34Å; I409-L413 PolarHBondContact O-N 2.92Å; I410-L413 PolarHBondContact O-N 2.9Å; L413-T416 WeakPolarHBondContact CA-OG1 3.48Å; L413-T416 PolarHBondContact O-N 3.42Å; L413-T416 PolarHBondContact O-OG1 3.35Å; L413-T417 VanDerWaalsContact O-CB 3.3Å; L413-T417 WeakPolarHBondContact O-CB 3.44Å; L413-T417 PolarHBondContact O-N 2.71Å; L413-T417 PolarHBondContact O-OG1 3.12Å; L413-I455 HydrophobicContact CD2-CB 4.33Å; L413-I455 HydrophobicContact CD2-CD1 4.09Å; L413-I455 HydrophobicContact CD2-CG1 3.72Å; L413-I455 HydrophobicContact CD2-CG2 3.9Å; L413-I455 HydrophobicContact CG-CG1 4.28Å
414	Q	55.1	Low	53.6	Low	101 Å²	101	69 Å²	69	47%	0.472	37%	0.368	S	S	.	.	H	α-helix	trans	-66.8	-39.8	175.2	-74.8	177.4	-8.5	0	0	111.2	I410 P412 A418	I410-Q414 HydrophobicContact CG2-CG 3.98Å; I410-Q414 VanDerWaalsContact CG2-NE2 3.35Å; I410-Q414 WeakPolarHBondContact O-CB 3.46Å; I410-Q414 WeakPolarHBondContact O-CG 3.49Å; I410-Q414 PolarHBondContact O-N 3.36Å; P412-Q414 VanDerWaalsContact C-N 3.34Å; P412-Q414 PolarHBondContact O-N 3.47Å; Q414-A418 VanDerWaalsContact O-CB 3.29Å; Q414-A418 WeakPolarHBondContact O-CB 3.2Å; Q414-A418 PolarHBondContact O-N 3.07Å
415	K	59.4	Low	53.7	Low	151 Å²	151	66 Å²	66	66%	0.657	36%	0.36	S	S	*	.	H	α-helix	trans	-63.3	-45.9	173.8	-78.2	-177.4	177.5	-178.7	0	111.9	G411 P412 A418 Q419	G411-K415 PolarHBondContact O-N 3.48Å; G411-K415 VanDerWaalsContact O-N 3.12Å; P412-K415 CarbonylContact O-C 3.6Å; P412-K415 WeakPolarHBondContact O-CB 3.42Å; P412-K415 PolarHBondContact O-N 3.34Å; P412-K415 VanDerWaalsContact O-N 3.14Å; K415-A418 PolarHBondContact O-N 3.44Å; K415-Q419 WeakPolarHBondContact O-CB 3.44Å; K415-Q419 VanDerWaalsContact O-CG 3.31Å; K415-Q419 WeakPolarHBondContact O-CG 3.47Å; K415-Q419 PolarHBondContact O-N 3.43Å
416	T	52.4	Low	54.1	Low	15 Å²	15	70 Å²	70	9%	0.092	38%	0.377	C	S	.	.	H	α-helix	trans	-68.9	-37.5	178.3	39.6	0	0	0	0	112	P412 L413 A418 Q419 L420 V451	P412-T416 PolarHBondContact O-N 3.06Å; P412-T416 PolarHBondContact O-OG1 3.34Å; L413-T416 WeakPolarHBondContact CA-OG1 3.48Å; L413-T416 PolarHBondContact O-N 3.42Å; L413-T416 PolarHBondContact O-OG1 3.35Å; T416-A418 PolarHBondContact O-N 2.66Å; T416-Q419 PolarHBondContact O-N 2.96Å; T416-L420 WeakPolarHBondContact O-CB 3.33Å; T416-L420 PolarHBondContact O-N 2.82Å; T416-V451 HydrophobicContact CG2-CB 4.49Å; T416-V451 HydrophobicContact CG2-CG1 3.5Å; T416-V451 HydrophobicContact CG2-CG2 4.36Å
417	T	49.2	Very low	54.5	Low	59 Å²	59	74.2 Å²	74.2	36%	0.362	39%	0.393	S	S	.	.	H	α-helix	trans	-63.6	-41.7	173.8	-52.9	0	0	0	0	111.3	L413 L420 Q421	L413-T417 VanDerWaalsContact O-CB 3.3Å; L413-T417 WeakPolarHBondContact O-CB 3.44Å; L413-T417 PolarHBondContact O-N 2.71Å; L413-T417 PolarHBondContact O-OG1 3.12Å; T417-L420 PolarHBondContact O-N 2.88Å; T417-Q421 WeakPolarHBondContact O-CG 3.21Å; T417-Q421 PolarHBondContact O-N 3.41Å
418	A	55.3	Low	54.6	Low	50 Å²	50	75 Å²	75	41%	0.413	40%	0.397	S	S	.	.	H	α-helix	trans	-65.1	-42.9	174.8	0	0	0	0	0	111.8	Q414 K415 T416 L420 Q421 E422	Q414-A418 VanDerWaalsContact O-CB 3.29Å; Q414-A418 WeakPolarHBondContact O-CB 3.2Å; Q414-A418 PolarHBondContact O-N 3.07Å; K415-A418 PolarHBondContact O-N 3.44Å; T416-A418 PolarHBondContact O-N 2.66Å; A418-L420 VanDerWaalsContact C-N 3.32Å; A418-L420 PolarHBondContact O-N 3.17Å; A418-Q421 PolarHBondContact O-N 2.99Å; A418-E422 WeakPolarHBondContact O-CB 3.39Å; A418-E422 PolarHBondContact O-N 3.41Å
419	Q	58.3	Low	55.2	Low	110 Å²	110	80.3 Å²	80.3	51%	0.514	40%	0.404	S	S	.	.	H	α-helix	trans	-60.4	-40.8	173.6	-76.5	173.8	-15.3	0	0	111.8	K415 T416 E422 Q423	K415-Q419 WeakPolarHBondContact O-CB 3.44Å; K415-Q419 VanDerWaalsContact O-CG 3.31Å; K415-Q419 WeakPolarHBondContact O-CG 3.47Å; K415-Q419 PolarHBondContact O-N 3.43Å; T416-Q419 PolarHBondContact O-N 2.96Å; Q419-E422 PolarHBondContact O-N 3.23Å; Q419-Q423 WeakPolarHBondContact O-CB 3.35Å; Q419-Q423 WeakPolarHBondContact O-CG 3.41Å; Q419-Q423 PolarHBondContact O-N 3.46Å
420	L	51	Low	55.7	Low	41 Å²	41	82.8 Å²	82.8	22%	0.215	43%	0.425	C	S	.	.	H	α-helix	trans	-65.1	-43.2	175.8	-88.7	160.9	0	0	0	112.3	T416 T417 A418 E422 Q423 C424 L447 V451	T416-L420 WeakPolarHBondContact O-CB 3.33Å; T416-L420 PolarHBondContact O-N 2.82Å; T417-L420 PolarHBondContact O-N 2.88Å; A418-L420 VanDerWaalsContact C-N 3.32Å; A418-L420 PolarHBondContact O-N 3.17Å; L420-E422 VanDerWaalsContact C-N 3.32Å; L420-E422 PolarHBondContact O-N 3.46Å; L420-Q423 PolarHBondContact O-N 3.2Å; L420-C424 WeakPolarHBondContact O-CB 3.15Å; L420-C424 PolarHBondContact O-N 2.86Å; L420-C424 PolarHBondContact O-SG 2.89Å; L420-L447 HydrophobicContact CD1-CD2 4.49Å; L420-L447 HydrophobicContact CD2-CD2 3.33Å; L420-L447 HydrophobicContact CD2-CG 4.09Å; L420-L447 HydrophobicContact CG-CD2 4.49Å; L420-V451 HydrophobicContact CD1-CG1 4.42Å
421	Q	56.6	Low	55.9	Low	132 Å²	132	88 Å²	88	62%	0.617	45%	0.446	S	S	*	.	H	α-helix	trans	-62.3	-41.3	173.9	-76.7	-179.5	-14.3	0	0	111.6	T417 A418 C424 A425	T417-Q421 WeakPolarHBondContact O-CG 3.21Å; T417-Q421 PolarHBondContact O-N 3.41Å; A418-Q421 PolarHBondContact O-N 2.99Å; Q421-C424 PolarHBondContact O-N 3.33Å; Q421-A425 WeakPolarHBondContact O-CB 3.41Å; Q421-A425 PolarHBondContact O-N 2.88Å
422	E	65.1	Low	56.2	Low	121 Å²	121	89.3 Å²	89.3	57%	0.565	45%	0.454	S	S	*	.	H	α-helix	trans	-69.2	-39.6	178	-169.9	157.1	-160	0	0	112.1	A418 Q419 L420 A425 Q426	A418-E422 WeakPolarHBondContact O-CB 3.39Å; A418-E422 PolarHBondContact O-N 3.41Å; Q419-E422 PolarHBondContact O-N 3.23Å; L420-E422 VanDerWaalsContact C-N 3.32Å; L420-E422 PolarHBondContact O-N 3.46Å; E422-A425 PolarHBondContact O-N 2.87Å; E422-Q426 WeakPolarHBondContact O-CB 3.27Å; E422-Q426 VanDerWaalsContact O-CG 3.29Å; E422-Q426 WeakPolarHBondContact O-CG 3.23Å; E422-Q426 PolarHBondContact O-N 3Å
423	Q	59.6	Low	56.5	Low	98 Å²	98	93.5 Å²	93.5	46%	0.458	47%	0.47	S	S	.	.	H	α-helix	trans	-64.5	-39.8	172.2	-78.4	-173.9	-10.1	0	0	112.2	Q419 L420 Q426 R427	Q419-Q423 WeakPolarHBondContact O-CB 3.35Å; Q419-Q423 WeakPolarHBondContact O-CG 3.41Å; Q419-Q423 PolarHBondContact O-N 3.46Å; L420-Q423 PolarHBondContact O-N 3.2Å; Q423-Q426 PolarHBondContact O-N 3.17Å; Q423-R427 WeakPolarHBondContact O-CB 3.24Å; Q423-R427 PolarHBondContact O-N 3.22Å
424	C	53.8	Low	56.7	Low	73 Å²	73	93 Å²	93	49%	0.493	47%	0.471	S	S	.	.	H	α-helix	trans	-63.4	-44	173.2	-77.5	0	0	0	0	111.5	L420 Q421 Q426 R427 E428	L420-C424 WeakPolarHBondContact O-CB 3.15Å; L420-C424 PolarHBondContact O-N 2.86Å; L420-C424 PolarHBondContact O-SG 2.89Å; Q421-C424 PolarHBondContact O-N 3.33Å; C424-Q426 PolarHBondContact O-N 3.44Å; C424-R427 WeakPolarHBondContact O-CB 3.32Å; C424-R427 PolarHBondContact O-N 2.91Å; C424-E428 PolarHBondContact O-N 3.29Å
425	A	61.2	Low	56.6	Low	41 Å²	41	95.7 Å²	95.7	34%	0.339	49%	0.486	S	S	.	.	H	α-helix	trans	-64.3	-39.5	175.5	0	0	0	0	0	112	Q421 E422 E428 R429	Q421-A425 WeakPolarHBondContact O-CB 3.41Å; Q421-A425 PolarHBondContact O-N 2.88Å; E422-A425 PolarHBondContact O-N 2.87Å; A425-E428 PolarHBondContact O-N 3.12Å; A425-R429 WeakPolarHBondContact O-CG 3.43Å; A425-R429 PolarHBondContact O-N 3.43Å
426	Q	61.2	Low	56.5	Low	107 Å²	107	97.4 Å²	97.4	50%	0.5	49%	0.493	S	S	.	.	H	α-helix	trans	-64.1	-40.2	172.7	-75.3	178.9	9.6	0	0	111.7	E422 Q423 C424 R429 A430	E422-Q426 WeakPolarHBondContact O-CB 3.27Å; E422-Q426 VanDerWaalsContact O-CG 3.29Å; E422-Q426 WeakPolarHBondContact O-CG 3.23Å; E422-Q426 PolarHBondContact O-N 3Å; Q423-Q426 PolarHBondContact O-N 3.17Å; C424-Q426 PolarHBondContact O-N 3.44Å; Q426-R429 PolarHBondContact O-N 3.35Å; Q426-A430 VanDerWaalsContact O-CB 3.27Å; Q426-A430 WeakPolarHBondContact O-CB 3.28Å; Q426-A430 PolarHBondContact O-N 2.83Å
427	R	54.4	Low	56.6	Low	106 Å²	106	104.8 Å²	104.8	40%	0.4	52%	0.524	S	S	.	.	H	α-helix	trans	-60.5	-44.2	173.3	-89.9	-178.6	174.6	-151	-7.3	112	Q423 C424 A430 K431 D444 P445	Q423-R427 WeakPolarHBondContact O-CB 3.24Å; Q423-R427 PolarHBondContact O-N 3.22Å; C424-R427 WeakPolarHBondContact O-CB 3.32Å; C424-R427 PolarHBondContact O-N 2.91Å; R427-A430 PolarHBondContact O-N 2.78Å; R427-K431 WeakPolarHBondContact O-CB 3.37Å; R427-K431 PolarHBondContact O-N 3.43Å; R427-D444 IonicContact CZ-OD1 3.31Å; R427-D444 IonicContact NH1-OD1 2.72Å; R427-D444 IonicContact NH2-OD1 3.41Å; R427-D444 PolarHBondContact NH2-OD1 2.98Å; R427-P445 PolarHBondContact NH2-O 2.99Å
428	E	55.6	Low	56.3	Low	152 Å²	152	105.4 Å²	105.4	71%	0.71	54%	0.542	S	S	*	.	H	α-helix	trans	-64.9	-41.5	176.6	-73.9	-151.7	155.1	0	0	111.9	C424 A425 K431 A432	C424-E428 PolarHBondContact O-N 3.29Å; A425-E428 PolarHBondContact O-N 3.12Å; E428-K431 PolarHBondContact O-N 2.98Å; E428-A432 WeakPolarHBondContact O-CB 3.5Å; E428-A432 PolarHBondContact O-N 3.4Å
429	R	65.8	Low	55.6	Low	172 Å²	172	105.8 Å²	105.8	65%	0.649	55%	0.545	S	S	*	.	H	α-helix	trans	-62.4	-45.5	173.9	-71.8	178	-168.1	158.8	5.1	111.8	A425 Q426 A432 E433	A425-R429 WeakPolarHBondContact O-CG 3.43Å; A425-R429 PolarHBondContact O-N 3.43Å; Q426-R429 PolarHBondContact O-N 3.35Å; R429-A432 PolarHBondContact O-N 2.89Å; R429-E433 PolarHBondContact O-N 3.46Å
430	A	56.4	Low	54.7	Low	57 Å²	57	106.1 Å²	106.1	47%	0.471	57%	0.567	S	S	.	*	H	α-helix	trans	-63.7	-40.6	177.5	0	0	0	0	0	111.5	Q426 R427 E433 A434	Q426-A430 VanDerWaalsContact O-CB 3.27Å; Q426-A430 WeakPolarHBondContact O-CB 3.28Å; Q426-A430 PolarHBondContact O-N 2.83Å; R427-A430 PolarHBondContact O-N 2.78Å; A430-E433 PolarHBondContact O-N 3.46Å; A430-A434 WeakPolarHBondContact O-CB 3.39Å; A430-A434 PolarHBondContact O-N 3.33Å
431	K	51.5	Low	54.1	Low	151 Å²	151	108.6 Å²	108.6	66%	0.657	59%	0.593	S	S	*	*	H	α-helix	trans	-61.2	-45.8	171.7	-99.7	-176.3	174.2	177.8	0	111.5	R427 E428 E433 A434 M435	R427-K431 WeakPolarHBondContact O-CB 3.37Å; R427-K431 PolarHBondContact O-N 3.43Å; E428-K431 PolarHBondContact O-N 2.98Å; K431-E433 VanDerWaalsContact C-N 3.34Å; K431-E433 PolarHBondContact O-N 2.97Å; K431-A434 PolarHBondContact O-N 3.01Å; K431-M435 WeakPolarHBondContact O-CB 3.39Å; K431-M435 WeakPolarHBondContact O-CG 3.31Å; K431-M435 PolarHBondContact O-N 2.91Å
432	A	58.7	Low	53.1	Low	56 Å²	56	106 Å²	106	46%	0.463	59%	0.594	S	S	.	*	H	α-helix	trans	-63.5	-39.3	178.9	0	0	0	0	0	111.9	E428 R429 K436	E428-A432 WeakPolarHBondContact O-CB 3.5Å; E428-A432 PolarHBondContact O-N 3.4Å; R429-A432 PolarHBondContact O-N 2.89Å; A432-K436 PolarHBondContact O-N 3.3Å
433	E	57.6	Low	51.6	Low	130 Å²	130	109.9 Å²	109.9	61%	0.607	61%	0.61	S	S	*	*	H	α-helix	trans	-71.5	-39.7	174.5	-75.1	-167.1	165.7	0	0	113.2	R429 A430 K431 M435 K436 K437	R429-E433 PolarHBondContact O-N 3.46Å; A430-E433 PolarHBondContact O-N 3.46Å; K431-E433 VanDerWaalsContact C-N 3.34Å; K431-E433 PolarHBondContact O-N 2.97Å; E433-M435 VanDerWaalsContact C-N 3.35Å; E433-K436 WeakPolarHBondContact O-CB 3.24Å; E433-K436 PolarHBondContact O-N 3.34Å; E433-K436 VanDerWaalsContact O-N 3.16Å; E433-K437 PolarHBondContact O-N 2.88Å
434	A	51.8	Low	50.6	Low	29 Å²	29	110.9 Å²	110.9	24%	0.24	62%	0.618	C	S	.	*	H	α-helix	trans	-64.7	-40.1	175.6	0	0	0	0	0	111.4	A430 K431 K436 K437 G438 A439	A430-A434 WeakPolarHBondContact O-CB 3.39Å; A430-A434 PolarHBondContact O-N 3.33Å; K431-A434 PolarHBondContact O-N 3.01Å; A434-K436 VanDerWaalsContact C-N 3.33Å; A434-K436 PolarHBondContact O-N 3.49Å; A434-K437 CarbonylContact O-C 3.58Å; A434-K437 PolarHBondContact O-N 3.24Å; A434-G438 PolarHBondContact O-N 3.35Å; A434-G438 VanDerWaalsContact O-N 3.07Å; A434-A439 PolarHBondContact O-N 3.1Å
435	M	54.2	Low	50.1	Low	159 Å²	159	111.6 Å²	111.6	78%	0.783	62%	0.622	S	S	*	*	H	α-helix	trans	-61.6	-40	170.9	-78.4	-167.7	175.9	0	0	111.6	K431 E433 K437 G438	K431-M435 WeakPolarHBondContact O-CB 3.39Å; K431-M435 WeakPolarHBondContact O-CG 3.31Å; K431-M435 PolarHBondContact O-N 2.91Å; E433-M435 VanDerWaalsContact C-N 3.35Å; M435-K437 VanDerWaalsContact C-N 3.34Å; M435-K437 PolarHBondContact O-N 3.08Å; M435-G438 PolarHBondContact O-N 2.85Å
436	K	57	Low	49.1	Very low	187 Å²	187	115 Å²	115	81%	0.813	64%	0.639	S	S	*	*	H	α-helix	trans	-64.9	-34	173.7	-84.9	-175.8	177.1	178.5	0	113.5	A432 E433 A434	A432-K436 PolarHBondContact O-N 3.3Å; E433-K436 WeakPolarHBondContact O-CB 3.24Å; E433-K436 PolarHBondContact O-N 3.34Å; E433-K436 VanDerWaalsContact O-N 3.16Å; A434-K436 VanDerWaalsContact C-N 3.33Å; A434-K436 PolarHBondContact O-N 3.49Å
437	K	53.4	Low	48.2	Very low	170 Å²	170	113.5 Å²	113.5	74%	0.739	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	4.8	-178	-72.7	-176.9	178.2	172.9	0	114.3	E433 A434 M435 A439	E433-K437 PolarHBondContact O-N 2.88Å; A434-K437 CarbonylContact O-C 3.58Å; A434-K437 PolarHBondContact O-N 3.24Å; M435-K437 VanDerWaalsContact C-N 3.34Å; M435-K437 PolarHBondContact O-N 3.08Å; K437-A439 PolarHBondContact O-N 3.4Å; K437-A439 VanDerWaalsContact O-N 3.1Å
438	G	43.8	Very low	47.7	Very low	72 Å²	72	114.5 Å²	114.5	74%	0.742	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.3	16.2	173.9	0	0	0	0	0	114.9	A434 M435	A434-G438 PolarHBondContact O-N 3.35Å; A434-G438 VanDerWaalsContact O-N 3.07Å; M435-G438 PolarHBondContact O-N 2.85Å
439	A	40.4	Very low	47.4	Very low	58 Å²	58	113 Å²	113	48%	0.479	64%	0.643	S	S	.	*			trans	-108.4	97.4	-178.5	0	0	0	0	0	109.5	A434 K437 A441	A434-A439 PolarHBondContact O-N 3.1Å; K437-A439 PolarHBondContact O-N 3.4Å; K437-A439 VanDerWaalsContact O-N 3.1Å; A439-A441 PolarHBondContact O-N 3.45Å
440	A	39.5	Very low	46.6	Very low	117 Å²	117	108 Å²	108	97%	0.967	64%	0.64	S	S	*	*			trans	-72.8	19	-177.9	0	0	0	0	0	114.8
441	A	38.4	Very low	46.3	Very low	92 Å²	92	107.1 Å²	107.1	76%	0.76	63%	0.628	S	S	*	*			trans	-134.9	73.8	-172.8	0	0	0	0	0	110.9	A439	A439-A441 PolarHBondContact O-N 3.45Å
442	A	36.6	Very low	46.2	Very low	78 Å²	78	104.1 Å²	104.1	65%	0.645	62%	0.618	S	S	*	*			trans	-136.8	91.2	168	0	0	0	0	0	110.1
443	F	33.5	Very low	46.2	Very low	202 Å²	202	105.6 Å²	105.6	89%	0.886	62%	0.622	S	S	*	*			trans	42.7	120.8	147.4	-77.4	-92.3	0	0	0	120.2	P445	F443-P445 WeakPolarHBondContact O-CD 3.37Å
444	D	38.6	Very low	46.3	Very low	119 Å²	119	103.9 Å²	103.9	64%	0.636	61%	0.614	S	S	*	*			trans	-97.9	92.7	164.1	-169.4	7.9	0	0	0	108.4	R427 V446	R427-D444 IonicContact CZ-OD1 3.31Å; R427-D444 IonicContact NH1-OD1 2.72Å; R427-D444 IonicContact NH2-OD1 3.41Å; R427-D444 PolarHBondContact NH2-OD1 2.98Å; D444-V446 PolarHBondContact O-N 3.17Å; D444-V446 VanDerWaalsContact O-N 3.13Å
445	P	42.2	Very low	46.3	Very low	88 Å²	88	104 Å²	104	57%	0.571	61%	0.61	S	S	*	*			trans	-77.3	98.6	166.4	29.6	-27.8	0	0	0	106.3	R427 F443 L447	R427-P445 PolarHBondContact NH2-O 2.99Å; F443-P445 WeakPolarHBondContact O-CD 3.37Å; P445-L447 PolarHBondContact O-N 3.38Å
446	V	40.3	Very low	46.4	Very low	114 Å²	114	100.8 Å²	100.8	69%	0.691	59%	0.593	S	S	*	*			trans	-38.7	131.9	165.9	178.3	0	0	0	0	108.3	D444 D448	D444-V446 PolarHBondContact O-N 3.17Å; D444-V446 VanDerWaalsContact O-N 3.13Å; V446-D448 PolarHBondContact O-N 3.12Å; V446-D448 VanDerWaalsContact O-N 3.11Å
447	L	42.6	Very low	46.9	Very low	75 Å²	75	99.7 Å²	99.7	39%	0.393	59%	0.589	S	S	.	*			trans	-39.5	122.4	173	-86.1	102.1	0	0	0	109.1	L420 P445 D449 L452	L420-L447 HydrophobicContact CD1-CD2 4.49Å; L420-L447 HydrophobicContact CD2-CD2 3.33Å; L420-L447 HydrophobicContact CD2-CG 4.09Å; L420-L447 HydrophobicContact CG-CD2 4.49Å; P445-L447 PolarHBondContact O-N 3.38Å; L447-D449 PolarHBondContact O-N 3.32Å; L447-L452 HydrophobicContact CB-CD1 4.36Å; L447-L452 HydrophobicContact CD2-CD1 4.14Å; L447-L452 HydrophobicContact CD2-CG 4.43Å
448	D	44.4	Very low	47.1	Very low	126 Å²	126	93.3 Å²	93.3	67%	0.674	56%	0.561	S	S	*	*			trans	-55.5	112	176.6	-94.5	-35.6	0	0	0	108.8	V446 A450 V451	V446-D448 PolarHBondContact O-N 3.12Å; V446-D448 VanDerWaalsContact O-N 3.11Å; D448-A450 PolarHBondContact O-N 3.33Å; D448-V451 PolarHBondContact O-N 2.97Å
449	D	49	Very low	47.6	Very low	120 Å²	120	94.3 Å²	94.3	64%	0.642	55%	0.546	S	S	*	.	H	α-helix	trans	-52.5	-29	-170.7	-137.9	-1	0	0	0	112.4	L447 V451 L452 T453	L447-D449 PolarHBondContact O-N 3.32Å; D449-V451 VanDerWaalsContact C-N 3.3Å; D449-V451 PolarHBondContact O-N 3.42Å; D449-L452 PolarHBondContact O-N 2.97Å; D449-T453 PolarHBondContact O-N 3.23Å; D449-T453 VanDerWaalsContact O-N 3.09Å; D449-T453 PolarHBondContact O-OG1 3.42Å; D449-T453 VanDerWaalsContact O-OG1 3.05Å
450	A	49.4	Very low	48.6	Very low	69 Å²	69	95.6 Å²	95.6	57%	0.57	55%	0.545	S	S	*	.	H	α-helix	trans	-57.9	-38.8	177.7	0	0	0	0	0	113	D448 T453 E454	D448-A450 PolarHBondContact O-N 3.33Å; A450-T453 WeakPolarHBondContact CA-OG1 3.34Å; A450-T453 PolarHBondContact O-OG1 3.39Å; A450-E454 PolarHBondContact O-N 3.44Å
451	V	49	Very low	49.7	Very low	38 Å²	38	93.9 Å²	93.9	23%	0.23	52%	0.517	C	S	.	.	H	α-helix	trans	-68.9	-43.2	-177.2	173.1	0	0	0	0	111.3	T416 L420 D448 D449 E454 I455	T416-V451 HydrophobicContact CG2-CB 4.49Å; T416-V451 HydrophobicContact CG2-CG1 3.5Å; T416-V451 HydrophobicContact CG2-CG2 4.36Å; L420-V451 HydrophobicContact CD1-CG1 4.42Å; D448-V451 PolarHBondContact O-N 2.97Å; D449-V451 VanDerWaalsContact C-N 3.3Å; D449-V451 PolarHBondContact O-N 3.42Å; V451-E454 PolarHBondContact O-N 2.98Å; V451-I455 HydrophobicContact CG1-CD1 4.12Å; V451-I455 WeakPolarHBondContact O-CG1 3.46Å; V451-I455 PolarHBondContact O-N 3.31Å
452	L	50.8	Low	50.3	Low	87 Å²	87	91 Å²	91	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-66.5	-43.4	177.7	-78.5	165.8	0	0	0	111.1	L447 D449 E454 I455 Q456	L447-L452 HydrophobicContact CB-CD1 4.36Å; L447-L452 HydrophobicContact CD2-CD1 4.14Å; L447-L452 HydrophobicContact CD2-CG 4.43Å; D449-L452 PolarHBondContact O-N 2.97Å; L452-E454 VanDerWaalsContact C-N 3.32Å; L452-E454 PolarHBondContact O-N 2.98Å; L452-I455 PolarHBondContact O-N 3.03Å; L452-Q456 PolarHBondContact O-N 3.1Å
453	T	56.9	Low	51.2	Low	87 Å²	87	92.6 Å²	92.6	53%	0.534	48%	0.483	S	S	.	.	H	α-helix	trans	-62.6	-35.4	174.9	46.7	0	0	0	0	113.5	D449 A450 Q456 K457	D449-T453 PolarHBondContact O-N 3.23Å; D449-T453 VanDerWaalsContact O-N 3.09Å; D449-T453 PolarHBondContact O-OG1 3.42Å; D449-T453 VanDerWaalsContact O-OG1 3.05Å; A450-T453 WeakPolarHBondContact CA-OG1 3.34Å; A450-T453 PolarHBondContact O-OG1 3.39Å; T453-Q456 PolarHBondContact O-N 3.04Å; T453-K457 PolarHBondContact O-N 2.8Å
454	E	60.9	Low	52.6	Low	95 Å²	95	86.5 Å²	86.5	44%	0.444	46%	0.459	S	S	.	.	H	α-helix	trans	-69.6	-38.8	176	-164.5	-174.5	161.9	0	0	111.8	A450 V451 L452 Q456 K458	A450-E454 PolarHBondContact O-N 3.44Å; V451-E454 PolarHBondContact O-N 2.98Å; L452-E454 VanDerWaalsContact C-N 3.32Å; L452-E454 PolarHBondContact O-N 2.98Å; E454-Q456 VanDerWaalsContact C-N 3.34Å; E454-K458 HydrophobicContact CG-CD 4.42Å; E454-K458 WeakPolarHBondContact O-CB 3.4Å; E454-K458 VanDerWaalsContact O-CG 3.3Å; E454-K458 WeakPolarHBondContact O-CG 3.44Å; E454-K458 PolarHBondContact O-N 3.38Å; E454-K458 WeakPolarHBondContact OE1-CE 3.47Å; E454-K458 IonicContact OE1-NZ 3.72Å; E454-K458 PolarHBondContact OE1-NZ 2.94Å
455	I	50.7	Low	53.3	Low	32 Å²	32	81.6 Å²	81.6	16%	0.164	43%	0.433	C	S	.	.	H	α-helix	trans	-60.2	-46.6	172.9	-71.1	171	0	0	0	110.1	L413 V451 L452 K458 E459	L413-I455 HydrophobicContact CD2-CB 4.33Å; L413-I455 HydrophobicContact CD2-CD1 4.09Å; L413-I455 HydrophobicContact CD2-CG1 3.72Å; L413-I455 HydrophobicContact CD2-CG2 3.9Å; L413-I455 HydrophobicContact CG-CG1 4.28Å; V451-I455 HydrophobicContact CG1-CD1 4.12Å; V451-I455 WeakPolarHBondContact O-CG1 3.46Å; V451-I455 PolarHBondContact O-N 3.31Å; L452-I455 PolarHBondContact O-N 3.03Å; I455-K458 PolarHBondContact O-N 2.97Å; I455-E459 PolarHBondContact O-N 3.04Å
456	Q	56.3	Low	53.7	Low	91 Å²	91	81.1 Å²	81.1	43%	0.425	43%	0.426	S	S	.	.	H	α-helix	trans	-61.1	-50.5	-179.3	-170.6	65.2	42.1	0	0	112.3	L452 T453 E454 K458 E459 D460	L452-Q456 PolarHBondContact O-N 3.1Å; T453-Q456 PolarHBondContact O-N 3.04Å; E454-Q456 VanDerWaalsContact C-N 3.34Å; Q456-K458 PolarHBondContact O-N 2.95Å; Q456-K458 VanDerWaalsContact O-N 3.13Å; Q456-E459 PolarHBondContact O-N 3.35Å; Q456-D460 PolarHBondContact NE2-OD1 3.07Å; Q456-D460 PolarHBondContact O-N 3.12Å
457	K	67.8	Low	54.3	Low	164 Å²	164	81 Å²	81	71%	0.713	42%	0.421	S	S	*	.	H	α-helix	trans	-58.4	-31.6	178.9	-173.3	175	-178.5	178.5	0	112	T453 H461	T453-K457 PolarHBondContact O-N 2.8Å; K457-H461 WeakPolarHBondContact O-CB 3.47Å; K457-H461 PolarHBondContact O-N 3.15Å
458	K	58.2	Low	55	Low	35 Å²	35	83.3 Å²	83.3	15%	0.152	42%	0.424	C	S	.	.	H	α-helix	trans	-79.3	-33.6	177.4	-74.2	-179.7	176.9	175.8	0	112.8	I409 P412 E454 I455 Q456 L462	I409-K458 HydrophobicContact CB-CB 4.47Å; I409-K458 HydrophobicContact CB-CD 4.47Å; I409-K458 HydrophobicContact CG1-CB 4.05Å; I409-K458 HydrophobicContact CG1-CD 4.3Å; I409-K458 HydrophobicContact CG1-CG 4.07Å; I409-K458 HydrophobicContact CG2-CB 3.84Å; I409-K458 HydrophobicContact CG2-CD 4.36Å; I409-K458 HydrophobicContact CG2-CG 4.46Å; P412-K458 VanDerWaalsContact CG-NZ 3.35Å; E454-K458 HydrophobicContact CG-CD 4.42Å; E454-K458 WeakPolarHBondContact O-CB 3.4Å; E454-K458 VanDerWaalsContact O-CG 3.3Å; E454-K458 WeakPolarHBondContact O-CG 3.44Å; E454-K458 PolarHBondContact O-N 3.38Å; E454-K458 WeakPolarHBondContact OE1-CE 3.47Å; E454-K458 IonicContact OE1-NZ 3.72Å; E454-K458 PolarHBondContact OE1-NZ 2.94Å; I455-K458 PolarHBondContact O-N 2.97Å; Q456-K458 PolarHBondContact O-N 2.95Å; Q456-K458 VanDerWaalsContact O-N 3.13Å; K458-L462 WeakPolarHBondContact O-CB 3.43Å; K458-L462 PolarHBondContact O-N 2.93Å
459	E	54.7	Low	55.4	Low	93 Å²	93	80.4 Å²	80.4	44%	0.435	40%	0.404	S	S	.	.	H	α-helix	trans	-65.9	-46.2	173.3	-170.5	174.9	175.5	0	0	111.7	I455 Q456 H461 L462 Q463	I455-E459 PolarHBondContact O-N 3.04Å; Q456-E459 PolarHBondContact O-N 3.35Å; E459-H461 VanDerWaalsContact C-N 3.29Å; E459-H461 PolarHBondContact O-N 3.33Å; E459-L462 WeakPolarHBondContact O-CB 3.5Å; E459-L462 PolarHBondContact O-N 2.64Å; E459-Q463 PolarHBondContact O-N 3.31Å
460	D	60.3	Low	55.3	Low	85 Å²	85	80.4 Å²	80.4	46%	0.455	40%	0.4	S	S	.	.	H	α-helix	trans	-59.7	-42.2	177	-63.6	-16.3	0	0	0	111.1	Q456 L462 Q463 D464	Q456-D460 PolarHBondContact NE2-OD1 3.07Å; Q456-D460 PolarHBondContact O-N 3.12Å; D460-L462 VanDerWaalsContact C-N 3.32Å; D460-L462 PolarHBondContact O-N 2.97Å; D460-Q463 PolarHBondContact O-N 3.12Å; D460-D464 PolarHBondContact O-N 3.43Å; D460-D464 VanDerWaalsContact O-N 3.12Å
461	H	64.3	Low	55.6	Low	82 Å²	82	81.3 Å²	81.3	38%	0.38	40%	0.395	S	S	.	.	H	α-helix	trans	-62.6	-39.5	174.9	-171.5	41.9	0	0	0	112	T405 K457 E459 D464 V465	T405-H461 VanDerWaalsContact CG2-CD2 3.44Å; T405-H461 WeakPolarHBondContact CG2-CD2 3.31Å; T405-H461 WeakPolarHBondContact CG2-NE2 3.39Å; K457-H461 WeakPolarHBondContact O-CB 3.47Å; K457-H461 PolarHBondContact O-N 3.15Å; E459-H461 VanDerWaalsContact C-N 3.29Å; E459-H461 PolarHBondContact O-N 3.33Å; H461-D464 PolarHBondContact O-N 3.44Å; H461-V465 WeakPolarHBondContact O-CG2 3.36Å; H461-V465 PolarHBondContact O-N 3.21Å
462	L	50.9	Low	55.5	Low	30 Å²	30	82.3 Å²	82.3	16%	0.157	41%	0.407	C	S	.	.	H	α-helix	trans	-70.5	-37	-179.6	-159.1	136.9	0	0	0	112	F406 I409 K458 E459 D460 V465 L466	F406-L462 HydrophobicContact CD1-CD1 3.67Å; F406-L462 HydrophobicContact CD1-CG 4.29Å; F406-L462 HydrophobicContact CE1-CD1 3.46Å; F406-L462 VanDerWaalsContact CE1-CD1 3.46Å; F406-L462 HydrophobicContact CE1-CD2 3.89Å; F406-L462 HydrophobicContact CE1-CG 3.63Å; F406-L462 HydrophobicContact CZ-CD1 4.47Å; F406-L462 HydrophobicContact CZ-CD2 4.4Å; F406-L462 HydrophobicContact CZ-CG 4.21Å; I409-L462 HydrophobicContact CB-CD1 4.43Å; I409-L462 HydrophobicContact CD1-CB 4.18Å; I409-L462 HydrophobicContact CD1-CD1 3.95Å; I409-L462 HydrophobicContact CG2-CD1 3.82Å; K458-L462 WeakPolarHBondContact O-CB 3.43Å; K458-L462 PolarHBondContact O-N 2.93Å; E459-L462 WeakPolarHBondContact O-CB 3.5Å; E459-L462 PolarHBondContact O-N 2.64Å; D460-L462 VanDerWaalsContact C-N 3.32Å; D460-L462 PolarHBondContact O-N 2.97Å; L462-V465 PolarHBondContact O-N 2.98Å; L462-L466 HydrophobicContact CD2-CD1 3.82Å; L462-L466 HydrophobicContact CD2-CG 4.42Å; L462-L466 WeakPolarHBondContact O-CB 3.47Å; L462-L466 VanDerWaalsContact O-CG 3.27Å; L462-L466 WeakPolarHBondContact O-CG 3.45Å; L462-L466 PolarHBondContact O-N 3.48Å
463	Q	55.7	Low	55.4	Low	113 Å²	113	84.5 Å²	84.5	53%	0.528	41%	0.409	S	S	.	.	H	α-helix	trans	-62.8	-46.2	172.8	-73.7	-175.4	3.5	0	0	111.8	E459 D460 V465 L466 L467	E459-Q463 PolarHBondContact O-N 3.31Å; D460-Q463 PolarHBondContact O-N 3.12Å; Q463-V465 VanDerWaalsContact C-N 3.34Å; Q463-V465 PolarHBondContact O-N 3.34Å; Q463-L466 PolarHBondContact O-N 3.36Å; Q463-L467 PolarHBondContact O-N 3.32Å
464	D	62.8	Low	55	Low	74 Å²	74	83 Å²	83	40%	0.396	40%	0.4	S	S	.	.	H	α-helix	trans	-61.9	-41.2	177.8	-178.2	43.3	0	0	0	112	D460 H461 L466 L467 R468	D460-D464 PolarHBondContact O-N 3.43Å; D460-D464 VanDerWaalsContact O-N 3.12Å; H461-D464 PolarHBondContact O-N 3.44Å; D464-L466 PolarHBondContact O-N 3.03Å; D464-L467 PolarHBondContact O-N 3.03Å; D464-R468 PolarHBondContact O-N 2.77Å; D464-R468 IonicContact OD1-NE 2.7Å; D464-R468 IonicContact OD2-CZ 2.81Å; D464-R468 IonicContact OD2-NE 2.68Å; D464-R468 PolarHBondContact OD2-NE 3.21Å; D464-R468 IonicContact OD2-NH2 3.54Å; D464-R468 PolarHBondContact OD2-NH2 2.87Å
465	V	53.3	Low	54.5	Low	15 Å²	15	81.8 Å²	81.8	9%	0.091	40%	0.402	C	S	.	.	H	α-helix	trans	-63.3	-40.1	174.8	170.6	0	0	0	0	112.1	L402 T405 H461 L462 Q463 R469	L402-V465 HydrophobicContact CD1-CG1 3.3Å; L402-V465 HydrophobicContact CG-CG1 4.08Å; T405-V465 HydrophobicContact CG2-CG2 4.22Å; H461-V465 WeakPolarHBondContact O-CG2 3.36Å; H461-V465 PolarHBondContact O-N 3.21Å; L462-V465 PolarHBondContact O-N 2.98Å; Q463-V465 VanDerWaalsContact C-N 3.34Å; Q463-V465 PolarHBondContact O-N 3.34Å; V465-R469 PolarHBondContact O-N 3.29Å
466	L	48.7	Very low	54.3	Low	79 Å²	79	87.6 Å²	87.6	41%	0.414	42%	0.422	S	S	.	.	H	α-helix	trans	-67.2	-39	176.2	-74.2	173	0	0	0	112.1	F406 L462 Q463 D464 R469 H470	F406-L466 HydrophobicContact CZ-CD2 4.3Å; L462-L466 HydrophobicContact CD2-CD1 3.82Å; L462-L466 HydrophobicContact CD2-CG 4.42Å; L462-L466 WeakPolarHBondContact O-CB 3.47Å; L462-L466 VanDerWaalsContact O-CG 3.27Å; L462-L466 WeakPolarHBondContact O-CG 3.45Å; L462-L466 PolarHBondContact O-N 3.48Å; Q463-L466 PolarHBondContact O-N 3.36Å; D464-L466 PolarHBondContact O-N 3.03Å; L466-R469 PolarHBondContact O-N 3.15Å; L466-H470 PolarHBondContact O-N 3.23Å
467	L	54.1	Low	53.8	Low	112 Å²	112	86 Å²	86	59%	0.586	42%	0.424	S	S	*	.	H	α-helix	trans	-63.9	-49.9	178.4	-152.1	89.8	0	0	0	111.2	Q463 D464 R469 H470 D471	Q463-L467 PolarHBondContact O-N 3.32Å; D464-L467 PolarHBondContact O-N 3.03Å; L467-R469 PolarHBondContact O-N 2.92Å; L467-R469 VanDerWaalsContact O-N 3.17Å; L467-H470 WeakPolarHBondContact O-CB 3.44Å; L467-H470 PolarHBondContact O-N 2.71Å; L467-D471 PolarHBondContact O-N 3.4Å; L467-D471 VanDerWaalsContact O-N 3.12Å
468	R	57	Low	52.9	Low	122 Å²	122	83.3 Å²	83.3	46%	0.46	41%	0.414	S	S	.	.	H	α-helix	trans	-56.9	-33.7	175.8	-73.1	-171.6	-98.4	152.3	-8	112.6	D464 A472	D464-R468 PolarHBondContact O-N 2.77Å; D464-R468 IonicContact OD1-NE 2.7Å; D464-R468 IonicContact OD2-CZ 2.81Å; D464-R468 IonicContact OD2-NE 2.68Å; D464-R468 PolarHBondContact OD2-NE 3.21Å; D464-R468 IonicContact OD2-NH2 3.54Å; D464-R468 PolarHBondContact OD2-NH2 2.87Å; R468-A472 PolarHBondContact O-N 2.95Å; R468-A472 VanDerWaalsContact O-N 3.08Å
469	R	52.3	Low	52.4	Low	66 Å²	66	84.4 Å²	84.4	25%	0.249	43%	0.429	C	S	.	.	H	α-helix	trans	-76	-33.7	175.7	-166.9	179.9	-172.8	-172.2	4.4	113.2	V465 L466 L467 D471 A472 R473	V465-R469 PolarHBondContact O-N 3.29Å; L466-R469 PolarHBondContact O-N 3.15Å; L467-R469 PolarHBondContact O-N 2.92Å; L467-R469 VanDerWaalsContact O-N 3.17Å; R469-D471 VanDerWaalsContact C-N 3.27Å; R469-A472 PolarHBondContact O-N 3.24Å; R469-R473 WeakPolarHBondContact O-CB 3.38Å; R469-R473 WeakPolarHBondContact O-CG 3.38Å; R469-R473 PolarHBondContact O-N 3.25Å
470	H	47.6	Very low	52	Low	120 Å²	120	84.4 Å²	84.4	56%	0.556	43%	0.432	S	S	*	.	H	α-helix	trans	-57.7	-47.6	171.4	176.8	-84.2	0	0	0	109.5	L466 L467 A472 R473 V474	L466-H470 PolarHBondContact O-N 3.23Å; L467-H470 WeakPolarHBondContact O-CB 3.44Å; L467-H470 PolarHBondContact O-N 2.71Å; H470-A472 PolarHBondContact O-N 3.39Å; H470-R473 PolarHBondContact O-N 2.78Å; H470-R473 VanDerWaalsContact O-N 3.14Å; H470-V474 WeakPolarHBondContact O-CG2 3.5Å; H470-V474 PolarHBondContact O-N 3.48Å
471	D	55.1	Low	51.5	Low	88 Å²	88	85.5 Å²	85.5	47%	0.471	43%	0.434	S	S	.	.	H	α-helix	trans	-64.4	-39.9	179.2	-64.2	-15	0	0	0	112.5	L467 R469 R473 V474 S475	L467-D471 PolarHBondContact O-N 3.4Å; L467-D471 VanDerWaalsContact O-N 3.12Å; R469-D471 VanDerWaalsContact C-N 3.27Å; D471-R473 PolarHBondContact O-N 2.86Å; D471-V474 PolarHBondContact O-N 2.89Å; D471-S475 WeakPolarHBondContact O-CB 3.39Å; D471-S475 PolarHBondContact O-N 3.48Å; D471-S475 PolarHBondContact O-OG 2.98Å
472	A	48.3	Very low	50.9	Low	58 Å²	58	86.9 Å²	86.9	48%	0.479	44%	0.444	S	S	.	.	H	α-helix	trans	-64.6	-37.9	173.5	0	0	0	0	0	112.7	R468 R469 H470 R476	R468-A472 PolarHBondContact O-N 2.95Å; R468-A472 VanDerWaalsContact O-N 3.08Å; R469-A472 PolarHBondContact O-N 3.24Å; H470-A472 PolarHBondContact O-N 3.39Å; A472-R476 WeakPolarHBondContact O-CB 3.26Å; A472-R476 PolarHBondContact O-N 3.3Å
473	R	47.8	Very low	50.7	Low	134 Å²	134	90.4 Å²	90.4	51%	0.506	46%	0.463	S	S	.	.	H	α-helix	trans	-69.4	-40	176.2	-78.4	178.9	176.3	174.8	0.7	112.2	R469 H470 D471 R476 A477	R469-R473 WeakPolarHBondContact O-CB 3.38Å; R469-R473 WeakPolarHBondContact O-CG 3.38Å; R469-R473 PolarHBondContact O-N 3.25Å; H470-R473 PolarHBondContact O-N 2.78Å; H470-R473 VanDerWaalsContact O-N 3.14Å; D471-R473 PolarHBondContact O-N 2.86Å; R473-R476 PolarHBondContact O-N 3.2Å; R473-A477 WeakPolarHBondContact O-CB 3.25Å; R473-A477 PolarHBondContact O-N 2.95Å
474	V	47.9	Very low	50.5	Low	55 Å²	55	91.6 Å²	91.6	33%	0.333	47%	0.468	S	S	.	.	H	α-helix	trans	-61.6	-48.9	173.7	172.3	0	0	0	0	109.4	H470 D471 R476 A477 E478	H470-V474 WeakPolarHBondContact O-CG2 3.5Å; H470-V474 PolarHBondContact O-N 3.48Å; D471-V474 PolarHBondContact O-N 2.89Å; V474-R476 VanDerWaalsContact C-N 3.26Å; V474-R476 PolarHBondContact O-N 3.32Å; V474-A477 WeakPolarHBondContact O-CB 3.47Å; V474-A477 PolarHBondContact O-N 2.9Å; V474-E478 WeakPolarHBondContact O-CG 3.3Å; V474-E478 PolarHBondContact O-N 3.3Å
475	S	51.6	Low	50	Low	70 Å²	70	93.7 Å²	93.7	49%	0.49	48%	0.476	S	S	.	.	H	α-helix	trans	-57.2	-38.8	175.9	-56.9	0	0	0	0	112.4	D471 A479	D471-S475 WeakPolarHBondContact O-CB 3.39Å; D471-S475 PolarHBondContact O-N 3.48Å; D471-S475 PolarHBondContact O-OG 2.98Å; S475-A479 WeakPolarHBondContact O-CB 3.45Å; S475-A479 PolarHBondContact O-N 2.9Å
476	R	46	Very low	49.9	Very low	154 Å²	154	96.5 Å²	96.5	58%	0.581	50%	0.496	S	S	*	.	H	α-helix	trans	-67.4	-42.8	174.2	179.8	179.7	174.7	-175.3	0.3	112.5	A472 R473 V474 E478 A479 L480	A472-R476 WeakPolarHBondContact O-CB 3.26Å; A472-R476 PolarHBondContact O-N 3.3Å; R473-R476 PolarHBondContact O-N 3.2Å; V474-R476 VanDerWaalsContact C-N 3.26Å; V474-R476 PolarHBondContact O-N 3.32Å; R476-E478 VanDerWaalsContact C-N 3.32Å; R476-A479 PolarHBondContact O-N 3.49Å; R476-L480 HydrophobicContact CG-CD1 4.01Å; R476-L480 HydrophobicContact CG-CG 4.37Å; R476-L480 WeakPolarHBondContact O-CB 3.28Å; R476-L480 WeakPolarHBondContact O-CG 3.4Å; R476-L480 PolarHBondContact O-N 3.38Å
477	A	46.5	Very low	49.8	Very low	57 Å²	57	97.7 Å²	97.7	47%	0.471	50%	0.502	S	S	.	.	H	α-helix	trans	-62.2	-43.7	178.5	0	0	0	0	0	110.6	R473 V474 L480 E481	R473-A477 WeakPolarHBondContact O-CB 3.25Å; R473-A477 PolarHBondContact O-N 2.95Å; V474-A477 WeakPolarHBondContact O-CB 3.47Å; V474-A477 PolarHBondContact O-N 2.9Å; A477-L480 PolarHBondContact O-N 3.01Å; A477-E481 WeakPolarHBondContact O-CB 3.46Å; A477-E481 PolarHBondContact O-N 3.31Å
478	E	48.8	Very low	49.9	Very low	108 Å²	108	95.1 Å²	95.1	51%	0.505	49%	0.493	S	S	.	.	H	α-helix	trans	-62.3	-43.6	174.3	-68.9	176	174.9	0	0	111.9	V474 R476 L480 E481 N482	V474-E478 WeakPolarHBondContact O-CG 3.3Å; V474-E478 PolarHBondContact O-N 3.3Å; R476-E478 VanDerWaalsContact C-N 3.32Å; E478-L480 PolarHBondContact O-N 3.39Å; E478-E481 PolarHBondContact O-N 2.92Å; E478-N482 WeakPolarHBondContact O-CB 3.42Å; E478-N482 VanDerWaalsContact O-CG 3.26Å; E478-N482 PolarHBondContact O-N 3.25Å; E478-N482 PolarHBondContact O-ND2 3.23Å
479	A	48	Very low	49.7	Very low	57 Å²	57	95 Å²	95	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-64.1	-40.1	176.4	0	0	0	0	0	112.6	S475 R476 L483	S475-A479 WeakPolarHBondContact O-CB 3.45Å; S475-A479 PolarHBondContact O-N 2.9Å; R476-A479 PolarHBondContact O-N 3.49Å; A479-L483 WeakPolarHBondContact O-CB 3.24Å; A479-L483 PolarHBondContact O-N 2.82Å
480	L	45.4	Very low	49.9	Very low	93 Å²	93	97.1 Å²	97.1	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-69.6	-38.4	176.5	-74.8	173.4	0	0	0	112.1	R476 A477 E478 L483 Q484	R476-L480 HydrophobicContact CG-CD1 4.01Å; R476-L480 HydrophobicContact CG-CG 4.37Å; R476-L480 WeakPolarHBondContact O-CB 3.28Å; R476-L480 WeakPolarHBondContact O-CG 3.4Å; R476-L480 PolarHBondContact O-N 3.38Å; A477-L480 PolarHBondContact O-N 3.01Å; E478-L480 PolarHBondContact O-N 3.39Å; L480-L483 PolarHBondContact O-N 2.94Å; L480-Q484 VanDerWaalsContact O-CB 3.31Å; L480-Q484 WeakPolarHBondContact O-CB 3.45Å; L480-Q484 PolarHBondContact O-N 2.87Å
481	E	48.9	Very low	50	Low	108 Å²	108	96 Å²	96	51%	0.505	50%	0.503	S	S	.	.	H	α-helix	trans	-63.1	-44.6	173.9	-174.6	171.3	-160.1	0	0	110.6	A477 E478 L483 Q484 H485	A477-E481 WeakPolarHBondContact O-CB 3.46Å; A477-E481 PolarHBondContact O-N 3.31Å; E478-E481 PolarHBondContact O-N 2.92Å; E481-L483 VanDerWaalsContact C-N 3.33Å; E481-L483 PolarHBondContact O-N 3.4Å; E481-Q484 WeakPolarHBondContact O-CB 3.17Å; E481-Q484 PolarHBondContact O-N 3.36Å; E481-H485 PolarHBondContact O-CD2 3.02Å; E481-H485 PolarHBondContact O-N 3.46Å
482	N	51.4	Low	50.3	Low	111 Å²	111	98.3 Å²	98.3	59%	0.594	51%	0.509	S	S	*	.	H	α-helix	trans	-60.1	-42	173.1	-74.9	-30.2	0	0	0	112.4	E478 H485 S486	E478-N482 WeakPolarHBondContact O-CB 3.42Å; E478-N482 VanDerWaalsContact O-CG 3.26Å; E478-N482 PolarHBondContact O-N 3.25Å; E478-N482 PolarHBondContact O-ND2 3.23Å; N482-H485 PolarHBondContact O-N 2.83Å; N482-S486 WeakPolarHBondContact O-CB 3.39Å; N482-S486 PolarHBondContact O-N 3.46Å
483	L	48.4	Very low	50.7	Low	105 Å²	105	99.4 Å²	99.4	55%	0.55	50%	0.504	S	S	.	.	H	α-helix	trans	-67.5	-38.8	177.1	-157.7	120.6	0	0	0	111.4	A479 L480 E481 S486 L487	A479-L483 WeakPolarHBondContact O-CB 3.24Å; A479-L483 PolarHBondContact O-N 2.82Å; L480-L483 PolarHBondContact O-N 2.94Å; E481-L483 VanDerWaalsContact C-N 3.33Å; E481-L483 PolarHBondContact O-N 3.4Å; L483-S486 PolarHBondContact O-N 3.31Å; L483-L487 HydrophobicContact CD2-CD1 3.81Å; L483-L487 HydrophobicContact CD2-CG 4.39Å; L483-L487 WeakPolarHBondContact O-CB 3.25Å; L483-L487 VanDerWaalsContact O-CG 3.29Å; L483-L487 WeakPolarHBondContact O-CG 3.22Å; L483-L487 PolarHBondContact O-N 3.33Å
484	Q	51.5	Low	50.8	Low	138 Å²	138	98.2 Å²	98.2	65%	0.645	51%	0.507	S	S	*	.	H	α-helix	trans	-64.2	-43.1	174.9	-175.8	179.5	-6.7	0	0	111.3	L480 E481 L487 C488	L480-Q484 VanDerWaalsContact O-CB 3.31Å; L480-Q484 WeakPolarHBondContact O-CB 3.45Å; L480-Q484 PolarHBondContact O-N 2.87Å; E481-Q484 WeakPolarHBondContact O-CB 3.17Å; E481-Q484 PolarHBondContact O-N 3.36Å; Q484-L487 PolarHBondContact O-N 3.38Å; Q484-C488 VanDerWaalsContact O-CB 3.31Å; Q484-C488 WeakPolarHBondContact O-CB 3.19Å; Q484-C488 PolarHBondContact O-N 2.93Å
485	H	51.4	Low	51.1	Low	118 Å²	118	100.3 Å²	100.3	55%	0.546	51%	0.513	S	S	.	.	H	α-helix	trans	-62.4	-43	173.2	-77.9	-59.7	0	0	0	111.9	E481 N482 C488 H489	E481-H485 PolarHBondContact O-CD2 3.02Å; E481-H485 PolarHBondContact O-N 3.46Å; N482-H485 PolarHBondContact O-N 2.83Å; H485-C488 PolarHBondContact O-N 3.4Å; H485-H489 PolarHBondContact O-N 3.07Å
486	S	50.4	Low	51.9	Low	73 Å²	73	102 Å²	102	51%	0.51	51%	0.513	S	S	.	.	H	α-helix	trans	-63.2	-41.5	175.7	-176.9	0	0	0	0	112.3	N482 L483 H489 K490	N482-S486 WeakPolarHBondContact O-CB 3.39Å; N482-S486 PolarHBondContact O-N 3.46Å; L483-S486 PolarHBondContact O-N 3.31Å; S486-H489 PolarHBondContact O-N 3.18Å; S486-K490 WeakPolarHBondContact O-CG 3.44Å; S486-K490 PolarHBondContact O-N 2.78Å
487	L	46.8	Very low	52.4	Low	105 Å²	105	99.1 Å²	99.1	55%	0.55	51%	0.509	S	S	.	.	H	α-helix	trans	-67.1	-42	176.8	-75.1	173.9	0	0	0	111.3	L483 Q484 H489 K490 E491	L483-L487 HydrophobicContact CD2-CD1 3.81Å; L483-L487 HydrophobicContact CD2-CG 4.39Å; L483-L487 WeakPolarHBondContact O-CB 3.25Å; L483-L487 VanDerWaalsContact O-CG 3.29Å; L483-L487 WeakPolarHBondContact O-CG 3.22Å; L483-L487 PolarHBondContact O-N 3.33Å; Q484-L487 PolarHBondContact O-N 3.38Å; L487-H489 VanDerWaalsContact C-N 3.32Å; L487-H489 PolarHBondContact O-N 2.89Å; L487-K490 CarbonylContact O-C 3.59Å; L487-K490 PolarHBondContact O-N 2.94Å; L487-E491 WeakPolarHBondContact O-CB 3.39Å; L487-E491 PolarHBondContact O-N 3.31Å
488	C	56.4	Low	52.5	Low	57 Å²	57	100.9 Å²	100.9	39%	0.385	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-39.1	175.7	-175.7	0	0	0	0	111.7	Q484 H485 E491 K492	Q484-C488 VanDerWaalsContact O-CB 3.31Å; Q484-C488 WeakPolarHBondContact O-CB 3.19Å; Q484-C488 PolarHBondContact O-N 2.93Å; H485-C488 PolarHBondContact O-N 3.4Å; C488-E491 PolarHBondContact O-N 3.01Å; C488-K492 PolarHBondContact O-N 3.25Å; C488-K492 VanDerWaalsContact O-N 3.09Å
489	H	54.1	Low	53.3	Low	119 Å²	119	101.6 Å²	101.6	55%	0.551	51%	0.51	S	S	*	.	H	α-helix	trans	-64.3	-43.8	174	-160.2	-73.2	0	0	0	111.7	H485 S486 L487 E491 K492 E493	H485-H489 PolarHBondContact O-N 3.07Å; S486-H489 PolarHBondContact O-N 3.18Å; L487-H489 VanDerWaalsContact C-N 3.32Å; L487-H489 PolarHBondContact O-N 2.89Å; H489-E491 VanDerWaalsContact C-N 3.35Å; H489-K492 PolarHBondContact O-N 3.02Å; H489-E493 IonicContact CE1-OE1 3.51Å; H489-E493 PolarHBondContact CE1-OE1 3.37Å; H489-E493 IonicContact ND1-OE1 3.43Å; H489-E493 PolarHBondContact ND1-OE1 2.93Å; H489-E493 PolarHBondContact O-N 2.94Å
490	K	56.6	Low	54	Low	111 Å²	111	102.7 Å²	102.7	48%	0.483	51%	0.508	S	S	.	.	H	α-helix	trans	-67.5	-33	176.7	-74.8	-76.3	166.9	-159.7	0	113	S486 L487 E493 L494	S486-K490 WeakPolarHBondContact O-CG 3.44Å; S486-K490 PolarHBondContact O-N 2.78Å; L487-K490 CarbonylContact O-C 3.59Å; L487-K490 PolarHBondContact O-N 2.94Å; K490-E493 WeakPolarHBondContact CD-OE2 3.3Å; K490-E493 WeakPolarHBondContact CE-OE2 3.4Å; K490-E493 IonicContact NZ-OE1 3.47Å; K490-E493 IonicContact NZ-OE2 4Å; K490-E493 PolarHBondContact NZ-OE2 3Å; K490-E493 WeakPolarHBondContact O-CB 3.37Å; K490-E493 PolarHBondContact O-N 3.2Å; K490-L494 WeakPolarHBondContact O-CG 3.35Å; K490-L494 PolarHBondContact O-N 2.94Å
491	E	49.2	Very low	54.2	Low	96 Å²	96	99.9 Å²	99.9	45%	0.449	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-44.2	173	-172	175.5	-167.1	0	0	110.5	L487 C488 H489 E493 L494 E495	L487-E491 WeakPolarHBondContact O-CB 3.39Å; L487-E491 PolarHBondContact O-N 3.31Å; C488-E491 PolarHBondContact O-N 3.01Å; H489-E491 VanDerWaalsContact C-N 3.35Å; E491-E493 VanDerWaalsContact C-N 3.34Å; E491-E493 PolarHBondContact O-N 2.86Å; E491-L494 PolarHBondContact O-N 3.17Å; E491-E495 PolarHBondContact O-N 3.42Å
492	K	61.1	Low	54.8	Low	138 Å²	138	99 Å²	99	60%	0.6	50%	0.495	S	S	*	.	H	α-helix	trans	-62	-39.5	172.9	-71.6	-179.7	-179.4	179.7	0	112.8	C488 H489 Q496	C488-K492 PolarHBondContact O-N 3.25Å; C488-K492 VanDerWaalsContact O-N 3.09Å; H489-K492 PolarHBondContact O-N 3.02Å; K492-Q496 WeakPolarHBondContact O-CB 3.44Å; K492-Q496 PolarHBondContact O-N 3.06Å
493	E	56	Low	55.4	Low	81 Å²	81	98.2 Å²	98.2	38%	0.379	49%	0.49	S	S	.	.	H	α-helix	trans	-63.1	-41.2	173.7	-72.9	171.3	-152.8	0	0	111.9	H489 K490 E491 Q496 L497	H489-E493 IonicContact CE1-OE1 3.51Å; H489-E493 PolarHBondContact CE1-OE1 3.37Å; H489-E493 IonicContact ND1-OE1 3.43Å; H489-E493 PolarHBondContact ND1-OE1 2.93Å; H489-E493 PolarHBondContact O-N 2.94Å; K490-E493 WeakPolarHBondContact CD-OE2 3.3Å; K490-E493 WeakPolarHBondContact CE-OE2 3.4Å; K490-E493 IonicContact NZ-OE1 3.47Å; K490-E493 IonicContact NZ-OE2 4Å; K490-E493 PolarHBondContact NZ-OE2 3Å; K490-E493 WeakPolarHBondContact O-CB 3.37Å; K490-E493 PolarHBondContact O-N 3.2Å; E491-E493 VanDerWaalsContact C-N 3.34Å; E491-E493 PolarHBondContact O-N 2.86Å; E493-Q496 PolarHBondContact O-N 2.94Å; E493-L497 WeakPolarHBondContact O-CB 3.42Å; E493-L497 PolarHBondContact O-N 3.01Å
494	L	49.8	Very low	55.9	Low	108 Å²	108	97.9 Å²	97.9	57%	0.565	49%	0.489	S	S	*	.	H	α-helix	trans	-69.1	-41.7	177.2	-79.3	167.8	0	0	0	112.5	K490 E491 Q496 L497 M498	K490-L494 WeakPolarHBondContact O-CG 3.35Å; K490-L494 PolarHBondContact O-N 2.94Å; E491-L494 PolarHBondContact O-N 3.17Å; L494-Q496 VanDerWaalsContact C-N 3.27Å; L494-Q496 PolarHBondContact O-N 3.3Å; L494-L497 CarbonylContact O-C 3.53Å; L494-L497 WeakPolarHBondContact O-CB 3.46Å; L494-L497 PolarHBondContact O-N 2.93Å; L494-L497 VanDerWaalsContact O-N 3.17Å; L494-M498 WeakPolarHBondContact O-CG 3.22Å; L494-M498 PolarHBondContact O-N 3.42Å
495	E	55.6	Low	56	Low	99 Å²	99	95.8 Å²	95.8	46%	0.463	48%	0.481	S	S	.	.	H	α-helix	trans	-60.1	-39.4	173.2	-77.8	-173.6	165.3	0	0	111.4	E491 M498 K499	E491-E495 PolarHBondContact O-N 3.42Å; E495-M498 PolarHBondContact O-N 2.94Å; E495-K499 WeakPolarHBondContact O-CG 3.37Å; E495-K499 PolarHBondContact O-N 3.06Å
496	Q	66.7	Low	56.3	Low	105 Å²	105	93.9 Å²	93.9	49%	0.491	48%	0.481	S	S	.	.	H	α-helix	trans	-66.6	-40.9	174.3	-167.2	66.2	28.1	0	0	111.5	K492 E493 L494 M498 K499 N500	K492-Q496 WeakPolarHBondContact O-CB 3.44Å; K492-Q496 PolarHBondContact O-N 3.06Å; E493-Q496 PolarHBondContact O-N 2.94Å; L494-Q496 VanDerWaalsContact C-N 3.27Å; L494-Q496 PolarHBondContact O-N 3.3Å; Q496-M498 VanDerWaalsContact C-N 3.34Å; Q496-K499 PolarHBondContact O-N 3.47Å; Q496-N500 VanDerWaalsContact O-CG 3.25Å; Q496-N500 PolarHBondContact O-N 3.41Å; Q496-N500 PolarHBondContact O-OD1 2.98Å
497	L	56.7	Low	56.5	Low	94 Å²	94	95.5 Å²	95.5	49%	0.492	48%	0.48	S	S	.	.	H	α-helix	trans	-65.3	-37.9	176.1	-154.4	102.7	0	0	0	111.9	E493 L494 N500 C501	E493-L497 WeakPolarHBondContact O-CB 3.42Å; E493-L497 PolarHBondContact O-N 3.01Å; L494-L497 CarbonylContact O-C 3.53Å; L494-L497 WeakPolarHBondContact O-CB 3.46Å; L494-L497 PolarHBondContact O-N 2.93Å; L494-L497 VanDerWaalsContact O-N 3.17Å; L497-N500 PolarHBondContact O-N 3.36Å; L497-C501 PolarHBondContact O-N 2.9Å; L497-C501 PolarHBondContact O-SG 3.22Å
498	M	49.4	Very low	56.6	Low	95 Å²	95	96 Å²	96	47%	0.468	48%	0.483	S	S	.	.	H	α-helix	trans	-61.6	-48.4	173.8	-77.9	-176.6	61	0	0	110.9	L494 E495 Q496 N500 C501 D502	L494-M498 WeakPolarHBondContact O-CG 3.22Å; L494-M498 PolarHBondContact O-N 3.42Å; E495-M498 PolarHBondContact O-N 2.94Å; Q496-M498 VanDerWaalsContact C-N 3.34Å; M498-N500 VanDerWaalsContact C-N 3.28Å; M498-N500 PolarHBondContact O-N 3.07Å; M498-C501 PolarHBondContact O-N 3.2Å; M498-C501 VanDerWaalsContact O-N 3.08Å; M498-D502 PolarHBondContact O-N 3.18Å
499	K	65.5	Low	56.7	Low	122 Å²	122	96.4 Å²	96.4	53%	0.53	48%	0.484	S	S	.	.	H	α-helix	trans	-57.4	-41.7	174.7	-75.4	177.4	-179.1	173.7	0	112.3	E495 Q496 D502 N503	E495-K499 WeakPolarHBondContact O-CG 3.37Å; E495-K499 PolarHBondContact O-N 3.06Å; Q496-K499 PolarHBondContact O-N 3.47Å; K499-D502 PolarHBondContact O-N 2.92Å; K499-N503 PolarHBondContact O-N 3.38Å; K499-N503 PolarHBondContact O-ND2 3.39Å; K499-N503 PolarHBondContact O-OD1 2.86Å
500	N	63	Low	56.8	Low	80 Å²	80	96.5 Å²	96.5	43%	0.428	49%	0.485	S	S	.	.	H	α-helix	trans	-65.6	-38.5	176.6	-66.9	-6	0	0	0	112	Q496 L497 M498 L504	Q496-N500 VanDerWaalsContact O-CG 3.25Å; Q496-N500 PolarHBondContact O-N 3.41Å; Q496-N500 PolarHBondContact O-OD1 2.98Å; L497-N500 PolarHBondContact O-N 3.36Å; M498-N500 VanDerWaalsContact C-N 3.28Å; M498-N500 PolarHBondContact O-N 3.07Å; N500-L504 WeakPolarHBondContact O-CG 3.4Å; N500-L504 PolarHBondContact O-N 3.28Å
501	C	49.3	Very low	56.6	Low	35 Å²	35	95.5 Å²	95.5	24%	0.236	48%	0.484	C	S	.	.	H	α-helix	trans	-67.8	-42.2	175.7	-66.9	0	0	0	0	111.8	L497 M498 N503 L504 I505	L497-C501 PolarHBondContact O-N 2.9Å; L497-C501 PolarHBondContact O-SG 3.22Å; M498-C501 PolarHBondContact O-N 3.2Å; M498-C501 VanDerWaalsContact O-N 3.08Å; C501-N503 VanDerWaalsContact C-N 3.31Å; C501-N503 PolarHBondContact O-N 2.98Å; C501-L504 PolarHBondContact O-N 2.79Å; C501-I505 VanDerWaalsContact O-CG1 3.28Å; C501-I505 WeakPolarHBondContact O-CG1 3.29Å; C501-I505 PolarHBondContact O-N 2.9Å
502	D	62.3	Low	57.1	Low	90 Å²	90	96.6 Å²	96.6	48%	0.481	49%	0.487	S	S	.	.	H	α-helix	trans	-62	-41.1	176.8	-69.7	-23.5	0	0	0	110.6	M498 K499 I505 S506	M498-D502 PolarHBondContact O-N 3.18Å; K499-D502 PolarHBondContact O-N 2.92Å; D502-I505 PolarHBondContact O-N 3.16Å; D502-S506 PolarHBondContact O-N 3.23Å; D502-S506 PolarHBondContact O-OG 3.34Å
503	N	64.3	Low	57.1	Low	93 Å²	93	95.9 Å²	95.9	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-60.7	-46.6	173.1	-68.6	-9.4	0	0	0	112	K499 C501 I505 S506 E507	K499-N503 PolarHBondContact O-N 3.38Å; K499-N503 PolarHBondContact O-ND2 3.39Å; K499-N503 PolarHBondContact O-OD1 2.86Å; C501-N503 VanDerWaalsContact C-N 3.31Å; C501-N503 PolarHBondContact O-N 2.98Å; N503-I505 VanDerWaalsContact C-N 3.32Å; N503-I505 PolarHBondContact O-N 2.98Å; N503-S506 WeakPolarHBondContact O-CB 3.49Å; N503-S506 PolarHBondContact O-N 2.85Å; N503-E507 WeakPolarHBondContact O-CG 3.39Å; N503-E507 PolarHBondContact O-N 3.21Å
504	L	57	Low	57.1	Low	98 Å²	98	97.7 Å²	97.7	51%	0.513	49%	0.494	S	S	.	.	H	α-helix	trans	-62.8	-37.7	177.1	-76.8	166.1	0	0	0	112.5	N500 C501 E507 L508	N500-L504 WeakPolarHBondContact O-CG 3.4Å; N500-L504 PolarHBondContact O-N 3.28Å; C501-L504 PolarHBondContact O-N 2.79Å; L504-E507 PolarHBondContact O-N 3.21Å; L504-L508 WeakPolarHBondContact O-CB 3.49Å; L504-L508 VanDerWaalsContact O-CG 3.31Å; L504-L508 WeakPolarHBondContact O-CG 3.32Å; L504-L508 PolarHBondContact O-N 3.08Å
505	I	53.6	Low	57.2	Low	95 Å²	95	97.8 Å²	97.8	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-65.4	-42.6	175.3	-69.1	166.8	0	0	0	109.8	C501 D502 N503 L508 T509	C501-I505 VanDerWaalsContact O-CG1 3.28Å; C501-I505 WeakPolarHBondContact O-CG1 3.29Å; C501-I505 PolarHBondContact O-N 2.9Å; D502-I505 PolarHBondContact O-N 3.16Å; N503-I505 VanDerWaalsContact C-N 3.32Å; N503-I505 PolarHBondContact O-N 2.98Å; I505-L508 PolarHBondContact O-N 2.83Å; I505-T509 WeakPolarHBondContact O-CB 3.37Å; I505-T509 PolarHBondContact O-N 2.87Å; I505-T509 PolarHBondContact O-OG1 2.91Å
506	S	58.9	Low	57.2	Low	77 Å²	77	97.8 Å²	97.8	54%	0.538	49%	0.493	S	S	.	.	H	α-helix	trans	-60.2	-47.5	174.9	-71.4	0	0	0	0	111.9	D502 N503 L508 T509 E510	D502-S506 PolarHBondContact O-N 3.23Å; D502-S506 PolarHBondContact O-OG 3.34Å; N503-S506 WeakPolarHBondContact O-CB 3.49Å; N503-S506 PolarHBondContact O-N 2.85Å; S506-L508 PolarHBondContact O-N 3.42Å; S506-T509 PolarHBondContact O-N 2.96Å; S506-E510 PolarHBondContact O-N 2.9Å
507	E	54.2	Low	56.9	Low	107 Å²	107	96.7 Å²	96.7	50%	0.5	49%	0.494	S	S	.	.	H	α-helix	trans	-59.7	-44.3	176	-71.2	172.2	-166.4	0	0	111.9	N503 L504 T509 E510 I511	N503-E507 WeakPolarHBondContact O-CG 3.39Å; N503-E507 PolarHBondContact O-N 3.21Å; L504-E507 PolarHBondContact O-N 3.21Å; E507-T509 VanDerWaalsContact C-N 3.31Å; E507-T509 PolarHBondContact O-N 3.45Å; E507-E510 PolarHBondContact O-N 3.15Å; E507-I511 VanDerWaalsContact O-CG1 3.3Å; E507-I511 WeakPolarHBondContact O-CG1 3.41Å; E507-I511 PolarHBondContact O-N 3.4Å
508	L	49.7	Very low	56.7	Low	115 Å²	115	94.8 Å²	94.8	60%	0.602	49%	0.491	S	S	*	.	H	α-helix	trans	-65.4	-34.1	176.5	-76.8	169.3	0	0	0	112.8	L504 I505 S506 K512	L504-L508 WeakPolarHBondContact O-CB 3.49Å; L504-L508 VanDerWaalsContact O-CG 3.31Å; L504-L508 WeakPolarHBondContact O-CG 3.32Å; L504-L508 PolarHBondContact O-N 3.08Å; I505-L508 PolarHBondContact O-N 2.83Å; S506-L508 PolarHBondContact O-N 3.42Å; L508-K512 WeakPolarHBondContact O-CB 3.38Å; L508-K512 PolarHBondContact O-N 3.2Å
509	T	57.3	Low	56.7	Low	67 Å²	67	95.2 Å²	95.2	41%	0.411	49%	0.492	S	S	.	.	H	α-helix	trans	-70.5	-40.2	177.6	-49.3	0	0	0	0	110.3	I505 S506 E507 K512 E513	I505-T509 WeakPolarHBondContact O-CB 3.37Å; I505-T509 PolarHBondContact O-N 2.87Å; I505-T509 PolarHBondContact O-OG1 2.91Å; S506-T509 PolarHBondContact O-N 2.96Å; E507-T509 VanDerWaalsContact C-N 3.31Å; E507-T509 PolarHBondContact O-N 3.45Å; T509-K512 PolarHBondContact O-N 3.29Å; T509-E513 WeakPolarHBondContact O-CG 3.47Å; T509-E513 PolarHBondContact O-N 3.03Å
510	E	57.2	Low	56.2	Low	121 Å²	121	95.1 Å²	95.1	57%	0.565	49%	0.494	S	S	*	.	H	α-helix	trans	-63	-47.5	174.9	-168.9	169.6	-158.3	0	0	111.4	S506 E507 K512 E513 E514	S506-E510 PolarHBondContact O-N 2.9Å; E507-E510 PolarHBondContact O-N 3.15Å; E510-K512 VanDerWaalsContact C-N 3.25Å; E510-K512 PolarHBondContact O-N 3.13Å; E510-E513 PolarHBondContact O-N 3.03Å; E510-E513 VanDerWaalsContact O-N 3.15Å; E510-E514 WeakPolarHBondContact O-CG 3.45Å; E510-E514 PolarHBondContact O-N 2.99Å
511	I	52.2	Low	55.7	Low	90 Å²	90	96 Å²	96	46%	0.462	50%	0.498	S	S	.	.	H	α-helix	trans	-58.6	-39.5	174.4	-67.6	165.8	0	0	0	111.2	E507 E514 M515	E507-I511 VanDerWaalsContact O-CG1 3.3Å; E507-I511 WeakPolarHBondContact O-CG1 3.41Å; E507-I511 PolarHBondContact O-N 3.4Å; I511-E514 PolarHBondContact O-N 2.85Å; I511-M515 WeakPolarHBondContact O-CB 3.36Å; I511-M515 PolarHBondContact O-N 3.33Å
512	K	60.3	Low	55.7	Low	118 Å²	118	99.1 Å²	99.1	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-66.6	-41.8	178.5	-169.9	-173.9	176.6	-142.7	0	111.6	L508 T509 E510 M515 E516	L508-K512 WeakPolarHBondContact O-CB 3.38Å; L508-K512 PolarHBondContact O-N 3.2Å; T509-K512 PolarHBondContact O-N 3.29Å; E510-K512 VanDerWaalsContact C-N 3.25Å; E510-K512 PolarHBondContact O-N 3.13Å; K512-M515 PolarHBondContact O-N 3.14Å; K512-E516 WeakPolarHBondContact CE-OE1 3.39Å; K512-E516 IonicContact NZ-OE1 3.05Å; K512-E516 PolarHBondContact NZ-OE1 3.23Å; K512-E516 WeakPolarHBondContact O-CB 3.41Å; K512-E516 PolarHBondContact O-N 3.2Å
513	E	59	Low	55.2	Low	124 Å²	124	102.5 Å²	102.5	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-65.3	-38.4	175.5	-72.5	178.8	-177.4	0	0	111.6	T509 E510 T517	T509-E513 WeakPolarHBondContact O-CG 3.47Å; T509-E513 PolarHBondContact O-N 3.03Å; E510-E513 PolarHBondContact O-N 3.03Å; E510-E513 VanDerWaalsContact O-N 3.15Å; E513-T517 WeakPolarHBondContact O-CB 3.34Å; E513-T517 WeakPolarHBondContact O-CG2 3.4Å; E513-T517 PolarHBondContact O-N 3.25Å; E513-T517 PolarHBondContact O-OG1 3.26Å
514	E	56.5	Low	54.7	Low	119 Å²	119	102.6 Å²	102.6	56%	0.556	52%	0.519	S	S	*	.	H	α-helix	trans	-64	-40.3	172.2	-71.9	-176.4	169.7	0	0	112.4	E510 I511 T517 A518	E510-E514 WeakPolarHBondContact O-CG 3.45Å; E510-E514 PolarHBondContact O-N 2.99Å; I511-E514 PolarHBondContact O-N 2.85Å; E514-T517 WeakPolarHBondContact CA-OG1 3.44Å; E514-T517 PolarHBondContact O-OG1 2.71Å; E514-A518 VanDerWaalsContact O-CB 3.3Å; E514-A518 WeakPolarHBondContact O-CB 3.42Å; E514-A518 PolarHBondContact O-N 3.3Å
515	M	53.2	Low	54.6	Low	109 Å²	109	103.9 Å²	103.9	54%	0.537	53%	0.526	S	S	.	.	H	α-helix	trans	-68.2	-45.1	175.3	-95.7	178.9	34	0	0	112.7	I511 K512 T517 A518 E519	I511-M515 WeakPolarHBondContact O-CB 3.36Å; I511-M515 PolarHBondContact O-N 3.33Å; K512-M515 PolarHBondContact O-N 3.14Å; M515-T517 VanDerWaalsContact C-N 3.28Å; M515-T517 PolarHBondContact O-N 3.43Å; M515-A518 PolarHBondContact O-N 2.84Å; M515-E519 WeakPolarHBondContact O-CB 3.45Å; M515-E519 PolarHBondContact O-N 3.22Å
516	E	55.7	Low	54.4	Low	99 Å²	99	107.8 Å²	107.8	46%	0.463	54%	0.539	S	S	.	.	H	α-helix	trans	-62	-39.5	178.2	-79.3	-178.8	-172.4	0	0	110.5	K512 Q520	K512-E516 WeakPolarHBondContact CE-OE1 3.39Å; K512-E516 IonicContact NZ-OE1 3.05Å; K512-E516 PolarHBondContact NZ-OE1 3.23Å; K512-E516 WeakPolarHBondContact O-CB 3.41Å; K512-E516 PolarHBondContact O-N 3.2Å; E516-Q520 WeakPolarHBondContact O-CB 3.47Å; E516-Q520 PolarHBondContact O-N 3.34Å
517	T	59.9	Low	53.7	Low	83 Å²	83	112 Å²	112	51%	0.509	55%	0.551	S	S	.	*	H	α-helix	trans	-67.5	-42.8	174.4	47.8	0	0	0	0	112.5	E513 E514 M515 E519 Q520 D521	E513-T517 WeakPolarHBondContact O-CB 3.34Å; E513-T517 WeakPolarHBondContact O-CG2 3.4Å; E513-T517 PolarHBondContact O-N 3.25Å; E513-T517 PolarHBondContact O-OG1 3.26Å; E514-T517 WeakPolarHBondContact CA-OG1 3.44Å; E514-T517 PolarHBondContact O-OG1 2.71Å; M515-T517 VanDerWaalsContact C-N 3.28Å; M515-T517 PolarHBondContact O-N 3.43Å; T517-E519 PolarHBondContact O-N 3.26Å; T517-Q520 PolarHBondContact O-N 3.22Å; T517-D521 PolarHBondContact O-N 2.92Å
518	A	51.7	Low	52.9	Low	53 Å²	53	109.6 Å²	109.6	44%	0.438	55%	0.554	S	S	.	*	H	α-helix	trans	-63.2	-38.1	175.3	0	0	0	0	0	113	E514 M515 N522	E514-A518 VanDerWaalsContact O-CB 3.3Å; E514-A518 WeakPolarHBondContact O-CB 3.42Å; E514-A518 PolarHBondContact O-N 3.3Å; M515-A518 PolarHBondContact O-N 2.84Å; A518-N522 WeakPolarHBondContact O-CB 3.49Å; A518-N522 PolarHBondContact O-N 2.77Å
519	E	51.2	Low	52.4	Low	104 Å²	104	111.5 Å²	111.5	49%	0.486	57%	0.565	S	S	.	*	H	α-helix	trans	-67	-41.1	173.4	-79.5	-168.9	-174.7	0	0	112.1	M515 T517 D521 N522 R523	M515-E519 WeakPolarHBondContact O-CB 3.45Å; M515-E519 PolarHBondContact O-N 3.22Å; T517-E519 PolarHBondContact O-N 3.26Å; E519-D521 VanDerWaalsContact C-N 3.34Å; E519-N522 PolarHBondContact O-N 2.82Å; E519-R523 WeakPolarHBondContact O-CG 3.26Å; E519-R523 PolarHBondContact O-N 3.05Å
520	Q	53.5	Low	51.4	Low	121 Å²	121	111.7 Å²	111.7	57%	0.565	58%	0.58	S	S	*	*	H	α-helix	trans	-62.6	-43.3	176.8	-151.3	101	-11.5	0	0	110.9	E516 T517 R523 N524	E516-Q520 WeakPolarHBondContact O-CB 3.47Å; E516-Q520 PolarHBondContact O-N 3.34Å; T517-Q520 PolarHBondContact O-N 3.22Å; Q520-R523 PolarHBondContact O-N 3.48Å; Q520-N524 PolarHBondContact O-N 2.87Å; Q520-N524 PolarHBondContact O-ND2 3.29Å
521	D	53.9	Low	50.1	Low	98 Å²	98	109.7 Å²	109.7	52%	0.524	59%	0.592	S	S	.	*	H	α-helix	trans	-66.1	-38.4	177	-77.1	-15.8	0	0	0	111.9	T517 E519 R523 N524 L525	T517-D521 PolarHBondContact O-N 2.92Å; E519-D521 VanDerWaalsContact C-N 3.34Å; D521-R523 PolarHBondContact O-N 3.09Å; D521-N524 PolarHBondContact O-N 3.07Å; D521-L525 WeakPolarHBondContact O-CB 3.49Å; D521-L525 WeakPolarHBondContact O-CG 3.32Å; D521-L525 PolarHBondContact O-N 3.49Å
522	N	48.5	Very low	49	Very low	101 Å²	101	109 Å²	109	54%	0.54	61%	0.608	S	S	.	*	H	α-helix	trans	-64.4	-37	172.6	-105	-32.6	0	0	0	113	A518 E519 K526	A518-N522 WeakPolarHBondContact O-CB 3.49Å; A518-N522 PolarHBondContact O-N 2.77Å; E519-N522 PolarHBondContact O-N 2.82Å; N522-K526 PolarHBondContact O-N 3.25Å; N522-K526 VanDerWaalsContact O-N 3.08Å
523	R	52.2	Low	47.6	Very low	160 Å²	160	107.1 Å²	107.1	60%	0.604	62%	0.621	S	S	*	*	H	α-helix	trans	-68.1	-41.4	174.3	-73.1	-178.9	-167.7	-171.6	7.6	111.4	E519 Q520 D521 L525 K526 E527	E519-R523 WeakPolarHBondContact O-CG 3.26Å; E519-R523 PolarHBondContact O-N 3.05Å; Q520-R523 PolarHBondContact O-N 3.48Å; D521-R523 PolarHBondContact O-N 3.09Å; R523-L525 VanDerWaalsContact C-N 3.32Å; R523-L525 PolarHBondContact O-N 3.17Å; R523-K526 PolarHBondContact O-N 2.69Å; R523-E527 PolarHBondContact O-N 2.86Å
524	N	53.1	Low	46.3	Very low	96 Å²	96	106.5 Å²	106.5	51%	0.513	64%	0.638	S	S	.	*	H	α-helix	trans	-63.3	-37.6	176	-68	-24.1	0	0	0	112	Q520 D521 G528	Q520-N524 PolarHBondContact O-N 2.87Å; Q520-N524 PolarHBondContact O-ND2 3.29Å; D521-N524 PolarHBondContact O-N 3.07Å; N524-G528 PolarHBondContact O-N 2.78Å
525	L	54.2	Low	44.9	Very low	124 Å²	124	104.6 Å²	104.6	65%	0.649	65%	0.65	S	S	*	*	H	α-helix	trans	-68.7	-36.9	175.3	-75	165.2	0	0	0	112.5	D521 R523	D521-L525 WeakPolarHBondContact O-CB 3.49Å; D521-L525 WeakPolarHBondContact O-CG 3.32Å; D521-L525 PolarHBondContact O-N 3.49Å; R523-L525 VanDerWaalsContact C-N 3.32Å; R523-L525 PolarHBondContact O-N 3.17Å
526	K	49.5	Very low	43.8	Very low	177 Å²	177	104.3 Å²	104.3	77%	0.77	67%	0.665	S	S	*	*	H	α-helix	trans	-73.7	-31.2	177.4	-80.2	-173.8	177.3	178	0	113.8	N522 R523	N522-K526 PolarHBondContact O-N 3.25Å; N522-K526 VanDerWaalsContact O-N 3.08Å; R523-K526 PolarHBondContact O-N 2.69Å
527	E	44.6	Very low	42.5	Very low	166 Å²	166	105.8 Å²	105.8	78%	0.776	69%	0.686	S	S	*	*	H	α-helix	trans	-81.8	-22.2	174.7	-71.5	-172.5	170	0	0	112.8	R523	R523-E527 PolarHBondContact O-N 2.86Å
528	G	38.8	Very low	41.1	Very low	56 Å²	56	105.4 Å²	105.4	58%	0.577	70%	0.698	S	S	*	*	H	α-helix	trans	-72.4	-27.5	-179.5	0	0	0	0	0	115.9	N524	N524-G528 PolarHBondContact O-N 2.78Å
529	D	38.9	Very low	39.8	Very low	155 Å²	155	106.5 Å²	106.5	83%	0.829	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	6.1	-175.8	-96.3	-12.4	0	0	0	114.5	G531	D529-G531 PolarHBondContact O-N 2.79Å
530	G	35.6	Very low	38.9	Very low	71 Å²	71	109.4 Å²	109.4	73%	0.732	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-6.7	174.2	0	0	0	0	0	114.6	G532	G530-G532 PolarHBondContact O-N 2.79Å
531	G	30.5	Very low	37.8	Very low	79 Å²	79	112.6 Å²	112.6	81%	0.814	75%	0.746	S	S	*	*	S	Bend	trans	-98.4	62.4	-171.9	0	0	0	0	0	114.4	D529	D529-G531 PolarHBondContact O-N 2.79Å
532	G	28.5	Very low	37.1	Very low	76 Å²	76	115.1 Å²	115.1	78%	0.784	76%	0.759	S	S	*	*			trans	160.9	113.2	166.4	0	0	0	0	0	115.1	G530	G530-G532 PolarHBondContact O-N 2.79Å
533	G	30	Very low	36.3	Very low	78 Å²	78	114.5 Å²	114.5	80%	0.804	78%	0.777	S	S	*	*			trans	150.7	70	166.5	0	0	0	0	0	113.7	G535	G533-G535 PolarHBondContact O-N 3.1Å
534	A	32	Very low	35.3	Very low	112 Å²	112	116 Å²	116	93%	0.926	79%	0.788	S	S	*	*			trans	-56.4	130	161.2	0	0	0	0	0	110.2
535	G	27.1	Very low	34.3	Very low	78 Å²	78	120 Å²	120	80%	0.804	80%	0.803	S	S	*	*			trans	102.9	86.6	157.1	0	0	0	0	0	116.6	G533	G533-G535 PolarHBondContact O-N 3.1Å
536	A	29.5	Very low	33.6	Very low	103 Å²	103	119.3 Å²	119.3	85%	0.851	81%	0.807	S	S	*	*			trans	-154.7	95.7	144.9	0	0	0	0	0	109.4
537	S	30	Very low	33.3	Very low	131 Å²	131	116.7 Å²	116.7	92%	0.916	81%	0.808	S	S	*	*			trans	-62.3	131.4	164.6	53.2	0	0	0	0	111
538	G	29.3	Very low	33	Very low	74 Å²	74	113.4 Å²	113.4	76%	0.763	81%	0.809	S	S	*	*			trans	161.7	94.8	169.3	0	0	0	0	0	107.7
539	G	25.4	Very low	33.1	Very low	77 Å²	77	116.7 Å²	116.7	79%	0.794	81%	0.813	S	S	*	*			cis	77.8	51	46	0	0	0	0	0	110.6
540	N	31.8	Very low	33.3	Very low	165 Å²	165	112.9 Å²	112.9	88%	0.882	80%	0.796	S	S	*	*			trans	-152.2	121.3	149.5	-117.5	-0.2	0	0	0	111.3
541	K	30.5	Very low	33.9	Very low	188 Å²	188	117.6 Å²	117.6	82%	0.817	80%	0.799	S	S	*	*			trans	-68.3	133	162.7	-68.3	175.1	174	179.4	0	107.3
542	D	39.1	Very low	34.7	Very low	150 Å²	150	121.1 Å²	121.1	80%	0.802	79%	0.794	S	S	*	*				-170.4	115.2	128.3	-88.9	-25.9	0	0	0	107.3	K544	D542-K544 PolarHBondContact O-N 2.68Å
543	G	31.3	Very low	35.5	Very low	88 Å²	88	122.6 Å²	122.6	91%	0.907	78%	0.781	S	S	*	*			trans	-65.8	79.6	176.9	0	0	0	0	0	110.6	E545	G543-E545 PolarHBondContact O-N 3.46Å
544	K	32.4	Very low	36.5	Very low	192 Å²	192	122.9 Å²	122.9	84%	0.835	77%	0.767	S	S	*	*			trans	-70.7	102.7	154.6	-73.7	-169	176	-176	0	106.3	D542	D542-K544 PolarHBondContact O-N 2.68Å
545	E	30.5	Very low	37.6	Very low	179 Å²	179	124.3 Å²	124.3	84%	0.836	75%	0.754	S	S	*	*			trans	-43.4	128.5	157.7	-92.5	175.5	151.7	0	0	107.9	G543	G543-E545 PolarHBondContact O-N 3.46Å
546	P	41.4	Very low	38.8	Very low	111 Å²	111	127.3 Å²	127.3	72%	0.721	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-55.4	135.3	-179.8	22.1	-31.1	0	0	0	108.4	A548	P546-A548 PolarHBondContact O-N 3.02Å; P546-A548 VanDerWaalsContact O-N 3.15Å
547	P	41.3	Very low	39.8	Very low	122 Å²	122	128.9 Å²	128.9	79%	0.792	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-54.3	126.7	178.2	22.9	-31.7	0	0	0	108.6	L549	P547-L549 PolarHBondContact O-N 2.92Å
548	A	38.7	Very low	41	Very low	96 Å²	96	128.3 Å²	128.3	79%	0.793	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-50.7	128.6	173.4	0	0	0	0	0	108.6	P546	P546-A548 PolarHBondContact O-N 3.02Å; P546-A548 VanDerWaalsContact O-N 3.15Å
549	L	40.6	Very low	42.8	Very low	126 Å²	126	131.1 Å²	131.1	66%	0.66	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-53.3	140.6	177.5	-73.9	160.3	0	0	0	109	P547 E551	P547-L549 PolarHBondContact O-N 2.92Å; L549-E551 PolarHBondContact O-N 2.96Å
550	P	43.6	Very low	44.4	Very low	74 Å²	74	133.9 Å²	133.9	48%	0.481	71%	0.706	S	S	.	*	P	Polyproline II helix	trans	-52.3	131.2	-178.6	-21.1	30.7	0	0	0	110.4	E552 E553	P550-E552 PolarHBondContact O-N 3.29Å; P550-E553 PolarHBondContact O-N 3.39Å
551	E	47.5	Very low	45.8	Very low	171 Å²	171	131.1 Å²	131.1	80%	0.799	69%	0.691	S	S	*	*	H	α-helix	trans	-56.3	-19	177.5	-69.9	-177.7	156.3	0	0	112.8	L549 Q555	L549-E551 PolarHBondContact O-N 2.96Å; E551-Q555 PolarHBondContact O-N 3.16Å
552	E	47.7	Very low	47.5	Very low	152 Å²	152	128.5 Å²	128.5	71%	0.71	68%	0.682	S	S	*	*	H	α-helix	trans	-66.5	-39.4	172.8	-75	-173.6	151.5	0	0	113.3	P550 V554 Q555 E556	P550-E552 PolarHBondContact O-N 3.29Å; E552-V554 PolarHBondContact O-N 3.42Å; E552-Q555 PolarHBondContact O-N 3.08Å; E552-E556 PolarHBondContact O-N 2.84Å
553	E	45.2	Very low	48.8	Very low	108 Å²	108	126.6 Å²	126.6	51%	0.505	67%	0.668	S	S	.	*	H	α-helix	trans	-67.4	-39	179.8	-78.2	-176.9	164.7	0	0	111.4	P550 Q555 E556 E557	P550-E553 PolarHBondContact O-N 3.39Å; E553-Q555 VanDerWaalsContact C-N 3.35Å; E553-E556 PolarHBondContact O-N 3.4Å; E553-E557 PolarHBondContact O-N 3.45Å
554	V	52.3	Low	50.2	Low	84 Å²	84	127.6 Å²	127.6	51%	0.509	65%	0.649	S	S	.	*	H	α-helix	trans	-68.5	-35.5	177.3	-176.8	0	0	0	0	111.2	E552 M558	E552-V554 PolarHBondContact O-N 3.42Å; V554-M558 WeakPolarHBondContact O-CB 3.44Å; V554-M558 PolarHBondContact O-N 2.95Å; V554-M558 VanDerWaalsContact O-N 3.1Å
555	Q	53.8	Low	51.6	Low	142 Å²	142	121.1 Å²	121.1	66%	0.664	63%	0.632	S	S	*	*	H	α-helix	trans	-69.3	-39.5	174.9	-84.2	-172.6	-1.7	0	0	112.5	E551 E552 E553 M558 K559	E551-Q555 PolarHBondContact O-N 3.16Å; E552-Q555 PolarHBondContact O-N 3.08Å; E553-Q555 VanDerWaalsContact C-N 3.35Å; Q555-M558 PolarHBondContact O-N 3.01Å; Q555-K559 WeakPolarHBondContact O-CB 3.37Å; Q555-K559 PolarHBondContact O-N 3.49Å
556	E	53.3	Low	53.4	Low	141 Å²	141	115.5 Å²	115.5	66%	0.659	62%	0.616	S	S	*	*	H	α-helix	trans	-65.5	-43	175.6	-80.7	-169.4	152.4	0	0	112.1	E552 E553 M558 K559 M560	E552-E556 PolarHBondContact O-N 2.84Å; E553-E556 PolarHBondContact O-N 3.4Å; E556-M558 PolarHBondContact O-N 3.26Å; E556-K559 PolarHBondContact O-N 2.97Å; E556-M560 WeakPolarHBondContact O-CG 3.28Å; E556-M560 PolarHBondContact O-N 2.92Å
557	E	50.8	Low	54.4	Low	135 Å²	135	115.1 Å²	115.1	63%	0.631	61%	0.607	S	S	*	*	H	α-helix	trans	-60.8	-44.1	174.5	-86.6	-167	151.6	0	0	112.4	E553 K559 M560 L561	E553-E557 PolarHBondContact O-N 3.45Å; E557-K559 VanDerWaalsContact C-N 3.28Å; E557-K559 PolarHBondContact O-N 3.47Å; E557-M560 PolarHBondContact O-N 2.83Å; E557-L561 WeakPolarHBondContact O-CB 3.33Å; E557-L561 WeakPolarHBondContact O-CG 3.19Å; E557-L561 PolarHBondContact O-N 2.99Å
558	M	54.5	Low	55.6	Low	120 Å²	120	114.9 Å²	114.9	59%	0.591	59%	0.594	S	S	*	*	H	α-helix	trans	-61	-38.3	176	-105.1	-93.2	-124.3	0	0	112.1	V554 Q555 E556 Q562	V554-M558 WeakPolarHBondContact O-CB 3.44Å; V554-M558 PolarHBondContact O-N 2.95Å; V554-M558 VanDerWaalsContact O-N 3.1Å; Q555-M558 PolarHBondContact O-N 3.01Å; E556-M558 PolarHBondContact O-N 3.26Å; M558-Q562 WeakPolarHBondContact O-CG 3.39Å; M558-Q562 PolarHBondContact O-N 3.43Å; M558-Q562 VanDerWaalsContact O-N 3.1Å
559	K	67.1	Low	57	Low	133 Å²	133	115.1 Å²	115.1	58%	0.578	58%	0.582	S	S	*	*	H	α-helix	trans	-70.6	-42.7	179.1	-160.5	179.9	179.6	-170.7	0	111.4	Q555 E556 E557 L561 Q562 E563	Q555-K559 WeakPolarHBondContact O-CB 3.37Å; Q555-K559 PolarHBondContact O-N 3.49Å; E556-K559 PolarHBondContact O-N 2.97Å; E557-K559 VanDerWaalsContact C-N 3.28Å; E557-K559 PolarHBondContact O-N 3.47Å; K559-L561 VanDerWaalsContact C-N 3.35Å; K559-L561 PolarHBondContact O-N 3.49Å; K559-Q562 PolarHBondContact O-N 3.34Å; K559-E563 WeakPolarHBondContact O-CG 3.49Å; K559-E563 PolarHBondContact O-N 3.17Å
560	M	58	Low	58.2	Low	134 Å²	134	113.5 Å²	113.5	66%	0.66	57%	0.571	S	S	*	*	H	α-helix	trans	-60.5	-42.2	173.5	-74.2	-122.2	-66.7	0	0	112.1	E556 E557 Q562 E563 E564	E556-M560 WeakPolarHBondContact O-CG 3.28Å; E556-M560 PolarHBondContact O-N 2.92Å; E557-M560 PolarHBondContact O-N 2.83Å; M560-Q562 VanDerWaalsContact C-N 3.33Å; M560-Q562 PolarHBondContact O-N 3.15Å; M560-E563 PolarHBondContact O-N 2.91Å; M560-E564 WeakPolarHBondContact O-CB 3.41Å; M560-E564 PolarHBondContact O-N 3.23Å
561	L	61.4	Low	59.3	Low	108 Å²	108	115.2 Å²	115.2	57%	0.565	58%	0.575	S	S	*	*	H	α-helix	trans	-63.6	-36.5	175.9	-80.9	163.2	0	0	0	112.7	E557 K559 A565	E557-L561 WeakPolarHBondContact O-CB 3.33Å; E557-L561 WeakPolarHBondContact O-CG 3.19Å; E557-L561 PolarHBondContact O-N 2.99Å; K559-L561 VanDerWaalsContact C-N 3.35Å; K559-L561 PolarHBondContact O-N 3.49Å; L561-A565 WeakPolarHBondContact O-CB 3.38Å; L561-A565 PolarHBondContact O-N 2.96Å
562	Q	66	Low	60.1	Low	132 Å²	132	111.9 Å²	111.9	62%	0.617	56%	0.558	S	S	*	*	H	α-helix	trans	-68.8	-41.1	173.9	-76.1	-177.2	4	0	0	112.2	M558 K559 M560 A565 A566	M558-Q562 WeakPolarHBondContact O-CG 3.39Å; M558-Q562 PolarHBondContact O-N 3.43Å; M558-Q562 VanDerWaalsContact O-N 3.1Å; K559-Q562 PolarHBondContact O-N 3.34Å; M560-Q562 VanDerWaalsContact C-N 3.33Å; M560-Q562 PolarHBondContact O-N 3.15Å; Q562-A565 PolarHBondContact O-N 3Å; Q562-A566 WeakPolarHBondContact O-CB 3.39Å; Q562-A566 PolarHBondContact O-N 2.89Å
563	E	67	Low	61	Low	110 Å²	110	109.1 Å²	109.1	51%	0.514	55%	0.547	S	S	.	.	H	α-helix	trans	-65.6	-40.3	176.2	-72.9	179.9	-173.5	0	0	111.7	K559 M560 A565 A566 L567	K559-E563 WeakPolarHBondContact O-CG 3.49Å; K559-E563 PolarHBondContact O-N 3.17Å; M560-E563 PolarHBondContact O-N 2.91Å; E563-A565 PolarHBondContact O-N 3.25Å; E563-A566 PolarHBondContact O-N 2.88Å; E563-L567 WeakPolarHBondContact O-CB 3.49Å; E563-L567 PolarHBondContact O-N 3.38Å
564	E	60.5	Low	62.3	Low	109 Å²	109	110 Å²	110	51%	0.509	55%	0.546	S	S	.	.	H	α-helix	trans	-62.4	-43.6	174.2	-161	-157.6	145.6	0	0	111.1	M560 A566 L567 K568	M560-E564 WeakPolarHBondContact O-CB 3.41Å; M560-E564 PolarHBondContact O-N 3.23Å; E564-A566 VanDerWaalsContact C-N 3.33Å; E564-A566 PolarHBondContact O-N 3.17Å; E564-L567 PolarHBondContact O-N 2.93Å; E564-K568 VanDerWaalsContact O-CB 3.28Å; E564-K568 WeakPolarHBondContact O-CB 3.44Å; E564-K568 PolarHBondContact O-N 3.43Å; E564-K568 IonicContact OE1-NZ 2.78Å
565	A	62.6	Low	63.2	Low	57 Å²	57	112.6 Å²	112.6	47%	0.471	55%	0.551	S	S	.	*	H	α-helix	trans	-62.8	-38.7	176.6	0	0	0	0	0	112.4	L561 Q562 E563 N569	L561-A565 WeakPolarHBondContact O-CB 3.38Å; L561-A565 PolarHBondContact O-N 2.96Å; Q562-A565 PolarHBondContact O-N 3Å; E563-A565 PolarHBondContact O-N 3.25Å; A565-N569 PolarHBondContact O-N 3.48Å; A565-N569 VanDerWaalsContact O-N 3.12Å
566	A	67.4	Low	63.4	Low	61 Å²	61	113.2 Å²	113.2	50%	0.504	55%	0.547	S	S	.	.	H	α-helix	trans	-65.6	-48.7	176	0	0	0	0	0	111.7	Q562 E563 E564 K568 N569 E570	Q562-A566 WeakPolarHBondContact O-CB 3.39Å; Q562-A566 PolarHBondContact O-N 2.89Å; E563-A566 PolarHBondContact O-N 2.88Å; E564-A566 VanDerWaalsContact C-N 3.33Å; E564-A566 PolarHBondContact O-N 3.17Å; A566-K568 VanDerWaalsContact C-N 3.3Å; A566-K568 PolarHBondContact O-N 3.37Å; A566-N569 PolarHBondContact O-N 2.92Å; A566-N569 VanDerWaalsContact O-N 3.16Å; A566-E570 PolarHBondContact O-N 3.18Å
567	L	64.1	Low	63.9	Low	103 Å²	103	112.4 Å²	112.4	54%	0.539	54%	0.543	S	S	.	.	H	α-helix	trans	-58.1	-42.4	175.9	-84.7	161.8	0	0	0	111.7	E563 E564 N569 E570 I571	E563-L567 WeakPolarHBondContact O-CB 3.49Å; E563-L567 PolarHBondContact O-N 3.38Å; E564-L567 PolarHBondContact O-N 2.93Å; L567-N569 VanDerWaalsContact C-N 3.31Å; L567-N569 PolarHBondContact O-N 2.89Å; L567-E570 PolarHBondContact O-N 3.39Å; L567-I571 WeakPolarHBondContact O-CG1 3.32Å; L567-I571 PolarHBondContact O-N 3.29Å
568	K	66	Low	64.3	Low	117 Å²	117	110.1 Å²	110.1	51%	0.509	54%	0.535	S	S	.	.	H	α-helix	trans	-65.3	-34.3	178.9	-154.5	171.2	-161.4	158.1	0	112.5	E564 A566 K572	E564-K568 VanDerWaalsContact O-CB 3.28Å; E564-K568 WeakPolarHBondContact O-CB 3.44Å; E564-K568 PolarHBondContact O-N 3.43Å; E564-K568 IonicContact OE1-NZ 2.78Å; A566-K568 VanDerWaalsContact C-N 3.3Å; A566-K568 PolarHBondContact O-N 3.37Å; K568-K572 WeakPolarHBondContact O-CG 3.45Å; K568-K572 PolarHBondContact O-N 2.81Å
569	N	67	Low	64.7	Low	101 Å²	101	108.5 Å²	108.5	54%	0.54	53%	0.528	S	S	.	.	H	α-helix	trans	-71.5	-38.7	172.8	-97.9	-15.2	0	0	0	112.2	A565 A566 L567 K572 N573	A565-N569 PolarHBondContact O-N 3.48Å; A565-N569 VanDerWaalsContact O-N 3.12Å; A566-N569 PolarHBondContact O-N 2.92Å; A566-N569 VanDerWaalsContact O-N 3.16Å; L567-N569 VanDerWaalsContact C-N 3.31Å; L567-N569 PolarHBondContact O-N 2.89Å; N569-K572 PolarHBondContact O-N 3.19Å; N569-N573 PolarHBondContact O-N 3.21Å
570	E	67.2	Low	64.3	Low	91 Å²	91	107.5 Å²	107.5	43%	0.425	53%	0.526	S	S	.	.	H	α-helix	trans	-64.7	-46	177	-162.6	-176.2	161.3	0	0	111.8	A566 L567 K572 N573 R574	A566-E570 PolarHBondContact O-N 3.18Å; L567-E570 PolarHBondContact O-N 3.39Å; E570-K572 VanDerWaalsContact C-N 3.27Å; E570-K572 PolarHBondContact O-N 3.44Å; E570-N573 PolarHBondContact O-N 3Å; E570-R574 WeakPolarHBondContact O-CG 3.28Å; E570-R574 PolarHBondContact O-N 3.49Å; E570-R574 IonicContact OE1-CZ 3.74Å; E570-R574 IonicContact OE1-NE 2.71Å; E570-R574 PolarHBondContact OE1-NE 3.49Å; E570-R574 IonicContact OE1-NH2 3.95Å; E570-R574 PolarHBondContact OE1-NH2 3.23Å
571	I	65.4	Low	64.2	Low	111 Å²	111	104.6 Å²	104.6	57%	0.569	51%	0.512	S	S	*	.	H	α-helix	trans	-57.6	-41.2	175.6	-68	167.8	0	0	0	110.8	L567 R574 K575	L567-I571 WeakPolarHBondContact O-CG1 3.32Å; L567-I571 PolarHBondContact O-N 3.29Å; I571-R574 PolarHBondContact O-N 3.34Å; I571-K575 WeakPolarHBondContact O-CB 3.4Å; I571-K575 PolarHBondContact O-N 2.96Å
572	K	65.2	Low	64	Low	101 Å²	101	102.2 Å²	102.2	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-65.7	-43.7	177.3	-79.5	176.1	-178.4	175.2	0	112.7	K568 N569 E570 R574 K575 R576	K568-K572 WeakPolarHBondContact O-CG 3.45Å; K568-K572 PolarHBondContact O-N 2.81Å; N569-K572 PolarHBondContact O-N 3.19Å; E570-K572 VanDerWaalsContact C-N 3.27Å; E570-K572 PolarHBondContact O-N 3.44Å; K572-R574 VanDerWaalsContact C-N 3.34Å; K572-K575 PolarHBondContact O-N 3.35Å; K572-R576 WeakPolarHBondContact O-CG 3.33Å; K572-R576 PolarHBondContact O-N 3.26Å
573	N	66.6	Low	63.4	Low	93 Å²	93	100.1 Å²	100.1	50%	0.497	50%	0.5	S	S	.	.	H	α-helix	trans	-64.6	-40.1	177.2	-80.8	-15.4	0	0	0	111.4	N569 E570 R576 H577	N569-N573 PolarHBondContact O-N 3.21Å; E570-N573 PolarHBondContact O-N 3Å; N573-R576 PolarHBondContact O-N 2.94Å; N573-H577 PolarHBondContact O-N 3.48Å
574	R	71.9	Confident	62.9	Low	127 Å²	127	99.7 Å²	99.7	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-61.6	-43.4	172.5	-71.1	-173.4	-173.5	-165.1	5.3	111.7	E570 I571 K572 R576 H577 L578	E570-R574 WeakPolarHBondContact O-CG 3.28Å; E570-R574 PolarHBondContact O-N 3.49Å; E570-R574 IonicContact OE1-CZ 3.74Å; E570-R574 IonicContact OE1-NE 2.71Å; E570-R574 PolarHBondContact OE1-NE 3.49Å; E570-R574 IonicContact OE1-NH2 3.95Å; E570-R574 PolarHBondContact OE1-NH2 3.23Å; I571-R574 PolarHBondContact O-N 3.34Å; K572-R574 VanDerWaalsContact C-N 3.34Å; R574-R576 PolarHBondContact O-N 3.28Å; R574-H577 WeakPolarHBondContact O-CB 3.36Å; R574-H577 PolarHBondContact O-N 3.01Å; R574-L578 WeakPolarHBondContact O-CG 3.44Å; R574-L578 PolarHBondContact O-N 3.43Å
575	K	70.4	Confident	62.8	Low	139 Å²	139	102.6 Å²	102.6	60%	0.604	50%	0.504	S	S	*	.	H	α-helix	trans	-62	-42	176.1	-170.9	172.3	-177.9	170.6	0	112.9	I571 K572 H577 L578 D579	I571-K575 WeakPolarHBondContact O-CB 3.4Å; I571-K575 PolarHBondContact O-N 2.96Å; K572-K575 PolarHBondContact O-N 3.35Å; K575-H577 VanDerWaalsContact C-N 3.32Å; K575-H577 PolarHBondContact O-N 2.92Å; K575-L578 WeakPolarHBondContact O-CB 3.3Å; K575-L578 PolarHBondContact O-N 2.99Å; K575-D579 PolarHBondContact O-N 2.84Å
576	R	58.8	Low	62.7	Low	155 Å²	155	102.3 Å²	102.3	59%	0.585	50%	0.499	S	S	*	.	H	α-helix	trans	-61	-41.6	174.4	-72.3	174.1	-178.7	175.8	-2.4	112	K572 N573 R574 L578 D579 H580	K572-R576 WeakPolarHBondContact O-CG 3.33Å; K572-R576 PolarHBondContact O-N 3.26Å; N573-R576 PolarHBondContact O-N 2.94Å; R574-R576 PolarHBondContact O-N 3.28Å; R576-L578 VanDerWaalsContact C-N 3.34Å; R576-D579 PolarHBondContact O-N 2.77Å; R576-H580 PolarHBondContact O-N 3.13Å; R576-H580 VanDerWaalsContact O-N 3.12Å
577	H	63.5	Low	62.1	Low	123 Å²	123	104 Å²	104	57%	0.569	50%	0.5	S	S	*	.	H	α-helix	trans	-64.1	-40.9	176.9	-170.1	52.5	0	0	0	111.6	N573 R574 K575 H580 L581	N573-H577 PolarHBondContact O-N 3.48Å; R574-H577 WeakPolarHBondContact O-CB 3.36Å; R574-H577 PolarHBondContact O-N 3.01Å; K575-H577 VanDerWaalsContact C-N 3.32Å; K575-H577 PolarHBondContact O-N 2.92Å; H577-H580 PolarHBondContact O-N 3.47Å; H577-L581 WeakPolarHBondContact O-CG 3.31Å; H577-L581 PolarHBondContact O-N 2.75Å
578	L	59.4	Low	61.8	Low	88 Å²	88	102.8 Å²	102.8	46%	0.461	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-42.1	174.9	-70.9	170.1	0	0	0	112.8	R574 K575 R576 H580 L581 A582	R574-L578 WeakPolarHBondContact O-CG 3.44Å; R574-L578 PolarHBondContact O-N 3.43Å; K575-L578 WeakPolarHBondContact O-CB 3.3Å; K575-L578 PolarHBondContact O-N 2.99Å; R576-L578 VanDerWaalsContact C-N 3.34Å; L578-H580 VanDerWaalsContact C-N 3.32Å; L578-H580 PolarHBondContact O-N 2.92Å; L578-L581 PolarHBondContact O-N 3.45Å; L578-A582 PolarHBondContact O-N 2.84Å
579	D	62.8	Low	61.9	Low	86 Å²	86	103.7 Å²	103.7	46%	0.46	50%	0.501	S	S	.	.	H	α-helix	trans	-62.9	-38.8	176.2	-73.9	-18.9	0	0	0	111.5	K575 R576 A582 I583	K575-D579 PolarHBondContact O-N 2.84Å; R576-D579 PolarHBondContact O-N 2.77Å; D579-A582 WeakPolarHBondContact O-CB 3.46Å; D579-A582 PolarHBondContact O-N 3.49Å; D579-I583 WeakPolarHBondContact O-CG1 3.29Å; D579-I583 PolarHBondContact O-N 3.33Å
580	H	58.7	Low	61.3	Low	112 Å²	112	100.8 Å²	100.8	52%	0.519	49%	0.485	S	S	.	.	H	α-helix	trans	-64.7	-42	175.9	-156.9	-63.3	0	0	0	111.9	R576 H577 L578 A582 I583 E584	R576-H580 PolarHBondContact O-N 3.13Å; R576-H580 VanDerWaalsContact O-N 3.12Å; H577-H580 PolarHBondContact O-N 3.47Å; L578-H580 VanDerWaalsContact C-N 3.32Å; L578-H580 PolarHBondContact O-N 2.92Å; H580-A582 VanDerWaalsContact C-N 3.3Å; H580-A582 PolarHBondContact O-N 3.22Å; H580-I583 PolarHBondContact O-N 3.41Å; H580-E584 IonicContact CE1-OE1 2.74Å; H580-E584 PolarHBondContact CE1-OE1 2.88Å; H580-E584 IonicContact ND1-OE1 3.41Å; H580-E584 PolarHBondContact ND1-OE1 3.38Å; H580-E584 PolarHBondContact O-N 2.94Å; H580-E584 VanDerWaalsContact O-N 3.11Å
581	L	56.2	Low	61.1	Low	72 Å²	72	103.6 Å²	103.6	38%	0.377	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-33.8	175.3	-70.8	169.8	0	0	0	112.3	H577 L578 E584 R585	H577-L581 WeakPolarHBondContact O-CG 3.31Å; H577-L581 PolarHBondContact O-N 2.75Å; L578-L581 PolarHBondContact O-N 3.45Å; L581-E584 PolarHBondContact O-N 2.83Å; L581-R585 PolarHBondContact O-N 3.13Å
582	A	56.8	Low	61	Low	58 Å²	58	102.9 Å²	102.9	48%	0.479	49%	0.492	S	S	.	.	H	α-helix	trans	-65.6	-38.7	175.4	0	0	0	0	0	112.4	L578 D579 H580 R585 S586	L578-A582 PolarHBondContact O-N 2.84Å; D579-A582 WeakPolarHBondContact O-CB 3.46Å; D579-A582 PolarHBondContact O-N 3.49Å; H580-A582 VanDerWaalsContact C-N 3.3Å; H580-A582 PolarHBondContact O-N 3.22Å; A582-R585 PolarHBondContact O-N 3.38Å; A582-S586 PolarHBondContact O-N 3.12Å; A582-S586 VanDerWaalsContact O-N 3.09Å
583	I	54.1	Low	61	Low	89 Å²	89	102.5 Å²	102.5	46%	0.456	49%	0.492	S	S	.	.	H	α-helix	trans	-66.4	-44.1	175.6	-64.7	167.3	0	0	0	110.6	D579 H580 R585 S586 N587	D579-I583 WeakPolarHBondContact O-CG1 3.29Å; D579-I583 PolarHBondContact O-N 3.33Å; H580-I583 PolarHBondContact O-N 3.41Å; I583-R585 VanDerWaalsContact C-N 3.32Å; I583-R585 PolarHBondContact O-N 2.98Å; I583-S586 WeakPolarHBondContact O-CB 3.48Å; I583-S586 PolarHBondContact O-N 2.83Å; I583-S586 VanDerWaalsContact O-N 3.1Å; I583-N587 PolarHBondContact O-N 2.87Å
584	E	57.2	Low	60.5	Low	100 Å²	100	99.6 Å²	99.6	47%	0.467	48%	0.478	S	S	.	.	H	α-helix	trans	-62.3	-37.9	176	-74.2	179.8	-172	0	0	112.4	H580 L581 S586 N587 T588	H580-E584 IonicContact CE1-OE1 2.74Å; H580-E584 PolarHBondContact CE1-OE1 2.88Å; H580-E584 IonicContact ND1-OE1 3.41Å; H580-E584 PolarHBondContact ND1-OE1 3.38Å; H580-E584 PolarHBondContact O-N 2.94Å; H580-E584 VanDerWaalsContact O-N 3.11Å; L581-E584 PolarHBondContact O-N 2.83Å; E584-S586 PolarHBondContact O-N 3.05Å; E584-N587 PolarHBondContact O-N 3.39Å; E584-T588 WeakPolarHBondContact O-CB 3.37Å; E584-T588 WeakPolarHBondContact O-CG2 3.39Å; E584-T588 PolarHBondContact O-N 3.49Å; E584-T588 PolarHBondContact O-OG1 3.09Å
585	R	56.7	Low	59.6	Low	170 Å²	170	98.2 Å²	98.2	64%	0.642	48%	0.48	S	S	*	.	H	α-helix	trans	-61.3	-39.7	171	-84.4	-174.6	174	-176.6	0.1	112.6	L581 A582 I583 T588 K589	L581-R585 PolarHBondContact O-N 3.13Å; A582-R585 PolarHBondContact O-N 3.38Å; I583-R585 VanDerWaalsContact C-N 3.32Å; I583-R585 PolarHBondContact O-N 2.98Å; R585-T588 WeakPolarHBondContact CA-OG1 3.27Å; R585-T588 PolarHBondContact O-OG1 2.87Å; R585-K589 WeakPolarHBondContact O-CB 3.49Å; R585-K589 PolarHBondContact O-N 3.4Å; R585-K589 VanDerWaalsContact O-N 3.07Å
586	S	60.8	Low	59.3	Low	52 Å²	52	97.6 Å²	97.6	36%	0.364	48%	0.479	S	S	.	.	H	α-helix	trans	-65.8	-47.1	176.7	-163	0	0	0	0	111.8	A582 I583 E584 T588 K589 L590	A582-S586 PolarHBondContact O-N 3.12Å; A582-S586 VanDerWaalsContact O-N 3.09Å; I583-S586 WeakPolarHBondContact O-CB 3.48Å; I583-S586 PolarHBondContact O-N 2.83Å; I583-S586 VanDerWaalsContact O-N 3.1Å; E584-S586 PolarHBondContact O-N 3.05Å; S586-T588 PolarHBondContact O-N 2.78Å; S586-K589 WeakPolarHBondContact O-CB 3.47Å; S586-K589 PolarHBondContact O-N 3.48Å; S586-L590 PolarHBondContact O-N 2.77Å
587	N	56.1	Low	59.4	Low	96 Å²	96	95.7 Å²	95.7	51%	0.513	47%	0.472	S	S	.	.	H	α-helix	trans	-63.1	-41.7	178.8	-84.7	-27.1	0	0	0	112.9	I583 E584 L590 K591	I583-N587 PolarHBondContact O-N 2.87Å; E584-N587 PolarHBondContact O-N 3.39Å; N587-L590 PolarHBondContact O-N 2.86Å; N587-K591 WeakPolarHBondContact O-CB 3.25Å; N587-K591 PolarHBondContact O-N 3.41Å
588	T	57.7	Low	59.1	Low	78 Å²	78	94 Å²	94	48%	0.479	46%	0.464	S	S	.	.	H	α-helix	trans	-65.3	-39.2	175.7	46.1	0	0	0	0	111.8	E584 R585 S586 K591 I592	E584-T588 WeakPolarHBondContact O-CB 3.37Å; E584-T588 WeakPolarHBondContact O-CG2 3.39Å; E584-T588 PolarHBondContact O-N 3.49Å; E584-T588 PolarHBondContact O-OG1 3.09Å; R585-T588 WeakPolarHBondContact CA-OG1 3.27Å; R585-T588 PolarHBondContact O-OG1 2.87Å; S586-T588 PolarHBondContact O-N 2.78Å; T588-K591 PolarHBondContact O-N 2.83Å; T588-I592 WeakPolarHBondContact O-CG1 3.39Å; T588-I592 PolarHBondContact O-N 3.24Å
589	K	66.9	Low	59.2	Low	135 Å²	135	95.5 Å²	95.5	59%	0.587	47%	0.467	S	S	*	.	H	α-helix	trans	-61.2	-44.8	174.4	-172.6	179.9	-179.9	-177.6	0	112.4	R585 S586 I592 Q593	R585-K589 WeakPolarHBondContact O-CB 3.49Å; R585-K589 PolarHBondContact O-N 3.4Å; R585-K589 VanDerWaalsContact O-N 3.07Å; S586-K589 WeakPolarHBondContact O-CB 3.47Å; S586-K589 PolarHBondContact O-N 3.48Å; K589-I592 PolarHBondContact O-N 3.2Å; K589-Q593 WeakPolarHBondContact O-CG 3.26Å; K589-Q593 PolarHBondContact O-N 3.35Å
590	L	55.7	Low	59.1	Low	41 Å²	41	95.5 Å²	95.5	22%	0.215	47%	0.471	C	S	.	.	H	α-helix	trans	-61.7	-43.3	174.2	-82.9	178.3	0	0	0	112.2	S586 N587 I592 Q593 C594 E701	S586-L590 PolarHBondContact O-N 2.77Å; N587-L590 PolarHBondContact O-N 2.86Å; L590-I592 VanDerWaalsContact C-N 3.3Å; L590-I592 PolarHBondContact O-N 3.38Å; L590-Q593 PolarHBondContact O-N 3.26Å; L590-C594 PolarHBondContact O-N 3.24Å; L590-C594 PolarHBondContact O-SG 3.36Å; L590-C594 VanDerWaalsContact O-SG 3.35Å; L590-E701 WeakPolarHBondContact CD1-OE2 3.42Å
591	K	63	Low	59	Low	149 Å²	149	91.7 Å²	91.7	65%	0.648	45%	0.454	S	S	*	.	H	α-helix	trans	-60.3	-41	177.9	-165.9	174.3	-176.4	179.3	0	111.5	N587 T588 C594 L595	N587-K591 WeakPolarHBondContact O-CB 3.25Å; N587-K591 PolarHBondContact O-N 3.41Å; T588-K591 PolarHBondContact O-N 2.83Å; K591-C594 PolarHBondContact O-N 2.99Å; K591-L595 WeakPolarHBondContact O-CG 3.45Å; K591-L595 PolarHBondContact O-N 3.4Å; K591-L595 VanDerWaalsContact O-N 3.11Å
592	I	61.8	Low	58.8	Low	96 Å²	96	93.2 Å²	93.2	49%	0.492	46%	0.461	S	S	.	.	H	α-helix	trans	-63.3	-47.5	174.7	-69.2	163	0	0	0	111	T588 K589 L590 C594 L595 E596	T588-I592 WeakPolarHBondContact O-CG1 3.39Å; T588-I592 PolarHBondContact O-N 3.24Å; K589-I592 PolarHBondContact O-N 3.2Å; L590-I592 VanDerWaalsContact C-N 3.3Å; L590-I592 PolarHBondContact O-N 3.38Å; I592-C594 VanDerWaalsContact C-N 3.31Å; I592-C594 PolarHBondContact O-N 3.44Å; I592-L595 PolarHBondContact O-N 3.09Å; I592-L595 VanDerWaalsContact O-N 3.13Å; I592-E596 HydrophobicContact CG2-CG 4.38Å; I592-E596 WeakPolarHBondContact O-CG 3.43Å; I592-E596 PolarHBondContact O-N 3.06Å
593	Q	66.7	Low	58.9	Low	94 Å²	94	94.1 Å²	94.1	44%	0.439	46%	0.458	S	S	.	.	H	α-helix	trans	-60.1	-39.2	178.2	-72.8	-178.8	-7.8	0	0	112.7	K589 L590 E596 R597	K589-Q593 WeakPolarHBondContact O-CG 3.26Å; K589-Q593 PolarHBondContact O-N 3.35Å; L590-Q593 PolarHBondContact O-N 3.26Å; Q593-E596 PolarHBondContact O-N 3.01Å; Q593-R597 PolarHBondContact O-N 2.63Å; Q593-R597 VanDerWaalsContact O-N 3.08Å
594	C	55.8	Low	59	Low	31 Å²	31	92.1 Å²	92.1	21%	0.209	45%	0.454	C	S	.	.	H	α-helix	trans	-63.7	-41.5	174.7	-71.5	0	0	0	0	112.3	L590 K591 I592 Q598	L590-C594 PolarHBondContact O-N 3.24Å; L590-C594 PolarHBondContact O-SG 3.36Å; L590-C594 VanDerWaalsContact O-SG 3.35Å; K591-C594 PolarHBondContact O-N 2.99Å; I592-C594 VanDerWaalsContact C-N 3.31Å; I592-C594 PolarHBondContact O-N 3.44Å; C594-Q598 WeakPolarHBondContact O-CG 3.35Å; C594-Q598 PolarHBondContact O-N 2.93Å
595	L	53.4	Low	58.7	Low	98 Å²	98	88.1 Å²	88.1	51%	0.513	44%	0.439	S	S	.	.	H	α-helix	trans	-67.9	-40.3	177.2	-71.3	170.8	0	0	0	112	K591 I592 R597 Q598 K599	K591-L595 WeakPolarHBondContact O-CG 3.45Å; K591-L595 PolarHBondContact O-N 3.4Å; K591-L595 VanDerWaalsContact O-N 3.11Å; I592-L595 PolarHBondContact O-N 3.09Å; I592-L595 VanDerWaalsContact O-N 3.13Å; L595-R597 PolarHBondContact O-N 3.47Å; L595-Q598 PolarHBondContact O-N 2.9Å; L595-K599 WeakPolarHBondContact O-CB 3.02Å; L595-K599 PolarHBondContact O-N 3.48Å
596	E	62.6	Low	58.7	Low	126 Å²	126	82.7 Å²	82.7	59%	0.589	43%	0.427	S	S	*	.	H	α-helix	trans	-61	-43.6	175.3	-75.4	-179.7	164	0	0	111.7	I592 Q593 K599 T600	I592-E596 HydrophobicContact CG2-CG 4.38Å; I592-E596 WeakPolarHBondContact O-CG 3.43Å; I592-E596 PolarHBondContact O-N 3.06Å; Q593-E596 PolarHBondContact O-N 3.01Å; E596-K599 WeakPolarHBondContact O-CB 3.47Å; E596-K599 PolarHBondContact O-N 3.5Å; E596-T600 PolarHBondContact O-N 2.96Å
597	R	61.3	Low	58.6	Low	116 Å²	116	86.7 Å²	86.7	44%	0.438	44%	0.44	S	S	.	.	H	α-helix	trans	-69.2	-40.3	178.7	-161.1	169.8	-175.3	-170.6	4.4	111.9	Q593 L595 K599 T600 I601	Q593-R597 PolarHBondContact O-N 2.63Å; Q593-R597 VanDerWaalsContact O-N 3.08Å; L595-R597 PolarHBondContact O-N 3.47Å; R597-K599 VanDerWaalsContact C-N 3.3Å; R597-K599 PolarHBondContact O-N 2.95Å; R597-T600 WeakPolarHBondContact CA-OG1 3.37Å; R597-T600 PolarHBondContact O-N 3.42Å; R597-T600 PolarHBondContact O-OG1 3.28Å; R597-I601 WeakPolarHBondContact O-CG1 3.34Å; R597-I601 PolarHBondContact O-N 3.38Å; R597-I601 VanDerWaalsContact O-N 3.13Å
598	Q	58.1	Low	58.8	Low	86 Å²	86	86 Å²	86	40%	0.402	43%	0.434	S	S	.	.	H	α-helix	trans	-57.2	-44.1	170.5	-79.8	179.4	-16.1	0	0	111.7	C594 L595 T600 I601 I602	C594-Q598 WeakPolarHBondContact O-CG 3.35Å; C594-Q598 PolarHBondContact O-N 2.93Å; L595-Q598 PolarHBondContact O-N 2.9Å; Q598-T600 PolarHBondContact O-N 2.85Å; Q598-I601 PolarHBondContact O-N 3.24Å; Q598-I602 WeakPolarHBondContact O-CG1 3.49Å; Q598-I602 PolarHBondContact O-N 2.67Å
599	K	60.6	Low	58.7	Low	121 Å²	121	86.6 Å²	86.6	53%	0.526	43%	0.429	S	S	.	.	H	α-helix	trans	-59.9	-46.4	176.3	-176.2	-177.1	175.2	-176.6	0	111.9	L595 E596 R597 I601 I602 D603	L595-K599 WeakPolarHBondContact O-CB 3.02Å; L595-K599 PolarHBondContact O-N 3.48Å; E596-K599 WeakPolarHBondContact O-CB 3.47Å; E596-K599 PolarHBondContact O-N 3.5Å; R597-K599 VanDerWaalsContact C-N 3.3Å; R597-K599 PolarHBondContact O-N 2.95Å; K599-I601 PolarHBondContact O-N 3.14Å; K599-I602 PolarHBondContact O-N 2.82Å; K599-I602 VanDerWaalsContact O-N 3.11Å; K599-D603 WeakPolarHBondContact CE-OD2 3.25Å; K599-D603 WeakPolarHBondContact O-CB 3.48Å; K599-D603 PolarHBondContact O-N 3.27Å
600	T	61.9	Low	57.9	Low	86 Å²	86	84.1 Å²	84.1	53%	0.528	42%	0.422	S	S	.	.	H	α-helix	trans	-60.7	-32.6	177.3	54.2	0	0	0	0	113.4	E596 R597 Q598 A604	E596-T600 PolarHBondContact O-N 2.96Å; R597-T600 WeakPolarHBondContact CA-OG1 3.37Å; R597-T600 PolarHBondContact O-N 3.42Å; R597-T600 PolarHBondContact O-OG1 3.28Å; Q598-T600 PolarHBondContact O-N 2.85Å; T600-A604 WeakPolarHBondContact O-CB 3.22Å; T600-A604 PolarHBondContact O-N 2.82Å; T600-A604 VanDerWaalsContact O-N 3.12Å
601	I	55.6	Low	58.6	Low	32 Å²	32	88.2 Å²	88.2	16%	0.164	44%	0.438	C	S	.	.	H	α-helix	trans	-69.6	-42.8	175.1	-65.2	166	0	0	0	110.6	R597 Q598 K599 A605 M687 H690	R597-I601 WeakPolarHBondContact O-CG1 3.34Å; R597-I601 PolarHBondContact O-N 3.38Å; R597-I601 VanDerWaalsContact O-N 3.13Å; Q598-I601 PolarHBondContact O-N 3.24Å; K599-I601 PolarHBondContact O-N 3.14Å; I601-A605 WeakPolarHBondContact O-CB 3.36Å; I601-A605 PolarHBondContact O-N 3.48Å; I601-M687 HydrophobicContact CG2-CG 4.44Å; I601-H690 HydrophobicContact CD1-CB 4.27Å
602	I	51.9	Low	58.2	Low	103 Å²	103	84 Å²	84	53%	0.528	43%	0.425	S	S	.	.	H	α-helix	trans	-66.1	-46.4	178.3	-66.5	167.1	0	0	0	110.8	Q598 K599 A604 A605 S606	Q598-I602 WeakPolarHBondContact O-CG1 3.49Å; Q598-I602 PolarHBondContact O-N 2.67Å; K599-I602 PolarHBondContact O-N 2.82Å; K599-I602 VanDerWaalsContact O-N 3.11Å; I602-A604 VanDerWaalsContact C-N 3.34Å; I602-A604 PolarHBondContact O-N 3.14Å; I602-A605 PolarHBondContact O-N 3.12Å; I602-S606 WeakPolarHBondContact O-CB 3.49Å; I602-S606 PolarHBondContact O-N 2.86Å
603	D	58.2	Low	57.7	Low	77 Å²	77	83.7 Å²	83.7	41%	0.412	42%	0.424	S	S	.	.	H	α-helix	trans	-59.9	-45.7	179.4	-70.9	-15.8	0	0	0	110.1	K599 A605 S606 E607	K599-D603 WeakPolarHBondContact CE-OD2 3.25Å; K599-D603 WeakPolarHBondContact O-CB 3.48Å; K599-D603 PolarHBondContact O-N 3.27Å; D603-A605 PolarHBondContact O-N 3.06Å; D603-S606 PolarHBondContact O-N 2.93Å; D603-S606 PolarHBondContact O-OG 3.41Å; D603-E607 PolarHBondContact O-N 2.82Å
604	A	58.2	Low	57.6	Low	47 Å²	47	87 Å²	87	39%	0.388	43%	0.432	S	S	.	.	H	α-helix	trans	-61.7	-41.5	175.7	0	0	0	0	0	113	T600 I602 S606 E608	T600-A604 WeakPolarHBondContact O-CB 3.22Å; T600-A604 PolarHBondContact O-N 2.82Å; T600-A604 VanDerWaalsContact O-N 3.12Å; I602-A604 VanDerWaalsContact C-N 3.34Å; I602-A604 PolarHBondContact O-N 3.14Å; A604-S606 VanDerWaalsContact C-N 3.35Å; A604-E608 PolarHBondContact O-N 3.44Å
605	A	50.5	Low	58.1	Low	17 Å²	17	90.6 Å²	90.6	14%	0.14	45%	0.446	C	S	.	.	H	α-helix	trans	-67.1	-35.8	176.3	0	0	0	0	0	112.3	I601 I602 D603 K609 N683	I601-A605 WeakPolarHBondContact O-CB 3.36Å; I601-A605 PolarHBondContact O-N 3.48Å; I602-A605 PolarHBondContact O-N 3.12Å; D603-A605 PolarHBondContact O-N 3.06Å; A605-K609 WeakPolarHBondContact O-CG 3.43Å; A605-K609 PolarHBondContact O-N 2.91Å; A605-K609 VanDerWaalsContact O-N 3.16Å; A605-N683 WeakPolarHBondContact CB-ND2 3.47Å
606	S	55.2	Low	58.3	Low	55 Å²	55	91.2 Å²	91.2	39%	0.385	44%	0.444	S	S	.	.	H	α-helix	trans	-69.5	-38.6	178	76.8	0	0	0	0	112.2	I602 D603 A604 K609 L610	I602-S606 WeakPolarHBondContact O-CB 3.49Å; I602-S606 PolarHBondContact O-N 2.86Å; D603-S606 PolarHBondContact O-N 2.93Å; D603-S606 PolarHBondContact O-OG 3.41Å; A604-S606 VanDerWaalsContact C-N 3.35Å; S606-K609 PolarHBondContact O-N 3.17Å; S606-L610 WeakPolarHBondContact O-CB 3.39Å; S606-L610 VanDerWaalsContact O-CG 3.3Å; S606-L610 WeakPolarHBondContact O-CG 3.34Å; S606-L610 PolarHBondContact O-N 3.5Å
607	E	59.9	Low	58	Low	137 Å²	137	90.8 Å²	90.8	64%	0.64	44%	0.442	S	S	*	.	H	α-helix	trans	-69.2	-38.2	178.5	-165.7	174.2	-168.8	0	0	111.6	D603 L610 K611	D603-E607 PolarHBondContact O-N 2.82Å; E607-L610 PolarHBondContact O-N 2.92Å; E607-K611 WeakPolarHBondContact O-CB 3.44Å; E607-K611 PolarHBondContact O-N 2.94Å
608	E	60.3	Low	58.5	Low	82 Å²	82	91.7 Å²	91.7	38%	0.383	45%	0.45	S	S	.	.	H	α-helix	trans	-64.4	-43	174.7	-167.9	169.9	-163.6	0	0	111.9	A604 K611 T612 V679	A604-E608 PolarHBondContact O-N 3.44Å; E608-K611 WeakPolarHBondContact O-CB 3.45Å; E608-K611 PolarHBondContact O-N 3.49Å; E608-T612 PolarHBondContact O-N 2.94Å; E608-T612 VanDerWaalsContact O-N 3.12Å; E608-T612 PolarHBondContact O-OG1 3.07Å; E608-V679 HydrophobicContact CG-CG1 4.42Å; E608-V679 WeakPolarHBondContact OE2-CG1 3.41Å
609	K	55.1	Low	58.5	Low	89 Å²	89	92.3 Å²	92.3	39%	0.387	45%	0.452	S	S	.	.	H	α-helix	trans	-63.6	-45.2	173.3	-74.4	-175.5	178.7	-174.7	0	112.6	A605 S606 K611 T612 I613	A605-K609 WeakPolarHBondContact O-CG 3.43Å; A605-K609 PolarHBondContact O-N 2.91Å; A605-K609 VanDerWaalsContact O-N 3.16Å; S606-K609 PolarHBondContact O-N 3.17Å; K609-K611 VanDerWaalsContact C-N 3.27Å; K609-K611 PolarHBondContact O-N 2.96Å; K609-T612 WeakPolarHBondContact CA-OG1 3.4Å; K609-T612 PolarHBondContact O-N 2.65Å; K609-T612 PolarHBondContact O-OG1 3.27Å; K609-T612 VanDerWaalsContact O-OG1 3.12Å; K609-I613 WeakPolarHBondContact O-CG1 3.5Å; K609-I613 PolarHBondContact O-N 3.12Å
610	L	50.2	Low	58.1	Low	83 Å²	83	90.2 Å²	90.2	44%	0.435	45%	0.446	S	S	.	.	H	α-helix	trans	-62.7	-35.5	176.9	-77.9	168.1	0	0	0	111.9	S606 E607 I613 R614	S606-L610 WeakPolarHBondContact O-CB 3.39Å; S606-L610 VanDerWaalsContact O-CG 3.3Å; S606-L610 WeakPolarHBondContact O-CG 3.34Å; S606-L610 PolarHBondContact O-N 3.5Å; E607-L610 PolarHBondContact O-N 2.92Å; L610-I613 PolarHBondContact O-N 3.41Å; L610-R614 WeakPolarHBondContact O-CG 3.42Å; L610-R614 PolarHBondContact O-N 3.49Å
611	K	70.5	Confident	57.9	Low	127 Å²	127	88 Å²	88	55%	0.552	44%	0.437	S	S	*	.	H	α-helix	trans	-63.7	-43.4	173.8	-173.5	-176.2	174.7	-170.5	0	111.6	E607 E608 K609 R614 E615	E607-K611 WeakPolarHBondContact O-CB 3.44Å; E607-K611 PolarHBondContact O-N 2.94Å; E608-K611 WeakPolarHBondContact O-CB 3.45Å; E608-K611 PolarHBondContact O-N 3.49Å; K609-K611 VanDerWaalsContact C-N 3.27Å; K609-K611 PolarHBondContact O-N 2.96Å; K611-R614 PolarHBondContact O-N 2.89Å; K611-E615 WeakPolarHBondContact CE-OE1 3.35Å; K611-E615 WeakPolarHBondContact O-CG 3.5Å; K611-E615 PolarHBondContact O-N 2.83Å
612	T	55.7	Low	58.3	Low	61 Å²	61	89.7 Å²	89.7	37%	0.374	45%	0.446	S	S	.	.	H	α-helix	trans	-64.2	-41.1	176.8	0.1	0	0	0	0	111.6	E608 K609 E615 F616	E608-T612 PolarHBondContact O-N 2.94Å; E608-T612 VanDerWaalsContact O-N 3.12Å; E608-T612 PolarHBondContact O-OG1 3.07Å; K609-T612 WeakPolarHBondContact CA-OG1 3.4Å; K609-T612 PolarHBondContact O-N 2.65Å; K609-T612 PolarHBondContact O-OG1 3.27Å; K609-T612 VanDerWaalsContact O-OG1 3.12Å; T612-E615 PolarHBondContact O-N 2.96Å; T612-F616 PolarHBondContact O-N 3.32Å
613	I	50.3	Low	58.3	Low	90 Å²	90	87.2 Å²	87.2	46%	0.462	44%	0.437	S	S	.	.	H	α-helix	trans	-61.4	-46.1	175.7	-66.7	166.4	0	0	0	110.9	K609 L610 E615 F616 E617	K609-I613 WeakPolarHBondContact O-CG1 3.5Å; K609-I613 PolarHBondContact O-N 3.12Å; L610-I613 PolarHBondContact O-N 3.41Å; I613-E615 VanDerWaalsContact C-N 3.32Å; I613-E615 PolarHBondContact O-N 2.93Å; I613-F616 WeakPolarHBondContact O-CB 3.41Å; I613-F616 PolarHBondContact O-N 3.27Å; I613-F616 VanDerWaalsContact O-N 3.1Å; I613-E617 HydrophobicContact CG2-CG 4.37Å; I613-E617 WeakPolarHBondContact O-CG 3.43Å; I613-E617 PolarHBondContact O-N 3.48Å
614	R	65.5	Low	58.2	Low	163 Å²	163	90.2 Å²	90.2	62%	0.615	45%	0.447	S	S	*	.	H	α-helix	trans	-62.7	-36.9	177.6	-73	173.8	-175.5	157.7	2.9	113	L610 K611 F616 K618	L610-R614 WeakPolarHBondContact O-CG 3.42Å; L610-R614 PolarHBondContact O-N 3.49Å; K611-R614 PolarHBondContact O-N 2.89Å; R614-F616 VanDerWaalsContact C-N 3.32Å; R614-K618 WeakPolarHBondContact O-CB 3.35Å; R614-K618 PolarHBondContact O-N 3.38Å; R614-K618 VanDerWaalsContact O-N 3.1Å
615	E	64.8	Low	58.2	Low	106 Å²	106	95.5 Å²	95.5	50%	0.495	46%	0.457	S	S	.	.	H	α-helix	trans	-64.6	-38.8	173.7	-74.2	173.9	-174.4	0	0	111.1	K611 T612 I613 K618 H619	K611-E615 WeakPolarHBondContact CE-OE1 3.35Å; K611-E615 WeakPolarHBondContact O-CG 3.5Å; K611-E615 PolarHBondContact O-N 2.83Å; T612-E615 PolarHBondContact O-N 2.96Å; I613-E615 VanDerWaalsContact C-N 3.32Å; I613-E615 PolarHBondContact O-N 2.93Å; E615-K618 PolarHBondContact O-N 3.43Å; E615-H619 PolarHBondContact O-N 2.76Å
616	F	57.8	Low	58.4	Low	111 Å²	111	97 Å²	97	49%	0.487	47%	0.47	S	S	.	.	H	α-helix	trans	-68.9	-46	176.6	-162.3	-106	0	0	0	112.8	T612 I613 R614 K618 H619 I620 L669	T612-F616 PolarHBondContact O-N 3.32Å; I613-F616 WeakPolarHBondContact O-CB 3.41Å; I613-F616 PolarHBondContact O-N 3.27Å; I613-F616 VanDerWaalsContact O-N 3.1Å; R614-F616 VanDerWaalsContact C-N 3.32Å; F616-K618 PolarHBondContact O-N 2.97Å; F616-H619 WeakPolarHBondContact O-CB 3.3Å; F616-H619 PolarHBondContact O-N 2.69Å; F616-I620 HydrophobicContact CD1-CD1 3.66Å; F616-I620 HydrophobicContact CD1-CG1 4.32Å; F616-I620 HydrophobicContact CE1-CD1 3.59Å; F616-I620 HydrophobicContact CE1-CG1 4.25Å; F616-I620 WeakPolarHBondContact O-CG1 3.35Å; F616-I620 PolarHBondContact O-N 2.81Å; F616-L669 HydrophobicContact CE2-CD1 4.29Å; F616-L669 HydrophobicContact CZ-CD1 4.32Å
617	E	56.7	Low	57.9	Low	118 Å²	118	98.3 Å²	98.3	55%	0.551	48%	0.475	S	S	*	.	H	α-helix	trans	-56.9	-39.6	174.4	-74.3	179.2	158.7	0	0	111.6	I613 I620 A621	I613-E617 HydrophobicContact CG2-CG 4.37Å; I613-E617 WeakPolarHBondContact O-CG 3.43Å; I613-E617 PolarHBondContact O-N 3.48Å; E617-I620 PolarHBondContact O-N 3.33Å; E617-A621 WeakPolarHBondContact O-CB 3.31Å; E617-A621 PolarHBondContact O-N 3.46Å
618	K	72.7	Confident	57.6	Low	135 Å²	135	95.3 Å²	95.3	59%	0.587	46%	0.463	S	S	*	.	H	α-helix	trans	-64	-45.2	174.4	-173	-174.6	173.1	-167.5	0	111.7	R614 E615 F616 I620 A621 D622	R614-K618 WeakPolarHBondContact O-CB 3.35Å; R614-K618 PolarHBondContact O-N 3.38Å; R614-K618 VanDerWaalsContact O-N 3.1Å; E615-K618 PolarHBondContact O-N 3.43Å; F616-K618 PolarHBondContact O-N 2.97Å; K618-I620 VanDerWaalsContact C-N 3.31Å; K618-I620 PolarHBondContact O-N 3.26Å; K618-A621 PolarHBondContact O-N 3.03Å; K618-D622 WeakPolarHBondContact O-CB 3.46Å; K618-D622 PolarHBondContact O-N 2.95Å
619	H	57.5	Low	57.4	Low	98 Å²	98	95.2 Å²	95.2	45%	0.454	47%	0.466	S	S	.	.	H	α-helix	trans	-59.9	-40.3	176.4	-116	-103.1	0	0	0	112.3	E615 F616 S623 E668	E615-H619 PolarHBondContact O-N 2.76Å; F616-H619 WeakPolarHBondContact O-CB 3.3Å; F616-H619 PolarHBondContact O-N 2.69Å; H619-S623 WeakPolarHBondContact O-CB 3.41Å; H619-S623 PolarHBondContact O-N 3.08Å; H619-S623 PolarHBondContact O-OG 3.03Å; H619-E668 IonicContact CE1-OE2 3.35Å; H619-E668 PolarHBondContact CE1-OE2 3.09Å
620	I	51.2	Low	57.1	Low	78 Å²	78	97.8 Å²	97.8	40%	0.4	47%	0.473	S	S	.	.	H	α-helix	trans	-63.7	-45	174.3	-66.5	170.3	0	0	0	110.6	F616 E617 K618 S623 K624	F616-I620 HydrophobicContact CD1-CD1 3.66Å; F616-I620 HydrophobicContact CD1-CG1 4.32Å; F616-I620 HydrophobicContact CE1-CD1 3.59Å; F616-I620 HydrophobicContact CE1-CG1 4.25Å; F616-I620 WeakPolarHBondContact O-CG1 3.35Å; F616-I620 PolarHBondContact O-N 2.81Å; E617-I620 PolarHBondContact O-N 3.33Å; K618-I620 VanDerWaalsContact C-N 3.31Å; K618-I620 PolarHBondContact O-N 3.26Å; I620-S623 PolarHBondContact O-N 2.92Å; I620-K624 PolarHBondContact O-N 3.46Å
621	A	59.3	Low	57.1	Low	40 Å²	40	102.7 Å²	102.7	33%	0.331	49%	0.485	S	S	.	.	H	α-helix	trans	-64.6	-42.4	179.4	0	0	0	0	0	112.3	E617 K618 K624 R625	E617-A621 WeakPolarHBondContact O-CB 3.31Å; E617-A621 PolarHBondContact O-N 3.46Å; K618-A621 PolarHBondContact O-N 3.03Å; A621-K624 PolarHBondContact O-N 3.43Å; A621-R625 PolarHBondContact O-N 2.95Å
622	D	63.7	Low	56.1	Low	67 Å²	67	105 Å²	105	36%	0.358	49%	0.49	S	S	.	.	H	α-helix	trans	-66.8	-38.7	176.5	-72.2	-21.8	0	0	0	111	K618 R625 A626	K618-D622 WeakPolarHBondContact O-CB 3.46Å; K618-D622 PolarHBondContact O-N 2.95Å; D622-R625 PolarHBondContact O-N 3.35Å; D622-R625 IonicContact OD1-NH1 3.27Å; D622-A626 PolarHBondContact O-N 3.44Å
623	S	51.2	Low	55.6	Low	50 Å²	50	111.9 Å²	111.9	35%	0.35	51%	0.511	S	S	.	.	H	α-helix	trans	-63.4	-43.1	172.3	-75.8	0	0	0	0	112.6	H619 I620 R625 A626 V627	H619-S623 WeakPolarHBondContact O-CB 3.41Å; H619-S623 PolarHBondContact O-N 3.08Å; H619-S623 PolarHBondContact O-OG 3.03Å; I620-S623 PolarHBondContact O-N 2.92Å; S623-R625 PolarHBondContact O-N 3.16Å; S623-A626 PolarHBondContact O-N 3.35Å; S623-V627 WeakPolarHBondContact O-CG2 3.41Å; S623-V627 PolarHBondContact O-N 3.37Å
624	K	55.1	Low	55.2	Low	141 Å²	141	116.5 Å²	116.5	61%	0.613	53%	0.528	S	S	*	.	H	α-helix	trans	-60.1	-44.3	174.4	-81.2	-175.4	177.4	179.7	0	111.5	I620 A621 A626 V627 D628	I620-K624 PolarHBondContact O-N 3.46Å; A621-K624 PolarHBondContact O-N 3.43Å; K624-A626 PolarHBondContact O-N 3.5Å; K624-V627 PolarHBondContact O-N 3.16Å; K624-D628 PolarHBondContact O-N 3Å
625	R	58.3	Low	53.8	Low	157 Å²	157	113.8 Å²	113.8	59%	0.592	53%	0.529	S	S	*	.	H	α-helix	trans	-61.4	-43.2	174.9	-74	-172.3	-148.8	150.8	10.9	112.4	A621 D622 S623 V627 D628 D629	A621-R625 PolarHBondContact O-N 2.95Å; D622-R625 PolarHBondContact O-N 3.35Å; D622-R625 IonicContact OD1-NH1 3.27Å; S623-R625 PolarHBondContact O-N 3.16Å; R625-V627 VanDerWaalsContact C-N 3.26Å; R625-V627 PolarHBondContact O-N 3.02Å; R625-D628 PolarHBondContact O-N 3.45Å; R625-D629 WeakPolarHBondContact O-CB 3.29Å; R625-D629 PolarHBondContact O-N 3.23Å
626	A	54.8	Low	52.4	Low	50 Å²	50	114.1 Å²	114.1	41%	0.413	54%	0.539	S	S	.	.	H	α-helix	trans	-60.8	-36.9	177.2	0	0	0	0	0	112.2	D622 S623 K624 R630	D622-A626 PolarHBondContact O-N 3.44Å; S623-A626 PolarHBondContact O-N 3.35Å; K624-A626 PolarHBondContact O-N 3.5Å; A626-R630 WeakPolarHBondContact O-CG 3.38Å; A626-R630 PolarHBondContact O-N 2.92Å
627	V	45.3	Very low	51.4	Low	81 Å²	81	115.2 Å²	115.2	49%	0.491	55%	0.55	S	S	.	.	H	α-helix	trans	-68.9	-44	174.2	173.6	0	0	0	0	111.4	S623 K624 R625 R630 R631	S623-V627 WeakPolarHBondContact O-CG2 3.41Å; S623-V627 PolarHBondContact O-N 3.37Å; K624-V627 PolarHBondContact O-N 3.16Å; R625-V627 VanDerWaalsContact C-N 3.26Å; R625-V627 PolarHBondContact O-N 3.02Å; V627-R630 PolarHBondContact O-N 2.93Å; V627-R631 PolarHBondContact O-N 3.18Å
628	D	54.1	Low	50.5	Low	74 Å²	74	115.8 Å²	115.8	40%	0.396	56%	0.564	S	S	.	*	H	α-helix	trans	-67.1	-41.4	179.3	-77.5	-20	0	0	0	112.5	K624 R625 R630 R631 R632	K624-D628 PolarHBondContact O-N 3Å; R625-D628 PolarHBondContact O-N 3.45Å; D628-R630 VanDerWaalsContact C-N 3.31Å; D628-R630 PolarHBondContact O-N 2.9Å; D628-R631 WeakPolarHBondContact O-CB 3.42Å; D628-R631 PolarHBondContact O-N 3.26Å; D628-R631 VanDerWaalsContact O-N 3.16Å; D628-R632 WeakPolarHBondContact O-CG 3.45Å; D628-R632 PolarHBondContact O-N 3.33Å
629	D	55.6	Low	48.7	Very low	81 Å²	81	115 Å²	115	43%	0.433	57%	0.565	S	S	.	*	H	α-helix	trans	-61.3	-41.1	174.9	-75.1	-14.7	0	0	0	110.6	R625 R631 R632 Y633	R625-D629 WeakPolarHBondContact O-CB 3.29Å; R625-D629 PolarHBondContact O-N 3.23Å; D629-R631 PolarHBondContact O-N 3.07Å; D629-R632 WeakPolarHBondContact O-CB 3.43Å; D629-R632 PolarHBondContact O-N 2.68Å; D629-R632 VanDerWaalsContact O-N 3.16Å; D629-R632 IonicContact OD1-NE 3.68Å; D629-Y633 WeakPolarHBondContact O-CD2 3.35Å; D629-Y633 PolarHBondContact O-N 3.08Å
630	R	49	Very low	48	Very low	143 Å²	143	114.6 Å²	114.6	54%	0.54	57%	0.571	S	S	.	*	H	α-helix	trans	-63.6	-37.4	173.6	-76.9	-179.6	-174.3	-173.6	4.3	113.1	A626 V627 D628 R632 Y633 K634	A626-R630 WeakPolarHBondContact O-CG 3.38Å; A626-R630 PolarHBondContact O-N 2.92Å; V627-R630 PolarHBondContact O-N 2.93Å; D628-R630 VanDerWaalsContact C-N 3.31Å; D628-R630 PolarHBondContact O-N 2.9Å; R630-R632 VanDerWaalsContact C-N 3.29Å; R630-R632 PolarHBondContact O-N 3.12Å; R630-Y633 PolarHBondContact O-N 3.03Å; R630-K634 PolarHBondContact O-N 2.98Å
631	R	50.2	Low	47.7	Very low	185 Å²	185	118.8 Å²	118.8	70%	0.698	60%	0.595	S	S	*	*	H	α-helix	trans	-63.2	-38.2	173.7	-76.7	-177.9	179.5	-169.6	0.2	111.1	V627 D628 D629 K634	V627-R631 PolarHBondContact O-N 3.18Å; D628-R631 WeakPolarHBondContact O-CB 3.42Å; D628-R631 PolarHBondContact O-N 3.26Å; D628-R631 VanDerWaalsContact O-N 3.16Å; D629-R631 PolarHBondContact O-N 3.07Å; R631-K634 PolarHBondContact O-N 3.01Å
632	R	48.6	Very low	47	Very low	175 Å²	175	123 Å²	123	66%	0.66	62%	0.616	S	S	*	*	H	α-helix	trans	-68.2	-30.7	175.3	-66	-179	-143.3	-136.3	3.4	113.4	D628 D629 R630 K634 V635	D628-R632 WeakPolarHBondContact O-CG 3.45Å; D628-R632 PolarHBondContact O-N 3.33Å; D629-R632 WeakPolarHBondContact O-CB 3.43Å; D629-R632 PolarHBondContact O-N 2.68Å; D629-R632 VanDerWaalsContact O-N 3.16Å; D629-R632 IonicContact OD1-NE 3.68Å; R630-R632 VanDerWaalsContact C-N 3.29Å; R630-R632 PolarHBondContact O-N 3.12Å; R632-K634 VanDerWaalsContact C-N 3.31Å; R632-V635 WeakPolarHBondContact O-CG2 3.27Å
633	Y	45	Very low	45.9	Very low	206 Å²	206	123.9 Å²	123.9	81%	0.808	62%	0.618	S	S	*	*	H	α-helix	trans	-79.3	-9.6	176.4	-80.7	-74.3	0	0	0	114.2	D629 R630 V635	D629-Y633 WeakPolarHBondContact O-CD2 3.35Å; D629-Y633 PolarHBondContact O-N 3.08Å; R630-Y633 PolarHBondContact O-N 3.03Å; Y633-V635 PolarHBondContact O-N 2.92Å
634	K	42.3	Very low	45.6	Very low	188 Å²	188	123.3 Å²	123.3	82%	0.817	62%	0.62	S	S	*	*			trans	-80.6	52	165.5	-77.7	-174.3	174.9	-179.7	0	110.9	R630 R631 R632	R630-K634 PolarHBondContact O-N 2.98Å; R631-K634 PolarHBondContact O-N 3.01Å; R632-K634 VanDerWaalsContact C-N 3.31Å
635	V	36.6	Very low	45.3	Very low	105 Å²	105	125.2 Å²	125.2	64%	0.636	63%	0.629	S	S	*	*			trans	-97.3	102	175.2	165.2	0	0	0	0	108.4	R632 Y633	R632-V635 WeakPolarHBondContact O-CG2 3.27Å; Y633-V635 PolarHBondContact O-N 2.92Å
636	T	35.9	Very low	45	Very low	114 Å²	114	122.9 Å²	122.9	70%	0.699	62%	0.624	S	S	*	*			trans	45.4	88.2	141.5	60.4	0	0	0	0	117.8
637	D	35.8	Very low	44.8	Very low	134 Å²	134	126.3 Å²	126.3	72%	0.717	63%	0.63	S	S	*	*			trans	-144.8	119.6	133.5	-98.7	-27.6	0	0	0	109.5	L639	D637-L639 VanDerWaalsContact C-N 3.33Å; D637-L639 HydrophobicContact CB-CD1 4.2Å; D637-L639 HydrophobicContact CB-CG 4.35Å; D637-L639 PolarHBondContact O-N 3.17Å
638	P	37.8	Very low	45.2	Very low	130 Å²	130	127.1 Å²	127.1	84%	0.844	63%	0.63	S	S	*	*			trans	-73.7	88.6	175	29.3	-29.7	0	0	0	108.7
639	L	36.3	Very low	45.6	Very low	118 Å²	118	130.3 Å²	130.3	62%	0.618	64%	0.643	S	S	*	*			trans	-84.3	146.2	-174.1	-86.7	145.4	0	0	0	113.7	D637	D637-L639 VanDerWaalsContact C-N 3.33Å; D637-L639 HydrophobicContact CB-CD1 4.2Å; D637-L639 HydrophobicContact CB-CG 4.35Å; D637-L639 PolarHBondContact O-N 3.17Å
640	P	41.5	Very low	45.5	Very low	90 Å²	90	132.6 Å²	132.6	58%	0.584	65%	0.651	S	S	*	*			trans	-71.7	157.5	-169.3	-13.5	29.2	0	0	0	115.2	T642	P640-T642 PolarHBondContact O-N 2.87Å
641	D	45.3	Very low	45.7	Very low	166 Å²	166	130.6 Å²	130.6	89%	0.888	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-57.7	-6	-166	-96.1	-26.3	0	0	0	118.3	H643	D641-H643 PolarHBondContact O-N 3.12Å
642	T	45.6	Very low	46.1	Very low	128 Å²	128	128.9 Å²	128.9	79%	0.785	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-75.7	-12.4	-180	50	0	0	0	0	113.5	P640	P640-T642 PolarHBondContact O-N 2.87Å
643	H	40.1	Very low	46.7	Very low	85 Å²	85	123.5 Å²	123.5	39%	0.394	64%	0.642	S	S	.	*	G	3₁₀ helix	trans	-89.1	2.6	180	-75.4	-73	0	0	0	115.3	D641 K645 Q646 K647	D641-H643 PolarHBondContact O-N 3.12Å; H643-K645 VanDerWaalsContact C-N 3.26Å; H643-K645 PolarHBondContact O-N 3.29Å; H643-K645 VanDerWaalsContact O-N 3.12Å; H643-Q646 PolarHBondContact CE1-OE1 2.94Å; H643-Q646 PolarHBondContact ND1-OE1 2.85Å; H643-Q646 PolarHBondContact O-N 3.16Å; H643-Q646 VanDerWaalsContact O-N 3.11Å; H643-K647 WeakPolarHBondContact O-CB 3.43Å; H643-K647 PolarHBondContact O-N 3.19Å
644	G	43.3	Very low	47.2	Very low	39 Å²	39	116.8 Å²	116.8	40%	0.402	62%	0.624	S	S	.	*	H	α-helix	trans	-52.4	-39.8	-177	0	0	0	0	0	114.3	I648	G644-I648 VanDerWaalsContact O-CG1 3.28Å; G644-I648 WeakPolarHBondContact O-CG1 3.4Å; G644-I648 PolarHBondContact O-N 2.91Å; G644-I648 VanDerWaalsContact O-N 3.14Å
645	K	49.1	Very low	48.1	Very low	181 Å²	181	112.7 Å²	112.7	79%	0.787	61%	0.611	S	S	*	*	H	α-helix	trans	-70.4	-46.4	176.5	-104.7	-176.3	176.3	-178.5	0	113.2	H643 K647 I648 E649	H643-K645 VanDerWaalsContact C-N 3.26Å; H643-K645 PolarHBondContact O-N 3.29Å; H643-K645 VanDerWaalsContact O-N 3.12Å; K645-K647 VanDerWaalsContact C-N 3.27Å; K645-K647 PolarHBondContact O-N 3.19Å; K645-I648 PolarHBondContact O-N 3.05Å; K645-E649 PolarHBondContact O-N 3Å; K645-E649 VanDerWaalsContact O-N 3.1Å
646	Q	53.7	Low	49.5	Very low	107 Å²	107	114.2 Å²	114.2	50%	0.5	61%	0.609	S	S	.	*	H	α-helix	trans	-61.6	-38.2	175.7	-88.4	-179	-19.2	0	0	111.2	H643 I648 E649 E650	H643-Q646 PolarHBondContact CE1-OE1 2.94Å; H643-Q646 PolarHBondContact ND1-OE1 2.85Å; H643-Q646 PolarHBondContact O-N 3.16Å; H643-Q646 VanDerWaalsContact O-N 3.11Å; Q646-I648 VanDerWaalsContact C-N 3.34Å; Q646-I648 PolarHBondContact O-N 3.31Å; Q646-E649 PolarHBondContact O-N 2.99Å; Q646-E650 WeakPolarHBondContact O-CB 3.31Å; Q646-E650 WeakPolarHBondContact O-CG 3.33Å; Q646-E650 PolarHBondContact O-N 3.37Å
647	K	50	Low	50.6	Low	122 Å²	122	111.7 Å²	111.7	53%	0.53	60%	0.596	S	S	.	*	H	α-helix	trans	-66.9	-34.7	178.3	-134.6	168.4	-170.6	170.1	0	112.6	H643 K645 L651	H643-K647 WeakPolarHBondContact O-CB 3.43Å; H643-K647 PolarHBondContact O-N 3.19Å; K645-K647 VanDerWaalsContact C-N 3.27Å; K645-K647 PolarHBondContact O-N 3.19Å; K647-L651 VanDerWaalsContact O-CB 3.25Å; K647-L651 WeakPolarHBondContact O-CB 3.28Å; K647-L651 PolarHBondContact O-N 2.97Å
648	I	53.4	Low	51.2	Low	98 Å²	98	108.1 Å²	108.1	50%	0.503	58%	0.579	S	S	.	*	H	α-helix	trans	-68	-40.4	173.2	-68.6	165.4	0	0	0	110.5	G644 K645 Q646 L651 K652	G644-I648 VanDerWaalsContact O-CG1 3.28Å; G644-I648 WeakPolarHBondContact O-CG1 3.4Å; G644-I648 PolarHBondContact O-N 2.91Å; G644-I648 VanDerWaalsContact O-N 3.14Å; K645-I648 PolarHBondContact O-N 3.05Å; Q646-I648 VanDerWaalsContact C-N 3.34Å; Q646-I648 PolarHBondContact O-N 3.31Å; I648-L651 PolarHBondContact O-N 2.89Å; I648-K652 WeakPolarHBondContact O-CB 3.43Å; I648-K652 WeakPolarHBondContact O-CG 3.45Å; I648-K652 PolarHBondContact O-N 3.31Å
649	E	61.7	Low	52	Low	142 Å²	142	104.8 Å²	104.8	66%	0.664	56%	0.563	S	S	*	*	H	α-helix	trans	-67.1	-41.7	174.7	-79.6	-176	165.6	0	0	112.4	K645 Q646 L651 K652 A653	K645-E649 PolarHBondContact O-N 3Å; K645-E649 VanDerWaalsContact O-N 3.1Å; Q646-E649 PolarHBondContact O-N 2.99Å; E649-L651 PolarHBondContact O-N 3.45Å; E649-K652 PolarHBondContact O-N 3.32Å; E649-A653 WeakPolarHBondContact O-CB 3.41Å; E649-A653 PolarHBondContact O-N 2.88Å
650	E	54.1	Low	53.2	Low	129 Å²	129	104.2 Å²	104.2	60%	0.603	56%	0.557	S	S	*	*	H	α-helix	trans	-62.6	-40.1	172.8	-75.6	177.3	178.6	0	0	111.7	Q646 A653 S654	Q646-E650 WeakPolarHBondContact O-CB 3.31Å; Q646-E650 WeakPolarHBondContact O-CG 3.33Å; Q646-E650 PolarHBondContact O-N 3.37Å; E650-A653 PolarHBondContact O-N 2.82Å; E650-S654 WeakPolarHBondContact O-CB 3.38Å; E650-S654 PolarHBondContact O-N 3.5Å
651	L	53.6	Low	54	Low	101 Å²	101	104.1 Å²	104.1	53%	0.529	55%	0.55	S	S	.	.	H	α-helix	trans	-65.6	-40.2	173.8	-94.5	154.3	0	0	0	111.9	K647 I648 E649 S654 N655	K647-L651 VanDerWaalsContact O-CB 3.25Å; K647-L651 WeakPolarHBondContact O-CB 3.28Å; K647-L651 PolarHBondContact O-N 2.97Å; I648-L651 PolarHBondContact O-N 2.89Å; E649-L651 PolarHBondContact O-N 3.45Å; L651-S654 PolarHBondContact O-N 3.25Å; L651-N655 WeakPolarHBondContact O-CB 3.46Å; L651-N655 PolarHBondContact O-N 2.94Å
652	K	58.6	Low	54.3	Low	148 Å²	148	101.5 Å²	101.5	64%	0.643	54%	0.535	S	S	*	.	H	α-helix	trans	-66.9	-42.9	175	-78.7	-177.1	177.6	-176.3	0	111.8	I648 E649 S654 N655 K656	I648-K652 WeakPolarHBondContact O-CB 3.43Å; I648-K652 WeakPolarHBondContact O-CG 3.45Å; I648-K652 PolarHBondContact O-N 3.31Å; E649-K652 PolarHBondContact O-N 3.32Å; K652-S654 VanDerWaalsContact C-N 3.32Å; K652-N655 PolarHBondContact O-N 2.87Å; K652-K656 WeakPolarHBondContact O-CB 3.45Å; K652-K656 PolarHBondContact O-N 2.9Å
653	A	61.8	Low	55	Low	63 Å²	63	100.4 Å²	100.4	52%	0.521	52%	0.524	S	S	.	.	H	α-helix	trans	-63.3	-40.4	174.3	0	0	0	0	0	111.1	E649 E650 K656 C657	E649-A653 WeakPolarHBondContact O-CB 3.41Å; E649-A653 PolarHBondContact O-N 2.88Å; E650-A653 PolarHBondContact O-N 2.82Å; A653-K656 PolarHBondContact O-N 3.35Å; A653-C657 WeakPolarHBondContact O-CB 3.32Å; A653-C657 PolarHBondContact O-N 2.97Å
654	S	55.6	Low	56	Low	64 Å²	64	100 Å²	100	45%	0.448	53%	0.528	S	S	.	.	H	α-helix	trans	-62.6	-47.9	174.4	-179.3	0	0	0	0	111.4	E650 L651 K652 K656 C657 T658	E650-S654 WeakPolarHBondContact O-CB 3.38Å; E650-S654 PolarHBondContact O-N 3.5Å; L651-S654 PolarHBondContact O-N 3.25Å; K652-S654 VanDerWaalsContact C-N 3.32Å; S654-K656 VanDerWaalsContact C-N 3.32Å; S654-K656 PolarHBondContact O-N 3.37Å; S654-C657 PolarHBondContact O-N 3.34Å; S654-T658 PolarHBondContact O-N 2.78Å; S654-T658 PolarHBondContact O-OG1 3.06Å
655	N	59.6	Low	56.4	Low	102 Å²	102	101.8 Å²	101.8	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-62.4	-40.7	179.3	-79.4	0.9	0	0	0	111.5	L651 K652 T658 A659	L651-N655 WeakPolarHBondContact O-CB 3.46Å; L651-N655 PolarHBondContact O-N 2.94Å; K652-N655 PolarHBondContact O-N 2.87Å; N655-T658 VanDerWaalsContact CA-OG1 3.24Å; N655-T658 WeakPolarHBondContact CA-OG1 3.47Å; N655-T658 PolarHBondContact O-N 3.28Å; N655-T658 PolarHBondContact O-OG1 3Å; N655-A659 WeakPolarHBondContact O-CB 3.42Å; N655-A659 PolarHBondContact O-N 3.02Å
656	K	66.4	Low	56.7	Low	137 Å²	137	98 Å²	98	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-61.4	-46	174	-170.4	179.8	176.6	-174.1	0	111.5	K652 A653 S654 T658 A659 E660	K652-K656 WeakPolarHBondContact O-CB 3.45Å; K652-K656 PolarHBondContact O-N 2.9Å; A653-K656 PolarHBondContact O-N 3.35Å; S654-K656 VanDerWaalsContact C-N 3.32Å; S654-K656 PolarHBondContact O-N 3.37Å; K656-T658 PolarHBondContact O-N 3.49Å; K656-A659 PolarHBondContact O-N 3.35Å; K656-E660 VanDerWaalsContact CE-OE1 3.31Å; K656-E660 WeakPolarHBondContact CE-OE1 3.44Å; K656-E660 WeakPolarHBondContact O-CG 3.41Å; K656-E660 PolarHBondContact O-N 2.72Å
657	C	58.7	Low	56.9	Low	61 Å²	61	95.9 Å²	95.9	41%	0.412	51%	0.51	S	S	.	.	H	α-helix	trans	-63.2	-40.5	177	-176.2	0	0	0	0	112.6	A653 S654 E660 M661	A653-C657 WeakPolarHBondContact O-CB 3.32Å; A653-C657 PolarHBondContact O-N 2.97Å; S654-C657 PolarHBondContact O-N 3.34Å; C657-E660 PolarHBondContact O-N 2.89Å; C657-M661 PolarHBondContact O-N 3.3Å
658	T	49.3	Very low	57.2	Low	59 Å²	59	94 Å²	94	36%	0.362	50%	0.503	S	S	.	.	H	α-helix	trans	-65.2	-39.5	174.4	32.1	0	0	0	0	112.6	S654 N655 K656 E660 M661 L662	S654-T658 PolarHBondContact O-N 2.78Å; S654-T658 PolarHBondContact O-OG1 3.06Å; N655-T658 VanDerWaalsContact CA-OG1 3.24Å; N655-T658 WeakPolarHBondContact CA-OG1 3.47Å; N655-T658 PolarHBondContact O-N 3.28Å; N655-T658 PolarHBondContact O-OG1 3Å; K656-T658 PolarHBondContact O-N 3.49Å; T658-E660 VanDerWaalsContact C-N 3.35Å; T658-M661 PolarHBondContact O-N 2.87Å; T658-L662 WeakPolarHBondContact O-CB 3.49Å; T658-L662 PolarHBondContact O-N 3.48Å
659	A	55.1	Low	57.1	Low	61 Å²	61	93.2 Å²	93.2	50%	0.504	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-41.9	175.7	0	0	0	0	0	111.3	N655 K656 L662 N663	N655-A659 WeakPolarHBondContact O-CB 3.42Å; N655-A659 PolarHBondContact O-N 3.02Å; K656-A659 PolarHBondContact O-N 3.35Å; A659-L662 PolarHBondContact O-N 3.11Å; A659-N663 WeakPolarHBondContact O-CB 3.35Å; A659-N663 PolarHBondContact O-N 2.98Å
660	E	60.7	Low	56.8	Low	105 Å²	105	92.9 Å²	92.9	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-62.7	-41.5	174.6	-72.3	169.1	-175.8	0	0	112.1	K656 C657 T658 N663 T664	K656-E660 VanDerWaalsContact CE-OE1 3.31Å; K656-E660 WeakPolarHBondContact CE-OE1 3.44Å; K656-E660 WeakPolarHBondContact O-CG 3.41Å; K656-E660 PolarHBondContact O-N 2.72Å; C657-E660 PolarHBondContact O-N 2.89Å; T658-E660 VanDerWaalsContact C-N 3.35Å; E660-N663 PolarHBondContact O-N 2.93Å; E660-T664 PolarHBondContact O-N 3.4Å; E660-T664 PolarHBondContact O-OG1 3.36Å
661	M	57.5	Low	57.3	Low	89 Å²	89	91.2 Å²	91.2	44%	0.438	49%	0.492	S	S	.	.	H	α-helix	trans	-63.1	-44.8	174.4	-107.8	-177.1	67.5	0	0	112.5	C657 T658 N663 T664 L665	C657-M661 PolarHBondContact O-N 3.3Å; T658-M661 PolarHBondContact O-N 2.87Å; M661-N663 VanDerWaalsContact C-N 3.3Å; M661-N663 PolarHBondContact O-N 2.98Å; M661-T664 WeakPolarHBondContact O-CB 3.35Å; M661-T664 PolarHBondContact O-N 3.18Å; M661-L665 PolarHBondContact O-N 2.9Å
662	L	51.9	Low	57.1	Low	111 Å²	111	89.5 Å²	89.5	58%	0.581	49%	0.488	S	S	*	.	H	α-helix	trans	-64.5	-39.4	179.6	-129.7	144.4	0	0	0	110.8	T658 A659 T664 L665 L666	T658-L662 WeakPolarHBondContact O-CB 3.49Å; T658-L662 PolarHBondContact O-N 3.48Å; A659-L662 PolarHBondContact O-N 3.11Å; L662-T664 VanDerWaalsContact C-N 3.33Å; L662-T664 PolarHBondContact O-N 3.09Å; L662-L665 PolarHBondContact O-N 3.46Å; L662-L666 HydrophobicContact CD2-CD1 4.36Å; L662-L666 WeakPolarHBondContact O-CG 3.36Å; L662-L666 PolarHBondContact O-N 2.94Å
663	N	61.2	Low	56.8	Low	105 Å²	105	87.9 Å²	87.9	56%	0.561	49%	0.486	S	S	*	.	H	α-helix	trans	-66.5	-35	174.5	-147.6	12.9	0	0	0	112.1	A659 E660 M661 T667	A659-N663 WeakPolarHBondContact O-CB 3.35Å; A659-N663 PolarHBondContact O-N 2.98Å; E660-N663 PolarHBondContact O-N 2.93Å; M661-N663 VanDerWaalsContact C-N 3.3Å; M661-N663 PolarHBondContact O-N 2.98Å; N663-T667 WeakPolarHBondContact O-CG2 3.29Å; N663-T667 PolarHBondContact O-N 3.46Å; N663-T667 PolarHBondContact O-OG1 3.3Å
664	T	60.2	Low	57	Low	75 Å²	75	92 Å²	92	46%	0.46	49%	0.492	S	S	.	.	H	α-helix	trans	-65.9	-42	173.1	-52.8	0	0	0	0	111.5	E660 M661 L662 T667 E668	E660-T664 PolarHBondContact O-N 3.4Å; E660-T664 PolarHBondContact O-OG1 3.36Å; M661-T664 WeakPolarHBondContact O-CB 3.35Å; M661-T664 PolarHBondContact O-N 3.18Å; L662-T664 VanDerWaalsContact C-N 3.33Å; L662-T664 PolarHBondContact O-N 3.09Å; T664-T667 WeakPolarHBondContact CA-OG1 3.46Å; T664-T667 PolarHBondContact O-N 2.84Å; T664-T667 PolarHBondContact O-OG1 3.39Å; T664-E668 WeakPolarHBondContact O-CG 3.26Å; T664-E668 PolarHBondContact O-N 3.49Å
665	L	51.6	Low	57.4	Low	78 Å²	78	95.3 Å²	95.3	41%	0.408	50%	0.498	S	S	.	.	H	α-helix	trans	-65.6	-41.7	176.1	-73.6	170.3	0	0	0	112.1	M661 L662 E668 L669	M661-L665 PolarHBondContact O-N 2.9Å; L662-L665 PolarHBondContact O-N 3.46Å; L665-E668 PolarHBondContact O-N 3.38Å; L665-L669 WeakPolarHBondContact O-CB 3.38Å; L665-L669 PolarHBondContact O-N 2.76Å
666	L	55.1	Low	56.9	Low	100 Å²	100	94.4 Å²	94.4	52%	0.524	49%	0.491	S	S	.	.	H	α-helix	trans	-61.5	-44	176.2	-76.5	168.2	0	0	0	111.6	L662 L669 E670	L662-L666 HydrophobicContact CD2-CD1 4.36Å; L662-L666 WeakPolarHBondContact O-CG 3.36Å; L662-L666 PolarHBondContact O-N 2.94Å; L666-L669 PolarHBondContact O-N 3.47Å; L666-E670 PolarHBondContact O-N 3.42Å
667	T	59.4	Low	56.3	Low	64 Å²	64	90.4 Å²	90.4	39%	0.393	48%	0.483	S	S	.	.	H	α-helix	trans	-66.9	-39.2	176.6	44.4	0	0	0	0	112.8	N663 T664 L669 E670 I671	N663-T667 WeakPolarHBondContact O-CG2 3.29Å; N663-T667 PolarHBondContact O-N 3.46Å; N663-T667 PolarHBondContact O-OG1 3.3Å; T664-T667 WeakPolarHBondContact CA-OG1 3.46Å; T664-T667 PolarHBondContact O-N 2.84Å; T664-T667 PolarHBondContact O-OG1 3.39Å; T667-L669 VanDerWaalsContact C-N 3.31Å; T667-L669 PolarHBondContact O-N 3.44Å; T667-E670 PolarHBondContact O-N 3.37Å; T667-I671 WeakPolarHBondContact O-CD1 3.42Å; T667-I671 VanDerWaalsContact O-CG1 3.25Å; T667-I671 WeakPolarHBondContact O-CG1 3.34Å; T667-I671 PolarHBondContact O-N 2.91Å
668	E	55.9	Low	56.5	Low	83 Å²	83	92 Å²	92	39%	0.388	49%	0.487	S	S	.	.	H	α-helix	trans	-63.2	-36.9	172.2	-77	-166.6	167.8	0	0	112.4	H619 T664 L665 I671 C672	H619-E668 IonicContact CE1-OE2 3.35Å; H619-E668 PolarHBondContact CE1-OE2 3.09Å; T664-E668 WeakPolarHBondContact O-CG 3.26Å; T664-E668 PolarHBondContact O-N 3.49Å; L665-E668 PolarHBondContact O-N 3.38Å; E668-I671 PolarHBondContact O-N 3.36Å; E668-C672 PolarHBondContact O-N 3.3Å; E668-C672 PolarHBondContact O-SG 2.89Å
669	L	50.3	Low	56.6	Low	81 Å²	81	90.9 Å²	90.9	42%	0.424	48%	0.481	S	S	.	.	H	α-helix	trans	-68.8	-42.2	178.3	-157.4	125.5	0	0	0	111.6	F616 L665 L666 T667 I671 C672 L673	F616-L669 HydrophobicContact CE2-CD1 4.29Å; F616-L669 HydrophobicContact CZ-CD1 4.32Å; L665-L669 WeakPolarHBondContact O-CB 3.38Å; L665-L669 PolarHBondContact O-N 2.76Å; L666-L669 PolarHBondContact O-N 3.47Å; T667-L669 VanDerWaalsContact C-N 3.31Å; T667-L669 PolarHBondContact O-N 3.44Å; L669-I671 PolarHBondContact O-N 2.96Å; L669-C672 PolarHBondContact O-N 2.95Å; L669-L673 HydrophobicContact CD2-CD1 3.89Å; L669-L673 WeakPolarHBondContact O-CG 3.48Å; L669-L673 PolarHBondContact O-N 2.88Å
670	E	57.1	Low	56.7	Low	135 Å²	135	90.7 Å²	90.7	63%	0.631	48%	0.475	S	S	*	.	H	α-helix	trans	-58.8	-43.9	170.9	-78.7	-175.8	163.1	0	0	112.1	L666 T667 C672 L673 K674	L666-E670 PolarHBondContact O-N 3.42Å; T667-E670 PolarHBondContact O-N 3.37Å; E670-C672 VanDerWaalsContact C-N 3.31Å; E670-C672 PolarHBondContact O-N 2.94Å; E670-L673 PolarHBondContact O-N 3.42Å; E670-K674 WeakPolarHBondContact O-CB 3.26Å; E670-K674 PolarHBondContact O-N 3.39Å
671	I	63.3	Low	56.6	Low	94 Å²	94	89.4 Å²	89.4	48%	0.482	48%	0.475	S	S	.	.	H	α-helix	trans	-61.7	-41	175.8	-68.6	164.7	0	0	0	110.8	T667 E668 L669 K674 K675	T667-I671 WeakPolarHBondContact O-CD1 3.42Å; T667-I671 VanDerWaalsContact O-CG1 3.25Å; T667-I671 WeakPolarHBondContact O-CG1 3.34Å; T667-I671 PolarHBondContact O-N 2.91Å; E668-I671 PolarHBondContact O-N 3.36Å; L669-I671 PolarHBondContact O-N 2.96Å; I671-K674 PolarHBondContact O-N 3.17Å; I671-K675 WeakPolarHBondContact O-CG 3.32Å; I671-K675 PolarHBondContact O-N 3.32Å
672	C	49	Very low	56.7	Low	65 Å²	65	86.6 Å²	86.6	44%	0.439	47%	0.465	S	S	.	.	H	α-helix	trans	-66.8	-44.7	178.2	-70.9	0	0	0	0	112.2	E668 L669 E670 K674 K675 H676	E668-C672 PolarHBondContact O-N 3.3Å; E668-C672 PolarHBondContact O-SG 2.89Å; L669-C672 PolarHBondContact O-N 2.95Å; E670-C672 VanDerWaalsContact C-N 3.31Å; E670-C672 PolarHBondContact O-N 2.94Å; C672-K674 VanDerWaalsContact C-N 3.31Å; C672-K674 PolarHBondContact O-N 2.82Å; C672-K675 PolarHBondContact O-N 3.02Å; C672-H676 WeakPolarHBondContact O-CB 3.4Å; C672-H676 PolarHBondContact O-N 3.42Å
673	L	53.1	Low	56.7	Low	113 Å²	113	82.1 Å²	82.1	59%	0.592	44%	0.442	S	S	*	.	H	α-helix	trans	-60.7	-41.7	176.1	-75.8	170.2	0	0	0	111.4	L669 E670 H676 A677	L669-L673 HydrophobicContact CD2-CD1 3.89Å; L669-L673 WeakPolarHBondContact O-CG 3.48Å; L669-L673 PolarHBondContact O-N 2.88Å; E670-L673 PolarHBondContact O-N 3.42Å; L673-H676 PolarHBondContact O-N 3.1Å; L673-A677 PolarHBondContact O-N 3.13Å
674	K	66.7	Low	56.4	Low	150 Å²	150	82.3 Å²	82.3	65%	0.652	44%	0.443	S	S	*	.	H	α-helix	trans	-62.7	-46.3	175.9	-167	172.8	-178.9	175.9	0	112	E670 I671 C672 H676 A677 D678	E670-K674 WeakPolarHBondContact O-CB 3.26Å; E670-K674 PolarHBondContact O-N 3.39Å; I671-K674 PolarHBondContact O-N 3.17Å; C672-K674 VanDerWaalsContact C-N 3.31Å; C672-K674 PolarHBondContact O-N 2.82Å; K674-H676 VanDerWaalsContact C-N 3.29Å; K674-H676 PolarHBondContact O-N 2.94Å; K674-A677 WeakPolarHBondContact O-CB 3.21Å; K674-A677 PolarHBondContact O-N 3.22Å; K674-D678 VanDerWaalsContact O-CG 3.29Å; K674-D678 PolarHBondContact O-N 3.35Å
675	K	63.6	Low	56.8	Low	133 Å²	133	85.5 Å²	85.5	58%	0.578	45%	0.452	S	S	*	.	H	α-helix	trans	-59.6	-39.5	173.6	-77.3	179.2	180	173.5	0	112.4	I671 C672 A677 D678 V679	I671-K675 WeakPolarHBondContact O-CG 3.32Å; I671-K675 PolarHBondContact O-N 3.32Å; C672-K675 PolarHBondContact O-N 3.02Å; K675-A677 VanDerWaalsContact C-N 3.34Å; K675-D678 PolarHBondContact O-N 3.19Å; K675-V679 WeakPolarHBondContact O-CG2 3.38Å; K675-V679 PolarHBondContact O-N 3.4Å
676	H	47.9	Very low	57.2	Low	84 Å²	84	87.7 Å²	87.7	39%	0.389	46%	0.455	S	S	.	.	H	α-helix	trans	-67.8	-36.4	179.1	-158.5	-81.8	0	0	0	111.6	C672 L673 K674 S680	C672-H676 WeakPolarHBondContact O-CB 3.4Å; C672-H676 PolarHBondContact O-N 3.42Å; L673-H676 PolarHBondContact O-N 3.1Å; K674-H676 VanDerWaalsContact C-N 3.29Å; K674-H676 PolarHBondContact O-N 2.94Å; H676-S680 WeakPolarHBondContact O-CB 3.47Å; H676-S680 PolarHBondContact O-N 3.27Å
677	A	55.2	Low	56.9	Low	52 Å²	52	88 Å²	88	43%	0.43	46%	0.455	S	S	.	.	H	α-helix	trans	-65.3	-41.7	171.5	0	0	0	0	0	112.2	L673 K674 K675 S680 T681	L673-A677 PolarHBondContact O-N 3.13Å; K674-A677 WeakPolarHBondContact O-CB 3.21Å; K674-A677 PolarHBondContact O-N 3.22Å; K675-A677 VanDerWaalsContact C-N 3.34Å; A677-S680 PolarHBondContact O-N 2.93Å; A677-T681 PolarHBondContact O-N 3.4Å; A677-T681 PolarHBondContact O-OG1 3.5Å
678	D	61.8	Low	56.8	Low	94 Å²	94	89 Å²	89	50%	0.503	46%	0.458	S	S	.	.	H	α-helix	trans	-63.3	-42.7	176.2	-66.1	-22.4	0	0	0	111.8	K674 K675 T681 A682	K674-D678 VanDerWaalsContact O-CG 3.29Å; K674-D678 PolarHBondContact O-N 3.35Å; K675-D678 PolarHBondContact O-N 3.19Å; D678-T681 WeakPolarHBondContact CA-OG1 3.24Å; D678-T681 PolarHBondContact O-OG1 3.44Å; D678-A682 WeakPolarHBondContact O-CB 3.4Å; D678-A682 PolarHBondContact O-N 3.27Å
679	V	53	Low	57	Low	37 Å²	37	88 Å²	88	22%	0.224	46%	0.464	C	S	.	.	H	α-helix	trans	-66.2	-41.3	175.7	171.7	0	0	0	0	111.2	E608 K675 A682 N683	E608-V679 HydrophobicContact CG-CG1 4.42Å; E608-V679 WeakPolarHBondContact OE2-CG1 3.41Å; K675-V679 WeakPolarHBondContact O-CG2 3.38Å; K675-V679 PolarHBondContact O-N 3.4Å; V679-A682 PolarHBondContact O-N 3.18Å; V679-N683 WeakPolarHBondContact O-CB 3.47Å; V679-N683 PolarHBondContact O-N 3.11Å; V679-N683 PolarHBondContact O-ND2 2.8Å
680	S	57	Low	57.2	Low	56 Å²	56	84.8 Å²	84.8	39%	0.392	45%	0.447	S	S	.	.	H	α-helix	trans	-65.1	-42.4	179.1	-165.6	0	0	0	0	112	H676 A677 N683 L684	H676-S680 WeakPolarHBondContact O-CB 3.47Å; H676-S680 PolarHBondContact O-N 3.27Å; A677-S680 PolarHBondContact O-N 2.93Å; S680-N683 PolarHBondContact O-N 3.4Å; S680-L684 PolarHBondContact O-N 3.41Å
681	T	58.4	Low	56.9	Low	79 Å²	79	86.1 Å²	86.1	49%	0.485	45%	0.446	S	S	.	.	H	α-helix	trans	-66.9	-41.1	175.9	45.5	0	0	0	0	111.9	A677 D678 N683 L684 Q685	A677-T681 PolarHBondContact O-N 3.4Å; A677-T681 PolarHBondContact O-OG1 3.5Å; D678-T681 WeakPolarHBondContact CA-OG1 3.24Å; D678-T681 PolarHBondContact O-OG1 3.44Å; T681-N683 VanDerWaalsContact C-N 3.33Å; T681-N683 PolarHBondContact O-N 2.92Å; T681-L684 WeakPolarHBondContact O-CB 3.49Å; T681-L684 PolarHBondContact O-N 3.32Å; T681-Q685 WeakPolarHBondContact O-CG 3.11Å; T681-Q685 PolarHBondContact O-N 2.79Å
682	A	59.7	Low	56.9	Low	29 Å²	29	85.3 Å²	85.3	24%	0.24	45%	0.446	C	S	.	.	H	α-helix	trans	-60.9	-39.5	174	0	0	0	0	0	112.6	D678 V679 Q685 R686	D678-A682 WeakPolarHBondContact O-CB 3.4Å; D678-A682 PolarHBondContact O-N 3.27Å; V679-A682 PolarHBondContact O-N 3.18Å; A682-Q685 PolarHBondContact O-N 3.11Å; A682-R686 WeakPolarHBondContact O-CG 3.42Å; A682-R686 PolarHBondContact O-N 2.81Å
683	N	51.9	Low	57.8	Low	18 Å²	18	87.5 Å²	87.5	10%	0.096	45%	0.445	C	S	.	.	H	α-helix	trans	-67.5	-38.3	175.8	-76.9	-29.1	0	0	0	112.4	A605 V679 S680 T681 R686 M687	A605-N683 WeakPolarHBondContact CB-ND2 3.47Å; V679-N683 WeakPolarHBondContact O-CB 3.47Å; V679-N683 PolarHBondContact O-N 3.11Å; V679-N683 PolarHBondContact O-ND2 2.8Å; S680-N683 PolarHBondContact O-N 3.4Å; T681-N683 VanDerWaalsContact C-N 3.33Å; T681-N683 PolarHBondContact O-N 2.92Å; N683-R686 PolarHBondContact O-N 3.3Å; N683-R686 PolarHBondContact OD1-NH1 2.86Å; N683-M687 PolarHBondContact O-N 3.34Å
684	L	53.7	Low	57.6	Low	109 Å²	109	83.4 Å²	83.4	57%	0.571	43%	0.425	S	S	*	.	H	α-helix	trans	-61.6	-45.4	174.6	-139.3	111.5	0	0	0	111	S680 T681 R686 M687 D688	S680-L684 PolarHBondContact O-N 3.41Å; T681-L684 WeakPolarHBondContact O-CB 3.49Å; T681-L684 PolarHBondContact O-N 3.32Å; L684-R686 PolarHBondContact O-N 3.42Å; L684-M687 WeakPolarHBondContact O-CB 3.31Å; L684-M687 PolarHBondContact O-N 2.88Å; L684-M687 VanDerWaalsContact O-N 3.14Å; L684-D688 PolarHBondContact O-N 3.44Å
685	Q	69.7	Low	57	Low	141 Å²	141	82 Å²	82	66%	0.659	42%	0.421	S	S	*	.	H	α-helix	trans	-62	-40.2	175.9	-70.7	175.2	-3.1	0	0	112.6	T681 A682 M687 D688 A689	T681-Q685 WeakPolarHBondContact O-CG 3.11Å; T681-Q685 PolarHBondContact O-N 2.79Å; A682-Q685 PolarHBondContact O-N 3.11Å; Q685-M687 VanDerWaalsContact C-N 3.32Å; Q685-M687 PolarHBondContact O-N 3.29Å; Q685-D688 PolarHBondContact O-N 2.87Å; Q685-A689 WeakPolarHBondContact O-CB 3.36Å; Q685-A689 PolarHBondContact O-N 3.49Å
686	R	59.1	Low	56.9	Low	125 Å²	125	82.5 Å²	82.5	47%	0.472	42%	0.423	S	S	.	.	H	α-helix	trans	-63	-39.1	173.7	-71.6	179.9	-149.1	162.8	7.4	111.7	A682 N683 L684 H690	A682-R686 WeakPolarHBondContact O-CG 3.42Å; A682-R686 PolarHBondContact O-N 2.81Å; N683-R686 PolarHBondContact O-N 3.3Å; N683-R686 PolarHBondContact OD1-NH1 2.86Å; L684-R686 PolarHBondContact O-N 3.42Å; R686-H690 WeakPolarHBondContact O-CB 3.35Å; R686-H690 PolarHBondContact O-N 3.27Å
687	M	48.4	Very low	57.1	Low	107 Å²	107	80.9 Å²	80.9	53%	0.527	42%	0.417	S	S	.	.	H	α-helix	trans	-66	-42.9	175.9	-83.1	-167.2	48.5	0	0	112.5	I601 N683 L684 Q685 H690 R691	I601-M687 HydrophobicContact CG2-CG 4.44Å; N683-M687 PolarHBondContact O-N 3.34Å; L684-M687 WeakPolarHBondContact O-CB 3.31Å; L684-M687 PolarHBondContact O-N 2.88Å; L684-M687 VanDerWaalsContact O-N 3.14Å; Q685-M687 VanDerWaalsContact C-N 3.32Å; Q685-M687 PolarHBondContact O-N 3.29Å; M687-H690 WeakPolarHBondContact O-CB 3.2Å; M687-H690 PolarHBondContact O-N 3.34Å; M687-R691 PolarHBondContact O-N 3.5Å
688	D	58.6	Low	56.9	Low	85 Å²	85	80.6 Å²	80.6	46%	0.455	42%	0.415	S	S	.	.	H	α-helix	trans	-67	-40.2	176.9	-77.4	-25.8	0	0	0	112.1	L684 Q685 H690 R691 T692	L684-D688 PolarHBondContact O-N 3.44Å; Q685-D688 PolarHBondContact O-N 2.87Å; D688-H690 VanDerWaalsContact C-N 3.31Å; D688-H690 PolarHBondContact O-N 2.94Å; D688-R691 PolarHBondContact O-N 3.4Å; D688-T692 WeakPolarHBondContact O-CB 3.32Å; D688-T692 PolarHBondContact O-N 2.89Å; D688-T692 PolarHBondContact O-OG1 2.95Å
689	A	60	Low	56.4	Low	62 Å²	62	78.5 Å²	78.5	51%	0.512	41%	0.41	S	S	.	.	H	α-helix	trans	-60.5	-41.4	171.7	0	0	0	0	0	111.5	Q685 T692 W693	Q685-A689 WeakPolarHBondContact O-CB 3.36Å; Q685-A689 PolarHBondContact O-N 3.49Å; A689-T692 PolarHBondContact O-N 3.17Å; A689-W693 WeakPolarHBondContact O-CB 3.19Å; A689-W693 PolarHBondContact O-N 3.06Å
690	H	53.9	Low	56.4	Low	12 Å²	12	83 Å²	83	6%	0.056	43%	0.427	C	S	.	.	H	α-helix	trans	-64.5	-44.3	175.6	-177.8	-98.6	0	0	0	112.2	I601 R686 M687 D688 T692 W693 C694	I601-H690 HydrophobicContact CD1-CB 4.27Å; R686-H690 WeakPolarHBondContact O-CB 3.35Å; R686-H690 PolarHBondContact O-N 3.27Å; M687-H690 WeakPolarHBondContact O-CB 3.2Å; M687-H690 PolarHBondContact O-N 3.34Å; D688-H690 VanDerWaalsContact C-N 3.31Å; D688-H690 PolarHBondContact O-N 2.94Å; H690-T692 VanDerWaalsContact C-N 3.32Å; H690-T692 PolarHBondContact O-N 2.98Å; H690-W693 PolarHBondContact O-N 3.22Å; H690-C694 PolarHBondContact CE1-SG 2.96Å; H690-C694 PolarHBondContact O-N 3.42Å; H690-C694 PolarHBondContact O-SG 3.03Å
691	R	51	Low	56	Low	164 Å²	164	84 Å²	84	62%	0.619	43%	0.426	S	S	*	.	H	α-helix	trans	-58.6	-46.5	176.1	-170.3	178.8	-174.7	179.2	2.7	110.8	M687 D688 W693 C694 H695	M687-R691 PolarHBondContact O-N 3.5Å; D688-R691 PolarHBondContact O-N 3.4Å; R691-W693 PolarHBondContact O-N 2.97Å; R691-C694 PolarHBondContact O-N 3.44Å; R691-H695 PolarHBondContact O-CD2 3.36Å; R691-H695 PolarHBondContact O-N 3.3Å
692	T	64.4	Low	55.4	Low	77 Å²	77	85.9 Å²	85.9	47%	0.472	43%	0.43	S	S	.	.	H	α-helix	trans	-62.6	-41	177.8	-52.1	0	0	0	0	112	D688 A689 H690 H695 K696	D688-T692 WeakPolarHBondContact O-CB 3.32Å; D688-T692 PolarHBondContact O-N 2.89Å; D688-T692 PolarHBondContact O-OG1 2.95Å; A689-T692 PolarHBondContact O-N 3.17Å; H690-T692 VanDerWaalsContact C-N 3.32Å; H690-T692 PolarHBondContact O-N 2.98Å; T692-H695 PolarHBondContact O-N 2.94Å; T692-K696 PolarHBondContact O-N 3.14Å
693	W	66.9	Low	54.8	Low	111 Å²	111	90.1 Å²	90.1	42%	0.42	45%	0.445	S	S	.	.	H	α-helix	trans	-64.7	-43.2	175.7	-179.4	88.6	0	0	0	112.6	A689 H690 R691 H695 K696 N697	A689-W693 WeakPolarHBondContact O-CB 3.19Å; A689-W693 PolarHBondContact O-N 3.06Å; H690-W693 PolarHBondContact O-N 3.22Å; R691-W693 PolarHBondContact O-N 2.97Å; W693-H695 VanDerWaalsContact C-N 3.31Å; W693-H695 PolarHBondContact O-N 3.43Å; W693-K696 PolarHBondContact O-N 3.42Å; W693-N697 WeakPolarHBondContact CH2-ND2 3.45Å; W693-N697 WeakPolarHBondContact CZ2-ND2 3.29Å; W693-N697 PolarHBondContact O-N 3.49Å
694	C	49.5	Very low	54.6	Low	27 Å²	27	93 Å²	93	18%	0.182	46%	0.463	C	S	.	.	H	α-helix	trans	-58.7	-44.5	175.5	-65.8	0	0	0	0	111	H690 R691 N697 A698	H690-C694 PolarHBondContact CE1-SG 2.96Å; H690-C694 PolarHBondContact O-N 3.42Å; H690-C694 PolarHBondContact O-SG 3.03Å; R691-C694 PolarHBondContact O-N 3.44Å; C694-N697 PolarHBondContact O-N 2.87Å; C694-A698 WeakPolarHBondContact O-CB 3.41Å; C694-A698 PolarHBondContact O-N 3.18Å
695	H	52.8	Low	54.5	Low	119 Å²	119	91.3 Å²	91.3	55%	0.551	46%	0.455	S	S	*	.	H	α-helix	trans	-64.2	-42.3	176	-72.4	-59.7	0	0	0	112.5	R691 T692 W693 A699	R691-H695 PolarHBondContact O-CD2 3.36Å; R691-H695 PolarHBondContact O-N 3.3Å; T692-H695 PolarHBondContact O-N 2.94Å; W693-H695 VanDerWaalsContact C-N 3.31Å; W693-H695 PolarHBondContact O-N 3.43Å; H695-A699 WeakPolarHBondContact O-CB 3.45Å; H695-A699 PolarHBondContact O-N 3Å
696	K	61.3	Low	53.3	Low	144 Å²	144	91.9 Å²	91.9	63%	0.626	45%	0.451	S	S	*	.	H	α-helix	trans	-63.7	-40	176.7	-82.7	-173.7	176.5	-178.4	0	113.1	T692 W693 A699 K700	T692-K696 PolarHBondContact O-N 3.14Å; W693-K696 PolarHBondContact O-N 3.42Å; K696-A699 PolarHBondContact O-N 3.38Å; K696-K700 PolarHBondContact O-N 3.34Å
697	N	53.9	Low	53	Low	50 Å²	50	89.8 Å²	89.8	27%	0.267	45%	0.449	S	S	.	.	H	α-helix	trans	-74.5	-39.4	178.8	-82.1	-8.6	0	0	0	112.7	W693 C694 A699 K700 E701	W693-N697 WeakPolarHBondContact CH2-ND2 3.45Å; W693-N697 WeakPolarHBondContact CZ2-ND2 3.29Å; W693-N697 PolarHBondContact O-N 3.49Å; C694-N697 PolarHBondContact O-N 2.87Å; N697-A699 PolarHBondContact O-N 3.05Å; N697-K700 PolarHBondContact O-N 3.34Å; N697-E701 PolarHBondContact O-N 3.08Å
698	A	50	Low	53.1	Low	47 Å²	47	90.1 Å²	90.1	39%	0.388	45%	0.448	S	S	.	.	H	α-helix	trans	-57.8	-41.3	170.9	0	0	0	0	0	110.9	C694 M702	C694-A698 WeakPolarHBondContact O-CB 3.41Å; C694-A698 PolarHBondContact O-N 3.18Å; A698-M702 WeakPolarHBondContact O-CB 3.3Å; A698-M702 VanDerWaalsContact O-CG 3.31Å; A698-M702 WeakPolarHBondContact O-CG 3.39Å; A698-M702 PolarHBondContact O-N 3.21Å
699	A	51.6	Low	52.7	Low	49 Å²	49	91.3 Å²	91.3	41%	0.405	45%	0.453	S	S	.	.	H	α-helix	trans	-63.2	-44.7	175.1	0	0	0	0	0	112.8	H695 K696 N697 M702 E703	H695-A699 WeakPolarHBondContact O-CB 3.45Å; H695-A699 PolarHBondContact O-N 3Å; K696-A699 PolarHBondContact O-N 3.38Å; N697-A699 PolarHBondContact O-N 3.05Å; A699-M702 PolarHBondContact O-N 2.87Å; A699-E703 WeakPolarHBondContact O-CB 3.37Å; A699-E703 PolarHBondContact O-N 2.95Å
700	K	53.7	Low	52.3	Low	133 Å²	133	92 Å²	92	58%	0.578	45%	0.446	S	S	*	.	H	α-helix	trans	-62.7	-41.5	177.8	-78.3	-176.3	176.6	-174	0	113.2	K696 N697 E703 V704	K696-K700 PolarHBondContact O-N 3.34Å; N697-K700 PolarHBondContact O-N 3.34Å; K700-E703 PolarHBondContact O-N 3.49Å; K700-V704 VanDerWaalsContact O-CG2 3.3Å; K700-V704 WeakPolarHBondContact O-CG2 3.36Å; K700-V704 PolarHBondContact O-N 2.89Å
701	E	47.1	Very low	52.1	Low	77 Å²	77	96.3 Å²	96.3	36%	0.36	47%	0.469	S	S	.	.	H	α-helix	trans	-67.2	-41.1	176.4	-77.6	-165.2	-173.2	0	0	111.6	L590 N697 E703 V704 D705	L590-E701 WeakPolarHBondContact CD1-OE2 3.42Å; N697-E701 PolarHBondContact O-N 3.08Å; E701-E703 VanDerWaalsContact C-N 3.31Å; E701-E703 PolarHBondContact O-N 3.27Å; E701-V704 PolarHBondContact O-N 2.97Å; E701-D705 PolarHBondContact O-N 2.98Å
702	M	46.9	Very low	52.1	Low	117 Å²	117	96.3 Å²	96.3	58%	0.576	47%	0.469	S	S	*	.	H	α-helix	trans	-63.9	-35.6	174.2	-71.1	-166.9	79.5	0	0	112.6	A698 A699 D705 W706	A698-M702 WeakPolarHBondContact O-CB 3.3Å; A698-M702 VanDerWaalsContact O-CG 3.31Å; A698-M702 WeakPolarHBondContact O-CG 3.39Å; A698-M702 PolarHBondContact O-N 3.21Å; A699-M702 PolarHBondContact O-N 2.87Å; M702-D705 PolarHBondContact O-N 3.44Å; M702-W706 VanDerWaalsContact O-CB 3.31Å; M702-W706 WeakPolarHBondContact O-CB 3.17Å; M702-W706 PolarHBondContact O-N 3.2Å
703	E	45.4	Very low	51.2	Low	118 Å²	118	98.3 Å²	98.3	55%	0.551	47%	0.471	S	S	*	.	H	α-helix	trans	-68	-40.1	174.4	-170.5	179.1	-172.2	0	0	111.7	A699 K700 E701 D705 W706 N707	A699-E703 WeakPolarHBondContact O-CB 3.37Å; A699-E703 PolarHBondContact O-N 2.95Å; K700-E703 PolarHBondContact O-N 3.49Å; E701-E703 VanDerWaalsContact C-N 3.31Å; E701-E703 PolarHBondContact O-N 3.27Å; E703-D705 VanDerWaalsContact C-N 3.34Å; E703-W706 PolarHBondContact O-N 2.97Å; E703-N707 VanDerWaalsContact O-CB 3.32Å; E703-N707 WeakPolarHBondContact O-CB 3.36Å; E703-N707 PolarHBondContact O-N 2.96Å; E703-N707 PolarHBondContact O-ND2 3.4Å
704	V	49.6	Very low	50.2	Low	78 Å²	78	96.8 Å²	96.8	47%	0.473	47%	0.471	S	S	.	.	H	α-helix	trans	-61.9	-42.6	172.8	169.6	0	0	0	0	111	K700 E701 N707 K708	K700-V704 VanDerWaalsContact O-CG2 3.3Å; K700-V704 WeakPolarHBondContact O-CG2 3.36Å; K700-V704 PolarHBondContact O-N 2.89Å; E701-V704 PolarHBondContact O-N 2.97Å; V704-N707 PolarHBondContact O-N 3.38Å; V704-K708 WeakPolarHBondContact O-CG 3.39Å; V704-K708 PolarHBondContact O-N 3.13Å
705	D	50.4	Low	50	Low	74 Å²	74	100.3 Å²	100.3	40%	0.396	49%	0.485	S	S	.	.	H	α-helix	trans	-70.7	-36.9	178.1	-76.1	-17.8	0	0	0	112.2	E701 M702 E703 K708 L709	E701-D705 PolarHBondContact O-N 2.98Å; M702-D705 PolarHBondContact O-N 3.44Å; E703-D705 VanDerWaalsContact C-N 3.34Å; D705-K708 PolarHBondContact O-N 2.71Å; D705-K708 IonicContact OD1-NZ 3.34Å; D705-L709 PolarHBondContact O-N 3.42Å
706	W	44.5	Very low	49.3	Very low	153 Å²	153	96.7 Å²	96.7	58%	0.58	47%	0.472	S	S	*	.	H	α-helix	trans	-62.4	-43.1	170.8	-176.6	-106.9	0	0	0	111.9	M702 E703 L709 Q710	M702-W706 VanDerWaalsContact O-CB 3.31Å; M702-W706 WeakPolarHBondContact O-CB 3.17Å; M702-W706 PolarHBondContact O-N 3.2Å; E703-W706 PolarHBondContact O-N 2.97Å; W706-L709 HydrophobicContact CZ3-CD2 4.37Å; W706-L709 CarbonylContact O-C 3.6Å; W706-L709 WeakPolarHBondContact O-CA 3.45Å; W706-L709 WeakPolarHBondContact O-CB 3.32Å; W706-L709 PolarHBondContact O-N 2.87Å; W706-L709 VanDerWaalsContact O-N 3.1Å; W706-Q710 WeakPolarHBondContact O-CG 3.25Å; W706-Q710 PolarHBondContact O-N 2.82Å
707	N	52.1	Low	48.5	Very low	81 Å²	81	95.8 Å²	95.8	43%	0.433	47%	0.47	S	S	.	.	H	α-helix	trans	-65.5	-37.7	176.5	-75.2	-27.8	0	0	0	112.3	E703 V704 L709 Q710 L711	E703-N707 VanDerWaalsContact O-CB 3.32Å; E703-N707 WeakPolarHBondContact O-CB 3.36Å; E703-N707 PolarHBondContact O-N 2.96Å; E703-N707 PolarHBondContact O-ND2 3.4Å; V704-N707 PolarHBondContact O-N 3.38Å; N707-L709 VanDerWaalsContact C-N 3.3Å; N707-L709 PolarHBondContact O-N 2.81Å; N707-Q710 PolarHBondContact O-N 3.05Å; N707-L711 WeakPolarHBondContact O-CB 3.37Å; N707-L711 PolarHBondContact O-N 3.42Å
708	K	51.6	Low	48	Very low	115 Å²	115	101.4 Å²	101.4	50%	0.5	49%	0.492	S	S	.	.	H	α-helix	trans	-61.8	-39.2	170	-77.2	175.1	-172.9	161	0	111.6	V704 D705 R712	V704-K708 WeakPolarHBondContact O-CG 3.39Å; V704-K708 PolarHBondContact O-N 3.13Å; D705-K708 PolarHBondContact O-N 2.71Å; D705-K708 IonicContact OD1-NZ 3.34Å; K708-R712 WeakPolarHBondContact O-CG 3.34Å; K708-R712 PolarHBondContact O-N 3.32Å
709	L	50.1	Low	47.3	Very low	109 Å²	109	101.9 Å²	101.9	57%	0.571	50%	0.502	S	S	*	.	H	α-helix	trans	-66.5	-42.8	177.2	-142.1	101.8	0	0	0	111.4	D705 W706 N707 R712 K713	D705-L709 PolarHBondContact O-N 3.42Å; W706-L709 HydrophobicContact CZ3-CD2 4.37Å; W706-L709 CarbonylContact O-C 3.6Å; W706-L709 WeakPolarHBondContact O-CA 3.45Å; W706-L709 WeakPolarHBondContact O-CB 3.32Å; W706-L709 PolarHBondContact O-N 2.87Å; W706-L709 VanDerWaalsContact O-N 3.1Å; N707-L709 VanDerWaalsContact C-N 3.3Å; N707-L709 PolarHBondContact O-N 2.81Å; L709-R712 PolarHBondContact O-N 2.66Å; L709-K713 PolarHBondContact O-N 3.49Å
710	Q	51.1	Low	46.7	Very low	76 Å²	76	103.6 Å²	103.6	36%	0.355	50%	0.503	S	S	.	.	H	α-helix	trans	-63.5	-43.4	174.7	-72.7	-80.9	-22.3	0	0	111.8	W706 N707 R712 K713 L714	W706-Q710 WeakPolarHBondContact O-CG 3.25Å; W706-Q710 PolarHBondContact O-N 2.82Å; N707-Q710 PolarHBondContact O-N 3.05Å; Q710-R712 VanDerWaalsContact C-N 3.32Å; Q710-R712 PolarHBondContact O-N 3.22Å; Q710-K713 WeakPolarHBondContact O-CB 3.29Å; Q710-K713 PolarHBondContact O-N 3.33Å; Q710-L714 WeakPolarHBondContact O-CB 3.43Å; Q710-L714 PolarHBondContact O-N 3.49Å
711	L	50.9	Low	45.9	Very low	103 Å²	103	100.8 Å²	100.8	54%	0.539	51%	0.505	S	S	.	.	H	α-helix	trans	-59.2	-43.3	173.5	-87.4	160.7	0	0	0	111.4	N707 K713 L714 E715	N707-L711 WeakPolarHBondContact O-CB 3.37Å; N707-L711 PolarHBondContact O-N 3.42Å; L711-K713 VanDerWaalsContact C-N 3.35Å; L711-L714 PolarHBondContact O-N 2.84Å; L711-E715 WeakPolarHBondContact O-CG 3.27Å; L711-E715 PolarHBondContact O-N 3.37Å
712	R	50.4	Low	45.4	Very low	165 Å²	165	102.8 Å²	102.8	62%	0.623	52%	0.522	S	S	*	.	H	α-helix	trans	-66.4	-35.7	175	-74.9	-179.7	180	177.2	0.7	112.7	K708 L709 Q710 E715 C716	K708-R712 WeakPolarHBondContact O-CG 3.34Å; K708-R712 PolarHBondContact O-N 3.32Å; L709-R712 PolarHBondContact O-N 2.66Å; Q710-R712 VanDerWaalsContact C-N 3.32Å; Q710-R712 PolarHBondContact O-N 3.22Å; R712-E715 PolarHBondContact O-N 3.38Å; R712-C716 WeakPolarHBondContact O-CB 3.17Å; R712-C716 PolarHBondContact O-N 2.81Å
713	K	45.9	Very low	44.9	Very low	118 Å²	118	105.4 Å²	105.4	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-63.2	-44.5	172	-170	-172	174.8	-160.5	0	110.9	L709 Q710 L711 C716 E717	L709-K713 PolarHBondContact O-N 3.49Å; Q710-K713 WeakPolarHBondContact O-CB 3.29Å; Q710-K713 PolarHBondContact O-N 3.33Å; L711-K713 VanDerWaalsContact C-N 3.35Å; K713-C716 CarbonylContact O-C 3.59Å; K713-C716 WeakPolarHBondContact O-CA 3.23Å; K713-C716 WeakPolarHBondContact O-CB 3.18Å; K713-C716 PolarHBondContact O-N 3.39Å; K713-E717 VanDerWaalsContact CE-OE1 3.24Å; K713-E717 WeakPolarHBondContact CE-OE1 3.32Å; K713-E717 IonicContact NZ-OE1 2.75Å; K713-E717 PolarHBondContact O-N 3.3Å
714	L	45.6	Very low	44	Very low	80 Å²	80	101.4 Å²	101.4	42%	0.419	52%	0.515	S	S	.	.	H	α-helix	trans	-65.4	-38.4	175.3	-87.6	161.2	0	0	0	112.8	Q710 L711 C716 E717 K718	Q710-L714 WeakPolarHBondContact O-CB 3.43Å; Q710-L714 PolarHBondContact O-N 3.49Å; L711-L714 PolarHBondContact O-N 2.84Å; L714-C716 VanDerWaalsContact C-N 3.26Å; L714-C716 PolarHBondContact O-N 2.91Å; L714-E717 PolarHBondContact O-N 3.5Å; L714-K718 WeakPolarHBondContact O-CB 3.37Å; L714-K718 WeakPolarHBondContact O-CG 3.37Å; L714-K718 PolarHBondContact O-N 2.98Å
715	E	44.7	Very low	43.4	Very low	101 Å²	101	103.9 Å²	103.9	47%	0.472	52%	0.521	S	S	.	.	H	α-helix	trans	-63.1	-35.5	172.4	-76	176.5	175	0	0	111.6	L711 R712	L711-E715 WeakPolarHBondContact O-CG 3.27Å; L711-E715 PolarHBondContact O-N 3.37Å; R712-E715 PolarHBondContact O-N 3.38Å
716	C	39	Very low	42.7	Very low	42 Å²	42	107.1 Å²	107.1	28%	0.284	54%	0.538	S	S	.	.	H	α-helix	trans	-66.7	-45.1	171.2	-103.7	0	0	0	0	112.4	R712 K713 L714 G719 C724	R712-C716 WeakPolarHBondContact O-CB 3.17Å; R712-C716 PolarHBondContact O-N 2.81Å; K713-C716 CarbonylContact O-C 3.59Å; K713-C716 WeakPolarHBondContact O-CA 3.23Å; K713-C716 WeakPolarHBondContact O-CB 3.18Å; K713-C716 PolarHBondContact O-N 3.39Å; L714-C716 VanDerWaalsContact C-N 3.26Å; L714-C716 PolarHBondContact O-N 2.91Å; C716-G719 PolarHBondContact O-N 3.27Å; C716-C724 VanDerWaalsContact CA-SG 3.52Å; C716-C724 HydrophobicContact CB-CB 4.11Å; C716-C724 WeakPolarHBondContact CB-SG 3.29Å; C716-C724 WeakPolarHBondContact SG-CB 3.32Å; C716-C724 CovalentContact SG-SG 2.05Å; C716-C724 PolarHBondContact SG-SG 3.18Å
717	E	43.6	Very low	42	Very low	126 Å²	126	107.4 Å²	107.4	59%	0.589	55%	0.55	S	S	*	.	H	α-helix	trans	-68.5	-32.5	177.5	-74.3	174.5	-175.1	0	0	112.5	K713 L714 G719	K713-E717 VanDerWaalsContact CE-OE1 3.24Å; K713-E717 WeakPolarHBondContact CE-OE1 3.32Å; K713-E717 IonicContact NZ-OE1 2.75Å; K713-E717 PolarHBondContact O-N 3.3Å; L714-E717 PolarHBondContact O-N 3.5Å; E717-G719 PolarHBondContact O-N 3.24Å
718	K	43.5	Very low	40.9	Very low	168 Å²	168	111.9 Å²	111.9	73%	0.73	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	17.3	175.6	-75.7	-173.4	177.4	-176.9	0	114.3	L714 I720	L714-K718 WeakPolarHBondContact O-CB 3.37Å; L714-K718 WeakPolarHBondContact O-CG 3.37Å; L714-K718 PolarHBondContact O-N 2.98Å; K718-I720 VanDerWaalsContact C-N 3.29Å; K718-I720 PolarHBondContact O-N 2.94Å
719	G	36.4	Very low	40	Very low	57 Å²	57	111.9 Å²	111.9	59%	0.588	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.5	18.4	163.3	0	0	0	0	0	115	C716 E717 A721	C716-G719 PolarHBondContact O-N 3.27Å; E717-G719 PolarHBondContact O-N 3.24Å; G719-A721 PolarHBondContact O-N 3.38Å
720	I	39.4	Very low	39.1	Very low	85 Å²	85	114.7 Å²	114.7	44%	0.436	59%	0.589	S	S	.	*			trans	-75.7	74.6	169.1	-51.7	178	0	0	0	107.7	K718 T722 K723	K718-I720 VanDerWaalsContact C-N 3.29Å; K718-I720 PolarHBondContact O-N 2.94Å; I720-T722 PolarHBondContact O-N 2.76Å; I720-K723 PolarHBondContact O-N 3.21Å
721	A	35.4	Very low	38.2	Very low	74 Å²	74	116.6 Å²	116.6	61%	0.612	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-23.4	-172.1	0	0	0	0	0	113.5	G719 K723	G719-A721 PolarHBondContact O-N 3.38Å; A721-K723 VanDerWaalsContact C-N 3.31Å; A721-K723 PolarHBondContact O-N 2.99Å
722	T	37.5	Very low	37.2	Very low	118 Å²	118	120.1 Å²	120.1	72%	0.724	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-11.4	179.1	46.9	0	0	0	0	114.5	I720	I720-T722 PolarHBondContact O-N 2.76Å
723	K	36.9	Very low	36.3	Very low	172 Å²	172	120.6 Å²	120.6	75%	0.748	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	-7.4	173.9	-73.2	-177	179.3	175.6	0	114.1	I720 A721 H725	I720-K723 PolarHBondContact O-N 3.21Å; A721-K723 VanDerWaalsContact C-N 3.31Å; A721-K723 PolarHBondContact O-N 2.99Å; K723-H725 PolarHBondContact O-N 3.38Å
724	C	25.9	Very low	35.5	Very low	35 Å²	35	118.1 Å²	118.1	24%	0.236	63%	0.627	C	S	.	*			trans	-101.9	58.4	-172.2	-155	0	0	0	0	113.6	C716	C716-C724 VanDerWaalsContact CA-SG 3.52Å; C716-C724 HydrophobicContact CB-CB 4.11Å; C716-C724 WeakPolarHBondContact CB-SG 3.29Å; C716-C724 WeakPolarHBondContact SG-CB 3.32Å; C716-C724 CovalentContact SG-SG 2.05Å; C716-C724 PolarHBondContact SG-SG 3.18Å
725	H	35.9	Very low	34.7	Very low	129 Å²	129	120.8 Å²	120.8	60%	0.597	64%	0.64	S	S	*	*			trans	-94.4	12.2	175.5	-69.1	-52.2	0	0	0	114.2	K723 L727	K723-H725 PolarHBondContact O-N 3.38Å; H725-L727 VanDerWaalsContact C-N 3.28Å; H725-L727 PolarHBondContact O-N 3.37Å
726	L	36.3	Very low	34	Very low	143 Å²	143	120.3 Å²	120.3	75%	0.749	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-6.2	-178.7	-105.5	147.3	0	0	0	114.5
727	L	29.9	Very low	33.2	Very low	159 Å²	159	123.1 Å²	123.1	83%	0.832	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.3	13.9	-176	-72	168.9	0	0	0	114.9	H725	H725-L727 VanDerWaalsContact C-N 3.28Å; H725-L727 PolarHBondContact O-N 3.37Å
728	K	28.6	Very low	32.5	Very low	175 Å²	175	121.7 Å²	121.7	76%	0.761	67%	0.665	S	S	*	*			trans	-113.5	74.8	171.9	-76.4	-170.4	176.9	-175.8	0	110.6
729	T	33.7	Very low	31.8	Very low	115 Å²	115	120.6 Å²	120.6	71%	0.706	67%	0.666	S	S	*	*			trans	-119.5	120.5	155.1	43.4	0	0	0	0	106.9	D731	T729-D731 PolarHBondContact O-N 2.93Å; T729-D731 VanDerWaalsContact O-N 3.12Å
730	I	31.6	Very low	31.2	Very low	168 Å²	168	128.2 Å²	128.2	86%	0.862	68%	0.677	S	S	*	*			trans	-76.6	13.8	-169.4	-68.4	163.9	0	0	0	111.9	E732	I730-E732 PolarHBondContact O-N 3.39Å; I730-E732 VanDerWaalsContact O-N 3.1Å
731	D	32	Very low	30.7	Very low	116 Å²	116	131.7 Å²	131.7	62%	0.62	70%	0.696	S	S	*	*			trans	-83.6	91.5	176.7	-77.6	-31.8	0	0	0	110.3	T729 E733 A734	T729-D731 PolarHBondContact O-N 2.93Å; T729-D731 VanDerWaalsContact O-N 3.12Å; D731-E733 PolarHBondContact O-N 3.46Å; D731-E733 VanDerWaalsContact O-N 3.11Å; D731-A734 HydrophobicContact CB-CB 4.49Å; D731-A734 PolarHBondContact O-N 3.33Å; D731-A734 VanDerWaalsContact O-N 3.12Å
732	E	29.9	Very low	30.4	Very low	176 Å²	176	133.9 Å²	133.9	82%	0.822	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	-18.4	171.4	-72.5	-169	152	0	0	113.1	I730	I730-E732 PolarHBondContact O-N 3.39Å; I730-E732 VanDerWaalsContact O-N 3.1Å
733	E	30.4	Very low	29.9	Very low	175 Å²	175	130.3 Å²	130.3	82%	0.818	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-28.7	175.5	-83.5	-172.5	149.2	0	0	113.8	D731 I735 S736	D731-E733 PolarHBondContact O-N 3.46Å; D731-E733 VanDerWaalsContact O-N 3.11Å; E733-I735 VanDerWaalsContact C-N 3.34Å; E733-I735 PolarHBondContact O-N 2.8Å; E733-S736 PolarHBondContact O-OG 2.8Å
734	A	30.2	Very low	29.6	Very low	67 Å²	67	130.9 Å²	130.9	55%	0.554	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-78.8	-17.7	-177.1	0	0	0	0	0	113.5	D731 S736	D731-A734 HydrophobicContact CB-CB 4.49Å; D731-A734 PolarHBondContact O-N 3.33Å; D731-A734 VanDerWaalsContact O-N 3.12Å; A734-S736 VanDerWaalsContact C-N 3.3Å
735	I	28.9	Very low	29.8	Very low	135 Å²	135	131.4 Å²	131.4	69%	0.692	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-79.4	-16.2	179.6	-54.6	177	0	0	0	111.3	E733 T737	E733-I735 VanDerWaalsContact C-N 3.34Å; E733-I735 PolarHBondContact O-N 2.8Å; I735-T737 VanDerWaalsContact C-N 3.34Å; I735-T737 PolarHBondContact O-N 3.07Å
736	S	28.3	Very low	29.6	Very low	92 Å²	92	130 Å²	130	64%	0.643	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-77.6	-15.4	-178	73.8	0	0	0	0	114.7	E733 A734 P738	E733-S736 PolarHBondContact O-OG 2.8Å; A734-S736 VanDerWaalsContact C-N 3.3Å; S736-P738 WeakPolarHBondContact O-CD 3.49Å
737	T	23.5	Very low	29.3	Very low	100 Å²	100	126.8 Å²	126.8	61%	0.613	69%	0.687	S	S	*	*	S	Bend	trans	-97.5	90.8	168.8	46.8	0	0	0	0	109.1	I735 I739	I735-T737 VanDerWaalsContact C-N 3.34Å; I735-T737 PolarHBondContact O-N 3.07Å; T737-I739 PolarHBondContact O-N 3.01Å
738	P	27.7	Very low	29.4	Very low	96 Å²	96	122.8 Å²	122.8	62%	0.623	67%	0.665	S	S	*	*			trans	-54.4	122.1	168.3	23	-31.4	0	0	0	106.8	S736 R740	S736-P738 WeakPolarHBondContact O-CD 3.49Å; P738-R740 PolarHBondContact O-N 2.94Å
739	I	28.5	Very low	29.4	Very low	146 Å²	146	120 Å²	120	75%	0.749	66%	0.658	S	S	*	*			trans	-59.2	80.8	176	-60.6	167.7	0	0	0	107.2	T737 N741 V742	T737-I739 PolarHBondContact O-N 3.01Å; I739-N741 PolarHBondContact O-N 2.95Å; I739-V742 HydrophobicContact CG2-CG2 3.68Å
740	R	25.3	Very low	29.3	Very low	217 Å²	217	123.4 Å²	123.4	82%	0.819	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-81	-3.5	178.4	-102.5	-176.2	173.1	-178	-1	112	P738	P738-R740 PolarHBondContact O-N 2.94Å
741	N	27.6	Very low	29.1	Very low	158 Å²	158	121.7 Å²	121.7	85%	0.845	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-100.1	4.3	-172	-73.3	-3.9	0	0	0	115.7	I739 G743	I739-N741 PolarHBondContact O-N 2.95Å; N741-G743 VanDerWaalsContact C-N 3.31Å
742	V	30	Very low	29.1	Very low	119 Å²	119	121 Å²	121	72%	0.721	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-91	0.4	168.3	-168.9	0	0	0	0	111.4	I739	I739-V742 HydrophobicContact CG2-CG2 3.68Å
743	G	26.3	Very low	29.3	Very low	44 Å²	44	119.4 Å²	119.4	45%	0.454	64%	0.636	S	S	.	*			trans	-100.9	27.4	-167.7	0	0	0	0	0	117.6	N741	N741-G743 VanDerWaalsContact C-N 3.31Å
744	Q	31.3	Very low	29.5	Very low	184 Å²	184	114.7 Å²	114.7	86%	0.86	62%	0.623	S	S	*	*			trans	-136.5	44.5	168.4	-67.9	-169	-9.1	0	0	112.3
745	S	29.7	Very low	29.8	Very low	46 Å²	46	113.4 Å²	113.4	32%	0.322	61%	0.61	S	S	.	*			trans	-71.3	130	161.9	179.8	0	0	0	0	108.7	V747 I748	S745-V747 PolarHBondContact O-N 3.45Å; S745-I748 PolarHBondContact O-N 3.29Å
746	P	31.6	Very low	30.4	Very low	98 Å²	98	111.1 Å²	111.1	64%	0.636	60%	0.604	S	S	*	*	H	α-helix	trans	-55.6	-16.5	-177.7	-25	32.4	0	0	0	114.9	L749 Y750	P746-L749 PolarHBondContact O-N 3.47Å; P746-Y750 PolarHBondContact O-N 3.43Å; P746-Y750 VanDerWaalsContact O-N 3.1Å
747	V	30.1	Very low	31.1	Very low	77 Å²	77	112.4 Å²	112.4	47%	0.467	60%	0.604	S	S	.	*	H	α-helix	trans	-70.3	-32.1	173.8	-178.7	0	0	0	0	111.6	S745 L749 Y750 H751	S745-V747 PolarHBondContact O-N 3.45Å; V747-L749 VanDerWaalsContact C-N 3.32Å; V747-L749 PolarHBondContact O-N 3.4Å; V747-Y750 PolarHBondContact O-N 3.17Å; V747-H751 VanDerWaalsContact O-CB 3.27Å; V747-H751 WeakPolarHBondContact O-CB 3.42Å; V747-H751 PolarHBondContact O-N 2.74Å
748	I	31.3	Very low	31.6	Very low	75 Å²	75	114.5 Å²	114.5	39%	0.385	60%	0.6	S	S	.	*	H	α-helix	trans	-64.6	-41.9	173.5	-60.9	178.8	0	0	0	109.4	S745 Y750 E752	S745-I748 PolarHBondContact O-N 3.29Å; I748-Y750 VanDerWaalsContact C-N 3.34Å; I748-Y750 PolarHBondContact O-N 3.27Å; I748-E752 VanDerWaalsContact CG2-CD 3.46Å; I748-E752 HydrophobicContact CG2-CG 3.86Å; I748-E752 VanDerWaalsContact CG2-OE1 3.22Å; I748-E752 WeakPolarHBondContact CG2-OE1 3.4Å; I748-E752 WeakPolarHBondContact O-CB 3.36Å; I748-E752 WeakPolarHBondContact O-CG 3.28Å; I748-E752 PolarHBondContact O-N 2.92Å
749	L	30.3	Very low	32.2	Very low	115 Å²	115	112.3 Å²	112.3	60%	0.602	59%	0.59	S	S	*	*	H	α-helix	trans	-62.1	-39.2	175.9	-80	163.3	0	0	0	112.9	P746 V747 L753	P746-L749 PolarHBondContact O-N 3.47Å; V747-L749 VanDerWaalsContact C-N 3.32Å; V747-L749 PolarHBondContact O-N 3.4Å; L749-L753 WeakPolarHBondContact O-CD1 3.46Å; L749-L753 VanDerWaalsContact O-CG 3.31Å; L749-L753 WeakPolarHBondContact O-CG 3.41Å; L749-L753 PolarHBondContact O-N 2.81Å
750	Y	30.1	Very low	32.7	Very low	188 Å²	188	109.8 Å²	109.8	74%	0.737	58%	0.578	S	S	*	*	H	α-helix	trans	-78.4	-41	179.9	-114.8	-85.9	0	0	0	113.2	P746 V747 I748 L753 S754	P746-Y750 PolarHBondContact O-N 3.43Å; P746-Y750 VanDerWaalsContact O-N 3.1Å; V747-Y750 PolarHBondContact O-N 3.17Å; I748-Y750 VanDerWaalsContact C-N 3.34Å; I748-Y750 PolarHBondContact O-N 3.27Å; Y750-L753 PolarHBondContact O-N 3.38Å; Y750-S754 WeakPolarHBondContact O-CB 3.24Å; Y750-S754 PolarHBondContact O-N 2.88Å; Y750-S754 PolarHBondContact O-OG 3.25Å; Y750-S754 VanDerWaalsContact O-OG 3.06Å
751	H	28.9	Very low	33.3	Very low	131 Å²	131	103.4 Å²	103.4	61%	0.606	56%	0.56	S	S	*	*	H	α-helix	trans	-73.6	-28.9	-180	-130.5	-55.5	0	0	0	112.2	V747 S755	V747-H751 VanDerWaalsContact O-CB 3.27Å; V747-H751 WeakPolarHBondContact O-CB 3.42Å; V747-H751 PolarHBondContact O-N 2.74Å; H751-S755 PolarHBondContact O-N 2.7Å
752	E	32	Very low	33.7	Very low	103 Å²	103	101.7 Å²	101.7	48%	0.481	55%	0.55	S	S	.	*	H	α-helix	trans	-70.7	-30.7	171.8	-75.6	-174.9	174.8	0	0	112.7	I748	I748-E752 VanDerWaalsContact CG2-CD 3.46Å; I748-E752 HydrophobicContact CG2-CG 3.86Å; I748-E752 VanDerWaalsContact CG2-OE1 3.22Å; I748-E752 WeakPolarHBondContact CG2-OE1 3.4Å; I748-E752 WeakPolarHBondContact O-CB 3.36Å; I748-E752 WeakPolarHBondContact O-CG 3.28Å; I748-E752 PolarHBondContact O-N 2.92Å
753	L	32.9	Very low	34.2	Very low	141 Å²	141	103.8 Å²	103.8	74%	0.738	55%	0.549	S	S	*	.	H	α-helix	trans	-83.2	-26.8	176.8	-74.3	170.1	0	0	0	113.3	L749 Y750	L749-L753 WeakPolarHBondContact O-CD1 3.46Å; L749-L753 VanDerWaalsContact O-CG 3.31Å; L749-L753 WeakPolarHBondContact O-CG 3.41Å; L749-L753 PolarHBondContact O-N 2.81Å; Y750-L753 PolarHBondContact O-N 3.38Å
754	S	35.1	Very low	34.8	Very low	76 Å²	76	108.7 Å²	108.7	53%	0.531	56%	0.561	S	S	.	*	H	α-helix	trans	-94.8	-0.7	-178.9	66.5	0	0	0	0	114.6	Y750 P756	Y750-S754 WeakPolarHBondContact O-CB 3.24Å; Y750-S754 PolarHBondContact O-N 2.88Å; Y750-S754 PolarHBondContact O-OG 3.25Å; Y750-S754 VanDerWaalsContact O-OG 3.06Å; S754-P756 WeakPolarHBondContact O-CD 3.2Å
755	S	36.2	Very low	35	Very low	40 Å²	40	107.5 Å²	107.5	28%	0.28	55%	0.553	S	S	.	*			trans	-75.2	119.6	176.3	-179.7	0	0	0	0	111.1	H751 D757 R758 A759	H751-S755 PolarHBondContact O-N 2.7Å; S755-D757 PolarHBondContact O-N 3.41Å; S755-R758 PolarHBondContact O-N 2.97Å; S755-A759 PolarHBondContact O-N 3.45Å
756	P	41.7	Very low	35.2	Very low	87 Å²	87	110.9 Å²	110.9	57%	0.565	57%	0.572	S	S	*	*	H	α-helix	trans	-58.1	-32.3	179.3	-21.7	32	0	0	0	113.1	S754 R758 A759 N760	S754-P756 WeakPolarHBondContact O-CD 3.2Å; P756-R758 PolarHBondContact O-N 3.5Å; P756-A759 PolarHBondContact O-N 3.31Å; P756-N760 PolarHBondContact O-N 2.85Å
757	D	44	Very low	35.3	Very low	120 Å²	120	111.8 Å²	111.8	64%	0.642	58%	0.576	S	S	*	*	H	α-helix	trans	-65	-31.8	-175.9	-64	-23.7	0	0	0	111.7	S755 L761	S755-D757 PolarHBondContact O-N 3.41Å; D757-L761 PolarHBondContact O-N 3.44Å; D757-L761 VanDerWaalsContact O-N 3.16Å
758	R	34.1	Very low	35.5	Very low	143 Å²	143	116.4 Å²	116.4	54%	0.54	59%	0.592	S	S	.	*	H	α-helix	trans	-89	-26.5	176.1	-149	173.9	-176.2	176.2	0.1	113.8	S755 P756 N760 L761 L762	S755-R758 PolarHBondContact O-N 2.97Å; P756-R758 PolarHBondContact O-N 3.5Å; R758-N760 PolarHBondContact O-N 2.79Å; R758-L761 HydrophobicContact CG-CB 4.21Å; R758-L761 HydrophobicContact CG-CD1 4.5Å; R758-L761 PolarHBondContact O-N 2.75Å; R758-L762 PolarHBondContact O-N 3.47Å
759	A	38.7	Very low	35.5	Very low	50 Å²	50	119.8 Å²	119.8	41%	0.413	62%	0.616	S	S	.	*	H	α-helix	trans	-60.3	-32.7	166.8	0	0	0	0	0	111.2	S755 P756 K763	S755-A759 PolarHBondContact O-N 3.45Å; P756-A759 PolarHBondContact O-N 3.31Å; A759-K763 PolarHBondContact O-N 3.42Å
760	N	38.6	Very low	35.4	Very low	93 Å²	93	125.8 Å²	125.8	50%	0.497	63%	0.631	S	S	.	*	H	α-helix	trans	-75.2	-41.1	172.6	-69.6	-21.5	0	0	0	112.7	P756 R758 L762 K763 E764	P756-N760 PolarHBondContact O-N 2.85Å; R758-N760 PolarHBondContact O-N 2.79Å; N760-L762 VanDerWaalsContact C-N 3.27Å; N760-L762 PolarHBondContact O-N 3.12Å; N760-K763 PolarHBondContact O-N 3.38Å; N760-E764 PolarHBondContact O-N 2.96Å
761	L	39.6	Very low	35.4	Very low	84 Å²	84	126.4 Å²	126.4	44%	0.44	64%	0.64	S	S	.	*	H	α-helix	trans	-60.9	-33.5	172.4	-94.9	142.1	0	0	0	113.3	D757 R758 E764 K765	D757-L761 PolarHBondContact O-N 3.44Å; D757-L761 VanDerWaalsContact O-N 3.16Å; R758-L761 HydrophobicContact CG-CB 4.21Å; R758-L761 HydrophobicContact CG-CD1 4.5Å; R758-L761 PolarHBondContact O-N 2.75Å; L761-E764 PolarHBondContact O-N 3.46Å; L761-K765 WeakPolarHBondContact O-CB 3.23Å; L761-K765 PolarHBondContact O-N 2.8Å
762	L	35.9	Very low	35.4	Very low	122 Å²	122	123.1 Å²	123.1	64%	0.639	64%	0.642	S	S	*	*	H	α-helix	trans	-71.5	-31.7	174.4	-79.6	165.2	0	0	0	112	R758 N760 T766	R758-L762 PolarHBondContact O-N 3.47Å; N760-L762 VanDerWaalsContact C-N 3.27Å; N760-L762 PolarHBondContact O-N 3.12Å; L762-T766 PolarHBondContact O-OG1 2.94Å
763	K	40.4	Very low	35.1	Very low	162 Å²	162	129.3 Å²	129.3	70%	0.704	66%	0.663	S	S	*	*	H	α-helix	trans	-73.1	-34.4	171.6	-78.4	-176.8	175.7	-179.3	0	112.9	A759 N760 T766	A759-K763 PolarHBondContact O-N 3.42Å; N760-K763 PolarHBondContact O-N 3.38Å; K763-T766 PolarHBondContact O-OG1 2.79Å
764	E	39.3	Very low	34.8	Very low	148 Å²	148	131.9 Å²	131.9	69%	0.692	67%	0.671	S	S	*	*	H	α-helix	trans	-77	-29.2	177.5	-85.8	-171.5	152.6	0	0	113.4	N760 L761 T767	N760-E764 PolarHBondContact O-N 2.96Å; L761-E764 PolarHBondContact O-N 3.46Å; E764-T767 PolarHBondContact O-OG1 3.23Å
765	K	33.6	Very low	34.4	Very low	158 Å²	158	131.8 Å²	131.8	69%	0.687	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-86	-4.7	-179.2	-76.1	-168.6	172.4	-171.1	0	115.5	L761 T767	L761-K765 WeakPolarHBondContact O-CB 3.23Å; L761-K765 PolarHBondContact O-N 2.8Å; K765-T767 PolarHBondContact O-N 3.45Å
766	T	34.2	Very low	34.1	Very low	118 Å²	118	136.5 Å²	136.5	72%	0.724	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-77.1	3	174.6	38.2	0	0	0	0	114.8	L762 K763	L762-T766 PolarHBondContact O-OG1 2.94Å; K763-T766 PolarHBondContact O-OG1 2.79Å
767	T	34.8	Very low	33.5	Very low	117 Å²	117	142.9 Å²	142.9	72%	0.718	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-100.4	-0	176.4	43.6	0	0	0	0	115.2	E764 K765	E764-T767 PolarHBondContact O-OG1 3.23Å; K765-T767 PolarHBondContact O-N 3.45Å
768	E	33.3	Very low	32.7	Very low	174 Å²	174	141.5 Å²	141.5	81%	0.813	72%	0.717	S	S	*	*			trans	-101.4	95.3	171.4	-79.6	-173.3	158.1	0	0	111.7	R770	E768-R770 PolarHBondContact O-N 3.32Å; E768-R770 VanDerWaalsContact O-N 3.1Å
769	T	32.2	Very low	32.5	Very low	146 Å²	146	140 Å²	140	90%	0.896	73%	0.726	S	S	*	*			trans	-57.1	100.5	165.5	31.1	0	0	0	0	110.9
770	R	28.6	Very low	32	Very low	241 Å²	241	143.4 Å²	143.4	91%	0.909	74%	0.742	S	S	*	*			trans	-134.9	100	164.9	-145.9	174.3	-176	176.6	1.3	110.9	E768 G772	E768-R770 PolarHBondContact O-N 3.32Å; E768-R770 VanDerWaalsContact O-N 3.1Å; R770-G772 PolarHBondContact O-N 3.2Å
771	E	30	Very low	31.4	Very low	200 Å²	200	145.4 Å²	145.4	94%	0.935	75%	0.751	S	S	*	*			trans	-51.8	126.1	172.3	-63.1	169.5	156.3	0	0	110.6
772	G	27.8	Very low	30.8	Very low	62 Å²	62	145.4 Å²	145.4	64%	0.639	76%	0.763	S	S	*	*	S	Bend	trans	164.9	-18.4	164	0	0	0	0	0	119.5	R770	R770-G772 PolarHBondContact O-N 3.2Å
773	Y	26.2	Very low	30.4	Very low	233 Å²	233	147.7 Å²	147.7	91%	0.914	77%	0.77	S	S	*	*			trans	-142.1	28.3	-168.9	-86.8	-83.4	0	0	0	116.6	G775	Y773-G775 PolarHBondContact O-N 3.22Å
774	E	26	Very low	30	Very low	195 Å²	195	144.9 Å²	144.9	91%	0.911	77%	0.769	S	S	*	*			trans	-87.1	8.7	176.4	-70.7	-166.7	155.6	0	0	115.3
775	G	27.1	Very low	29.8	Very low	75 Å²	75	143.4 Å²	143.4	77%	0.773	77%	0.772	S	S	*	*	S	Bend	trans	-85.7	-9.5	-164.3	0	0	0	0	0	119.6	Y773	Y773-G775 PolarHBondContact O-N 3.22Å
776	I	29.4	Very low	29.6	Very low	139 Å²	139	147.7 Å²	147.7	71%	0.713	78%	0.784	S	S	*	*	S	Bend	trans	-124.7	-16.4	-162.6	-47.9	-177	0	0	0	115.9
777	Y	28.9	Very low	29.5	Very low	221 Å²	221	150.7 Å²	150.7	87%	0.867	79%	0.789	S	S	*	*	S	Bend	trans	-140.5	23.5	-175.1	-70.8	-76.8	0	0	0	116.7	P779	Y777-P779 WeakPolarHBondContact O-CD 3.35Å
778	S	27.6	Very low	29.4	Very low	90 Å²	90	153.4 Å²	153.4	63%	0.629	79%	0.794	S	S	*	*			trans	-101.1	111.2	163.8	-160.9	0	0	0	0	108.7	T780	S778-T780 PolarHBondContact O-N 3.31Å
779	P	29.4	Very low	29.2	Very low	113 Å²	113	154.3 Å²	154.3	73%	0.734	80%	0.798	S	S	*	*			trans	-67.3	87.7	166.7	28.2	-28.4	0	0	0	106.3	Y777 I781	Y777-P779 WeakPolarHBondContact O-CD 3.35Å; P779-I781 PolarHBondContact O-N 3.2Å
780	T	29.3	Very low	29.2	Very low	121 Å²	121	158 Å²	158	74%	0.742	80%	0.795	S	S	*	*			trans	-58.7	98	165	-51.1	0	0	0	0	105.2	S778 A782	S778-T780 PolarHBondContact O-N 3.31Å; T780-A782 PolarHBondContact O-N 2.81Å
781	I	26.8	Very low	29.5	Very low	135 Å²	135	151.9 Å²	151.9	69%	0.692	79%	0.79	S	S	*	*			trans	-57	101	164.7	-62.7	172.1	0	0	0	103.3	P779 H783	P779-I781 PolarHBondContact O-N 3.2Å; I781-H783 VanDerWaalsContact C-N 3.29Å; I781-H783 PolarHBondContact O-N 3.38Å
782	A	26.8	Very low	29.7	Very low	84 Å²	84	147.3 Å²	147.3	69%	0.694	78%	0.78	S	S	*	*			trans	-58.4	102.8	172	0	0	0	0	0	105.3	T780 P784	T780-A782 PolarHBondContact O-N 2.81Å; A782-P784 WeakPolarHBondContact O-CD 3.36Å; A782-P784 VanDerWaalsContact O-N 3.11Å
783	H	25.8	Very low	29.9	Very low	169 Å²	169	155.7 Å²	155.7	78%	0.782	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-55.7	122.1	172.6	-75.6	-69.2	0	0	0	106.2	I781	I781-H783 VanDerWaalsContact C-N 3.29Å; I781-H783 PolarHBondContact O-N 3.38Å
784	P	32.9	Very low	30.4	Very low	104 Å²	104	149.9 Å²	149.9	68%	0.675	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-54.6	140.9	175.1	20.4	-29.8	0	0	0	108.3	A782 R786	A782-P784 WeakPolarHBondContact O-CD 3.36Å; A782-P784 VanDerWaalsContact O-N 3.11Å; P784-R786 PolarHBondContact O-N 2.87Å
785	P	34.8	Very low	30.7	Very low	117 Å²	117	147 Å²	147	76%	0.76	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-52.9	127.6	-177	20.6	-31.1	0	0	0	108.6	Q787	P785-Q787 VanDerWaalsContact C-N 3.31Å; P785-Q787 PolarHBondContact O-N 3.35Å
786	R	29	Very low	30.9	Very low	248 Å²	248	146.4 Å²	146.4	94%	0.936	78%	0.776	S	S	*	*			trans	-49.5	97.9	175	-78.6	179.9	170.5	178.5	-3.2	108	P784 E788	P784-R786 PolarHBondContact O-N 2.87Å; R786-E788 PolarHBondContact O-N 3.4Å
787	Q	33.3	Very low	30.9	Very low	180 Å²	180	149 Å²	149	84%	0.841	79%	0.787	S	S	*	*			trans	-65.6	118.1	163.8	-82.9	-174	-20.3	0	0	105.4	P785 E789	P785-Q787 VanDerWaalsContact C-N 3.31Å; P785-Q787 PolarHBondContact O-N 3.35Å; Q787-E789 PolarHBondContact O-N 2.91Å
788	E	31.8	Very low	30.8	Very low	175 Å²	175	147.6 Å²	147.6	82%	0.818	79%	0.788	S	S	*	*			trans	-48.5	110.6	170.4	-67.5	179.3	160.8	0	0	108	R786 R790	R786-E788 PolarHBondContact O-N 3.4Å; E788-R790 PolarHBondContact O-N 2.89Å
789	E	29.8	Very low	30.9	Very low	193 Å²	193	148.9 Å²	148.9	90%	0.902	79%	0.793	S	S	*	*			trans	-62.5	84.5	173.4	-71.6	-178.8	161.8	0	0	108.4	Q787 S791	Q787-E789 PolarHBondContact O-N 2.91Å; E789-S791 PolarHBondContact O-N 3.29Å; E789-S791 VanDerWaalsContact O-N 3.14Å
790	R	31.1	Very low	30.9	Very low	222 Å²	222	149.9 Å²	149.9	84%	0.838	80%	0.799	S	S	*	*			trans	-70.8	102.9	156.2	-83.5	-173.4	176.3	-172.8	-0.4	106.5	E788 S792	E788-R790 PolarHBondContact O-N 2.89Å; R790-S792 PolarHBondContact O-N 2.82Å
791	S	34.9	Very low	30.8	Very low	113 Å²	113	155.3 Å²	155.3	79%	0.79	81%	0.806	S	S	*	*			trans	-63.5	79.2	174.7	53.3	0	0	0	0	111.2	E789 W793	E789-S791 PolarHBondContact O-N 3.29Å; E789-S791 VanDerWaalsContact O-N 3.14Å; S791-W793 VanDerWaalsContact C-N 3.32Å
792	S	35.5	Very low	30.8	Very low	105 Å²	105	154.4 Å²	154.4	73%	0.734	81%	0.812	S	S	*	*			trans	-100.1	53.3	165.4	65.3	0	0	0	0	109.9	R790	R790-S792 PolarHBondContact O-N 2.82Å
793	W	31.6	Very low	30.7	Very low	238 Å²	238	156.3 Å²	156.3	90%	0.902	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-84.4	121.5	163.7	-79	68.8	0	0	0	107.9	S791	S791-W793 VanDerWaalsContact C-N 3.32Å
794	P	37.4	Very low	30.6	Very low	111 Å²	111	156.8 Å²	156.8	72%	0.721	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-65.5	143.1	-179.6	25.6	-31.1	0	0	0	110.6
795	P	32	Very low	30.2	Very low	134 Å²	134	161.2 Å²	161.2	87%	0.87	82%	0.82	S	S	*	*	S	Bend	trans	-73.4	130.2	179.9	30.7	-31.5	0	0	0	109.4
796	G	30	Very low	29.9	Very low	63 Å²	63	165 Å²	165	65%	0.649	83%	0.827	S	S	*	*			trans	118.9	62.9	160.6	0	0	0	0	0	116.3
797	M	30.1	Very low	29.7	Very low	194 Å²	194	159 Å²	159	96%	0.956	82%	0.818	S	S	*	*			trans	-126.4	87.7	140.4	-72.1	-164.3	110.1	0	0	107.8	T799	M797-T799 PolarHBondContact O-N 3.08Å; M797-T799 VanDerWaalsContact O-N 3.16Å
798	Q	27.8	Very low	29.4	Very low	190 Å²	190	161.4 Å²	161.4	89%	0.888	82%	0.819	S	S	*	*			trans	-67.5	101.5	174.7	-70.4	174	-9.4	0	0	108.9
799	T	29	Very low	29	Very low	118 Å²	118	160.9 Å²	160.9	72%	0.724	82%	0.817	S	S	*	*			trans	-74.3	129.3	153.5	46.4	0	0	0	0	107.7	M797 R801	M797-T799 PolarHBondContact O-N 3.08Å; M797-T799 VanDerWaalsContact O-N 3.16Å; T799-R801 PolarHBondContact O-N 2.81Å
800	P	29.2	Very low	29	Very low	134 Å²	134	159.4 Å²	159.4	87%	0.87	81%	0.81	S	S	*	*			trans	-64.9	104.4	-176.3	3.4	5	0	0	0	109.3	S802	P800-S802 PolarHBondContact O-N 3.14Å
801	R	26.2	Very low	28.9	Very low	234 Å²	234	156.7 Å²	156.7	88%	0.883	81%	0.807	S	S	*	*			trans	-70.8	115.1	169.7	-90.7	-179.7	165	176.2	-4.7	107.9	T799 T803	T799-R801 PolarHBondContact O-N 2.81Å; R801-T803 PolarHBondContact O-N 2.75Å; R801-T803 VanDerWaalsContact O-N 3.1Å
802	S	27.4	Very low	28.4	Very low	116 Å²	116	163 Å²	163	81%	0.811	81%	0.813	S	S	*	*			trans	-58	110.2	160.3	54	0	0	0	0	108.4	P800 F804	P800-S802 PolarHBondContact O-N 3.14Å; S802-F804 PolarHBondContact O-N 3.02Å
803	T	25.1	Very low	28.2	Very low	124 Å²	124	163.6 Å²	163.6	76%	0.761	82%	0.817	S	S	*	*			trans	-51.9	121.3	170.9	39.3	0	0	0	0	111.7	R801	R801-T803 PolarHBondContact O-N 2.75Å; R801-T803 VanDerWaalsContact O-N 3.1Å
804	F	23.2	Very low	28	Very low	180 Å²	180	156.5 Å²	156.5	79%	0.789	81%	0.809	S	S	*	*			trans	-160.3	124.3	144.9	-99.4	-63.8	0	0	0	111.5	S802	S802-F804 PolarHBondContact O-N 3.02Å
805	Y	24.5	Very low	27.5	Very low	196 Å²	196	161.9 Å²	161.9	77%	0.769	82%	0.817	S	S	*	*			trans	44.6	107.8	165.6	-61.8	-71.4	0	0	0	120.5
806	Q	28.3	Very low	27.7	Very low	196 Å²	196	161.1 Å²	161.1	92%	0.916	81%	0.812	S	S	*	*				-153.1	115.4	120.4	-136.4	165.3	5.7	0	0	111.6
807	V	24.7	Very low	27.6	Very low	123 Å²	123	162 Å²	162	75%	0.745	82%	0.82	S	S	*	*			trans	-66.5	123.7	167	173.9	0	0	0	0	107.5	E809	V807-E809 HydrophobicContact CG1-CG 4.48Å
808	R	27.5	Very low	27.4	Very low	231 Å²	231	156.1 Å²	156.1	87%	0.872	81%	0.81	S	S	*	*			trans	-132.3	101.2	157.5	-158.6	169.9	-176.2	160.5	1.1	108
809	E	24.7	Very low	27.3	Very low	164 Å²	164	155.5 Å²	155.5	77%	0.766	81%	0.809	S	S	*	*			trans	-47.6	132.3	156.1	-63	173.1	135.4	0	0	109	V807	V807-E809 HydrophobicContact CG1-CG 4.48Å
810	E	28.6	Very low	27.2	Very low	161 Å²	161	158.3 Å²	158.3	75%	0.752	81%	0.814	S	S	*	*				175.5	131.2	129.5	-97.1	167	175.5	0	0	111
811	E	28.3	Very low	27	Very low	166 Å²	166	158.3 Å²	158.3	78%	0.776	81%	0.812	S	S	*	*			trans	75.1	94.1	150	-61	-175.1	161	0	0	118.6
812	R	24.5	Very low	27.2	Very low	246 Å²	246	153.3 Å²	153.3	93%	0.928	81%	0.81	S	S	*	*				62.7	92.5	88.5	-79.6	-177	167.6	-179	-1.8	113.6
813	S	31.8	Very low	27.1	Very low	116 Å²	116	158.6 Å²	158.6	81%	0.811	81%	0.812	S	S	*	*			trans	-159.3	112.7	131.4	64.2	0	0	0	0	111.8
814	A	28.7	Very low	27.3	Very low	89 Å²	89	157.5 Å²	157.5	74%	0.736	82%	0.816	S	S	*	*			trans	50.3	97	143.2	0	0	0	0	0	120.3
815	Y	26.6	Very low	27.5	Very low	225 Å²	225	154 Å²	154	88%	0.882	81%	0.809	S	S	*	*				32.9	166.1	118.4	-76.7	-74.1	0	0	0	121.7
816	P	35.7	Very low	27.7	Very low	118 Å²	118	154.5 Å²	154.5	77%	0.766	82%	0.816	S	S	*	*			cis	-134.5	142.8	-24.7	31	-12.8	0	0	0	112.9
817	G	27.6	Very low	27.6	Very low	80 Å²	80	153 Å²	153	83%	0.825	81%	0.808	S	S	*	*			trans	-174.6	82.7	171	0	0	0	0	0	114.8
818	G	25.2	Very low	27.7	Very low	72 Å²	72	156 Å²	156	74%	0.742	81%	0.814	S	S	*	*			trans	81.8	107.7	137.4	0	0	0	0	0	119.8
819	M	27.6	Very low	28	Very low	177 Å²	177	155.1 Å²	155.1	87%	0.872	82%	0.817	S	S	*	*			trans	85.2	93.3	139.5	-64.8	-168.3	148.2	0	0	120.4
820	Q	25.9	Very low	28.2	Very low	177 Å²	177	150.6 Å²	150.6	83%	0.827	81%	0.814	S	S	*	*				57.6	95.6	123.2	-67.6	-178.7	2.1	0	0	119
821	T	25.7	Very low	28.2	Very low	134 Å²	134	149.3 Å²	149.3	82%	0.822	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-69.6	132	149.7	44.1	0	0	0	0	111.9
822	P	30.3	Very low	28.2	Very low	129 Å²	129	145.5 Å²	145.5	84%	0.838	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-82.9	121.6	152.6	11.6	5.9	0	0	0	109.4
823	R	24	Very low	28.4	Very low	227 Å²	227	137.1 Å²	137.1	86%	0.857	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-73.1	121.8	173.7	-179.5	179.5	-175.3	163.3	0.4	109.5
824	A	30.6	Very low	28.4	Very low	101 Å²	101	140.7 Å²	140.7	84%	0.835	82%	0.819	S	S	*	*			trans	-126	104.3	157.3	0	0	0	0	0	108.1
825	T	27.8	Very low	28.3	Very low	106 Å²	106	145.5 Å²	145.5	65%	0.65	83%	0.827	S	S	*	*			trans	-58.2	134.4	167.1	25.3	0	0	0	0	111.7
826	F	27.8	Very low	28.6	Very low	207 Å²	207	140.2 Å²	140.2	91%	0.908	82%	0.82	S	S	*	*			trans	-146.6	146	144.7	-126.4	-89.3	0	0	0	110.3
827	E	27.1	Very low	28.2	Very low	163 Å²	163	143.5 Å²	143.5	76%	0.762	83%	0.825	S	S	*	*			trans	-89.2	163.1	-148.4	-68.5	169.7	141.2	0	0	115.8
828	Q	25.5	Very low	28.3	Very low	187 Å²	187	145.9 Å²	145.9	87%	0.874	82%	0.818	S	S	*	*			trans	-53.3	131.2	167.6	-70.2	159.1	-36.2	0	0	113
829	F	34.7	Very low	28.2	Very low	212 Å²	212	149.9 Å²	149.9	93%	0.93	82%	0.819	S	S	*	*			trans	-122.7	129.9	141.3	-84.5	-80.4	0	0	0	108.6
830	G	27.5	Very low	28.1	Very low	69 Å²	69	151.2 Å²	151.2	71%	0.711	82%	0.816	S	S	*	*			trans	-81.2	-176	-169.3	0	0	0	0	0	115.4
831	P	29.2	Very low	28.1	Very low	135 Å²	135	148.5 Å²	148.5	88%	0.877	81%	0.811	S	S	*	*			trans	-94	135	-168.8	35.8	-29.4	0	0	0	111.6
832	G	28.6	Very low	28	Very low	86 Å²	86	148.3 Å²	148.3	89%	0.887	81%	0.81	S	S	*	*			trans	157.7	102.3	168.8	0	0	0	0	0	112.5
833	G	29.4	Very low	27.7	Very low	70 Å²	70	150.1 Å²	150.1	72%	0.722	81%	0.807	S	S	*	*			trans	152.5	90	170	0	0	0	0	0	112.8
834	E	29.8	Very low	27.8	Very low	190 Å²	190	146.4 Å²	146.4	89%	0.888	80%	0.799	S	S	*	*			trans	49.2	114	145.4	-63.1	178.1	166.8	0	0	118.6	P836	E834-P836 WeakPolarHBondContact O-CD 3.31Å
835	E	27	Very low	27.7	Very low	191 Å²	191	147.9 Å²	147.9	89%	0.893	80%	0.798	S	S	*	*			trans	-49.8	120.5	164.9	-73.5	-179	142.9	0	0	110.4	E837	E835-E837 PolarHBondContact O-N 3.26Å
836	P	34.1	Very low	27.7	Very low	114 Å²	114	150.9 Å²	150.9	74%	0.74	80%	0.802	S	S	*	*			trans	-71.7	114.1	175.5	26.8	-30.6	0	0	0	109.1	E834 I838	E834-P836 WeakPolarHBondContact O-CD 3.31Å; P836-I838 WeakPolarHBondContact O-CG1 3.28Å; P836-I838 PolarHBondContact O-N 3.16Å
837	E	27.6	Very low	27.7	Very low	186 Å²	186	149.2 Å²	149.2	87%	0.869	80%	0.797	S	S	*	*			trans	-58.3	101.8	167.9	-152.6	172.3	-158.5	0	0	108.4	E835 M839	E835-E837 PolarHBondContact O-N 3.26Å; E837-M839 PolarHBondContact O-N 3.1Å
838	I	28.6	Very low	27.7	Very low	130 Å²	130	147.7 Å²	147.7	67%	0.667	80%	0.799	S	S	*	*			trans	-71.6	94.9	-176.5	-57.1	176.3	0	0	0	108.3	P836 Y840	P836-I838 WeakPolarHBondContact O-CG1 3.28Å; P836-I838 PolarHBondContact O-N 3.16Å; I838-Y840 WeakPolarHBondContact O-CD2 3.24Å; I838-Y840 PolarHBondContact O-N 2.91Å
839	M	24.1	Very low	27.8	Very low	157 Å²	157	144.3 Å²	144.3	77%	0.773	79%	0.791	S	S	*	*			trans	-67.6	111.6	168.3	-66.5	-142.9	-61.8	0	0	109.5	E837 T841	E837-M839 PolarHBondContact O-N 3.1Å; M839-T841 PolarHBondContact O-N 3.12Å
840	Y	24.6	Very low	27.6	Very low	205 Å²	205	145.4 Å²	145.4	80%	0.804	79%	0.789	S	S	*	*			trans	-71.7	97.2	169.8	-70.8	-91.6	0	0	0	109.5	I838 V842	I838-Y840 WeakPolarHBondContact O-CD2 3.24Å; I838-Y840 PolarHBondContact O-N 2.91Å; Y840-V842 PolarHBondContact O-N 2.82Å
841	T	26.2	Very low	27.6	Very low	119 Å²	119	151.4 Å²	151.4	73%	0.73	79%	0.79	S	S	*	*			trans	-79	107.1	163	43.4	0	0	0	0	109	M839 E843	M839-T841 PolarHBondContact O-N 3.12Å; T841-E843 PolarHBondContact O-N 3.11Å
842	V	23.3	Very low	27.6	Very low	131 Å²	131	151.6 Å²	151.6	79%	0.794	79%	0.789	S	S	*	*			trans	-77.2	99	172.3	-178.8	0	0	0	0	107.8	Y840 E844	Y840-V842 PolarHBondContact O-N 2.82Å; V842-E844 PolarHBondContact O-N 3.19Å
843	E	24.3	Very low	27.6	Very low	167 Å²	167	156 Å²	156	78%	0.78	78%	0.78	S	S	*	*			trans	-70.9	105.7	170.2	-76.9	-173.4	151	0	0	110	T841 T845	T841-E843 PolarHBondContact O-N 3.11Å; E843-T845 PolarHBondContact O-N 3.1Å
844	E	25.3	Very low	27.8	Very low	149 Å²	149	157.9 Å²	157.9	70%	0.696	78%	0.778	S	S	*	*			trans	-65.5	91	168.8	-74.6	-171.5	161.5	0	0	110.5	V842 K846	V842-E844 PolarHBondContact O-N 3.19Å; E844-K846 PolarHBondContact O-N 3.44Å; E844-K846 VanDerWaalsContact OE2-CE 3.31Å; E844-K846 WeakPolarHBondContact OE2-CE 3.27Å; E844-K846 IonicContact OE2-NZ 3.41Å; E844-K846 PolarHBondContact OE2-NZ 3.24Å
845	T	29.1	Very low	27.9	Very low	132 Å²	132	152.6 Å²	152.6	81%	0.81	76%	0.762	S	S	*	*			trans	-73.9	89.2	170.1	38.2	0	0	0	0	110.4	E843 E847	E843-T845 PolarHBondContact O-N 3.1Å; T845-E847 VanDerWaalsContact C-N 3.3Å; T845-E847 PolarHBondContact O-N 3.14Å
846	K	28.2	Very low	27.9	Very low	168 Å²	168	152.3 Å²	152.3	73%	0.73	75%	0.754	S	S	*	*			trans	-75.8	73	171.5	-71.4	177.5	-177.5	162	0	111.1	E844	E844-K846 PolarHBondContact O-N 3.44Å; E844-K846 VanDerWaalsContact OE2-CE 3.31Å; E844-K846 WeakPolarHBondContact OE2-CE 3.27Å; E844-K846 IonicContact OE2-NZ 3.41Å; E844-K846 PolarHBondContact OE2-NZ 3.24Å
847	E	27.5	Very low	27.7	Very low	172 Å²	172	152 Å²	152	80%	0.804	74%	0.743	S	S	*	*			trans	-108.6	76	170.1	-128.1	176.6	-170	0	0	110.9	T845 T849	T845-E847 VanDerWaalsContact C-N 3.3Å; T845-E847 PolarHBondContact O-N 3.14Å; E847-T849 VanDerWaalsContact C-N 3.29Å; E847-T849 PolarHBondContact O-N 3.4Å
848	V	28.1	Very low	28.4	Very low	131 Å²	131	149.4 Å²	149.4	79%	0.794	74%	0.741	S	S	*	*			trans	-73.8	85	173.2	-175.8	0	0	0	0	108.4	R850	V848-R850 PolarHBondContact O-N 3.16Å
849	T	27.6	Very low	29.1	Very low	117 Å²	117	146.5 Å²	146.5	72%	0.718	74%	0.737	S	S	*	*			trans	-66	98.5	170.5	20.6	0	0	0	0	109.3	E847 R851	E847-T849 VanDerWaalsContact C-N 3.29Å; E847-T849 PolarHBondContact O-N 3.4Å; T849-R851 PolarHBondContact O-N 2.71Å
850	R	29.5	Very low	29.7	Very low	235 Å²	235	142.4 Å²	142.4	89%	0.887	74%	0.735	S	S	*	*			trans	-59.7	100.6	173.7	-82.6	-178.1	171.1	-178.1	-1.4	109.9	V848 T852	V848-R850 PolarHBondContact O-N 3.16Å; R850-T852 PolarHBondContact O-N 3.46Å
851	R	28.1	Very low	30.5	Very low	195 Å²	195	143.3 Å²	143.3	74%	0.736	74%	0.737	S	S	*	*			trans	-76	113.6	172.4	-70.1	-177.1	-179.9	178.4	0.6	110.4	T849 Y853	T849-R851 PolarHBondContact O-N 2.71Å; R851-Y853 HydrophobicContact CB-CD2 4.36Å; R851-Y853 HydrophobicContact CB-CE2 3.63Å; R851-Y853 WeakPolarHBondContact CD-OH 3.49Å; R851-Y853 WeakPolarHBondContact O-CD2 3.43Å
852	T	29.3	Very low	31.1	Very low	139 Å²	139	144 Å²	144	85%	0.853	73%	0.73	S	S	*	*			trans	-82.3	112.8	175.1	-5.1	0	0	0	0	109.7	R850	R850-T852 PolarHBondContact O-N 3.46Å
853	Y	28.9	Very low	32	Very low	177 Å²	177	145.1 Å²	145.1	69%	0.694	72%	0.724	S	S	*	*			trans	-101.6	113.9	175	-63.7	-85.3	0	0	0	110	R851	R851-Y853 HydrophobicContact CB-CD2 4.36Å; R851-Y853 HydrophobicContact CB-CE2 3.63Å; R851-Y853 WeakPolarHBondContact CD-OH 3.49Å; R851-Y853 WeakPolarHBondContact O-CD2 3.43Å
854	T	32.1	Very low	32.8	Very low	110 Å²	110	142 Å²	142	68%	0.675	71%	0.705	S	S	*	*			trans	-95.7	104.5	167.1	21.1	0	0	0	0	109.1
855	S	32.3	Very low	33.9	Very low	79 Å²	79	140.9 Å²	140.9	55%	0.552	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-89.4	130.3	171.3	52.5	0	0	0	0	110.5
856	Y	27	Very low	34.6	Very low	185 Å²	185	137.6 Å²	137.6	73%	0.725	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-93.8	128	176.2	-67.3	-90.8	0	0	0	109.3
857	H	30.9	Very low	35.7	Very low	109 Å²	109	132.3 Å²	132.3	51%	0.505	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-78.6	135.4	173.2	-169.8	-85.5	0	0	0	110.1	A859 G860	H857-A859 PolarHBondContact ND1-N 3.42Å; H857-A859 PolarHBondContact O-N 2.8Å; H857-G860 PolarHBondContact O-N 3.36Å
858	P	41.7	Very low	36.5	Very low	130 Å²	130	131.4 Å²	131.4	84%	0.844	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-20.7	-173.7	19.2	-31	0	0	0	114.9	G860	P858-G860 VanDerWaalsContact C-N 3.25Å; P858-G860 PolarHBondContact O-N 3.35Å
859	A	42.7	Very low	37.3	Very low	70 Å²	70	125.7 Å²	125.7	58%	0.579	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	6.8	176.4	0	0	0	0	0	114.9	H857 R861	H857-A859 PolarHBondContact ND1-N 3.42Å; H857-A859 PolarHBondContact O-N 2.8Å; A859-R861 PolarHBondContact O-N 2.81Å
860	G	37.2	Very low	38.2	Very low	71 Å²	71	127 Å²	127	73%	0.732	63%	0.632	S	S	*	*	S	Bend	trans	66.9	-1.1	167.2	0	0	0	0	0	117.7	H857 P858	H857-G860 PolarHBondContact O-N 3.36Å; P858-G860 VanDerWaalsContact C-N 3.25Å; P858-G860 PolarHBondContact O-N 3.35Å
861	R	40.7	Very low	39.2	Very low	224 Å²	224	121.5 Å²	121.5	85%	0.845	62%	0.624	S	S	*	*	S	Bend	trans	-133.7	52.9	-169.2	-63.2	-168.8	-174.1	-151.8	3.3	115.3	A859	A859-R861 PolarHBondContact O-N 2.81Å
862	K	40.1	Very low	39.8	Very low	134 Å²	134	114.7 Å²	114.7	58%	0.583	62%	0.615	S	S	*	*			trans	178	124.3	155.4	-95.3	146.1	-165.3	-168.5	0	109.8	W864	K862-W864 VanDerWaalsContact O-CD1 3.27Å
863	K	42.6	Very low	40.5	Very low	154 Å²	154	114.9 Å²	114.9	67%	0.67	61%	0.606	S	S	*	*			trans	-82.3	123.3	169.7	-69.4	-172.9	179.3	-177.6	0	108.3	M879	K863-M879 PolarHBondContact O-N 3.41Å
864	W	39.9	Very low	41	Very low	101 Å²	101	110.3 Å²	110.3	38%	0.383	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.1	142.5	176.2	-58.6	85.5	0	0	0	109.1	K862 L876	K862-W864 VanDerWaalsContact O-CD1 3.27Å; W864-L876 HydrophobicContact CB-CD2 3.86Å; W864-L876 HydrophobicContact CE3-CB 4.29Å
865	K	49.4	Very low	41.9	Very low	126 Å²	126	110.7 Å²	110.7	55%	0.548	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.6	127.7	171.2	-170.9	177.8	178.9	-178.3	0	108.4	T867 V877 M879	K865-T867 HydrophobicContact CG-CG2 4.49Å; K865-V877 PolarHBondContact N-O 2.72Å; K865-V877 VanDerWaalsContact N-O 3.13Å; K865-V877 PolarHBondContact O-N 3.41Å; K865-M879 HydrophobicContact CB-CG 4.32Å
866	T	42	Very low	42.5	Very low	63 Å²	63	112.1 Å²	112.1	39%	0.387	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.6	123.2	173.6	-40	0	0	0	0	108.6	P874	T866-P874 HydrophobicContact CG2-CB 3.82Å
867	T	52.5	Low	43.5	Very low	56 Å²	56	107 Å²	107	34%	0.344	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.1	142	175	45.1	0	0	0	0	109.3	K865 Q875 V877	K865-T867 HydrophobicContact CG-CG2 4.49Å; T867-Q875 PolarHBondContact N-O 2.84Å; T867-Q875 PolarHBondContact O-N 3.39Å; T867-Q875 PolarHBondContact OG1-O 3.06Å; T867-V877 WeakPolarHBondContact OG1-CG2 3.3Å
868	F	43.3	Very low	44.5	Very low	153 Å²	153	105 Å²	105	67%	0.671	58%	0.579	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.3	121.5	177.8	-68	-88.9	0	0	0	109.5	P874	F868-P874 HydrophobicContact CD1-CB 4.09Å; F868-P874 HydrophobicContact CE1-CB 3.8Å; F868-P874 HydrophobicContact CE1-CG 4.24Å; F868-P874 HydrophobicContact CZ-CB 4.36Å
869	G	44.7	Very low	44.3	Very low	12 Å²	12	103.9 Å²	103.9	12%	0.124	56%	0.564	C	S	.	*			trans	-69.9	171.6	175.8	0	0	0	0	0	112.2	T871 G872 Q873	G869-T871 PolarHBondContact O-N 2.89Å; G869-T871 VanDerWaalsContact O-N 3.1Å; G869-G872 PolarHBondContact O-N 3.23Å; G869-Q873 PolarHBondContact N-O 2.83Å
870	P	46.7	Very low	44.4	Very low	143 Å²	143	106 Å²	106	93%	0.929	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-20.1	-177.9	22.7	-31.8	0	0	0	113.9	G872	P870-G872 VanDerWaalsContact C-N 3.32Å
871	T	52.1	Low	44.3	Very low	120 Å²	120	106.9 Å²	106.9	74%	0.736	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	5.1	173.9	52.7	0	0	0	0	113.8	G869 Q873	G869-T871 PolarHBondContact O-N 2.89Å; G869-T871 VanDerWaalsContact O-N 3.1Å; T871-Q873 VanDerWaalsContact C-N 3.26Å; T871-Q873 PolarHBondContact O-N 3.48Å
872	G	40.6	Very low	43.9	Very low	52 Å²	52	101.8 Å²	101.8	54%	0.536	56%	0.563	S	S	.	*	S	Bend	trans	78.6	-0.6	177.9	0	0	0	0	0	115.2	G869 P870	G869-G872 PolarHBondContact O-N 3.23Å; P870-G872 VanDerWaalsContact C-N 3.32Å
873	Q	42.6	Very low	43.6	Very low	144 Å²	144	103.3 Å²	103.3	67%	0.673	58%	0.576	S	S	*	*			trans	-83.1	137.9	172.7	-75.6	-167.6	-14.6	0	0	111.8	G869 T871 Q875	G869-Q873 PolarHBondContact N-O 2.83Å; T871-Q873 VanDerWaalsContact C-N 3.26Å; T871-Q873 PolarHBondContact O-N 3.48Å; Q873-Q875 PolarHBondContact O-N 3.47Å
874	P	40	Very low	43.2	Very low	81 Å²	81	102.4 Å²	102.4	53%	0.526	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.8	123.3	175.7	25.4	-30.5	0	0	0	110.8	T866 F868	T866-P874 HydrophobicContact CG2-CB 3.82Å; F868-P874 HydrophobicContact CD1-CB 4.09Å; F868-P874 HydrophobicContact CE1-CB 3.8Å; F868-P874 HydrophobicContact CE1-CG 4.24Å; F868-P874 HydrophobicContact CZ-CB 4.36Å
875	Q	50.8	Low	42.7	Very low	117 Å²	117	101.9 Å²	101.9	55%	0.547	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110	133	171	-77.1	-178	-14.4	0	0	110.2	T867 Q873	T867-Q875 PolarHBondContact N-O 2.84Å; T867-Q875 PolarHBondContact O-N 3.39Å; T867-Q875 PolarHBondContact OG1-O 3.06Å; Q873-Q875 PolarHBondContact O-N 3.47Å
876	L	45.4	Very low	41.6	Very low	109 Å²	109	99.2 Å²	99.2	57%	0.571	61%	0.608	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.5	119.2	173.6	-80.9	156.3	0	0	0	109.2	W864	W864-L876 HydrophobicContact CB-CD2 3.86Å; W864-L876 HydrophobicContact CE3-CB 4.29Å
877	V	46.6	Very low	41	Very low	77 Å²	77	108.3 Å²	108.3	47%	0.467	64%	0.636	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112	128.2	175.7	-170.3	0	0	0	0	108.8	K865 T867	K865-V877 PolarHBondContact N-O 2.72Å; K865-V877 VanDerWaalsContact N-O 3.13Å; K865-V877 PolarHBondContact O-N 3.41Å; T867-V877 WeakPolarHBondContact OG1-CG2 3.3Å
878	S	52.3	Low	39.9	Very low	67 Å²	67	111.6 Å²	111.6	47%	0.469	66%	0.656	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.5	127.4	178.4	64.4	0	0	0	0	110.5
879	M	39	Very low	39.2	Very low	107 Å²	107	112.4 Å²	112.4	53%	0.527	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-76	134.2	175.3	-69.8	-72.9	-68.7	0	0	110.4	K863 K865 S881	K863-M879 PolarHBondContact O-N 3.41Å; K865-M879 HydrophobicContact CB-CG 4.32Å; M879-S881 PolarHBondContact O-N 3.43Å
880	P	43	Very low	38.4	Very low	115 Å²	115	118.6 Å²	118.6	75%	0.747	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-57	133.9	171.5	-20	30.6	0	0	0	110.3
881	S	35	Very low	37.8	Very low	90 Å²	90	117.8 Å²	117.8	63%	0.629	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-71	134.7	178.2	-60.8	0	0	0	0	109.7	M879 I883	M879-S881 PolarHBondContact O-N 3.43Å; S881-I883 PolarHBondContact O-N 3Å
882	P	34	Very low	36.6	Very low	117 Å²	117	117.5 Å²	117.5	76%	0.76	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-62.4	127.4	176.5	23.2	-29.7	0	0	0	109.8	V884	P882-V884 PolarHBondContact O-N 2.84Å
883	I	32.9	Very low	36.4	Very low	166 Å²	166	120.7 Å²	120.7	85%	0.851	70%	0.704	S	S	*	*			trans	-70.1	100.5	176.3	-59	169.2	0	0	0	107	S881 A885	S881-I883 PolarHBondContact O-N 3Å; I883-A885 PolarHBondContact O-N 3.29Å
884	V	35.2	Very low	35.7	Very low	135 Å²	135	120.1 Å²	120.1	82%	0.818	71%	0.71	S	S	*	*			trans	-90.8	99.3	165.2	-176.9	0	0	0	0	106.6	P882	P882-V884 PolarHBondContact O-N 2.84Å
885	A	29.4	Very low	35.1	Very low	89 Å²	89	124.7 Å²	124.7	74%	0.736	73%	0.725	S	S	*	*			trans	-66.8	133.5	169.4	0	0	0	0	0	110	I883	I883-A885 PolarHBondContact O-N 3.29Å
886	G	26.3	Very low	34.1	Very low	71 Å²	71	128.4 Å²	128.4	73%	0.732	74%	0.74	S	S	*	*			trans	92.5	91.2	152.6	0	0	0	0	0	117.5
887	R	29.2	Very low	33.1	Very low	254 Å²	254	129.5 Å²	129.5	96%	0.958	75%	0.746	S	S	*	*				-162.1	123.6	113.2	-117.4	177.1	177.2	-176.1	-1.3	110.4
888	T	28.8	Very low	32.4	Very low	125 Å²	125	132 Å²	132	77%	0.767	76%	0.761	S	S	*	*			trans	-78.7	165.1	-175.1	37.4	0	0	0	0	113.4
889	Q	28	Very low	31.1	Very low	170 Å²	170	139.5 Å²	139.5	79%	0.794	78%	0.779	S	S	*	*			trans	83.1	142.4	161.3	-65.6	-175.9	-32.5	0	0	117.3
890	D	29	Very low	30.6	Very low	141 Å²	141	140.9 Å²	140.9	75%	0.754	79%	0.794	S	S	*	*			cis	168.9	122.5	-21.7	-105.3	-27.6	0	0	0	102.6
891	S	33.4	Very low	30	Very low	127 Å²	127	141 Å²	141	89%	0.888	80%	0.795	S	S	*	*			trans	167.9	145.6	143.5	39.3	0	0	0	0	111.4
892	S	28.1	Very low	29.5	Very low	114 Å²	114	145.5 Å²	145.5	80%	0.797	81%	0.806	S	S	*	*			trans	-106.8	175.7	-148	33.3	0	0	0	0	112.9
893	P	34.6	Very low	29.4	Very low	119 Å²	119	146.2 Å²	146.2	77%	0.773	81%	0.811	S	S	*	*			trans	-96.9	151.8	-156.9	37.1	-31.2	0	0	0	114
894	T	28.2	Very low	29.1	Very low	132 Å²	132	144.1 Å²	144.1	81%	0.81	81%	0.81	S	S	*	*			trans	-100	105	171.6	-17	0	0	0	0	110
895	Q	28.3	Very low	28.8	Very low	177 Å²	177	140.7 Å²	140.7	83%	0.827	80%	0.803	S	S	*	*			trans	-71.5	132.2	159.9	-79	173.3	-33.4	0	0	108.9
896	F	28.5	Very low	28.8	Very low	195 Å²	195	143.1 Å²	143.1	86%	0.855	81%	0.809	S	S	*	*			trans	-121.3	112.2	156.1	-108.7	-87.5	0	0	0	108.3
897	D	25.6	Very low	28.8	Very low	131 Å²	131	146.8 Å²	146.8	70%	0.701	81%	0.811	S	S	*	*			trans	-102.4	122.9	-178.9	-157.6	-5.1	0	0	0	106.1
898	T	32.6	Very low	28.9	Very low	129 Å²	129	142.5 Å²	142.5	79%	0.791	81%	0.808	S	S	*	*			trans	-145.6	100.4	167.7	7.1	0	0	0	0	110.2
899	R	24.2	Very low	28.8	Very low	226 Å²	226	144.4 Å²	144.4	85%	0.853	81%	0.806	S	S	*	*			trans	-60.6	137.4	170.1	-65	169.7	173.1	179.8	-4.6	111
900	T	29.5	Very low	28.9	Very low	136 Å²	136	146 Å²	146	83%	0.834	81%	0.81	S	S	*	*			trans	-140.6	136.2	153.3	-29.8	0	0	0	0	109
901	P	28.9	Very low	28.8	Very low	117 Å²	117	147.9 Å²	147.9	76%	0.76	81%	0.811	S	S	*	*			trans	-95.8	152.1	-149	3.7	17	0	0	0	115
902	Q	24.6	Very low	28.6	Very low	185 Å²	185	149.8 Å²	149.8	86%	0.864	81%	0.806	S	S	*	*			trans	-64.2	133.6	168.1	-78	173.9	-55.7	0	0	111.9	S904	Q902-S904 PolarHBondContact O-N 3.47Å
903	P	33.3	Very low	28.5	Very low	132 Å²	132	152.8 Å²	152.8	86%	0.857	81%	0.81	S	S	*	*			trans	-80	106.7	160.7	29.3	-26.9	0	0	0	109.6
904	S	26.1	Very low	28.2	Very low	121 Å²	121	153 Å²	153	85%	0.846	81%	0.808	S	S	*	*			trans	-84.4	113.4	160.5	51.9	0	0	0	0	108.4	Q902	Q902-S904 PolarHBondContact O-N 3.47Å
905	G	28.1	Very low	28.2	Very low	64 Å²	64	155.2 Å²	155.2	66%	0.66	81%	0.81	S	S	*	*			trans	-141.7	87.3	-178.4	0	0	0	0	0	111.5
906	T	29.6	Very low	28.1	Very low	140 Å²	140	153.3 Å²	153.3	86%	0.859	81%	0.81	S	S	*	*			trans	50.4	117	138.2	37.2	0	0	0	0	120.8
907	D	25.8	Very low	28.1	Very low	147 Å²	147	148.3 Å²	148.3	79%	0.786	81%	0.805	S	S	*	*			trans	-42.9	132.3	154.2	-66	-62.3	0	0	0	113.2
908	D	31.9	Very low	28.4	Very low	165 Å²	165	147.5 Å²	147.5	88%	0.882	81%	0.807	S	S	*	*			trans	-144	112	149.4	-112.9	-25.8	0	0	0	110.8	K910	D908-K910 PolarHBondContact O-N 3.48Å
909	F	27.7	Very low	28.3	Very low	165 Å²	165	146.1 Å²	146.1	72%	0.724	80%	0.803	S	S	*	*			trans	-56.8	112	172.8	-95.9	-116.1	0	0	0	111.2	K911	F909-K911 HydrophobicContact CD1-CG 4.49Å
910	K	29.9	Very low	28.6	Very low	202 Å²	202	142.5 Å²	142.5	88%	0.878	80%	0.8	S	S	*	*			trans	-130.3	89.1	147	-87	-173.8	178.3	174.1	0	110.3	D908 Q912	D908-K910 PolarHBondContact O-N 3.48Å; K910-Q912 VanDerWaalsContact C-N 3.33Å; K910-Q912 PolarHBondContact O-N 3.28Å
911	K	26.8	Very low	28.6	Very low	181 Å²	181	141.5 Å²	141.5	79%	0.787	79%	0.793	S	S	*	*			trans	-60.1	93.4	157.7	-71.6	176.5	175.1	177.4	0	108.1	F909	F909-K911 HydrophobicContact CD1-CG 4.49Å
912	Q	28.3	Very low	28.5	Very low	167 Å²	167	141.6 Å²	141.6	78%	0.78	79%	0.792	S	S	*	*			trans	-102.2	96	165.2	-145.6	168.5	7	0	0	107.5	K910 V914	K910-Q912 VanDerWaalsContact C-N 3.33Å; K910-Q912 PolarHBondContact O-N 3.28Å; Q912-V914 PolarHBondContact O-N 2.84Å
913	M	25.4	Very low	28.6	Very low	178 Å²	178	138.1 Å²	138.1	88%	0.877	78%	0.784	S	S	*	*			trans	-59.4	99.6	166.3	-76.5	175.7	70.3	0	0	107.7
914	V	29.2	Very low	28.3	Very low	123 Å²	123	140.1 Å²	140.1	75%	0.745	78%	0.784	S	S	*	*			trans	-93.1	109.8	162.6	-179.5	0	0	0	0	106	Q912 T916	Q912-V914 PolarHBondContact O-N 2.84Å; V914-T916 PolarHBondContact O-N 3.48Å
915	Q	27.2	Very low	28.2	Very low	178 Å²	178	141.3 Å²	141.3	83%	0.832	78%	0.779	S	S	*	*			trans	-54.3	116.4	176	-77.9	170.8	-33.6	0	0	109.8	A917	Q915-A917 PolarHBondContact O-N 3Å
916	T	27.9	Very low	28	Very low	138 Å²	138	143.2 Å²	143.2	85%	0.847	78%	0.782	S	S	*	*			trans	-66.4	100	164.4	20.7	0	0	0	0	108.9	V914 P918	V914-T916 PolarHBondContact O-N 3.48Å; T916-P918 WeakPolarHBondContact O-CD 3.21Å
917	A	27.1	Very low	27.9	Very low	89 Å²	89	142.1 Å²	142.1	74%	0.736	78%	0.775	S	S	*	*			trans	-81.1	116.7	156.7	0	0	0	0	0	107.3	Q915 S919	Q915-A917 PolarHBondContact O-N 3Å; A917-S919 PolarHBondContact O-N 2.89Å; A917-S919 VanDerWaalsContact O-N 3.11Å
918	P	33	Very low	28	Very low	114 Å²	114	140.2 Å²	140.2	74%	0.74	77%	0.769	S	S	*	*			trans	-70.2	106.1	174.7	27.8	-29.6	0	0	0	108	T916 D920	T916-P918 WeakPolarHBondContact O-CD 3.21Å; P918-D920 PolarHBondContact O-N 3.14Å; P918-D920 VanDerWaalsContact O-N 3.15Å
919	S	30.1	Very low	27.8	Very low	101 Å²	101	138.5 Å²	138.5	71%	0.706	76%	0.764	S	S	*	*			trans	-77.1	98.1	169.4	62.8	0	0	0	0	108.3	A917 V921	A917-S919 PolarHBondContact O-N 2.89Å; A917-S919 VanDerWaalsContact O-N 3.11Å; S919-V921 VanDerWaalsContact C-N 3.26Å; S919-V921 PolarHBondContact O-N 3.2Å
920	D	29.7	Very low	27.7	Very low	149 Å²	149	139 Å²	139	80%	0.797	77%	0.769	S	S	*	*			trans	-61	87.2	163.4	-78.3	-34.3	0	0	0	109.1	P918 T922	P918-D920 PolarHBondContact O-N 3.14Å; P918-D920 VanDerWaalsContact O-N 3.15Å; D920-T922 PolarHBondContact O-N 3.3Å
921	V	30.2	Very low	27.5	Very low	115 Å²	115	140.6 Å²	140.6	70%	0.697	77%	0.769	S	S	*	*			trans	-98.3	76.5	167	-173.4	0	0	0	0	107.2	S919 T923	S919-V921 VanDerWaalsContact C-N 3.26Å; S919-V921 PolarHBondContact O-N 3.2Å; V921-T923 PolarHBondContact O-N 3.33Å
922	T	26.2	Very low	27.6	Very low	119 Å²	119	136.3 Å²	136.3	73%	0.73	77%	0.767	S	S	*	*			trans	-84.2	92.4	164	-14.7	0	0	0	0	107.1	D920 M924	D920-T922 PolarHBondContact O-N 3.3Å; T922-M924 PolarHBondContact O-N 2.85Å
923	T	27.9	Very low	27.6	Very low	113 Å²	113	132.9 Å²	132.9	69%	0.693	76%	0.762	S	S	*	*			trans	-69.8	94	176.3	-36.7	0	0	0	0	108.9	V921 I925	V921-T923 PolarHBondContact O-N 3.33Å; T923-I925 PolarHBondContact O-N 3.36Å
924	M	25.4	Very low	28	Very low	174 Å²	174	130.7 Å²	130.7	86%	0.857	76%	0.761	S	S	*	*			trans	-72	103.4	168.7	-70.8	-146.1	-72.6	0	0	108.9	T922 S926	T922-M924 PolarHBondContact O-N 2.85Å; M924-S926 PolarHBondContact O-N 2.99Å; M924-S926 VanDerWaalsContact O-N 3.1Å
925	I	25	Very low	27.8	Very low	145 Å²	145	134.7 Å²	134.7	74%	0.744	77%	0.768	S	S	*	*			trans	-76.1	96.1	170.4	-58.4	173.1	0	0	0	106.9	T923 V927	T923-I925 PolarHBondContact O-N 3.36Å; I925-V927 HydrophobicContact CG2-CG2 4.26Å; I925-V927 PolarHBondContact O-N 3.1Å
926	S	24.6	Very low	27.9	Very low	104 Å²	104	129.4 Å²	129.4	73%	0.727	76%	0.762	S	S	*	*			trans	-77.9	106.1	170.9	-168.6	0	0	0	0	108.8	M924 V928	M924-S926 PolarHBondContact O-N 2.99Å; M924-S926 VanDerWaalsContact O-N 3.1Å; S926-V928 PolarHBondContact O-N 3.44Å; S926-V928 VanDerWaalsContact O-N 3.16Å
927	V	25.8	Very low	28	Very low	117 Å²	117	132.1 Å²	132.1	71%	0.709	77%	0.765	S	S	*	*			trans	-80.4	92.4	173.6	-176.6	0	0	0	0	107.8	I925 T929	I925-V927 HydrophobicContact CG2-CG2 4.26Å; I925-V927 PolarHBondContact O-N 3.1Å; V927-T929 PolarHBondContact O-N 3.21Å
928	V	28.1	Very low	28.3	Very low	108 Å²	108	137.2 Å²	137.2	66%	0.655	77%	0.774	S	S	*	*			trans	-73.1	111.2	170.9	-179.2	0	0	0	0	107.9	S926 E930	S926-V928 PolarHBondContact O-N 3.44Å; S926-V928 VanDerWaalsContact O-N 3.16Å; V928-E930 HydrophobicContact CG1-CG 3.95Å; V928-E930 PolarHBondContact O-N 3.07Å
929	T	27.6	Very low	28	Very low	128 Å²	128	136.4 Å²	136.4	79%	0.785	78%	0.776	S	S	*	*			trans	-81	85.6	170.5	31.9	0	0	0	0	108.4	V927 R931	V927-T929 PolarHBondContact O-N 3.21Å; T929-R931 PolarHBondContact O-N 3.5Å
930	E	26.3	Very low	27.9	Very low	176 Å²	176	142.3 Å²	142.3	82%	0.822	79%	0.785	S	S	*	*			trans	-67.7	104.9	173.2	-81.3	-163.8	152.5	0	0	110.5	V928 A932	V928-E930 HydrophobicContact CG1-CG 3.95Å; V928-E930 PolarHBondContact O-N 3.07Å; E930-A932 VanDerWaalsContact C-N 3.32Å; E930-A932 PolarHBondContact O-N 3.16Å; E930-A932 VanDerWaalsContact O-N 3.16Å
931	R	25	Very low	28	Very low	236 Å²	236	141 Å²	141	89%	0.891	78%	0.784	S	S	*	*			trans	-84.7	71.9	177.1	-154.5	179	-167.4	175	3.5	108.7	T929 S933	T929-R931 PolarHBondContact O-N 3.5Å; R931-S933 PolarHBondContact O-N 2.93Å
932	A	29.7	Very low	28.1	Very low	90 Å²	90	140 Å²	140	74%	0.744	79%	0.788	S	S	*	*			trans	-87	85.6	173.1	0	0	0	0	0	109.8	E930 P934	E930-A932 VanDerWaalsContact C-N 3.32Å; E930-A932 PolarHBondContact O-N 3.16Å; E930-A932 VanDerWaalsContact O-N 3.16Å; A932-P934 WeakPolarHBondContact O-CD 3.47Å
933	S	28.4	Very low	28.2	Very low	96 Å²	96	146.2 Å²	146.2	67%	0.671	80%	0.798	S	S	*	*			trans	-75.8	120.1	165.2	-67.9	0	0	0	0	109.7	R931 K935	R931-S933 PolarHBondContact O-N 2.93Å; S933-K935 PolarHBondContact O-N 3.08Å
934	P	32.9	Very low	28.3	Very low	132 Å²	132	149.8 Å²	149.8	86%	0.857	81%	0.807	S	S	*	*			trans	-72.9	113.7	167.4	-6.8	23.9	0	0	0	108.6	A932	A932-P934 WeakPolarHBondContact O-CD 3.47Å
935	K	26.7	Very low	28.3	Very low	206 Å²	206	150.4 Å²	150.4	90%	0.896	81%	0.808	S	S	*	*			trans	-90.7	137.4	161.6	-81.4	-179.2	174.8	177.6	0	108.4	S933	S933-K935 PolarHBondContact O-N 3.08Å
936	G	29.4	Very low	28.5	Very low	67 Å²	67	153.7 Å²	153.7	69%	0.691	82%	0.817	S	S	*	*			trans	131.8	87.4	167.7	0	0	0	0	0	110.6
937	Q	29.5	Very low	28.5	Very low	196 Å²	196	159.9 Å²	159.9	92%	0.916	82%	0.824	S	S	*	*				59.3	83.8	96.2	-74.6	-173.1	-12.8	0	0	112.9
938	E	32.3	Very low	28.5	Very low	196 Å²	196	163.2 Å²	163.2	92%	0.916	83%	0.832	S	S	*	*			trans	-134	136.6	142.6	-75.7	-164.3	160.9	0	0	109.6
939	A	27.4	Very low	28.7	Very low	96 Å²	96	163.5 Å²	163.5	79%	0.793	84%	0.839	S	S	*	*			trans	-87.5	145.8	-158.1	0	0	0	0	0	112.6
940	Y	27.2	Very low	28.8	Very low	226 Å²	226	162.4 Å²	162.4	89%	0.886	84%	0.842	S	S	*	*			trans	-60.2	134.5	167.8	-71.5	-94.6	0	0	0	112
941	P	33	Very low	28.8	Very low	122 Å²	122	157.8 Å²	157.8	79%	0.792	84%	0.842	S	S	*	*			trans	-90.3	96.6	144.2	30.7	-22.3	0	0	0	108.1	R943	P941-R943 PolarHBondContact O-N 2.86Å; P941-R943 VanDerWaalsContact O-N 3.12Å
942	A	30.9	Very low	28.9	Very low	94 Å²	94	152.2 Å²	152.2	78%	0.777	83%	0.834	S	S	*	*			trans	-67.4	99.9	165.1	0	0	0	0	0	108.8
943	R	29.5	Very low	28.6	Very low	249 Å²	249	155.7 Å²	155.7	94%	0.94	84%	0.84	S	S	*	*			trans	-95.6	112.5	169.2	-154.3	173.7	-172.7	179.4	1.7	109.1	P941	P941-R943 PolarHBondContact O-N 2.86Å; P941-R943 VanDerWaalsContact O-N 3.12Å
944	Q	28.9	Very low	28.6	Very low	187 Å²	187	156 Å²	156	87%	0.874	84%	0.842	S	S	*	*			trans	-53.8	148.8	-175.8	-76.8	169	-43.1	0	0	115
945	E	26.2	Very low	28.4	Very low	188 Å²	188	158.1 Å²	158.1	88%	0.879	84%	0.84	S	S	*	*			trans	-40.3	134.2	164.8	-59.4	171.3	145	0	0	114.2
946	K	28.9	Very low	28.5	Very low	214 Å²	214	156.4 Å²	156.4	93%	0.93	84%	0.84	S	S	*	*			trans	-129.2	100.7	146	-99.8	-172.4	175.7	-176.2	0	108.3
947	R	24.5	Very low	28.7	Very low	234 Å²	234	158.7 Å²	158.7	88%	0.883	84%	0.843	S	S	*	*			trans	-82.1	162.3	162	-140.6	175.7	-174.5	-168.8	1.4	107.7
948	E	26.6	Very low	28.6	Very low	186 Å²	186	154.6 Å²	154.6	87%	0.869	84%	0.835	S	S	*	*			trans	86.9	127.3	-179.4	-51.7	176.6	-174.4	0	0	113
949	S	32.7	Very low	28.5	Very low	115 Å²	115	150.4 Å²	150.4	80%	0.804	83%	0.828	S	S	*	*			cis	-164.4	145.3	29.9	29	0	0	0	0	109.6	G951	S949-G951 PolarHBondContact O-N 3.5Å
950	A	28.2	Very low	28.4	Very low	104 Å²	104	153.9 Å²	153.9	86%	0.86	83%	0.827	S	S	*	*			trans	-71.1	107.5	171.2	0	0	0	0	0	109.5
951	G	28.1	Very low	28.9	Very low	79 Å²	79	149 Å²	149	81%	0.814	82%	0.824	S	S	*	*			trans	-104	104.9	173.6	0	0	0	0	0	110.7	S949	S949-G951 PolarHBondContact O-N 3.5Å
952	T	27	Very low	28.7	Very low	119 Å²	119	152.8 Å²	152.8	73%	0.73	83%	0.827	S	S	*	*			trans	-75.2	132.7	176	-53.5	0	0	0	0	110.9
953	L	23.2	Very low	28.7	Very low	163 Å²	163	151.8 Å²	151.8	85%	0.853	83%	0.827	S	S	*	*			trans	25.3	111.7	154.4	-74.5	119.1	0	0	0	119.4
954	S	26.9	Very low	28.7	Very low	103 Å²	103	149.1 Å²	149.1	72%	0.72	83%	0.825	S	S	*	*			trans	-167.8	156.6	136.2	56.7	0	0	0	0	110
955	H	30.5	Very low	28.9	Very low	177 Å²	177	145.8 Å²	145.8	82%	0.819	82%	0.819	S	S	*	*			trans	93.3	59.9	-178.5	-55.6	-73.3	0	0	0	116.9
956	L	27	Very low	29.5	Very low	169 Å²	169	142.9 Å²	142.9	89%	0.885	82%	0.817	S	S	*	*			trans	-72.2	120.2	133.8	-98.5	138.6	0	0	0	108.5	S958	L956-S958 PolarHBondContact O-N 3.48Å
957	P	35	Very low	29.5	Very low	116 Å²	116	136.5 Å²	136.5	75%	0.753	81%	0.812	S	S	*	*			trans	-81.7	106.7	157.8	18.1	-3.8	0	0	0	108.1
958	S	26.2	Very low	29.6	Very low	109 Å²	109	128.9 Å²	128.9	76%	0.762	81%	0.806	S	S	*	*			trans	-75.7	124.5	160.7	141.7	0	0	0	0	108.1	L956	L956-S958 PolarHBondContact O-N 3.48Å
959	S	31.1	Very low	29.8	Very low	108 Å²	108	125.9 Å²	125.9	76%	0.755	80%	0.803	S	S	*	*			trans	-150.5	85.7	160.1	54.8	0	0	0	0	107.9
960	E	26	Very low	29.8	Very low	169 Å²	169	126.4 Å²	126.4	79%	0.79	80%	0.801	S	S	*	*			trans	-69.4	131.4	160.4	-74.2	178.9	141.6	0	0	109.9
961	P	36.6	Very low	30	Very low	124 Å²	124	129 Å²	129	81%	0.805	80%	0.801	S	S	*	*			trans	-94.7	113.3	145.5	20.3	-3.9	0	0	0	108.7
962	K	29.2	Very low	30	Very low	201 Å²	201	128.4 Å²	128.4	87%	0.874	79%	0.794	S	S	*	*			trans	-54.8	128.4	164.4	-68.5	171.2	172.8	176.1	0	110.4
963	G	31.6	Very low	30.2	Very low	74 Å²	74	128.2 Å²	128.2	76%	0.763	80%	0.795	S	S	*	*			trans	-150.1	127.7	167.8	0	0	0	0	0	109.3
964	E	29.4	Very low	30.8	Very low	193 Å²	193	128.8 Å²	128.8	90%	0.902	80%	0.798	S	S	*	*			trans	-65.2	149.5	-160.5	-66.2	160	136.9	0	0	117.5
965	P	31.3	Very low	30.8	Very low	116 Å²	116	129.1 Å²	129.1	75%	0.753	80%	0.795	S	S	*	*			trans	-100.5	175.4	143.5	38.8	-28.5	0	0	0	110
966	P	40.2	Very low	30.8	Very low	127 Å²	127	129.5 Å²	129.5	83%	0.825	80%	0.795	S	S	*	*			cis	-131.5	148	-10.4	34.7	-16.1	0	0	0	113.9
967	G	28.2	Very low	31	Very low	80 Å²	80	129.6 Å²	129.6	83%	0.825	79%	0.791	S	S	*	*			trans	-116.2	123.3	166.8	0	0	0	0	0	110.5
968	G	25.7	Very low	30.9	Very low	74 Å²	74	132 Å²	132	76%	0.763	79%	0.793	S	S	*	*			trans	-75.6	174	-166.1	0	0	0	0	0	117.2
969	P	31.7	Very low	31.2	Very low	123 Å²	123	137.7 Å²	137.7	80%	0.799	80%	0.798	S	S	*	*			trans	-100.4	131.3	-179.4	35.3	-25	0	0	0	112
970	T	33	Very low	31.1	Very low	127 Å²	127	141.8 Å²	141.8	78%	0.779	80%	0.802	S	S	*	*			trans	-167.1	129.2	156.5	17.4	0	0	0	0	112.5
971	D	31.1	Very low	31.4	Very low	158 Å²	158	142.2 Å²	142.2	85%	0.845	81%	0.805	S	S	*	*			trans	62	119.3	141.7	-58.1	-27.7	0	0	0	123.1
972	G	28.6	Very low	31.1	Very low	66 Å²	66	142.6 Å²	142.6	68%	0.68	80%	0.8	S	S	*	*			trans	155.6	86.4	147.8	0	0	0	0	0	116.2
973	P	31.9	Very low	31.1	Very low	116 Å²	116	141.2 Å²	141.2	75%	0.753	80%	0.802	S	S	*	*			trans	-81.1	116.4	171.3	31.1	-28.8	0	0	0	111	T975	P973-T975 PolarHBondContact O-N 3.08Å
974	I	34.9	Very low	31.3	Very low	175 Å²	175	146.4 Å²	146.4	90%	0.897	80%	0.803	S	S	*	*			trans	-78.1	112.1	172.2	-62.9	172.8	0	0	0	108.3
975	T	28	Very low	31.5	Very low	110 Å²	110	145.9 Å²	145.9	68%	0.675	80%	0.801	S	S	*	*			trans	-109.1	152.2	174.3	40.8	0	0	0	0	110.6	P973	P973-T975 PolarHBondContact O-N 3.08Å
976	K	29.4	Very low	31.6	Very low	185 Å²	185	150 Å²	150	80%	0.804	81%	0.807	S	S	*	*			trans	81.4	107.8	163.9	-62.1	176.6	178.4	175.6	0	117.9
977	E	31.7	Very low	31.2	Very low	171 Å²	171	153 Å²	153	80%	0.799	81%	0.807	S	S	*	*				-145	109.2	123.7	-114.7	-174.5	-174.1	0	0	109.5
978	M	32.8	Very low	31.4	Very low	165 Å²	165	160 Å²	160	81%	0.813	81%	0.81	S	S	*	*			trans	-80.2	119.6	169.9	-66.8	-173	-165	0	0	108.1
979	R	32.9	Very low	31.8	Very low	230 Å²	230	161.5 Å²	161.5	87%	0.868	81%	0.806	S	S	*	*			trans	-106.2	103.2	158.8	-75	-172.8	-176.6	177.5	1.6	108.8
980	K	29.3	Very low	32.3	Very low	193 Å²	193	161.3 Å²	161.3	84%	0.839	81%	0.806	S	S	*	*			trans	-99.3	120.7	159.9	-84.1	-179	172.5	-179.4	0	106
981	E	31.2	Very low	32.3	Very low	179 Å²	179	164.1 Å²	164.1	84%	0.836	81%	0.81	S	S	*	*			trans	-157.6	114	158.7	-115.3	167.8	-163.1	0	0	110.8
982	D	31.5	Very low	32.5	Very low	132 Å²	132	164 Å²	164	71%	0.706	81%	0.809	S	S	*	*			trans	72.8	94.1	138.3	-61.8	-5.4	0	0	0	122.6	K984	D982-K984 PolarHBondContact O-N 2.95Å
983	D	29.3	Very low	32.6	Very low	171 Å²	171	169.6 Å²	169.6	91%	0.914	82%	0.82	S	S	*	*			trans	-50.2	107.8	146.8	-78.8	-46.8	0	0	0	112.3
984	K	35.9	Very low	32.7	Very low	183 Å²	183	170 Å²	170	80%	0.796	82%	0.822	S	S	*	*			trans	-115.8	103.6	162.3	-77.7	-175.1	-179	173	0	111.5	D982	D982-K984 PolarHBondContact O-N 2.95Å
985	Q	32.1	Very low	32.5	Very low	183 Å²	183	165.5 Å²	165.5	86%	0.855	82%	0.819	S	S	*	*			trans	-0.4	109	154.5	-67.5	174.8	-12.3	0	0	116.9	K987	Q985-K987 PolarHBondContact O-N 3.38Å
986	K	33.5	Very low	32.6	Very low	203 Å²	203	164 Å²	164	88%	0.883	83%	0.825	S	S	*	*			trans	-79.9	103.3	160.3	-76.5	-179.5	176.7	176.5	0	109.5
987	K	31.9	Very low	32.7	Very low	190 Å²	190	160.9 Å²	160.9	83%	0.826	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-69.1	143	164.1	-83.3	-179.9	174.5	178.2	0	110.1	Q985	Q985-K987 PolarHBondContact O-N 3.38Å
988	Y	32.6	Very low	32.8	Very low	226 Å²	226	156.4 Å²	156.4	89%	0.886	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-60.5	155.3	-178.8	-83.6	-94.8	0	0	0	114
989	P	33.6	Very low	32.8	Very low	105 Å²	105	155 Å²	155	68%	0.682	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-85.8	146.4	-171.2	34.8	-32.2	0	0	0	112.3	E991	P989-E991 PolarHBondContact O-N 3.45Å
990	P	42	Very low	32.8	Very low	120 Å²	120	153.5 Å²	153.5	78%	0.779	83%	0.83	S	S	*	*			trans	-82	111.9	165.7	30.4	-26.2	0	0	0	109.5	N992	P990-N992 PolarHBondContact O-N 3.33Å
991	E	33	Very low	32.7	Very low	186 Å²	186	149.2 Å²	149.2	87%	0.869	83%	0.825	S	S	*	*			trans	-63.4	115.4	156.9	-68.7	178.1	154.1	0	0	108.2	P989	P989-E991 PolarHBondContact O-N 3.45Å
992	N	35.9	Very low	32.5	Very low	156 Å²	156	150.5 Å²	150.5	83%	0.834	83%	0.827	S	S	*	*			trans	-138.6	117.3	159	-92.3	-29.7	0	0	0	109.3	P990	P990-N992 PolarHBondContact O-N 3.33Å
993	M	32.1	Very low	32.4	Very low	183 Å²	183	157.3 Å²	157.3	90%	0.901	86%	0.855	S	S	*	*			trans	-25	154.3	178	-74.4	-85.6	-179.5	0	0	119.9
994	P	34	Very low	32.6	Very low	124 Å²	124	156.7 Å²	156.7	81%	0.805	85%	0.852	S	S	*	*			trans	-84	138.1	-172.1	35.1	-32.9	0	0	0	112.3
995	G	29.2	Very low	32.4	Very low	81 Å²	81	155.3 Å²	155.3	84%	0.835	86%	0.855	S	S	*	*			trans	-133.8	136.5	173.4	0	0	0	0	0	111.2
996	G	30.5	Very low	32.4	Very low	77 Å²	77	153.7 Å²	153.7	79%	0.794	86%	0.855	S	S	*	*			trans	100.1	81.8	150.9	0	0	0	0	0	116.3	G998	G996-G998 PolarHBondContact O-N 3.27Å; G996-G998 VanDerWaalsContact O-N 3.08Å
997	S	32.4	Very low	32.3	Very low	121 Å²	121	150.8 Å²	150.8	85%	0.846	85%	0.853	S	S	*	*			trans	-56.4	99.6	150.8	54.7	0	0	0	0	110.4
998	G	32.8	Very low	32.4	Very low	76 Å²	76	148.4 Å²	148.4	78%	0.784	86%	0.855	S	S	*	*			trans	-96.2	82.7	170.4	0	0	0	0	0	110.9	G996 Q1000	G996-G998 PolarHBondContact O-N 3.27Å; G996-G998 VanDerWaalsContact O-N 3.08Å; G998-Q1000 PolarHBondContact O-N 3.39Å
999	T	33.3	Very low	32.3	Very low	135 Å²	135	143.2 Å²	143.2	83%	0.828	85%	0.853	S	S	*	*			trans	-71.6	107.7	160.3	33.7	0	0	0	0	108.7
1000	Q	31.7	Very low	32.2	Very low	200 Å²	200	145.9 Å²	145.9	94%	0.935	87%	0.865	S	S	*	*			trans	-112.9	109.2	160.1	-88.2	-172.3	-25	0	0	109	G998	G998-Q1000 PolarHBondContact O-N 3.39Å
1001	S	28.6	Very low	31.5	Very low	103 Å²	103	147.9 Å²	147.9	72%	0.72	87%	0.872	S	S	*	*			trans	-99.4	137.9	168.6	57.3	0	0	0	0	109.7
1002	K	27.1	Very low	31.4	Very low	206 Å²	206	144.8 Å²	144.8	90%	0.896	87%	0.872	S	S	*	*			trans	70.1	101.1	160.1	-62.8	-179.1	176.2	-178.4	0	117.6
1003	Q	28.9	Very low	31	Very low	275 Å²	275	143.7 Å²	143.7	100%	1.285	88%	0.875	S	S	*	*				-150.6	0	108.8	-135.8	174.3	4.6	0	0	110.2

Retrieved 1,003 of 1,003 residues in 608.2 ms (Link to these results)

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